NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
538560 | 2lr9 | 18354 | cing | 4-filtered-FRED | STAR | entry | full | 159 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2lr9 # This FRED archive file contains, for PDB entry <2lr9>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396. save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.PDB_coordinate_file_version . _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_2lr9 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2lr9 _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 2397.94 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 $Rho_conotoxin_TIA A . 1 1 stop_ save_ save_Rho_conotoxin_TIA _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Rho conotoxin TIA" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code FNWRCCLIPACRRNHKKFCX _Entity.Number_of_monomers 20 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 PHE . 1 1 2 ASN . 1 1 3 TRP . 1 1 4 ARG . 1 1 5 CYS . 1 1 6 CYS . 1 1 7 LEU . 1 1 8 ILE . 1 1 9 PRO . 1 1 10 ALA . 1 1 11 CYS . 1 1 12 ARG . 1 1 13 ARG . 1 1 14 ASN . 1 1 15 HIS . 1 1 16 LYS . 1 1 17 LYS . 1 1 18 PHE . 1 1 19 CYS . 1 1 20 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 PHE 1 1 1 1 ASN 2 2 1 1 TRP 3 3 1 1 ARG 4 4 1 1 CYS 5 5 1 1 CYS 6 6 1 1 LEU 7 7 1 1 ILE 8 8 1 1 PRO 9 9 1 1 ALA 10 10 1 1 CYS 11 11 1 1 ARG 12 12 1 1 ARG 13 13 1 1 ASN 14 14 1 1 HIS 15 15 1 1 LYS 16 16 1 1 LYS 17 17 1 1 PHE 18 18 1 1 CYS 19 19 1 1 NH2 20 20 1 1 stop_ save_ save_NH2 _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID NH2 _Chem_comp.Type non-polymer save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 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 8 ILE HB . 8 . HB 1 1 1 1 2 1 1 12 ARG H . 12 . HN 1 1 2 1 1 1 1 12 ARG H . 12 . HN 1 1 2 1 2 1 1 12 ARG HB2 . 12 . HB2 1 1 3 1 1 1 1 11 CYS HB2 . 11 . HB2 1 1 3 1 2 1 1 12 ARG H . 12 . HN 1 1 4 1 1 1 1 11 CYS HB3 . 11 . HB1 1 1 4 1 2 1 1 12 ARG H . 12 . HN 1 1 5 1 1 1 1 7 LEU HA . 7 . HA 1 1 5 1 2 1 1 8 ILE H . 8 . HN 1 1 6 1 1 1 1 7 LEU HB2 . 7 . HB2 1 1 6 1 2 1 1 8 ILE H . 8 . HN 1 1 7 1 1 1 1 7 LEU HB3 . 7 . HB1 1 1 7 1 2 1 1 8 ILE H . 8 . HN 1 1 8 1 1 1 1 6 CYS HB2 . 6 . HB2 1 1 8 1 2 1 1 7 LEU H . 7 . HN 1 1 9 1 1 1 1 12 ARG HB2 . 12 . HB2 1 1 9 1 2 1 1 13 ARG H . 13 . HN 1 1 10 1 1 1 1 17 LYS HB2 . 17 . HB2 1 1 10 1 2 1 1 18 PHE H . 18 . HN 1 1 11 1 1 1 1 7 LEU H . 7 . HN 1 1 11 1 2 1 1 8 ILE H . 8 . HN 1 1 12 1 1 1 1 14 ASN H . 14 . HN 1 1 12 1 2 1 1 15 HIS H . 15 . HN 1 1 13 1 1 1 1 11 CYS H . 11 . HN 1 1 13 1 2 1 1 12 ARG H . 12 . HN 1 1 14 1 1 1 1 12 ARG H . 12 . HN 1 1 14 1 2 1 1 13 ARG H . 13 . HN 1 1 15 1 1 1 1 12 ARG HB3 . 12 . HB1 1 1 15 1 2 1 1 13 ARG H . 13 . HN 1 1 16 1 1 1 1 14 ASN QB . 14 . HB# 1 1 16 1 2 1 1 15 HIS H . 15 . HN 1 1 17 1 1 1 1 6 CYS HB3 . 6 . HB1 1 1 17 1 2 1 1 7 LEU H . 7 . HN 1 1 18 1 1 1 1 13 ARG HB2 . 13 . HB2 1 1 18 1 2 1 1 14 ASN H . 14 . HN 1 1 19 1 1 1 1 13 ARG HB3 . 13 . HB1 1 1 19 1 2 1 1 14 ASN H . 14 . HN 1 1 20 1 1 1 1 15 HIS HA . 15 . HA 1 1 20 1 2 1 1 16 LYS H . 16 . HN 1 1 21 1 1 1 1 2 ASN HA . 2 . HA 1 1 21 1 2 1 1 3 TRP H . 3 . HN 1 1 22 1 1 1 1 2 ASN QB . 2 . HB# 1 1 22 1 2 1 1 3 TRP H . 3 . HN 1 1 23 1 1 1 1 1 PHE HA . 1 . HA 1 1 23 1 2 1 1 2 ASN H . 2 . HN 1 1 24 1 1 1 1 1 PHE HB2 . 1 . HB2 1 1 24 1 2 1 1 2 ASN H . 2 . HN 1 1 25 1 1 1 1 1 PHE HB3 . 1 . HB1 1 1 25 1 2 1 1 2 ASN H . 2 . HN 1 1 26 1 1 1 1 2 ASN HA . 2 . HA 1 1 26 1 2 1 1 4 ARG H . 4 . HN 1 1 27 1 1 1 1 3 TRP HA . 3 . HA 1 1 27 1 2 1 1 4 ARG H . 4 . HN 1 1 28 1 1 1 1 2 ASN QB . 2 . HB# 1 1 28 1 2 1 1 4 ARG H . 4 . HN 1 1 29 1 1 1 1 3 TRP QB . 3 . HB# 1 1 29 1 2 1 1 4 ARG H . 4 . HN 1 1 30 1 1 1 1 4 ARG HB3 . 4 . HB1 1 1 30 1 2 1 1 5 CYS H . 5 . HN 1 1 31 1 1 1 1 4 ARG HB2 . 4 . HB2 1 1 31 1 2 1 1 5 CYS H . 5 . HN 1 1 32 1 1 1 1 4 ARG HA . 4 . HA 1 1 32 1 2 1 1 5 CYS H . 5 . HN 1 1 33 1 1 1 1 5 CYS HB3 . 5 . HB1 1 1 33 1 2 1 1 6 CYS H . 6 . HN 1 1 34 1 1 1 1 5 CYS HB2 . 5 . HB2 1 1 34 1 2 1 1 6 CYS H . 6 . HN 1 1 35 1 1 1 1 8 ILE HB . 8 . HB 1 1 35 1 2 1 1 11 CYS H . 11 . HN 1 1 36 1 1 1 1 9 PRO HA . 9 . HA 1 1 36 1 2 1 1 12 ARG H . 12 . HN 1 1 37 1 1 1 1 18 PHE HB2 . 18 . HB2 1 1 37 1 2 1 1 19 CYS H . 19 . HN 1 1 38 1 1 1 1 18 PHE HB3 . 18 . HB1 1 1 38 1 2 1 1 19 CYS H . 19 . HN 1 1 39 1 1 1 1 16 LYS QB . 16 . HB# 1 1 39 1 2 1 1 17 LYS H . 17 . HN 1 1 40 1 1 1 1 14 ASN HA . 14 . HA 1 1 40 1 2 1 1 16 LYS H . 16 . HN 1 1 41 1 1 1 1 15 HIS HA . 15 . HA 1 1 41 1 2 1 1 17 LYS H . 17 . HN 1 1 42 1 1 1 1 11 CYS HA . 11 . HA 1 1 42 1 2 1 1 14 ASN H . 14 . HN 1 1 43 1 1 1 1 17 LYS HB3 . 17 . HB1 1 1 43 1 2 1 1 18 PHE H . 18 . HN 1 1 44 1 1 1 1 16 LYS HA . 16 . HA 1 1 44 1 2 1 1 19 CYS H . 19 . HN 1 1 45 1 1 1 1 17 LYS HA . 17 . HA 1 1 45 1 2 1 1 19 CYS H . 19 . HN 1 1 46 1 1 1 1 13 ARG HA . 13 . HA 1 1 46 1 2 1 1 15 HIS H . 15 . HN 1 1 47 1 1 1 1 12 ARG HA . 12 . HA 1 1 47 1 2 1 1 15 HIS H . 15 . HN 1 1 48 1 1 1 1 16 LYS H . 16 . HN 1 1 48 1 2 1 1 17 LYS H . 17 . HN 1 1 49 1 1 1 1 17 LYS H . 17 . HN 1 1 49 1 2 1 1 18 PHE H . 18 . HN 1 1 50 1 1 1 1 15 HIS H . 15 . HN 1 1 50 1 2 1 1 16 LYS H . 16 . HN 1 1 51 1 1 1 1 3 TRP H . 3 . HN 1 1 51 1 2 1 1 4 ARG H . 4 . HN 1 1 52 1 1 1 1 10 ALA H . 10 . HN 1 1 52 1 2 1 1 11 CYS H . 11 . HN 1 1 53 1 1 1 1 11 CYS H . 11 . HN 1 1 53 1 2 1 1 13 ARG H . 13 . HN 1 1 54 1 1 1 1 13 ARG H . 13 . HN 1 1 54 1 2 1 1 14 ASN H . 14 . HN 1 1 55 1 1 1 1 18 PHE H . 18 . HN 1 1 55 1 2 1 1 19 CYS H . 19 . HN 1 1 56 1 1 1 1 3 TRP HA . 3 . HA 1 1 56 1 2 1 1 6 CYS H . 6 . HN 1 1 57 1 1 1 1 15 HIS HB2 . 15 . HB2 1 1 57 1 2 1 1 16 LYS H . 16 . HN 1 1 58 1 1 1 1 15 HIS HB3 . 15 . HB1 1 1 58 1 2 1 1 16 LYS H . 16 . HN 1 1 59 1 1 1 1 15 HIS HB3 . 15 . HB1 1 1 59 1 2 1 1 18 PHE H . 18 . HN 1 1 60 1 1 1 1 2 ASN QB . 2 . HB# 1 1 60 1 2 1 1 6 CYS H . 6 . HN 1 1 61 1 1 1 1 7 LEU HA . 7 . HA 1 1 61 1 2 1 1 7 LEU HB3 . 7 . HB1 1 1 62 1 1 1 1 6 CYS HA . 6 . HA 1 1 62 1 2 1 1 12 ARG HA . 12 . HA 1 1 63 1 1 1 1 11 CYS HA . 11 . HA 1 1 63 1 2 1 1 14 ASN QB . 14 . HB# 1 1 64 1 1 1 1 16 LYS HA . 16 . HA 1 1 64 1 2 1 1 19 CYS HB2 . 19 . HB2 1 1 65 1 1 1 1 5 CYS HA . 5 . HA 1 1 65 1 2 1 1 8 ILE HB . 8 . HB 1 1 66 1 1 1 1 9 PRO HA . 9 . HA 1 1 66 1 2 1 1 12 ARG HB3 . 12 . HB1 1 1 67 1 1 1 1 4 ARG HA . 4 . HA 1 1 67 1 2 1 1 6 CYS H . 6 . HN 1 1 68 1 1 1 1 8 ILE HA . 8 . HA 1 1 68 1 2 1 1 9 PRO HD2 . 9 . HD2 1 1 69 1 1 1 1 8 ILE HA . 8 . HA 1 1 69 1 2 1 1 9 PRO HD3 . 9 . HD1 1 1 70 1 1 1 1 8 ILE HB . 8 . HB 1 1 70 1 2 1 1 11 CYS HB3 . 11 . HB1 1 1 71 1 1 1 1 13 ARG QG . 13 . HG# 1 1 71 1 2 1 1 14 ASN H . 14 . HN 1 1 72 1 1 1 1 4 ARG HG2 . 4 . HG2 1 1 72 1 2 1 1 5 CYS H . 5 . HN 1 1 73 1 1 1 1 4 ARG HG3 . 4 . HG1 1 1 73 1 2 1 1 5 CYS H . 5 . HN 1 1 74 1 1 1 1 14 ASN QB . 14 . HB# 1 1 74 1 2 1 1 15 HIS HE1 . 15 . HE1 1 1 75 1 1 1 1 12 ARG QD . 12 . HD# 1 1 75 1 2 1 1 13 ARG H . 13 . HN 1 1 76 1 1 1 1 3 TRP HE3 . 3 . HE3 1 1 76 1 2 1 1 4 ARG HA . 4 . HA 1 1 77 1 1 1 1 3 TRP HE3 . 3 . HE3 1 1 77 1 2 1 1 4 ARG HG2 . 4 . HG2 1 1 78 1 1 1 1 3 TRP QB . 3 . HB# 1 1 78 1 2 1 1 4 ARG CB . 4 . CB 1 1 79 1 1 1 1 2 ASN QB . 2 . HB# 1 1 79 1 2 1 1 3 TRP HD1 . 3 . HD1 1 1 80 1 1 1 1 15 HIS HB3 . 15 . HB1 1 1 80 1 2 1 1 18 PHE QD . 18 . HD# 1 1 81 1 1 1 1 1 PHE QD . 1 . HD# 1 1 81 1 2 1 1 3 TRP HA . 3 . HA 1 1 82 1 1 1 1 1 PHE QD . 1 . HD# 1 1 82 1 2 1 1 5 CYS HB3 . 5 . HB1 1 1 83 1 1 1 1 1 PHE QE . 1 . HE# 1 1 83 1 2 1 1 5 CYS HB3 . 5 . HB1 1 1 84 1 1 1 1 1 PHE QE . 1 . HE# 1 1 84 1 2 1 1 3 TRP HA . 3 . HA 1 1 85 1 1 1 1 11 CYS HA . 11 . HA 1 1 85 1 2 1 1 15 HIS HD2 . 15 . HD2 1 1 86 1 1 1 1 8 ILE HA . 8 . HA 1 1 86 1 2 1 1 9 PRO HG3 . 9 . HG1 1 1 87 1 1 1 1 8 ILE HA . 8 . HA 1 1 87 1 2 1 1 9 PRO HG2 . 9 . HG2 1 1 88 1 1 1 1 3 TRP HE3 . 3 . HE3 1 1 88 1 2 1 1 4 ARG HG3 . 4 . HG1 1 1 89 1 1 1 1 3 TRP HZ3 . 3 . HZ3 1 1 89 1 2 1 1 4 ARG HG2 . 4 . HG2 1 1 90 1 1 1 1 3 TRP HZ3 . 3 . HZ3 1 1 90 1 2 1 1 4 ARG HG3 . 4 . HG1 1 1 91 1 1 1 1 3 TRP HH2 . 3 . HH2 1 1 91 1 2 1 1 4 ARG HG2 . 4 . HG2 1 1 92 1 1 1 1 3 TRP HH2 . 3 . HH2 1 1 92 1 2 1 1 4 ARG HG3 . 4 . HG1 1 1 93 1 1 1 1 1 PHE QE . 1 . HE# 1 1 93 1 2 1 1 2 ASN H . 2 . HN 1 1 94 1 1 1 1 1 PHE QD . 1 . HD# 1 1 94 1 2 1 1 2 ASN H . 2 . HN 1 1 95 1 1 1 1 14 ASN QB . 14 . HB# 1 1 95 1 2 1 1 15 HIS HD2 . 15 . HD2 1 1 96 1 1 1 1 1 PHE QE . 1 . HE# 1 1 96 1 2 1 1 15 HIS HB3 . 15 . HB1 1 1 97 1 1 1 1 1 PHE QE . 1 . HE# 1 1 97 1 2 1 1 15 HIS HB2 . 15 . HB2 1 1 98 1 1 1 1 5 CYS HA . 5 . HA 1 1 98 1 2 1 1 11 CYS HB2 . 11 . HB2 1 1 99 1 1 1 1 5 CYS HA . 5 . HA 1 1 99 1 2 1 1 11 CYS HB3 . 11 . HB1 1 1 100 1 1 1 1 6 CYS HB3 . 6 . HB1 1 1 100 1 2 1 1 19 CYS HB2 . 19 . HB2 1 1 101 1 1 1 1 6 CYS HA . 6 . HA 1 1 101 1 2 1 1 12 ARG HB2 . 12 . HB2 1 1 102 1 1 1 1 6 CYS HA . 6 . HA 1 1 102 1 2 1 1 12 ARG HB3 . 12 . HB1 1 1 103 1 1 1 1 6 CYS HA . 6 . HA 1 1 103 1 2 1 1 12 ARG QG . 12 . HG# 1 1 104 1 1 1 1 6 CYS HA . 6 . HA 1 1 104 1 2 1 1 19 CYS HB3 . 19 . HB1 1 1 105 1 1 1 1 10 ALA MB . 10 . HB# 1 1 105 1 2 1 1 11 CYS H . 11 . HN 1 1 106 1 1 1 1 8 ILE MG . 8 . HG2# 1 1 106 1 2 1 1 11 CYS H . 11 . HN 1 1 107 1 1 1 1 8 ILE MG . 8 . HG2# 1 1 107 1 2 1 1 10 ALA H . 10 . HN 1 1 108 1 1 1 1 8 ILE MG . 8 . HG2# 1 1 108 1 2 1 1 12 ARG H . 12 . HN 1 1 109 1 1 1 1 8 ILE MD . 8 . HD1# 1 1 109 1 2 1 1 11 CYS HB3 . 11 . HB1 1 1 110 1 1 1 1 5 CYS HA . 5 . HA 1 1 110 1 2 1 1 8 ILE MD . 8 . HD1# 1 1 111 1 1 1 1 8 ILE MG . 8 . HG2# 1 1 111 1 2 1 1 11 CYS HB2 . 11 . HB2 1 1 112 1 1 1 1 8 ILE MG . 8 . HG2# 1 1 112 1 2 1 1 11 CYS HB3 . 11 . HB1 1 1 113 1 1 1 1 8 ILE MG . 8 . HG2# 1 1 113 1 2 1 1 10 ALA MB . 10 . HB# 1 1 114 1 1 1 1 1 PHE QB . 1 . HB# 1 1 114 1 2 1 1 2 ASN H . 2 . HN 1 1 115 1 1 1 1 1 PHE QE . 1 . HE# 1 1 115 1 2 1 1 18 PHE QB . 18 . HB# 1 1 116 1 1 1 1 8 ILE H . 8 . HN 1 1 116 1 2 1 1 9 PRO QD . 9 . HD# 1 1 117 1 1 1 1 8 ILE HA . 8 . HA 1 1 117 1 2 1 1 9 PRO QD . 9 . HD# 1 1 118 1 1 1 1 8 ILE MG . 8 . HG2# 1 1 118 1 2 1 1 9 PRO QD . 9 . HD# 1 1 119 1 1 1 1 13 ARG QB . 13 . HB# 1 1 119 1 2 1 1 14 ASN H . 14 . HN 1 1 120 1 1 1 1 16 LYS QG . 16 . HG# 1 1 120 1 2 1 1 17 LYS H . 17 . HN 1 1 121 1 1 1 1 17 LYS QB . 17 . HB# 1 1 121 1 2 1 1 18 PHE H . 18 . HN 1 1 122 1 1 1 1 18 PHE H . 18 . HN 1 1 122 1 2 1 1 18 PHE QB . 18 . HB# 1 1 123 1 1 1 1 18 PHE QB . 18 . HB# 1 1 123 1 2 1 1 19 CYS H . 19 . HN 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 2.985 1.8 4.17 1 1 2 1 . . . . . 2.335 1.8 2.87 1 1 3 1 . . . . . 2.935 1.8 4.07 1 1 4 1 . . . . . 2.44 1.8 3.08 1 1 5 1 . . . . . 2.485 1.8 3.17 1 1 6 1 . . . . . 2.72 1.8 3.64 1 1 7 1 . . . . . 3.125 1.8 4.45 1 1 8 1 . . . . . 3.045 1.8 4.29 1 1 9 1 . . . . . 2.765 1.8 3.73 1 1 10 1 . . . . . 2.625 1.8 3.45 1 1 11 1 . . . . . 2.24 1.8 2.68 1 1 12 1 . . . . . 2.225 1.8 2.65 1 1 13 1 . . . . . 2.195 1.8 2.59 1 1 14 1 . . . . . 2.455 1.8 3.11 1 1 15 1 . . . . . 2.44 1.8 3.08 1 1 16 1 . . . . . 3.625 1.8 5.45 1 1 17 1 . . . . . 3.015 1.8 4.23 1 1 18 1 . . . . . 2.875 1.8 3.95 1 1 19 1 . . . . . 2.875 1.8 3.95 1 1 20 1 . . . . . 2.35 1.8 2.9 1 1 21 1 . . . . . 2.18 1.8 2.56 1 1 22 1 . . . . . 3.035 1.8 4.27 1 1 23 1 . . . . . 2.335 1.8 2.87 1 1 24 1 . . . . . 2.97 1.8 4.14 1 1 25 1 . . . . . 2.97 1.8 4.14 1 1 26 1 . . . . . 3.075 1.8 4.35 1 1 27 1 . . . . . 2.58 1.8 3.36 1 1 28 1 . . . . . 3.72 1.8 5.64 1 1 29 1 . . . . . 3.345 1.8 4.89 1 1 30 1 . . . . . 2.625 1.8 3.45 1 1 31 1 . . . . . 2.58 1.8 3.36 1 1 32 1 . . . . . 2.52 1.8 3.24 1 1 33 1 . . . . . 2.69 1.8 3.58 1 1 34 1 . . . . . 2.315 1.8 2.83 1 1 35 1 . . . . . 2.52 1.8 3.24 1 1 36 1 . . . . . 2.985 1.8 4.17 1 1 37 1 . . . . . 2.705 1.8 3.61 1 1 38 1 . . . . . 2.705 1.8 3.61 1 1 39 1 . . . . . 3.035 1.8 4.27 1 1 40 1 . . . . . 3.26 1.8 4.72 1 1 41 1 . . . . . 3.125 1.8 4.45 1 1 42 1 . . . . . 2.815 1.8 3.83 1 1 43 1 . . . . . 2.625 1.8 3.45 1 1 44 1 . . . . . 2.72 1.8 3.64 1 1 45 1 . . . . . 3.2 1.8 4.6 1 1 46 1 . . . . . 3.045 1.8 4.29 1 1 47 1 . . . . . 3.03 1.8 4.26 1 1 48 1 . . . . . 2.44 1.8 3.08 1 1 49 1 . . . . . 2.35 1.8 2.9 1 1 50 1 . . . . . 2.365 1.8 2.93 1 1 51 1 . . . . . 2.455 1.8 3.11 1 1 52 1 . . . . . 2.38 1.8 2.96 1 1 53 1 . . . . . 2.875 1.8 3.95 1 1 54 1 . . . . . 2.35 1.8 2.9 1 1 55 1 . . . . . 2.255 1.8 2.71 1 1 56 1 . . . . . 2.765 1.8 3.73 1 1 57 1 . . . . . 3.45 1.8 5.1 1 1 58 1 . . . . . 3.495 1.8 5.19 1 1 59 1 . . . . . 3.03 1.8 4.26 1 1 60 1 . . . . . 3.67 1.8 5.54 1 1 61 1 . . . . . 2.365 1.8 2.93 1 1 62 1 . . . . . 2.64 1.8 3.48 1 1 63 1 . . . . . 3.44 1.8 5.08 1 1 64 1 . . . . . 2.765 1.8 3.73 1 1 65 1 . . . . . 2.675 1.8 3.55 1 1 66 1 . . . . . 2.535 1.8 3.27 1 1 67 1 . . . . . 2.72 1.8 3.64 1 1 68 1 . . . . . 2.58 1.8 3.36 1 1 69 1 . . . . . 2.58 1.8 3.36 1 1 70 1 . . . . . 2.315 1.8 2.83 1 1 71 1 . . . . . 4.03 1.8 6.26 1 1 72 1 . . . . . 3.65 1.8 5.5 1 1 73 1 . . . . . 3.65 1.8 5.5 1 1 74 1 . . . . . 3.89 1.8 5.98 1 1 75 1 . . . . . 4.09 1.8 6.38 1 1 76 1 . . . . . 3.4 1.8 5.0 1 1 77 1 . . . . . 3.65 1.8 5.5 1 1 78 1 . . . . . 3.625 1.8 5.45 1 1 79 1 . . . . . 4.09 1.8 6.38 1 1 80 1 . . . . . 4.635 1.8 7.47 1 1 81 1 . . . . . 4.715 1.8 7.63 1 1 82 1 . . . . . 4.715 1.8 7.63 1 1 83 1 . . . . . 4.715 1.8 7.63 1 1 84 1 . . . . . 4.265 1.8 6.73 1 1 85 1 . . . . . 3.605 1.8 5.41 1 1 86 1 . . . . . 3.65 1.8 5.5 1 1 87 1 . . . . . 3.65 1.8 5.5 1 1 88 1 . . . . . 3.65 1.8 5.5 1 1 89 1 . . . . . 3.65 1.8 5.5 1 1 90 1 . . . . . 3.65 1.8 5.5 1 1 91 1 . . . . . 3.65 1.8 5.5 1 1 92 1 . . . . . 3.65 1.8 5.5 1 1 93 1 . . . . . 4.715 1.8 7.63 1 1 94 1 . . . . . 4.715 1.8 7.63 1 1 95 1 . . . . . 3.69 1.8 5.58 1 1 96 1 . . . . . 4.315 1.8 6.83 1 1 97 1 . . . . . 4.715 1.8 7.63 1 1 98 1 . . . . . 2.505 1.8 3.21 1 1 99 1 . . . . . 3.34 1.8 4.88 1 1 100 1 . . . . . 2.365 1.8 2.93 1 1 101 1 . . . . . 2.485 1.8 3.17 1 1 102 1 . . . . . 2.795 1.8 3.79 1 1 103 1 . . . . . 3.795 1.8 5.79 1 1 104 1 . . . . . 3.435 1.8 5.07 1 1 105 1 . . . . . 3.34 1.8 4.88 1 1 106 1 . . . . . 2.875 1.8 3.95 1 1 107 1 . . . . . 2.965 1.8 4.13 1 1 108 1 . . . . . 4.16 1.8 6.52 1 1 109 1 . . . . . 4.16 1.8 6.52 1 1 110 1 . . . . . 3.4 1.8 5.0 1 1 111 1 . . . . . 3.57 1.8 5.34 1 1 112 1 . . . . . 3.6 1.8 5.4 1 1 113 1 . . . . . 4.11 1.8 6.42 1 1 114 1 . . . . . 2.715 1.8 3.63 1 1 115 1 . . . . . 4.265 1.8 6.73 1 1 116 1 . . . . . 3.31 1.8 4.82 1 1 117 1 . . . . . 2.37 1.8 2.94 1 1 118 1 . . . . . 3.2 1.8 4.6 1 1 119 1 . . . . . 2.565 1.8 3.33 1 1 120 1 . . . . . 3.57 1.8 5.34 1 1 121 1 . . . . . 2.36 1.8 2.92 1 1 122 1 . . . . . 2.14 1.8 2.48 1 1 123 1 . . . . . 2.48 1.8 3.16 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_3_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 . . . 1 2 7 1 . . . 1 2 8 1 . . . 1 2 9 1 . . . 1 2 10 1 . . . 1 2 11 1 . . . 1 2 12 1 . . . 1 2 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 ASN O . 2 . O 1 2 1 1 2 1 1 5 CYS H . 5 . HN 1 2 2 1 1 1 1 2 ASN O . 2 . O 1 2 2 1 2 1 1 5 CYS N . 5 . N 1 2 3 1 1 1 1 3 TRP O . 3 . O 1 2 3 1 2 1 1 6 CYS H . 6 . HN 1 2 4 1 1 1 1 3 TRP O . 3 . O 1 2 4 1 2 1 1 6 CYS N . 6 . N 1 2 5 1 1 1 1 4 ARG O . 4 . O 1 2 5 1 2 1 1 7 LEU H . 7 . HN 1 2 6 1 1 1 1 4 ARG O . 4 . O 1 2 6 1 2 1 1 7 LEU N . 7 . N 1 2 7 1 1 1 1 5 CYS O . 5 . O 1 2 7 1 2 1 1 8 ILE H . 8 . HN 1 2 8 1 1 1 1 5 CYS O . 5 . O 1 2 8 1 2 1 1 8 ILE N . 8 . N 1 2 9 1 1 1 1 8 ILE O . 8 . O 1 2 9 1 2 1 1 11 CYS H . 11 . HN 1 2 10 1 1 1 1 8 ILE O . 8 . O 1 2 10 1 2 1 1 11 CYS N . 11 . N 1 2 11 1 1 1 1 15 HIS O . 15 . O 1 2 11 1 2 1 1 19 CYS H . 19 . HN 1 2 12 1 1 1 1 15 HIS O . 15 . O 1 2 12 1 2 1 1 19 CYS N . 19 . N 1 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 1.9 1.8 2.0 1 2 2 1 . . . . . 2.4 1.8 3.0 1 2 3 1 . . . . . 1.9 1.8 2.0 1 2 4 1 . . . . . 2.4 1.8 3.0 1 2 5 1 . . . . . 1.9 1.8 2.0 1 2 6 1 . . . . . 2.4 1.8 3.0 1 2 7 1 . . . . . 1.9 1.8 2.0 1 2 8 1 . . . . . 2.4 1.8 3.0 1 2 9 1 . . . . . 1.9 1.8 2.0 1 2 10 1 . . . . . 2.4 1.8 3.0 1 2 11 1 . . . . . 1.9 1.8 2.0 1 2 12 1 . . . . . 2.4 1.8 3.0 1 2 stop_ save_ save_CNS/XPLOR_dihedral_4 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 1 1 1 PHE C 1 1 2 ASN N 1 1 2 ASN CA 1 1 2 ASN C -150.0 -89.99999 . 1 . C . 2 . N . 2 . CA . 2 . C 1 1 2 . 1 1 2 ASN C 1 1 3 TRP N 1 1 3 TRP CA 1 1 3 TRP C -89.99999 -30.0 . 2 . C . 3 . N . 3 . CA . 3 . C 1 1 3 . 1 1 3 TRP C 1 1 4 ARG N 1 1 4 ARG CA 1 1 4 ARG C -89.99999 -30.0 . 3 . C . 4 . N . 4 . CA . 4 . C 1 1 4 . 1 1 4 ARG C 1 1 5 CYS N 1 1 5 CYS CA 1 1 5 CYS C -89.99999 -30.0 . 4 . C . 5 . N . 5 . CA . 5 . C 1 1 5 . 1 1 5 CYS C 1 1 6 CYS N 1 1 6 CYS CA 1 1 6 CYS C -179.99998 -20.0 . 5 . C . 6 . N . 6 . CA . 6 . C 1 1 6 . 1 1 6 CYS C 1 1 7 LEU N 1 1 7 LEU CA 1 1 7 LEU C -150.0 -89.99999 . 6 . C . 7 . N . 7 . CA . 7 . C 1 1 7 . 1 1 7 LEU C 1 1 8 ILE N 1 1 8 ILE CA 1 1 8 ILE C -150.0 -89.99999 . 7 . C . 8 . N . 8 . CA . 8 . C 1 1 8 . 1 1 9 PRO C 1 1 10 ALA N 1 1 10 ALA CA 1 1 10 ALA C -89.99999 -30.0 . 9 . C . 10 . N . 10 . CA . 10 . C 1 1 9 . 1 1 10 ALA C 1 1 11 CYS N 1 1 11 CYS CA 1 1 11 CYS C -150.0 -89.99999 . 10 . C . 11 . N . 11 . CA . 11 . C 1 1 10 . 1 1 11 CYS C 1 1 12 ARG N 1 1 12 ARG CA 1 1 12 ARG C -89.99999 -30.0 . 11 . C . 12 . N . 12 . CA . 12 . C 1 1 11 . 1 1 12 ARG C 1 1 13 ARG N 1 1 13 ARG CA 1 1 13 ARG C -89.99999 -30.0 . 12 . C . 13 . N . 13 . CA . 13 . C 1 1 12 . 1 1 13 ARG C 1 1 14 ASN N 1 1 14 ASN CA 1 1 14 ASN C -150.0 -89.99999 . 13 . C . 14 . N . 14 . CA . 14 . C 1 1 13 . 1 1 14 ASN C 1 1 15 HIS N 1 1 15 HIS CA 1 1 15 HIS C -150.0 -89.99999 . 14 . C . 15 . N . 15 . CA . 15 . C 1 1 14 . 1 1 15 HIS C 1 1 16 LYS N 1 1 16 LYS CA 1 1 16 LYS C -89.99999 -30.0 . 15 . C . 16 . N . 16 . CA . 16 . C 1 1 15 . 1 1 16 LYS C 1 1 17 LYS N 1 1 17 LYS CA 1 1 17 LYS C -89.99999 -30.0 . 16 . C . 17 . N . 17 . CA . 17 . C 1 1 16 . 1 1 18 PHE C 1 1 19 CYS N 1 1 19 CYS CA 1 1 19 CYS C -89.99999 -30.0 . 18 . C . 19 . N . 19 . CA . 19 . C 1 1 17 . 1 1 4 ARG N 1 1 4 ARG CA 1 1 4 ARG CB 1 1 4 ARG CG -89.99999 -30.0 . 4 . N . 4 . CA . 4 . CB . 4 . CG 1 1 18 . 1 1 5 CYS N 1 1 5 CYS CA 1 1 5 CYS CB 1 1 5 CYS SG -89.99999 -30.0 . 5 . N . 5 . CA . 5 . CB . 5 . SG 1 1 19 . 1 1 6 CYS N 1 1 6 CYS CA 1 1 6 CYS CB 1 1 6 CYS SG -89.99999 -30.0 . 6 . N . 6 . CA . 6 . CB . 6 . SG 1 1 20 . 1 1 7 LEU N 1 1 7 LEU CA 1 1 7 LEU CB 1 1 7 LEU CG -89.99999 -30.0 . 7 . N . 7 . CA . 7 . CB . 7 . CG 1 1 21 . 1 1 11 CYS N 1 1 11 CYS CA 1 1 11 CYS CB 1 1 11 CYS SG -210.0 -150.0 . 11 . N . 11 . CA . 11 . CB . 11 . SG 1 1 22 . 1 1 12 ARG N 1 1 12 ARG CA 1 1 12 ARG CB 1 1 12 ARG CG -210.0 -150.0 . 12 . N . 12 . CA . 12 . CB . 12 . CG 1 1 23 . 1 1 15 HIS N 1 1 15 HIS CA 1 1 15 HIS CB 1 1 15 HIS CG -89.99999 -30.0 . 15 . N . 15 . CA . 15 . CB . 15 . CG 1 1 24 . 1 1 19 CYS N 1 1 19 CYS CA 1 1 19 CYS CB 1 1 19 CYS SG -89.99999 -30.0 . 19 . N . 19 . CA . 19 . CB . 19 . SG 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 PHE C C 1.698 6.381 -5.220 1.00 . A A . 1 PHE C 1 1 1 2 1 1 1 PHE CA C 3.172 6.248 -5.577 1.00 . A A . 1 PHE CA 1 1 1 3 1 1 1 PHE CB C 4.019 6.115 -4.301 1.00 . A A . 1 PHE CB 1 1 1 4 1 1 1 PHE CD1 C 3.686 3.692 -3.723 1.00 . A A . 1 PHE CD1 1 1 1 5 1 1 1 PHE CD2 C 2.992 5.340 -2.144 1.00 . A A . 1 PHE CD2 1 1 1 6 1 1 1 PHE CE1 C 3.259 2.692 -2.870 1.00 . A A . 1 PHE CE1 1 1 1 7 1 1 1 PHE CE2 C 2.562 4.344 -1.288 1.00 . A A . 1 PHE CE2 1 1 1 8 1 1 1 PHE CG C 3.558 5.025 -3.370 1.00 . A A . 1 PHE CG 1 1 1 9 1 1 1 PHE CZ C 2.695 3.019 -1.652 1.00 . A A . 1 PHE CZ 1 1 1 10 1 1 1 PHE H1 H 4.629 7.374 -6.552 1.00 . A A . 1 PHE H1 1 1 1 11 1 1 1 PHE H2 H 3.412 8.298 -5.822 1.00 . A A . 1 PHE H2 1 1 1 12 1 1 1 PHE H3 H 3.095 7.469 -7.260 1.00 . A A . 1 PHE H3 1 1 1 13 1 1 1 PHE HA H 3.305 5.366 -6.187 1.00 . A A . 1 PHE HA 1 1 1 14 1 1 1 PHE HB2 H 5.040 5.899 -4.579 1.00 . A A . 1 PHE HB2 1 1 1 15 1 1 1 PHE HB3 H 3.989 7.049 -3.762 1.00 . A A . 1 PHE HB3 1 1 1 16 1 1 1 PHE HD1 H 4.126 3.435 -4.675 1.00 . A A . 1 PHE HD1 1 1 1 17 1 1 1 PHE HD2 H 2.887 6.376 -1.860 1.00 . A A . 1 PHE HD2 1 1 1 18 1 1 1 PHE HE1 H 3.365 1.657 -3.157 1.00 . A A . 1 PHE HE1 1 1 1 19 1 1 1 PHE HE2 H 2.124 4.603 -0.336 1.00 . A A . 1 PHE HE2 1 1 1 20 1 1 1 PHE HZ H 2.361 2.239 -0.986 1.00 . A A . 1 PHE HZ 1 1 1 21 1 1 1 PHE N N 3.610 7.428 -6.357 1.00 . A A . 1 PHE N 1 1 1 22 1 1 1 PHE O O 1.220 7.482 -4.962 1.00 . A A . 1 PHE O 1 1 1 23 1 1 2 ASN C C -0.626 5.011 -3.402 1.00 . A A . 2 ASN C 1 1 1 24 1 1 2 ASN CA C -0.434 5.264 -4.892 1.00 . A A . 2 ASN CA 1 1 1 25 1 1 2 ASN CB C -1.175 4.196 -5.703 1.00 . A A . 2 ASN CB 1 1 1 26 1 1 2 ASN CG C -2.668 4.188 -5.429 1.00 . A A . 2 ASN CG 1 1 1 27 1 1 2 ASN H H 1.420 4.415 -5.444 1.00 . A A . 2 ASN H 1 1 1 28 1 1 2 ASN HA H -0.834 6.236 -5.137 1.00 . A A . 2 ASN HA 1 1 1 29 1 1 2 ASN HB2 H -1.023 4.382 -6.755 1.00 . A A . 2 ASN HB2 1 1 1 30 1 1 2 ASN HB3 H -0.777 3.223 -5.452 1.00 . A A . 2 ASN HB3 1 1 1 31 1 1 2 ASN HD21 H -2.739 2.224 -5.728 1.00 . A A . 2 ASN HD21 1 1 1 32 1 1 2 ASN HD22 H -4.242 2.982 -5.342 1.00 . A A . 2 ASN HD22 1 1 1 33 1 1 2 ASN N N 0.984 5.264 -5.223 1.00 . A A . 2 ASN N 1 1 1 34 1 1 2 ASN ND2 N -3.278 3.015 -5.505 1.00 . A A . 2 ASN ND2 1 1 1 35 1 1 2 ASN O O -0.611 3.864 -2.954 1.00 . A A . 2 ASN O 1 1 1 36 1 1 2 ASN OD1 O -3.267 5.227 -5.144 1.00 . A A . 2 ASN OD1 1 1 1 37 1 1 3 TRP C C -2.252 5.197 -0.860 1.00 . A A . 3 TRP C 1 1 1 38 1 1 3 TRP CA C -0.995 5.992 -1.196 1.00 . A A . 3 TRP CA 1 1 1 39 1 1 3 TRP CB C -1.070 7.392 -0.572 1.00 . A A . 3 TRP CB 1 1 1 40 1 1 3 TRP CD1 C -1.692 9.150 -2.334 1.00 . A A . 3 TRP CD1 1 1 1 41 1 1 3 TRP CD2 C -3.391 8.544 -1.007 1.00 . A A . 3 TRP CD2 1 1 1 42 1 1 3 TRP CE2 C -3.857 9.504 -1.926 1.00 . A A . 3 TRP CE2 1 1 1 43 1 1 3 TRP CE3 C -4.287 8.017 -0.071 1.00 . A A . 3 TRP CE3 1 1 1 44 1 1 3 TRP CG C -2.001 8.327 -1.289 1.00 . A A . 3 TRP CG 1 1 1 45 1 1 3 TRP CH2 C -6.031 9.415 -1.008 1.00 . A A . 3 TRP CH2 1 1 1 46 1 1 3 TRP CZ2 C -5.177 9.946 -1.935 1.00 . A A . 3 TRP CZ2 1 1 1 47 1 1 3 TRP CZ3 C -5.596 8.460 -0.081 1.00 . A A . 3 TRP CZ3 1 1 1 48 1 1 3 TRP H H -0.801 6.971 -3.064 1.00 . A A . 3 TRP H 1 1 1 49 1 1 3 TRP HA H -0.142 5.473 -0.788 1.00 . A A . 3 TRP HA 1 1 1 50 1 1 3 TRP HB2 H -1.410 7.304 0.448 1.00 . A A . 3 TRP HB2 1 1 1 51 1 1 3 TRP HB3 H -0.083 7.833 -0.580 1.00 . A A . 3 TRP HB3 1 1 1 52 1 1 3 TRP HD1 H -0.711 9.220 -2.781 1.00 . A A . 3 TRP HD1 1 1 1 53 1 1 3 TRP HE1 H -2.832 10.508 -3.456 1.00 . A A . 3 TRP HE1 1 1 1 54 1 1 3 TRP HE3 H -3.971 7.280 0.652 1.00 . A A . 3 TRP HE3 1 1 1 55 1 1 3 TRP HH2 H -7.063 9.732 -0.978 1.00 . A A . 3 TRP HH2 1 1 1 56 1 1 3 TRP HZ2 H -5.529 10.682 -2.643 1.00 . A A . 3 TRP HZ2 1 1 1 57 1 1 3 TRP HZ3 H -6.302 8.065 0.635 1.00 . A A . 3 TRP HZ3 1 1 1 58 1 1 3 TRP N N -0.803 6.086 -2.643 1.00 . A A . 3 TRP N 1 1 1 59 1 1 3 TRP NE1 N -2.802 9.855 -2.726 1.00 . A A . 3 TRP NE1 1 1 1 60 1 1 3 TRP O O -2.379 4.635 0.228 1.00 . A A . 3 TRP O 1 1 1 61 1 1 4 ARG C C -4.159 2.928 -1.430 1.00 . A A . 4 ARG C 1 1 1 62 1 1 4 ARG CA C -4.417 4.405 -1.637 1.00 . A A . 4 ARG CA 1 1 1 63 1 1 4 ARG CB C -5.325 4.607 -2.842 1.00 . A A . 4 ARG CB 1 1 1 64 1 1 4 ARG CD C -6.898 6.147 -4.044 1.00 . A A . 4 ARG CD 1 1 1 65 1 1 4 ARG CG C -6.255 5.801 -2.713 1.00 . A A . 4 ARG CG 1 1 1 66 1 1 4 ARG CZ C -7.503 8.403 -4.847 1.00 . A A . 4 ARG CZ 1 1 1 67 1 1 4 ARG H H -2.994 5.584 -2.667 1.00 . A A . 4 ARG H 1 1 1 68 1 1 4 ARG HA H -4.894 4.792 -0.760 1.00 . A A . 4 ARG HA 1 1 1 69 1 1 4 ARG HB2 H -4.710 4.753 -3.718 1.00 . A A . 4 ARG HB2 1 1 1 70 1 1 4 ARG HB3 H -5.918 3.719 -2.976 1.00 . A A . 4 ARG HB3 1 1 1 71 1 1 4 ARG HD2 H -6.124 6.242 -4.790 1.00 . A A . 4 ARG HD2 1 1 1 72 1 1 4 ARG HD3 H -7.570 5.350 -4.323 1.00 . A A . 4 ARG HD3 1 1 1 73 1 1 4 ARG HE H -8.302 7.495 -3.250 1.00 . A A . 4 ARG HE 1 1 1 74 1 1 4 ARG HG2 H -7.030 5.565 -1.999 1.00 . A A . 4 ARG HG2 1 1 1 75 1 1 4 ARG HG3 H -5.688 6.651 -2.364 1.00 . A A . 4 ARG HG3 1 1 1 76 1 1 4 ARG HH11 H -6.062 7.476 -5.933 1.00 . A A . 4 ARG HH11 1 1 1 77 1 1 4 ARG HH12 H -6.509 9.053 -6.493 1.00 . A A . 4 ARG HH12 1 1 1 78 1 1 4 ARG HH21 H -8.897 9.589 -3.974 1.00 . A A . 4 ARG HH21 1 1 1 79 1 1 4 ARG HH22 H -8.128 10.261 -5.372 1.00 . A A . 4 ARG HH22 1 1 1 80 1 1 4 ARG N N -3.168 5.132 -1.816 1.00 . A A . 4 ARG N 1 1 1 81 1 1 4 ARG NE N -7.650 7.401 -3.980 1.00 . A A . 4 ARG NE 1 1 1 82 1 1 4 ARG NH1 N -6.620 8.304 -5.837 1.00 . A A . 4 ARG NH1 1 1 1 83 1 1 4 ARG NH2 N -8.234 9.507 -4.721 1.00 . A A . 4 ARG NH2 1 1 1 84 1 1 4 ARG O O -4.981 2.214 -0.863 1.00 . A A . 4 ARG O 1 1 1 85 1 1 5 CYS C C -2.514 0.738 -0.281 1.00 . A A . 5 CYS C 1 1 1 86 1 1 5 CYS CA C -2.606 1.102 -1.750 1.00 . A A . 5 CYS CA 1 1 1 87 1 1 5 CYS CB C -1.252 0.869 -2.410 1.00 . A A . 5 CYS CB 1 1 1 88 1 1 5 CYS H H -2.423 3.120 -2.357 1.00 . A A . 5 CYS H 1 1 1 89 1 1 5 CYS HA H -3.348 0.478 -2.226 1.00 . A A . 5 CYS HA 1 1 1 90 1 1 5 CYS HB2 H -0.663 1.770 -2.318 1.00 . A A . 5 CYS HB2 1 1 1 91 1 1 5 CYS HB3 H -0.747 0.062 -1.900 1.00 . A A . 5 CYS HB3 1 1 1 92 1 1 5 CYS N N -3.013 2.488 -1.897 1.00 . A A . 5 CYS N 1 1 1 93 1 1 5 CYS O O -2.813 -0.386 0.110 1.00 . A A . 5 CYS O 1 1 1 94 1 1 5 CYS SG S -1.350 0.438 -4.176 1.00 . A A . 5 CYS SG 1 1 1 95 1 1 6 CYS C C -3.362 1.296 2.625 1.00 . A A . 6 CYS C 1 1 1 96 1 1 6 CYS CA C -2.000 1.488 1.969 1.00 . A A . 6 CYS CA 1 1 1 97 1 1 6 CYS CB C -1.246 2.651 2.608 1.00 . A A . 6 CYS CB 1 1 1 98 1 1 6 CYS H H -1.976 2.615 0.167 1.00 . A A . 6 CYS H 1 1 1 99 1 1 6 CYS HA H -1.425 0.581 2.102 1.00 . A A . 6 CYS HA 1 1 1 100 1 1 6 CYS HB2 H -1.927 3.474 2.769 1.00 . A A . 6 CYS HB2 1 1 1 101 1 1 6 CYS HB3 H -0.844 2.327 3.557 1.00 . A A . 6 CYS HB3 1 1 1 102 1 1 6 CYS N N -2.144 1.712 0.536 1.00 . A A . 6 CYS N 1 1 1 103 1 1 6 CYS O O -3.458 0.848 3.767 1.00 . A A . 6 CYS O 1 1 1 104 1 1 6 CYS SG S 0.142 3.260 1.596 1.00 . A A . 6 CYS SG 1 1 1 105 1 1 7 LEU C C -6.332 0.142 1.899 1.00 . A A . 7 LEU C 1 1 1 106 1 1 7 LEU CA C -5.770 1.467 2.389 1.00 . A A . 7 LEU CA 1 1 1 107 1 1 7 LEU CB C -6.655 2.628 1.928 1.00 . A A . 7 LEU CB 1 1 1 108 1 1 7 LEU CD1 C -6.961 5.091 1.571 1.00 . A A . 7 LEU CD1 1 1 1 109 1 1 7 LEU CD2 C -6.095 4.248 3.759 1.00 . A A . 7 LEU CD2 1 1 1 110 1 1 7 LEU CG C -6.120 4.025 2.254 1.00 . A A . 7 LEU CG 1 1 1 111 1 1 7 LEU H H -4.272 2.003 0.998 1.00 . A A . 7 LEU H 1 1 1 112 1 1 7 LEU HA H -5.729 1.450 3.463 1.00 . A A . 7 LEU HA 1 1 1 113 1 1 7 LEU HB2 H -6.779 2.554 0.857 1.00 . A A . 7 LEU HB2 1 1 1 114 1 1 7 LEU HB3 H -7.624 2.521 2.393 1.00 . A A . 7 LEU HB3 1 1 1 115 1 1 7 LEU HD11 H -6.566 6.068 1.809 1.00 . A A . 7 LEU HD11 1 1 1 116 1 1 7 LEU HD12 H -7.982 5.021 1.918 1.00 . A A . 7 LEU HD12 1 1 1 117 1 1 7 LEU HD13 H -6.933 4.941 0.502 1.00 . A A . 7 LEU HD13 1 1 1 118 1 1 7 LEU HD21 H -5.452 3.514 4.222 1.00 . A A . 7 LEU HD21 1 1 1 119 1 1 7 LEU HD22 H -7.095 4.152 4.155 1.00 . A A . 7 LEU HD22 1 1 1 120 1 1 7 LEU HD23 H -5.719 5.239 3.970 1.00 . A A . 7 LEU HD23 1 1 1 121 1 1 7 LEU HG H -5.108 4.111 1.885 1.00 . A A . 7 LEU HG 1 1 1 122 1 1 7 LEU N N -4.412 1.630 1.894 1.00 . A A . 7 LEU N 1 1 1 123 1 1 7 LEU O O -7.348 -0.346 2.390 1.00 . A A . 7 LEU O 1 1 1 124 1 1 8 ILE C C -5.060 -2.813 0.797 1.00 . A A . 8 ILE C 1 1 1 125 1 1 8 ILE CA C -6.025 -1.718 0.358 1.00 . A A . 8 ILE CA 1 1 1 126 1 1 8 ILE CB C -6.044 -1.646 -1.188 1.00 . A A . 8 ILE CB 1 1 1 127 1 1 8 ILE CD1 C -8.389 -0.628 -1.248 1.00 . A A . 8 ILE CD1 1 1 1 128 1 1 8 ILE CG1 C -6.938 -0.495 -1.667 1.00 . A A . 8 ILE CG1 1 1 1 129 1 1 8 ILE CG2 C -6.512 -2.969 -1.781 1.00 . A A . 8 ILE CG2 1 1 1 130 1 1 8 ILE H H -4.795 -0.024 0.646 1.00 . A A . 8 ILE H 1 1 1 131 1 1 8 ILE HA H -7.020 -1.958 0.706 1.00 . A A . 8 ILE HA 1 1 1 132 1 1 8 ILE HB H -5.033 -1.470 -1.527 1.00 . A A . 8 ILE HB 1 1 1 133 1 1 8 ILE HD11 H -8.952 0.211 -1.631 1.00 . A A . 8 ILE HD11 1 1 1 134 1 1 8 ILE HD12 H -8.454 -0.641 -0.170 1.00 . A A . 8 ILE HD12 1 1 1 135 1 1 8 ILE HD13 H -8.797 -1.546 -1.645 1.00 . A A . 8 ILE HD13 1 1 1 136 1 1 8 ILE HG12 H -6.563 0.433 -1.263 1.00 . A A . 8 ILE HG12 1 1 1 137 1 1 8 ILE HG13 H -6.907 -0.451 -2.745 1.00 . A A . 8 ILE HG13 1 1 1 138 1 1 8 ILE HG21 H -7.511 -3.188 -1.433 1.00 . A A . 8 ILE HG21 1 1 1 139 1 1 8 ILE HG22 H -5.844 -3.760 -1.473 1.00 . A A . 8 ILE HG22 1 1 1 140 1 1 8 ILE HG23 H -6.515 -2.900 -2.859 1.00 . A A . 8 ILE HG23 1 1 1 141 1 1 8 ILE N N -5.628 -0.448 0.946 1.00 . A A . 8 ILE N 1 1 1 142 1 1 8 ILE O O -3.914 -2.849 0.356 1.00 . A A . 8 ILE O 1 1 1 143 1 1 9 PRO C C -3.888 -5.563 1.142 1.00 . A A . 9 PRO C 1 1 1 144 1 1 9 PRO CA C -4.711 -4.829 2.202 1.00 . A A . 9 PRO CA 1 1 1 145 1 1 9 PRO CB C -5.756 -5.765 2.807 1.00 . A A . 9 PRO CB 1 1 1 146 1 1 9 PRO CD C -6.905 -3.761 2.191 1.00 . A A . 9 PRO CD 1 1 1 147 1 1 9 PRO CG C -6.872 -4.867 3.211 1.00 . A A . 9 PRO CG 1 1 1 148 1 1 9 PRO HA H -4.050 -4.481 2.982 1.00 . A A . 9 PRO HA 1 1 1 149 1 1 9 PRO HB2 H -6.073 -6.482 2.065 1.00 . A A . 9 PRO HB2 1 1 1 150 1 1 9 PRO HB3 H -5.335 -6.279 3.658 1.00 . A A . 9 PRO HB3 1 1 1 151 1 1 9 PRO HD2 H -7.611 -3.994 1.407 1.00 . A A . 9 PRO HD2 1 1 1 152 1 1 9 PRO HD3 H -7.160 -2.822 2.662 1.00 . A A . 9 PRO HD3 1 1 1 153 1 1 9 PRO HG2 H -7.804 -5.412 3.204 1.00 . A A . 9 PRO HG2 1 1 1 154 1 1 9 PRO HG3 H -6.680 -4.463 4.194 1.00 . A A . 9 PRO HG3 1 1 1 155 1 1 9 PRO N N -5.526 -3.727 1.665 1.00 . A A . 9 PRO N 1 1 1 156 1 1 9 PRO O O -2.757 -5.967 1.401 1.00 . A A . 9 PRO O 1 1 1 157 1 1 10 ALA C C -2.562 -5.624 -1.654 1.00 . A A . 10 ALA C 1 1 1 158 1 1 10 ALA CA C -3.775 -6.403 -1.143 1.00 . A A . 10 ALA CA 1 1 1 159 1 1 10 ALA CB C -4.752 -6.661 -2.280 1.00 . A A . 10 ALA CB 1 1 1 160 1 1 10 ALA H H -5.348 -5.345 -0.200 1.00 . A A . 10 ALA H 1 1 1 161 1 1 10 ALA HA H -3.441 -7.361 -0.769 1.00 . A A . 10 ALA HA 1 1 1 162 1 1 10 ALA HB1 H -4.262 -7.238 -3.051 1.00 . A A . 10 ALA HB1 1 1 1 163 1 1 10 ALA HB2 H -5.082 -5.718 -2.691 1.00 . A A . 10 ALA HB2 1 1 1 164 1 1 10 ALA HB3 H -5.604 -7.210 -1.906 1.00 . A A . 10 ALA HB3 1 1 1 165 1 1 10 ALA N N -4.452 -5.710 -0.050 1.00 . A A . 10 ALA N 1 1 1 166 1 1 10 ALA O O -1.536 -6.212 -1.986 1.00 . A A . 10 ALA O 1 1 1 167 1 1 11 CYS C C -0.636 -3.094 -1.043 1.00 . A A . 11 CYS C 1 1 1 168 1 1 11 CYS CA C -1.573 -3.475 -2.185 1.00 . A A . 11 CYS CA 1 1 1 169 1 1 11 CYS CB C -2.115 -2.222 -2.881 1.00 . A A . 11 CYS CB 1 1 1 170 1 1 11 CYS H H -3.489 -3.873 -1.366 1.00 . A A . 11 CYS H 1 1 1 171 1 1 11 CYS HA H -1.019 -4.062 -2.904 1.00 . A A . 11 CYS HA 1 1 1 172 1 1 11 CYS HB2 H -3.069 -2.454 -3.332 1.00 . A A . 11 CYS HB2 1 1 1 173 1 1 11 CYS HB3 H -2.252 -1.441 -2.146 1.00 . A A . 11 CYS HB3 1 1 1 174 1 1 11 CYS N N -2.669 -4.303 -1.693 1.00 . A A . 11 CYS N 1 1 1 175 1 1 11 CYS O O 0.575 -2.970 -1.232 1.00 . A A . 11 CYS O 1 1 1 176 1 1 11 CYS SG S -1.026 -1.569 -4.194 1.00 . A A . 11 CYS SG 1 1 1 177 1 1 12 ARG C C 0.510 -3.708 1.707 1.00 . A A . 12 ARG C 1 1 1 178 1 1 12 ARG CA C -0.433 -2.574 1.333 1.00 . A A . 12 ARG CA 1 1 1 179 1 1 12 ARG CB C -1.377 -2.280 2.495 1.00 . A A . 12 ARG CB 1 1 1 180 1 1 12 ARG CD C -1.688 -1.350 4.811 1.00 . A A . 12 ARG CD 1 1 1 181 1 1 12 ARG CG C -0.686 -1.718 3.727 1.00 . A A . 12 ARG CG 1 1 1 182 1 1 12 ARG CZ C -3.838 -2.468 5.316 1.00 . A A . 12 ARG CZ 1 1 1 183 1 1 12 ARG H H -2.179 -3.030 0.225 1.00 . A A . 12 ARG H 1 1 1 184 1 1 12 ARG HA H 0.145 -1.690 1.110 1.00 . A A . 12 ARG HA 1 1 1 185 1 1 12 ARG HB2 H -2.116 -1.573 2.165 1.00 . A A . 12 ARG HB2 1 1 1 186 1 1 12 ARG HB3 H -1.874 -3.193 2.776 1.00 . A A . 12 ARG HB3 1 1 1 187 1 1 12 ARG HD2 H -1.149 -0.974 5.667 1.00 . A A . 12 ARG HD2 1 1 1 188 1 1 12 ARG HD3 H -2.339 -0.576 4.429 1.00 . A A . 12 ARG HD3 1 1 1 189 1 1 12 ARG HE H -2.029 -3.315 5.474 1.00 . A A . 12 ARG HE 1 1 1 190 1 1 12 ARG HG2 H -0.007 -2.461 4.118 1.00 . A A . 12 ARG HG2 1 1 1 191 1 1 12 ARG HG3 H -0.132 -0.834 3.445 1.00 . A A . 12 ARG HG3 1 1 1 192 1 1 12 ARG HH11 H -4.018 -0.557 4.641 1.00 . A A . 12 ARG HH11 1 1 1 193 1 1 12 ARG HH12 H -5.510 -1.352 5.034 1.00 . A A . 12 ARG HH12 1 1 1 194 1 1 12 ARG HH21 H -3.998 -4.370 5.998 1.00 . A A . 12 ARG HH21 1 1 1 195 1 1 12 ARG HH22 H -5.497 -3.523 5.812 1.00 . A A . 12 ARG HH22 1 1 1 196 1 1 12 ARG N N -1.204 -2.927 0.145 1.00 . A A . 12 ARG N 1 1 1 197 1 1 12 ARG NE N -2.504 -2.492 5.230 1.00 . A A . 12 ARG NE 1 1 1 198 1 1 12 ARG NH1 N -4.511 -1.374 4.971 1.00 . A A . 12 ARG NH1 1 1 1 199 1 1 12 ARG NH2 N -4.497 -3.541 5.741 1.00 . A A . 12 ARG NH2 1 1 1 200 1 1 12 ARG O O 1.579 -3.485 2.266 1.00 . A A . 12 ARG O 1 1 1 201 1 1 13 ARG C C 2.182 -6.095 0.874 1.00 . A A . 13 ARG C 1 1 1 202 1 1 13 ARG CA C 0.883 -6.111 1.680 1.00 . A A . 13 ARG CA 1 1 1 203 1 1 13 ARG CB C 0.070 -7.372 1.359 1.00 . A A . 13 ARG CB 1 1 1 204 1 1 13 ARG CD C 1.257 -8.835 3.043 1.00 . A A . 13 ARG CD 1 1 1 205 1 1 13 ARG CG C 0.808 -8.684 1.596 1.00 . A A . 13 ARG CG 1 1 1 206 1 1 13 ARG CZ C 3.437 -8.843 4.210 1.00 . A A . 13 ARG CZ 1 1 1 207 1 1 13 ARG H H -0.798 -5.023 0.987 1.00 . A A . 13 ARG H 1 1 1 208 1 1 13 ARG HA H 1.128 -6.105 2.730 1.00 . A A . 13 ARG HA 1 1 1 209 1 1 13 ARG HB2 H -0.819 -7.372 1.971 1.00 . A A . 13 ARG HB2 1 1 1 210 1 1 13 ARG HB3 H -0.226 -7.335 0.320 1.00 . A A . 13 ARG HB3 1 1 1 211 1 1 13 ARG HD2 H 0.621 -8.227 3.669 1.00 . A A . 13 ARG HD2 1 1 1 212 1 1 13 ARG HD3 H 1.161 -9.871 3.330 1.00 . A A . 13 ARG HD3 1 1 1 213 1 1 13 ARG HE H 3.014 -7.780 2.562 1.00 . A A . 13 ARG HE 1 1 1 214 1 1 13 ARG HG2 H 0.150 -9.504 1.349 1.00 . A A . 13 ARG HG2 1 1 1 215 1 1 13 ARG HG3 H 1.677 -8.715 0.956 1.00 . A A . 13 ARG HG3 1 1 1 216 1 1 13 ARG HH11 H 2.026 -10.016 5.070 1.00 . A A . 13 ARG HH11 1 1 1 217 1 1 13 ARG HH12 H 3.566 -10.016 5.860 1.00 . A A . 13 ARG HH12 1 1 1 218 1 1 13 ARG HH21 H 5.047 -7.776 3.595 1.00 . A A . 13 ARG HH21 1 1 1 219 1 1 13 ARG HH22 H 5.296 -8.735 5.016 1.00 . A A . 13 ARG HH22 1 1 1 220 1 1 13 ARG N N 0.088 -4.922 1.400 1.00 . A A . 13 ARG N 1 1 1 221 1 1 13 ARG NE N 2.647 -8.416 3.226 1.00 . A A . 13 ARG NE 1 1 1 222 1 1 13 ARG NH1 N 2.973 -9.693 5.120 1.00 . A A . 13 ARG NH1 1 1 1 223 1 1 13 ARG NH2 N 4.694 -8.417 4.281 1.00 . A A . 13 ARG NH2 1 1 1 224 1 1 13 ARG O O 3.229 -6.534 1.351 1.00 . A A . 13 ARG O 1 1 1 225 1 1 14 ASN C C 4.037 -4.196 -0.989 1.00 . A A . 14 ASN C 1 1 1 226 1 1 14 ASN CA C 3.267 -5.494 -1.216 1.00 . A A . 14 ASN CA 1 1 1 227 1 1 14 ASN CB C 2.818 -5.597 -2.680 1.00 . A A . 14 ASN CB 1 1 1 228 1 1 14 ASN CG C 3.912 -5.229 -3.668 1.00 . A A . 14 ASN CG 1 1 1 229 1 1 14 ASN H H 1.244 -5.220 -0.651 1.00 . A A . 14 ASN H 1 1 1 230 1 1 14 ASN HA H 3.912 -6.328 -0.986 1.00 . A A . 14 ASN HA 1 1 1 231 1 1 14 ASN HB2 H 2.508 -6.611 -2.882 1.00 . A A . 14 ASN HB2 1 1 1 232 1 1 14 ASN HB3 H 1.980 -4.934 -2.837 1.00 . A A . 14 ASN HB3 1 1 1 233 1 1 14 ASN HD21 H 4.588 -7.096 -3.665 1.00 . A A . 14 ASN HD21 1 1 1 234 1 1 14 ASN HD22 H 5.444 -5.987 -4.675 1.00 . A A . 14 ASN HD22 1 1 1 235 1 1 14 ASN N N 2.106 -5.567 -0.337 1.00 . A A . 14 ASN N 1 1 1 236 1 1 14 ASN ND2 N 4.730 -6.201 -4.040 1.00 . A A . 14 ASN ND2 1 1 1 237 1 1 14 ASN O O 5.249 -4.132 -1.189 1.00 . A A . 14 ASN O 1 1 1 238 1 1 14 ASN OD1 O 4.014 -4.079 -4.098 1.00 . A A . 14 ASN OD1 1 1 1 239 1 1 15 HIS C C 4.030 -1.569 1.192 1.00 . A A . 15 HIS C 1 1 1 240 1 1 15 HIS CA C 3.959 -1.875 -0.297 1.00 . A A . 15 HIS CA 1 1 1 241 1 1 15 HIS CB C 3.193 -0.770 -1.030 1.00 . A A . 15 HIS CB 1 1 1 242 1 1 15 HIS CD2 C 2.266 -1.292 -3.395 1.00 . A A . 15 HIS CD2 1 1 1 243 1 1 15 HIS CE1 C 4.073 -0.871 -4.554 1.00 . A A . 15 HIS CE1 1 1 1 244 1 1 15 HIS CG C 3.225 -0.908 -2.522 1.00 . A A . 15 HIS CG 1 1 1 245 1 1 15 HIS H H 2.380 -3.291 -0.339 1.00 . A A . 15 HIS H 1 1 1 246 1 1 15 HIS HA H 4.965 -1.918 -0.688 1.00 . A A . 15 HIS HA 1 1 1 247 1 1 15 HIS HB2 H 2.159 -0.789 -0.717 1.00 . A A . 15 HIS HB2 1 1 1 248 1 1 15 HIS HB3 H 3.623 0.188 -0.774 1.00 . A A . 15 HIS HB3 1 1 1 249 1 1 15 HIS HD1 H 5.217 -0.361 -2.936 1.00 . A A . 15 HIS HD1 1 1 1 250 1 1 15 HIS HD2 H 1.250 -1.569 -3.148 1.00 . A A . 15 HIS HD2 1 1 1 251 1 1 15 HIS HE1 H 4.763 -0.751 -5.375 1.00 . A A . 15 HIS HE1 1 1 1 252 1 1 15 HIS HE2 H 2.432 -1.702 -5.441 1.00 . A A . 15 HIS HE2 1 1 1 253 1 1 15 HIS N N 3.337 -3.171 -0.533 1.00 . A A . 15 HIS N 1 1 1 254 1 1 15 HIS ND1 N 4.346 -0.651 -3.280 1.00 . A A . 15 HIS ND1 1 1 1 255 1 1 15 HIS NE2 N 2.817 -1.263 -4.653 1.00 . A A . 15 HIS NE2 1 1 1 256 1 1 15 HIS O O 3.887 -0.421 1.612 1.00 . A A . 15 HIS O 1 1 1 257 1 1 16 LYS C C 5.566 -1.605 3.827 1.00 . A A . 16 LYS C 1 1 1 258 1 1 16 LYS CA C 4.364 -2.459 3.433 1.00 . A A . 16 LYS CA 1 1 1 259 1 1 16 LYS CB C 4.448 -3.837 4.103 1.00 . A A . 16 LYS CB 1 1 1 260 1 1 16 LYS CD C 3.214 -3.109 6.178 1.00 . A A . 16 LYS CD 1 1 1 261 1 1 16 LYS CE C 3.500 -2.388 7.486 1.00 . A A . 16 LYS CE 1 1 1 262 1 1 16 LYS CG C 4.464 -3.781 5.625 1.00 . A A . 16 LYS CG 1 1 1 263 1 1 16 LYS H H 4.387 -3.492 1.586 1.00 . A A . 16 LYS H 1 1 1 264 1 1 16 LYS HA H 3.465 -1.964 3.769 1.00 . A A . 16 LYS HA 1 1 1 265 1 1 16 LYS HB2 H 3.596 -4.425 3.796 1.00 . A A . 16 LYS HB2 1 1 1 266 1 1 16 LYS HB3 H 5.352 -4.328 3.773 1.00 . A A . 16 LYS HB3 1 1 1 267 1 1 16 LYS HD2 H 2.853 -2.393 5.455 1.00 . A A . 16 LYS HD2 1 1 1 268 1 1 16 LYS HD3 H 2.459 -3.863 6.350 1.00 . A A . 16 LYS HD3 1 1 1 269 1 1 16 LYS HE2 H 2.561 -2.122 7.949 1.00 . A A . 16 LYS HE2 1 1 1 270 1 1 16 LYS HE3 H 4.044 -3.055 8.139 1.00 . A A . 16 LYS HE3 1 1 1 271 1 1 16 LYS HG2 H 4.519 -4.788 6.011 1.00 . A A . 16 LYS HG2 1 1 1 272 1 1 16 LYS HG3 H 5.332 -3.223 5.945 1.00 . A A . 16 LYS HG3 1 1 1 273 1 1 16 LYS HZ1 H 5.080 -1.331 6.605 1.00 . A A . 16 LYS HZ1 1 1 1 274 1 1 16 LYS HZ2 H 4.707 -0.828 8.180 1.00 . A A . 16 LYS HZ2 1 1 1 275 1 1 16 LYS HZ3 H 3.701 -0.391 6.891 1.00 . A A . 16 LYS HZ3 1 1 1 276 1 1 16 LYS N N 4.276 -2.604 1.985 1.00 . A A . 16 LYS N 1 1 1 277 1 1 16 LYS NZ N 4.303 -1.150 7.279 1.00 . A A . 16 LYS NZ 1 1 1 278 1 1 16 LYS O O 5.596 -1.020 4.911 1.00 . A A . 16 LYS O 1 1 1 279 1 1 17 LYS C C 7.462 0.736 3.036 1.00 . A A . 17 LYS C 1 1 1 280 1 1 17 LYS CA C 7.749 -0.750 3.203 1.00 . A A . 17 LYS CA 1 1 1 281 1 1 17 LYS CB C 8.881 -1.173 2.267 1.00 . A A . 17 LYS CB 1 1 1 282 1 1 17 LYS CD C 10.828 -2.702 1.839 1.00 . A A . 17 LYS CD 1 1 1 283 1 1 17 LYS CE C 11.678 -3.837 2.390 1.00 . A A . 17 LYS CE 1 1 1 284 1 1 17 LYS CG C 9.656 -2.386 2.754 1.00 . A A . 17 LYS CG 1 1 1 285 1 1 17 LYS H H 6.474 -2.029 2.104 1.00 . A A . 17 LYS H 1 1 1 286 1 1 17 LYS HA H 8.047 -0.930 4.223 1.00 . A A . 17 LYS HA 1 1 1 287 1 1 17 LYS HB2 H 8.461 -1.406 1.299 1.00 . A A . 17 LYS HB2 1 1 1 288 1 1 17 LYS HB3 H 9.569 -0.348 2.160 1.00 . A A . 17 LYS HB3 1 1 1 289 1 1 17 LYS HD2 H 10.449 -2.989 0.870 1.00 . A A . 17 LYS HD2 1 1 1 290 1 1 17 LYS HD3 H 11.442 -1.819 1.740 1.00 . A A . 17 LYS HD3 1 1 1 291 1 1 17 LYS HE2 H 12.055 -3.549 3.359 1.00 . A A . 17 LYS HE2 1 1 1 292 1 1 17 LYS HE3 H 11.059 -4.717 2.491 1.00 . A A . 17 LYS HE3 1 1 1 293 1 1 17 LYS HG2 H 10.032 -2.188 3.747 1.00 . A A . 17 LYS HG2 1 1 1 294 1 1 17 LYS HG3 H 8.992 -3.238 2.781 1.00 . A A . 17 LYS HG3 1 1 1 295 1 1 17 LYS HZ1 H 13.370 -4.953 1.882 1.00 . A A . 17 LYS HZ1 1 1 1 296 1 1 17 LYS HZ2 H 13.457 -3.327 1.420 1.00 . A A . 17 LYS HZ2 1 1 1 297 1 1 17 LYS HZ3 H 12.486 -4.404 0.549 1.00 . A A . 17 LYS HZ3 1 1 1 298 1 1 17 LYS N N 6.553 -1.538 2.946 1.00 . A A . 17 LYS N 1 1 1 299 1 1 17 LYS NZ N 12.828 -4.153 1.498 1.00 . A A . 17 LYS NZ 1 1 1 300 1 1 17 LYS O O 8.005 1.566 3.758 1.00 . A A . 17 LYS O 1 1 1 301 1 1 18 PHE C C 5.226 2.932 2.847 1.00 . A A . 18 PHE C 1 1 1 302 1 1 18 PHE CA C 6.235 2.439 1.819 1.00 . A A . 18 PHE CA 1 1 1 303 1 1 18 PHE CB C 5.650 2.574 0.411 1.00 . A A . 18 PHE CB 1 1 1 304 1 1 18 PHE CD1 C 7.479 3.214 -1.181 1.00 . A A . 18 PHE CD1 1 1 1 305 1 1 18 PHE CD2 C 6.684 0.967 -1.216 1.00 . A A . 18 PHE CD2 1 1 1 306 1 1 18 PHE CE1 C 8.376 2.916 -2.189 1.00 . A A . 18 PHE CE1 1 1 1 307 1 1 18 PHE CE2 C 7.579 0.662 -2.223 1.00 . A A . 18 PHE CE2 1 1 1 308 1 1 18 PHE CG C 6.625 2.245 -0.684 1.00 . A A . 18 PHE CG 1 1 1 309 1 1 18 PHE CZ C 8.426 1.637 -2.710 1.00 . A A . 18 PHE CZ 1 1 1 310 1 1 18 PHE H H 6.192 0.343 1.557 1.00 . A A . 18 PHE H 1 1 1 311 1 1 18 PHE HA H 7.129 3.039 1.889 1.00 . A A . 18 PHE HA 1 1 1 312 1 1 18 PHE HB2 H 4.806 1.908 0.314 1.00 . A A . 18 PHE HB2 1 1 1 313 1 1 18 PHE HB3 H 5.316 3.592 0.265 1.00 . A A . 18 PHE HB3 1 1 1 314 1 1 18 PHE HD1 H 7.442 4.214 -0.773 1.00 . A A . 18 PHE HD1 1 1 1 315 1 1 18 PHE HD2 H 6.022 0.203 -0.835 1.00 . A A . 18 PHE HD2 1 1 1 316 1 1 18 PHE HE1 H 9.036 3.681 -2.569 1.00 . A A . 18 PHE HE1 1 1 1 317 1 1 18 PHE HE2 H 7.616 -0.339 -2.630 1.00 . A A . 18 PHE HE2 1 1 1 318 1 1 18 PHE HZ H 9.126 1.402 -3.499 1.00 . A A . 18 PHE HZ 1 1 1 319 1 1 18 PHE N N 6.599 1.055 2.087 1.00 . A A . 18 PHE N 1 1 1 320 1 1 18 PHE O O 5.350 4.033 3.379 1.00 . A A . 18 PHE O 1 1 1 321 1 1 19 CYS C C 3.595 2.008 5.489 1.00 . A A . 19 CYS C 1 1 1 322 1 1 19 CYS CA C 3.204 2.471 4.089 1.00 . A A . 19 CYS CA 1 1 1 323 1 1 19 CYS CB C 1.851 1.885 3.679 1.00 . A A . 19 CYS CB 1 1 1 324 1 1 19 CYS H H 4.191 1.232 2.686 1.00 . A A . 19 CYS H 1 1 1 325 1 1 19 CYS HA H 3.130 3.549 4.094 1.00 . A A . 19 CYS HA 1 1 1 326 1 1 19 CYS HB2 H 1.771 0.873 4.041 1.00 . A A . 19 CYS HB2 1 1 1 327 1 1 19 CYS HB3 H 1.064 2.480 4.118 1.00 . A A . 19 CYS HB3 1 1 1 328 1 1 19 CYS N N 4.231 2.107 3.128 1.00 . A A . 19 CYS N 1 1 1 329 1 1 19 CYS O O 3.146 0.958 5.963 1.00 . A A . 19 CYS O 1 1 1 330 1 1 19 CYS SG S 1.577 1.855 1.877 1.00 . A A . 19 CYS SG 1 1 1 331 1 1 20 NH2 HN1 H 4.755 3.605 5.705 1.00 . A A . 20 NH2 HN1 1 1 1 332 1 1 20 NH2 HN2 H 4.720 2.514 7.044 1.00 . A A . 20 NH2 HN2 1 1 1 333 1 1 20 NH2 N N 4.441 2.785 6.147 1.00 . A A . 20 NH2 N 1 1 2 334 1 1 1 PHE C C 1.680 6.514 -5.083 1.00 . A A . 1 PHE C 1 1 2 335 1 1 1 PHE CA C 3.178 6.498 -5.351 1.00 . A A . 1 PHE CA 1 1 2 336 1 1 1 PHE CB C 3.954 6.364 -4.033 1.00 . A A . 1 PHE CB 1 1 2 337 1 1 1 PHE CD1 C 3.835 3.897 -3.576 1.00 . A A . 1 PHE CD1 1 1 2 338 1 1 1 PHE CD2 C 2.823 5.388 -2.014 1.00 . A A . 1 PHE CD2 1 1 2 339 1 1 1 PHE CE1 C 3.444 2.820 -2.804 1.00 . A A . 1 PHE CE1 1 1 2 340 1 1 1 PHE CE2 C 2.427 4.314 -1.240 1.00 . A A . 1 PHE CE2 1 1 2 341 1 1 1 PHE CG C 3.530 5.192 -3.190 1.00 . A A . 1 PHE CG 1 1 2 342 1 1 1 PHE CZ C 2.738 3.028 -1.636 1.00 . A A . 1 PHE CZ 1 1 2 343 1 1 1 PHE H1 H 3.290 8.569 -5.491 1.00 . A A . 1 PHE H1 1 1 2 344 1 1 1 PHE H2 H 3.113 7.791 -6.980 1.00 . A A . 1 PHE H2 1 1 2 345 1 1 1 PHE H3 H 4.607 7.764 -6.187 1.00 . A A . 1 PHE H3 1 1 2 346 1 1 1 PHE HA H 3.410 5.657 -5.988 1.00 . A A . 1 PHE HA 1 1 2 347 1 1 1 PHE HB2 H 5.004 6.250 -4.254 1.00 . A A . 1 PHE HB2 1 1 2 348 1 1 1 PHE HB3 H 3.811 7.263 -3.449 1.00 . A A . 1 PHE HB3 1 1 2 349 1 1 1 PHE HD1 H 4.387 3.732 -4.490 1.00 . A A . 1 PHE HD1 1 1 2 350 1 1 1 PHE HD2 H 2.578 6.394 -1.704 1.00 . A A . 1 PHE HD2 1 1 2 351 1 1 1 PHE HE1 H 3.688 1.815 -3.116 1.00 . A A . 1 PHE HE1 1 1 2 352 1 1 1 PHE HE2 H 1.877 4.480 -0.326 1.00 . A A . 1 PHE HE2 1 1 2 353 1 1 1 PHE HZ H 2.431 2.188 -1.032 1.00 . A A . 1 PHE HZ 1 1 2 354 1 1 1 PHE N N 3.576 7.741 -6.052 1.00 . A A . 1 PHE N 1 1 2 355 1 1 1 PHE O O 1.106 7.572 -4.836 1.00 . A A . 1 PHE O 1 1 2 356 1 1 2 ASN C C -0.640 4.987 -3.421 1.00 . A A . 2 ASN C 1 1 2 357 1 1 2 ASN CA C -0.380 5.237 -4.901 1.00 . A A . 2 ASN CA 1 1 2 358 1 1 2 ASN CB C -0.986 4.107 -5.741 1.00 . A A . 2 ASN CB 1 1 2 359 1 1 2 ASN CG C -2.482 3.964 -5.527 1.00 . A A . 2 ASN CG 1 1 2 360 1 1 2 ASN H H 1.562 4.538 -5.355 1.00 . A A . 2 ASN H 1 1 2 361 1 1 2 ASN HA H -0.839 6.173 -5.184 1.00 . A A . 2 ASN HA 1 1 2 362 1 1 2 ASN HB2 H -0.808 4.309 -6.786 1.00 . A A . 2 ASN HB2 1 1 2 363 1 1 2 ASN HB3 H -0.511 3.174 -5.471 1.00 . A A . 2 ASN HB3 1 1 2 364 1 1 2 ASN HD21 H -2.389 2.030 -5.976 1.00 . A A . 2 ASN HD21 1 1 2 365 1 1 2 ASN HD22 H -3.959 2.641 -5.594 1.00 . A A . 2 ASN HD22 1 1 2 366 1 1 2 ASN N N 1.051 5.347 -5.146 1.00 . A A . 2 ASN N 1 1 2 367 1 1 2 ASN ND2 N -2.994 2.757 -5.715 1.00 . A A . 2 ASN ND2 1 1 2 368 1 1 2 ASN O O -0.616 3.845 -2.961 1.00 . A A . 2 ASN O 1 1 2 369 1 1 2 ASN OD1 O -3.169 4.926 -5.191 1.00 . A A . 2 ASN OD1 1 1 2 370 1 1 3 TRP C C -2.381 5.138 -0.952 1.00 . A A . 3 TRP C 1 1 2 371 1 1 3 TRP CA C -1.147 5.985 -1.249 1.00 . A A . 3 TRP CA 1 1 2 372 1 1 3 TRP CB C -1.314 7.391 -0.658 1.00 . A A . 3 TRP CB 1 1 2 373 1 1 3 TRP CD1 C -2.226 8.958 -2.475 1.00 . A A . 3 TRP CD1 1 1 2 374 1 1 3 TRP CD2 C -3.730 8.387 -0.918 1.00 . A A . 3 TRP CD2 1 1 2 375 1 1 3 TRP CE2 C -4.350 9.240 -1.851 1.00 . A A . 3 TRP CE2 1 1 2 376 1 1 3 TRP CE3 C -4.484 7.900 0.154 1.00 . A A . 3 TRP CE3 1 1 2 377 1 1 3 TRP CG C -2.371 8.214 -1.338 1.00 . A A . 3 TRP CG 1 1 2 378 1 1 3 TRP CH2 C -6.399 9.124 -0.684 1.00 . A A . 3 TRP CH2 1 1 2 379 1 1 3 TRP CZ2 C -5.686 9.616 -1.743 1.00 . A A . 3 TRP CZ2 1 1 2 380 1 1 3 TRP CZ3 C -5.810 8.275 0.260 1.00 . A A . 3 TRP CZ3 1 1 2 381 1 1 3 TRP H H -0.900 6.943 -3.121 1.00 . A A . 3 TRP H 1 1 2 382 1 1 3 TRP HA H -0.293 5.516 -0.793 1.00 . A A . 3 TRP HA 1 1 2 383 1 1 3 TRP HB2 H -1.582 7.304 0.384 1.00 . A A . 3 TRP HB2 1 1 2 384 1 1 3 TRP HB3 H -0.375 7.919 -0.739 1.00 . A A . 3 TRP HB3 1 1 2 385 1 1 3 TRP HD1 H -1.307 9.037 -3.036 1.00 . A A . 3 TRP HD1 1 1 2 386 1 1 3 TRP HE1 H -3.562 10.157 -3.564 1.00 . A A . 3 TRP HE1 1 1 2 387 1 1 3 TRP HE3 H -4.047 7.244 0.892 1.00 . A A . 3 TRP HE3 1 1 2 388 1 1 3 TRP HH2 H -7.439 9.391 -0.560 1.00 . A A . 3 TRP HH2 1 1 2 389 1 1 3 TRP HZ2 H -6.156 10.269 -2.462 1.00 . A A . 3 TRP HZ2 1 1 2 390 1 1 3 TRP HZ3 H -6.408 7.909 1.083 1.00 . A A . 3 TRP HZ3 1 1 2 391 1 1 3 TRP N N -0.890 6.065 -2.686 1.00 . A A . 3 TRP N 1 1 2 392 1 1 3 TRP NE1 N -3.412 9.572 -2.791 1.00 . A A . 3 TRP NE1 1 1 2 393 1 1 3 TRP O O -2.516 4.572 0.134 1.00 . A A . 3 TRP O 1 1 2 394 1 1 4 ARG C C -4.173 2.790 -1.542 1.00 . A A . 4 ARG C 1 1 2 395 1 1 4 ARG CA C -4.484 4.251 -1.785 1.00 . A A . 4 ARG CA 1 1 2 396 1 1 4 ARG CB C -5.376 4.393 -3.014 1.00 . A A . 4 ARG CB 1 1 2 397 1 1 4 ARG CD C -7.428 5.256 -1.842 1.00 . A A . 4 ARG CD 1 1 2 398 1 1 4 ARG CG C -6.385 5.526 -2.918 1.00 . A A . 4 ARG CG 1 1 2 399 1 1 4 ARG CZ C -9.017 3.470 -1.201 1.00 . A A . 4 ARG CZ 1 1 2 400 1 1 4 ARG H H -3.086 5.486 -2.785 1.00 . A A . 4 ARG H 1 1 2 401 1 1 4 ARG HA H -4.999 4.627 -0.926 1.00 . A A . 4 ARG HA 1 1 2 402 1 1 4 ARG HB2 H -4.749 4.573 -3.875 1.00 . A A . 4 ARG HB2 1 1 2 403 1 1 4 ARG HB3 H -5.908 3.468 -3.158 1.00 . A A . 4 ARG HB3 1 1 2 404 1 1 4 ARG HD2 H -6.936 5.240 -0.880 1.00 . A A . 4 ARG HD2 1 1 2 405 1 1 4 ARG HD3 H -8.157 6.052 -1.858 1.00 . A A . 4 ARG HD3 1 1 2 406 1 1 4 ARG HE H -7.885 3.470 -2.854 1.00 . A A . 4 ARG HE 1 1 2 407 1 1 4 ARG HG2 H -5.864 6.441 -2.678 1.00 . A A . 4 ARG HG2 1 1 2 408 1 1 4 ARG HG3 H -6.883 5.632 -3.870 1.00 . A A . 4 ARG HG3 1 1 2 409 1 1 4 ARG HH11 H -8.943 5.030 0.090 1.00 . A A . 4 ARG HH11 1 1 2 410 1 1 4 ARG HH12 H -10.035 3.760 0.529 1.00 . A A . 4 ARG HH12 1 1 2 411 1 1 4 ARG HH21 H -9.330 1.782 -2.283 1.00 . A A . 4 ARG HH21 1 1 2 412 1 1 4 ARG HH22 H -10.254 1.906 -0.824 1.00 . A A . 4 ARG HH22 1 1 2 413 1 1 4 ARG N N -3.265 5.031 -1.936 1.00 . A A . 4 ARG N 1 1 2 414 1 1 4 ARG NE N -8.115 3.977 -2.046 1.00 . A A . 4 ARG NE 1 1 2 415 1 1 4 ARG NH1 N -9.359 4.140 -0.107 1.00 . A A . 4 ARG NH1 1 1 2 416 1 1 4 ARG NH2 N -9.580 2.293 -1.457 1.00 . A A . 4 ARG NH2 1 1 2 417 1 1 4 ARG O O -4.975 2.062 -0.960 1.00 . A A . 4 ARG O 1 1 2 418 1 1 5 CYS C C -2.464 0.681 -0.326 1.00 . A A . 5 CYS C 1 1 2 419 1 1 5 CYS CA C -2.558 1.010 -1.805 1.00 . A A . 5 CYS CA 1 1 2 420 1 1 5 CYS CB C -1.194 0.802 -2.452 1.00 . A A . 5 CYS CB 1 1 2 421 1 1 5 CYS H H -2.431 3.021 -2.451 1.00 . A A . 5 CYS H 1 1 2 422 1 1 5 CYS HA H -3.277 0.352 -2.269 1.00 . A A . 5 CYS HA 1 1 2 423 1 1 5 CYS HB2 H -0.632 1.721 -2.375 1.00 . A A . 5 CYS HB2 1 1 2 424 1 1 5 CYS HB3 H -0.669 0.020 -1.922 1.00 . A A . 5 CYS HB3 1 1 2 425 1 1 5 CYS N N -3.008 2.379 -1.986 1.00 . A A . 5 CYS N 1 1 2 426 1 1 5 CYS O O -2.748 -0.437 0.091 1.00 . A A . 5 CYS O 1 1 2 427 1 1 5 CYS SG S -1.267 0.333 -4.209 1.00 . A A . 5 CYS SG 1 1 2 428 1 1 6 CYS C C -3.330 1.338 2.569 1.00 . A A . 6 CYS C 1 1 2 429 1 1 6 CYS CA C -1.968 1.485 1.905 1.00 . A A . 6 CYS CA 1 1 2 430 1 1 6 CYS CB C -1.189 2.647 2.517 1.00 . A A . 6 CYS CB 1 1 2 431 1 1 6 CYS H H -1.978 2.581 0.083 1.00 . A A . 6 CYS H 1 1 2 432 1 1 6 CYS HA H -1.411 0.567 2.057 1.00 . A A . 6 CYS HA 1 1 2 433 1 1 6 CYS HB2 H -1.861 3.474 2.689 1.00 . A A . 6 CYS HB2 1 1 2 434 1 1 6 CYS HB3 H -0.765 2.326 3.457 1.00 . A A . 6 CYS HB3 1 1 2 435 1 1 6 CYS N N -2.117 1.679 0.469 1.00 . A A . 6 CYS N 1 1 2 436 1 1 6 CYS O O -3.433 0.929 3.726 1.00 . A A . 6 CYS O 1 1 2 437 1 1 6 CYS SG S 0.177 3.243 1.468 1.00 . A A . 6 CYS SG 1 1 2 438 1 1 7 LEU C C -6.363 0.267 1.777 1.00 . A A . 7 LEU C 1 1 2 439 1 1 7 LEU CA C -5.734 1.543 2.320 1.00 . A A . 7 LEU CA 1 1 2 440 1 1 7 LEU CB C -6.563 2.768 1.921 1.00 . A A . 7 LEU CB 1 1 2 441 1 1 7 LEU CD1 C -6.926 5.249 1.993 1.00 . A A . 7 LEU CD1 1 1 2 442 1 1 7 LEU CD2 C -6.043 4.063 4.007 1.00 . A A . 7 LEU CD2 1 1 2 443 1 1 7 LEU CG C -6.061 4.100 2.486 1.00 . A A . 7 LEU CG 1 1 2 444 1 1 7 LEU H H -4.223 1.994 0.914 1.00 . A A . 7 LEU H 1 1 2 445 1 1 7 LEU HA H -5.690 1.479 3.395 1.00 . A A . 7 LEU HA 1 1 2 446 1 1 7 LEU HB2 H -6.568 2.836 0.842 1.00 . A A . 7 LEU HB2 1 1 2 447 1 1 7 LEU HB3 H -7.576 2.616 2.261 1.00 . A A . 7 LEU HB3 1 1 2 448 1 1 7 LEU HD11 H -6.554 6.178 2.398 1.00 . A A . 7 LEU HD11 1 1 2 449 1 1 7 LEU HD12 H -7.945 5.097 2.316 1.00 . A A . 7 LEU HD12 1 1 2 450 1 1 7 LEU HD13 H -6.892 5.287 0.914 1.00 . A A . 7 LEU HD13 1 1 2 451 1 1 7 LEU HD21 H -5.678 5.006 4.386 1.00 . A A . 7 LEU HD21 1 1 2 452 1 1 7 LEU HD22 H -5.395 3.266 4.339 1.00 . A A . 7 LEU HD22 1 1 2 453 1 1 7 LEU HD23 H -7.043 3.889 4.375 1.00 . A A . 7 LEU HD23 1 1 2 454 1 1 7 LEU HG H -5.051 4.272 2.142 1.00 . A A . 7 LEU HG 1 1 2 455 1 1 7 LEU N N -4.373 1.662 1.825 1.00 . A A . 7 LEU N 1 1 2 456 1 1 7 LEU O O -7.511 -0.056 2.073 1.00 . A A . 7 LEU O 1 1 2 457 1 1 8 ILE C C -5.078 -2.823 0.818 1.00 . A A . 8 ILE C 1 1 2 458 1 1 8 ILE CA C -6.022 -1.706 0.387 1.00 . A A . 8 ILE CA 1 1 2 459 1 1 8 ILE CB C -6.050 -1.627 -1.157 1.00 . A A . 8 ILE CB 1 1 2 460 1 1 8 ILE CD1 C -6.806 -0.149 -3.093 1.00 . A A . 8 ILE CD1 1 1 2 461 1 1 8 ILE CG1 C -6.936 -0.465 -1.619 1.00 . A A . 8 ILE CG1 1 1 2 462 1 1 8 ILE CG2 C -6.545 -2.942 -1.750 1.00 . A A . 8 ILE CG2 1 1 2 463 1 1 8 ILE H H -4.672 -0.136 0.796 1.00 . A A . 8 ILE H 1 1 2 464 1 1 8 ILE HA H -7.019 -1.924 0.744 1.00 . A A . 8 ILE HA 1 1 2 465 1 1 8 ILE HB H -5.041 -1.461 -1.505 1.00 . A A . 8 ILE HB 1 1 2 466 1 1 8 ILE HD11 H -7.460 0.674 -3.344 1.00 . A A . 8 ILE HD11 1 1 2 467 1 1 8 ILE HD12 H -7.082 -1.017 -3.673 1.00 . A A . 8 ILE HD12 1 1 2 468 1 1 8 ILE HD13 H -5.785 0.122 -3.314 1.00 . A A . 8 ILE HD13 1 1 2 469 1 1 8 ILE HG12 H -7.969 -0.710 -1.422 1.00 . A A . 8 ILE HG12 1 1 2 470 1 1 8 ILE HG13 H -6.670 0.422 -1.063 1.00 . A A . 8 ILE HG13 1 1 2 471 1 1 8 ILE HG21 H -6.559 -2.867 -2.828 1.00 . A A . 8 ILE HG21 1 1 2 472 1 1 8 ILE HG22 H -7.543 -3.146 -1.391 1.00 . A A . 8 ILE HG22 1 1 2 473 1 1 8 ILE HG23 H -5.884 -3.742 -1.452 1.00 . A A . 8 ILE HG23 1 1 2 474 1 1 8 ILE N N -5.583 -0.454 0.982 1.00 . A A . 8 ILE N 1 1 2 475 1 1 8 ILE O O -3.946 -2.894 0.346 1.00 . A A . 8 ILE O 1 1 2 476 1 1 9 PRO C C -3.941 -5.590 1.203 1.00 . A A . 9 PRO C 1 1 2 477 1 1 9 PRO CA C -4.747 -4.824 2.255 1.00 . A A . 9 PRO CA 1 1 2 478 1 1 9 PRO CB C -5.808 -5.732 2.872 1.00 . A A . 9 PRO CB 1 1 2 479 1 1 9 PRO CD C -6.907 -3.689 2.283 1.00 . A A . 9 PRO CD 1 1 2 480 1 1 9 PRO CG C -6.889 -4.801 3.299 1.00 . A A . 9 PRO CG 1 1 2 481 1 1 9 PRO HA H -4.077 -4.485 3.032 1.00 . A A . 9 PRO HA 1 1 2 482 1 1 9 PRO HB2 H -6.160 -6.436 2.130 1.00 . A A . 9 PRO HB2 1 1 2 483 1 1 9 PRO HB3 H -5.390 -6.264 3.713 1.00 . A A . 9 PRO HB3 1 1 2 484 1 1 9 PRO HD2 H -7.643 -3.891 1.519 1.00 . A A . 9 PRO HD2 1 1 2 485 1 1 9 PRO HD3 H -7.111 -2.744 2.764 1.00 . A A . 9 PRO HD3 1 1 2 486 1 1 9 PRO HG2 H -7.836 -5.318 3.305 1.00 . A A . 9 PRO HG2 1 1 2 487 1 1 9 PRO HG3 H -6.668 -4.408 4.280 1.00 . A A . 9 PRO HG3 1 1 2 488 1 1 9 PRO N N -5.543 -3.708 1.716 1.00 . A A . 9 PRO N 1 1 2 489 1 1 9 PRO O O -2.838 -6.057 1.482 1.00 . A A . 9 PRO O 1 1 2 490 1 1 10 ALA C C -2.587 -5.667 -1.586 1.00 . A A . 10 ALA C 1 1 2 491 1 1 10 ALA CA C -3.822 -6.417 -1.082 1.00 . A A . 10 ALA CA 1 1 2 492 1 1 10 ALA CB C -4.794 -6.661 -2.227 1.00 . A A . 10 ALA CB 1 1 2 493 1 1 10 ALA H H -5.364 -5.296 -0.165 1.00 . A A . 10 ALA H 1 1 2 494 1 1 10 ALA HA H -3.511 -7.379 -0.700 1.00 . A A . 10 ALA HA 1 1 2 495 1 1 10 ALA HB1 H -4.310 -7.249 -2.992 1.00 . A A . 10 ALA HB1 1 1 2 496 1 1 10 ALA HB2 H -5.105 -5.714 -2.643 1.00 . A A . 10 ALA HB2 1 1 2 497 1 1 10 ALA HB3 H -5.659 -7.192 -1.856 1.00 . A A . 10 ALA HB3 1 1 2 498 1 1 10 ALA N N -4.489 -5.702 -0.001 1.00 . A A . 10 ALA N 1 1 2 499 1 1 10 ALA O O -1.556 -6.274 -1.865 1.00 . A A . 10 ALA O 1 1 2 500 1 1 11 CYS C C -0.662 -3.114 -1.018 1.00 . A A . 11 CYS C 1 1 2 501 1 1 11 CYS CA C -1.570 -3.542 -2.168 1.00 . A A . 11 CYS CA 1 1 2 502 1 1 11 CYS CB C -2.089 -2.315 -2.928 1.00 . A A . 11 CYS CB 1 1 2 503 1 1 11 CYS H H -3.508 -3.901 -1.383 1.00 . A A . 11 CYS H 1 1 2 504 1 1 11 CYS HA H -0.998 -4.156 -2.848 1.00 . A A . 11 CYS HA 1 1 2 505 1 1 11 CYS HB2 H -3.008 -2.577 -3.431 1.00 . A A . 11 CYS HB2 1 1 2 506 1 1 11 CYS HB3 H -2.286 -1.520 -2.223 1.00 . A A . 11 CYS HB3 1 1 2 507 1 1 11 CYS N N -2.683 -4.346 -1.676 1.00 . A A . 11 CYS N 1 1 2 508 1 1 11 CYS O O 0.547 -2.949 -1.194 1.00 . A A . 11 CYS O 1 1 2 509 1 1 11 CYS SG S -0.933 -1.672 -4.187 1.00 . A A . 11 CYS SG 1 1 2 510 1 1 12 ARG C C 0.488 -3.630 1.742 1.00 . A A . 12 ARG C 1 1 2 511 1 1 12 ARG CA C -0.509 -2.551 1.352 1.00 . A A . 12 ARG CA 1 1 2 512 1 1 12 ARG CB C -1.471 -2.304 2.512 1.00 . A A . 12 ARG CB 1 1 2 513 1 1 12 ARG CD C -1.639 -2.118 5.014 1.00 . A A . 12 ARG CD 1 1 2 514 1 1 12 ARG CG C -0.795 -1.816 3.784 1.00 . A A . 12 ARG CG 1 1 2 515 1 1 12 ARG CZ C -3.979 -1.693 5.692 1.00 . A A . 12 ARG CZ 1 1 2 516 1 1 12 ARG H H -2.222 -3.087 0.230 1.00 . A A . 12 ARG H 1 1 2 517 1 1 12 ARG HA H 0.024 -1.639 1.131 1.00 . A A . 12 ARG HA 1 1 2 518 1 1 12 ARG HB2 H -2.192 -1.570 2.205 1.00 . A A . 12 ARG HB2 1 1 2 519 1 1 12 ARG HB3 H -1.987 -3.221 2.735 1.00 . A A . 12 ARG HB3 1 1 2 520 1 1 12 ARG HD2 H -1.885 -3.169 5.017 1.00 . A A . 12 ARG HD2 1 1 2 521 1 1 12 ARG HD3 H -1.064 -1.880 5.897 1.00 . A A . 12 ARG HD3 1 1 2 522 1 1 12 ARG HE H -2.887 -0.498 4.514 1.00 . A A . 12 ARG HE 1 1 2 523 1 1 12 ARG HG2 H 0.160 -2.311 3.886 1.00 . A A . 12 ARG HG2 1 1 2 524 1 1 12 ARG HG3 H -0.644 -0.749 3.714 1.00 . A A . 12 ARG HG3 1 1 2 525 1 1 12 ARG HH11 H -3.199 -3.406 6.442 1.00 . A A . 12 ARG HH11 1 1 2 526 1 1 12 ARG HH12 H -4.834 -3.078 6.902 1.00 . A A . 12 ARG HH12 1 1 2 527 1 1 12 ARG HH21 H -5.029 -0.059 5.109 1.00 . A A . 12 ARG HH21 1 1 2 528 1 1 12 ARG HH22 H -5.887 -1.162 6.137 1.00 . A A . 12 ARG HH22 1 1 2 529 1 1 12 ARG N N -1.251 -2.950 0.161 1.00 . A A . 12 ARG N 1 1 2 530 1 1 12 ARG NE N -2.878 -1.342 5.030 1.00 . A A . 12 ARG NE 1 1 2 531 1 1 12 ARG NH1 N -4.008 -2.817 6.402 1.00 . A A . 12 ARG NH1 1 1 2 532 1 1 12 ARG NH2 N -5.052 -0.910 5.643 1.00 . A A . 12 ARG NH2 1 1 2 533 1 1 12 ARG O O 1.568 -3.341 2.246 1.00 . A A . 12 ARG O 1 1 2 534 1 1 13 ARG C C 2.201 -6.021 0.937 1.00 . A A . 13 ARG C 1 1 2 535 1 1 13 ARG CA C 0.955 -6.016 1.821 1.00 . A A . 13 ARG CA 1 1 2 536 1 1 13 ARG CB C 0.177 -7.320 1.639 1.00 . A A . 13 ARG CB 1 1 2 537 1 1 13 ARG CD C 0.098 -9.815 1.945 1.00 . A A . 13 ARG CD 1 1 2 538 1 1 13 ARG CG C 0.952 -8.561 2.053 1.00 . A A . 13 ARG CG 1 1 2 539 1 1 13 ARG CZ C -1.997 -10.675 2.937 1.00 . A A . 13 ARG CZ 1 1 2 540 1 1 13 ARG H H -0.790 -5.027 1.131 1.00 . A A . 13 ARG H 1 1 2 541 1 1 13 ARG HA H 1.261 -5.929 2.852 1.00 . A A . 13 ARG HA 1 1 2 542 1 1 13 ARG HB2 H -0.725 -7.270 2.228 1.00 . A A . 13 ARG HB2 1 1 2 543 1 1 13 ARG HB3 H -0.092 -7.422 0.597 1.00 . A A . 13 ARG HB3 1 1 2 544 1 1 13 ARG HD2 H -0.381 -9.826 0.976 1.00 . A A . 13 ARG HD2 1 1 2 545 1 1 13 ARG HD3 H 0.739 -10.679 2.038 1.00 . A A . 13 ARG HD3 1 1 2 546 1 1 13 ARG HE H -0.817 -9.280 3.760 1.00 . A A . 13 ARG HE 1 1 2 547 1 1 13 ARG HG2 H 1.812 -8.668 1.409 1.00 . A A . 13 ARG HG2 1 1 2 548 1 1 13 ARG HG3 H 1.277 -8.445 3.076 1.00 . A A . 13 ARG HG3 1 1 2 549 1 1 13 ARG HH11 H -1.521 -11.481 1.138 1.00 . A A . 13 ARG HH11 1 1 2 550 1 1 13 ARG HH12 H -2.978 -12.084 1.855 1.00 . A A . 13 ARG HH12 1 1 2 551 1 1 13 ARG HH21 H -2.744 -10.072 4.723 1.00 . A A . 13 ARG HH21 1 1 2 552 1 1 13 ARG HH22 H -3.678 -11.277 3.903 1.00 . A A . 13 ARG HH22 1 1 2 553 1 1 13 ARG N N 0.102 -4.873 1.510 1.00 . A A . 13 ARG N 1 1 2 554 1 1 13 ARG NE N -0.932 -9.872 2.984 1.00 . A A . 13 ARG NE 1 1 2 555 1 1 13 ARG NH1 N -2.182 -11.478 1.893 1.00 . A A . 13 ARG NH1 1 1 2 556 1 1 13 ARG NH2 N -2.877 -10.674 3.934 1.00 . A A . 13 ARG NH2 1 1 2 557 1 1 13 ARG O O 3.265 -6.478 1.348 1.00 . A A . 13 ARG O 1 1 2 558 1 1 14 ASN C C 3.982 -4.159 -1.019 1.00 . A A . 14 ASN C 1 1 2 559 1 1 14 ASN CA C 3.173 -5.437 -1.214 1.00 . A A . 14 ASN CA 1 1 2 560 1 1 14 ASN CB C 2.639 -5.519 -2.651 1.00 . A A . 14 ASN CB 1 1 2 561 1 1 14 ASN CG C 3.695 -5.197 -3.698 1.00 . A A . 14 ASN CG 1 1 2 562 1 1 14 ASN H H 1.191 -5.128 -0.530 1.00 . A A . 14 ASN H 1 1 2 563 1 1 14 ASN HA H 3.811 -6.287 -1.026 1.00 . A A . 14 ASN HA 1 1 2 564 1 1 14 ASN HB2 H 2.276 -6.518 -2.836 1.00 . A A . 14 ASN HB2 1 1 2 565 1 1 14 ASN HB3 H 1.824 -4.819 -2.764 1.00 . A A . 14 ASN HB3 1 1 2 566 1 1 14 ASN HD21 H 4.309 -7.085 -3.706 1.00 . A A . 14 ASN HD21 1 1 2 567 1 1 14 ASN HD22 H 5.148 -6.017 -4.771 1.00 . A A . 14 ASN HD22 1 1 2 568 1 1 14 ASN N N 2.062 -5.490 -0.267 1.00 . A A . 14 ASN N 1 1 2 569 1 1 14 ASN ND2 N 4.460 -6.200 -4.099 1.00 . A A . 14 ASN ND2 1 1 2 570 1 1 14 ASN O O 5.182 -4.117 -1.284 1.00 . A A . 14 ASN O 1 1 2 571 1 1 14 ASN OD1 O 3.815 -4.055 -4.145 1.00 . A A . 14 ASN OD1 1 1 2 572 1 1 15 HIS C C 4.075 -1.545 1.181 1.00 . A A . 15 HIS C 1 1 2 573 1 1 15 HIS CA C 3.986 -1.843 -0.308 1.00 . A A . 15 HIS CA 1 1 2 574 1 1 15 HIS CB C 3.244 -0.716 -1.033 1.00 . A A . 15 HIS CB 1 1 2 575 1 1 15 HIS CD2 C 2.294 -1.254 -3.384 1.00 . A A . 15 HIS CD2 1 1 2 576 1 1 15 HIS CE1 C 4.077 -0.798 -4.568 1.00 . A A . 15 HIS CE1 1 1 2 577 1 1 15 HIS CG C 3.258 -0.853 -2.525 1.00 . A A . 15 HIS CG 1 1 2 578 1 1 15 HIS H H 2.373 -3.216 -0.311 1.00 . A A . 15 HIS H 1 1 2 579 1 1 15 HIS HA H 4.987 -1.916 -0.707 1.00 . A A . 15 HIS HA 1 1 2 580 1 1 15 HIS HB2 H 2.214 -0.707 -0.710 1.00 . A A . 15 HIS HB2 1 1 2 581 1 1 15 HIS HB3 H 3.703 0.228 -0.780 1.00 . A A . 15 HIS HB3 1 1 2 582 1 1 15 HIS HD1 H 5.233 -0.265 -2.967 1.00 . A A . 15 HIS HD1 1 1 2 583 1 1 15 HIS HD2 H 1.287 -1.552 -3.122 1.00 . A A . 15 HIS HD2 1 1 2 584 1 1 15 HIS HE1 H 4.752 -0.664 -5.400 1.00 . A A . 15 HIS HE1 1 1 2 585 1 1 15 HIS HE2 H 2.441 -1.663 -5.431 1.00 . A A . 15 HIS HE2 1 1 2 586 1 1 15 HIS N N 3.325 -3.120 -0.533 1.00 . A A . 15 HIS N 1 1 2 587 1 1 15 HIS ND1 N 4.364 -0.574 -3.299 1.00 . A A . 15 HIS ND1 1 1 2 588 1 1 15 HIS NE2 N 2.826 -1.212 -4.649 1.00 . A A . 15 HIS NE2 1 1 2 589 1 1 15 HIS O O 3.991 -0.393 1.604 1.00 . A A . 15 HIS O 1 1 2 590 1 1 16 LYS C C 5.606 -1.670 3.815 1.00 . A A . 16 LYS C 1 1 2 591 1 1 16 LYS CA C 4.364 -2.463 3.419 1.00 . A A . 16 LYS CA 1 1 2 592 1 1 16 LYS CB C 4.384 -3.847 4.079 1.00 . A A . 16 LYS CB 1 1 2 593 1 1 16 LYS CD C 3.125 -3.074 6.122 1.00 . A A . 16 LYS CD 1 1 2 594 1 1 16 LYS CE C 3.419 -2.346 7.424 1.00 . A A . 16 LYS CE 1 1 2 595 1 1 16 LYS CG C 4.357 -3.802 5.601 1.00 . A A . 16 LYS CG 1 1 2 596 1 1 16 LYS H H 4.336 -3.487 1.566 1.00 . A A . 16 LYS H 1 1 2 597 1 1 16 LYS HA H 3.490 -1.927 3.758 1.00 . A A . 16 LYS HA 1 1 2 598 1 1 16 LYS HB2 H 3.521 -4.405 3.743 1.00 . A A . 16 LYS HB2 1 1 2 599 1 1 16 LYS HB3 H 5.278 -4.366 3.772 1.00 . A A . 16 LYS HB3 1 1 2 600 1 1 16 LYS HD2 H 2.805 -2.355 5.382 1.00 . A A . 16 LYS HD2 1 1 2 601 1 1 16 LYS HD3 H 2.339 -3.794 6.291 1.00 . A A . 16 LYS HD3 1 1 2 602 1 1 16 LYS HE2 H 2.484 -2.056 7.879 1.00 . A A . 16 LYS HE2 1 1 2 603 1 1 16 LYS HE3 H 3.947 -3.017 8.086 1.00 . A A . 16 LYS HE3 1 1 2 604 1 1 16 LYS HG2 H 4.351 -4.813 5.980 1.00 . A A . 16 LYS HG2 1 1 2 605 1 1 16 LYS HG3 H 5.241 -3.290 5.950 1.00 . A A . 16 LYS HG3 1 1 2 606 1 1 16 LYS HZ1 H 3.661 -0.355 6.821 1.00 . A A . 16 LYS HZ1 1 1 2 607 1 1 16 LYS HZ2 H 5.016 -1.330 6.529 1.00 . A A . 16 LYS HZ2 1 1 2 608 1 1 16 LYS HZ3 H 4.668 -0.814 8.103 1.00 . A A . 16 LYS HZ3 1 1 2 609 1 1 16 LYS N N 4.268 -2.595 1.970 1.00 . A A . 16 LYS N 1 1 2 610 1 1 16 LYS NZ N 4.248 -1.128 7.207 1.00 . A A . 16 LYS NZ 1 1 2 611 1 1 16 LYS O O 5.678 -1.113 4.913 1.00 . A A . 16 LYS O 1 1 2 612 1 1 17 LYS C C 7.604 0.606 2.972 1.00 . A A . 17 LYS C 1 1 2 613 1 1 17 LYS CA C 7.807 -0.887 3.171 1.00 . A A . 17 LYS CA 1 1 2 614 1 1 17 LYS CB C 8.924 -1.388 2.257 1.00 . A A . 17 LYS CB 1 1 2 615 1 1 17 LYS CD C 10.969 -2.823 1.992 1.00 . A A . 17 LYS CD 1 1 2 616 1 1 17 LYS CE C 11.965 -3.728 2.703 1.00 . A A . 17 LYS CE 1 1 2 617 1 1 17 LYS CG C 9.825 -2.424 2.909 1.00 . A A . 17 LYS CG 1 1 2 618 1 1 17 LYS H H 6.462 -2.086 2.064 1.00 . A A . 17 LYS H 1 1 2 619 1 1 17 LYS HA H 8.085 -1.062 4.197 1.00 . A A . 17 LYS HA 1 1 2 620 1 1 17 LYS HB2 H 8.481 -1.830 1.377 1.00 . A A . 17 LYS HB2 1 1 2 621 1 1 17 LYS HB3 H 9.531 -0.547 1.959 1.00 . A A . 17 LYS HB3 1 1 2 622 1 1 17 LYS HD2 H 10.568 -3.349 1.139 1.00 . A A . 17 LYS HD2 1 1 2 623 1 1 17 LYS HD3 H 11.480 -1.931 1.661 1.00 . A A . 17 LYS HD3 1 1 2 624 1 1 17 LYS HE2 H 11.434 -4.573 3.115 1.00 . A A . 17 LYS HE2 1 1 2 625 1 1 17 LYS HE3 H 12.692 -4.075 1.984 1.00 . A A . 17 LYS HE3 1 1 2 626 1 1 17 LYS HG2 H 10.234 -2.010 3.818 1.00 . A A . 17 LYS HG2 1 1 2 627 1 1 17 LYS HG3 H 9.238 -3.301 3.142 1.00 . A A . 17 LYS HG3 1 1 2 628 1 1 17 LYS HZ1 H 13.378 -3.647 4.240 1.00 . A A . 17 LYS HZ1 1 1 2 629 1 1 17 LYS HZ2 H 11.993 -2.720 4.534 1.00 . A A . 17 LYS HZ2 1 1 2 630 1 1 17 LYS HZ3 H 13.158 -2.176 3.435 1.00 . A A . 17 LYS HZ3 1 1 2 631 1 1 17 LYS N N 6.577 -1.618 2.917 1.00 . A A . 17 LYS N 1 1 2 632 1 1 17 LYS NZ N 12.673 -3.018 3.805 1.00 . A A . 17 LYS NZ 1 1 2 633 1 1 17 LYS O O 8.289 1.419 3.584 1.00 . A A . 17 LYS O 1 1 2 634 1 1 18 PHE C C 5.320 2.882 2.806 1.00 . A A . 18 PHE C 1 1 2 635 1 1 18 PHE CA C 6.368 2.352 1.834 1.00 . A A . 18 PHE CA 1 1 2 636 1 1 18 PHE CB C 5.878 2.514 0.393 1.00 . A A . 18 PHE CB 1 1 2 637 1 1 18 PHE CD1 C 5.824 5.011 0.117 1.00 . A A . 18 PHE CD1 1 1 2 638 1 1 18 PHE CD2 C 7.302 3.748 -1.263 1.00 . A A . 18 PHE CD2 1 1 2 639 1 1 18 PHE CE1 C 6.253 6.179 -0.486 1.00 . A A . 18 PHE CE1 1 1 2 640 1 1 18 PHE CE2 C 7.735 4.912 -1.870 1.00 . A A . 18 PHE CE2 1 1 2 641 1 1 18 PHE CG C 6.343 3.784 -0.264 1.00 . A A . 18 PHE CG 1 1 2 642 1 1 18 PHE CZ C 7.209 6.129 -1.481 1.00 . A A . 18 PHE CZ 1 1 2 643 1 1 18 PHE H H 6.143 0.259 1.664 1.00 . A A . 18 PHE H 1 1 2 644 1 1 18 PHE HA H 7.280 2.915 1.962 1.00 . A A . 18 PHE HA 1 1 2 645 1 1 18 PHE HB2 H 6.237 1.685 -0.197 1.00 . A A . 18 PHE HB2 1 1 2 646 1 1 18 PHE HB3 H 4.797 2.512 0.386 1.00 . A A . 18 PHE HB3 1 1 2 647 1 1 18 PHE HD1 H 5.076 5.052 0.895 1.00 . A A . 18 PHE HD1 1 1 2 648 1 1 18 PHE HD2 H 7.712 2.797 -1.569 1.00 . A A . 18 PHE HD2 1 1 2 649 1 1 18 PHE HE1 H 5.840 7.128 -0.180 1.00 . A A . 18 PHE HE1 1 1 2 650 1 1 18 PHE HE2 H 8.483 4.870 -2.648 1.00 . A A . 18 PHE HE2 1 1 2 651 1 1 18 PHE HZ H 7.546 7.039 -1.954 1.00 . A A . 18 PHE HZ 1 1 2 652 1 1 18 PHE N N 6.659 0.955 2.114 1.00 . A A . 18 PHE N 1 1 2 653 1 1 18 PHE O O 5.432 3.996 3.314 1.00 . A A . 18 PHE O 1 1 2 654 1 1 19 CYS C C 3.580 2.064 5.412 1.00 . A A . 19 CYS C 1 1 2 655 1 1 19 CYS CA C 3.243 2.475 3.983 1.00 . A A . 19 CYS CA 1 1 2 656 1 1 19 CYS CB C 1.902 1.875 3.551 1.00 . A A . 19 CYS CB 1 1 2 657 1 1 19 CYS H H 4.276 1.184 2.657 1.00 . A A . 19 CYS H 1 1 2 658 1 1 19 CYS HA H 3.172 3.553 3.944 1.00 . A A . 19 CYS HA 1 1 2 659 1 1 19 CYS HB2 H 1.834 0.857 3.901 1.00 . A A . 19 CYS HB2 1 1 2 660 1 1 19 CYS HB3 H 1.102 2.451 3.994 1.00 . A A . 19 CYS HB3 1 1 2 661 1 1 19 CYS N N 4.305 2.072 3.074 1.00 . A A . 19 CYS N 1 1 2 662 1 1 19 CYS O O 3.148 1.011 5.894 1.00 . A A . 19 CYS O 1 1 2 663 1 1 19 CYS SG S 1.636 1.860 1.747 1.00 . A A . 19 CYS SG 1 1 2 664 1 1 20 NH2 HN1 H 4.670 3.710 5.641 1.00 . A A . 20 NH2 HN1 1 1 2 665 1 1 20 NH2 HN2 H 4.605 2.656 7.008 1.00 . A A . 20 NH2 HN2 1 1 2 666 1 1 20 NH2 N N 4.363 2.891 6.091 1.00 . A A . 20 NH2 N 1 1 3 667 1 1 1 PHE C C 1.992 6.278 -4.914 1.00 . A A . 1 PHE C 1 1 3 668 1 1 1 PHE CA C 3.487 6.206 -5.198 1.00 . A A . 1 PHE CA 1 1 3 669 1 1 1 PHE CB C 4.179 5.253 -4.208 1.00 . A A . 1 PHE CB 1 1 3 670 1 1 1 PHE CD1 C 4.981 6.563 -2.216 1.00 . A A . 1 PHE CD1 1 1 3 671 1 1 1 PHE CD2 C 3.077 5.151 -1.949 1.00 . A A . 1 PHE CD2 1 1 3 672 1 1 1 PHE CE1 C 4.893 6.939 -0.889 1.00 . A A . 1 PHE CE1 1 1 3 673 1 1 1 PHE CE2 C 2.983 5.525 -0.622 1.00 . A A . 1 PHE CE2 1 1 3 674 1 1 1 PHE CG C 4.075 5.666 -2.763 1.00 . A A . 1 PHE CG 1 1 3 675 1 1 1 PHE CZ C 3.893 6.419 -0.092 1.00 . A A . 1 PHE CZ 1 1 3 676 1 1 1 PHE H1 H 3.910 7.970 -4.177 1.00 . A A . 1 PHE H1 1 1 3 677 1 1 1 PHE H2 H 3.642 8.182 -5.831 1.00 . A A . 1 PHE H2 1 1 3 678 1 1 1 PHE H3 H 5.103 7.523 -5.290 1.00 . A A . 1 PHE H3 1 1 3 679 1 1 1 PHE HA H 3.629 5.835 -6.203 1.00 . A A . 1 PHE HA 1 1 3 680 1 1 1 PHE HB2 H 3.736 4.272 -4.301 1.00 . A A . 1 PHE HB2 1 1 3 681 1 1 1 PHE HB3 H 5.228 5.188 -4.460 1.00 . A A . 1 PHE HB3 1 1 3 682 1 1 1 PHE HD1 H 5.763 6.972 -2.840 1.00 . A A . 1 PHE HD1 1 1 3 683 1 1 1 PHE HD2 H 2.365 4.452 -2.363 1.00 . A A . 1 PHE HD2 1 1 3 684 1 1 1 PHE HE1 H 5.606 7.637 -0.475 1.00 . A A . 1 PHE HE1 1 1 3 685 1 1 1 PHE HE2 H 2.200 5.118 0.000 1.00 . A A . 1 PHE HE2 1 1 3 686 1 1 1 PHE HZ H 3.821 6.712 0.946 1.00 . A A . 1 PHE HZ 1 1 3 687 1 1 1 PHE N N 4.079 7.564 -5.118 1.00 . A A . 1 PHE N 1 1 3 688 1 1 1 PHE O O 1.473 7.347 -4.600 1.00 . A A . 1 PHE O 1 1 3 689 1 1 2 ASN C C -0.402 4.810 -3.306 1.00 . A A . 2 ASN C 1 1 3 690 1 1 2 ASN CA C -0.125 5.090 -4.776 1.00 . A A . 2 ASN CA 1 1 3 691 1 1 2 ASN CB C -0.777 4.008 -5.644 1.00 . A A . 2 ASN CB 1 1 3 692 1 1 2 ASN CG C -2.285 3.949 -5.472 1.00 . A A . 2 ASN CG 1 1 3 693 1 1 2 ASN H H 1.784 4.323 -5.263 1.00 . A A . 2 ASN H 1 1 3 694 1 1 2 ASN HA H -0.543 6.052 -5.033 1.00 . A A . 2 ASN HA 1 1 3 695 1 1 2 ASN HB2 H -0.562 4.212 -6.683 1.00 . A A . 2 ASN HB2 1 1 3 696 1 1 2 ASN HB3 H -0.364 3.046 -5.378 1.00 . A A . 2 ASN HB3 1 1 3 697 1 1 2 ASN HD21 H -2.244 1.962 -5.563 1.00 . A A . 2 ASN HD21 1 1 3 698 1 1 2 ASN HD22 H -3.803 2.675 -5.350 1.00 . A A . 2 ASN HD22 1 1 3 699 1 1 2 ASN N N 1.311 5.144 -5.020 1.00 . A A . 2 ASN N 1 1 3 700 1 1 2 ASN ND2 N -2.834 2.743 -5.460 1.00 . A A . 2 ASN ND2 1 1 3 701 1 1 2 ASN O O -0.460 3.654 -2.884 1.00 . A A . 2 ASN O 1 1 3 702 1 1 2 ASN OD1 O -2.952 4.975 -5.337 1.00 . A A . 2 ASN OD1 1 1 3 703 1 1 3 TRP C C -2.158 5.026 -0.850 1.00 . A A . 3 TRP C 1 1 3 704 1 1 3 TRP CA C -0.849 5.767 -1.102 1.00 . A A . 3 TRP CA 1 1 3 705 1 1 3 TRP CB C -0.892 7.159 -0.458 1.00 . A A . 3 TRP CB 1 1 3 706 1 1 3 TRP CD1 C -1.464 8.955 -2.198 1.00 . A A . 3 TRP CD1 1 1 3 707 1 1 3 TRP CD2 C -3.183 8.370 -0.887 1.00 . A A . 3 TRP CD2 1 1 3 708 1 1 3 TRP CE2 C -3.623 9.352 -1.794 1.00 . A A . 3 TRP CE2 1 1 3 709 1 1 3 TRP CE3 C -4.095 7.852 0.039 1.00 . A A . 3 TRP CE3 1 1 3 710 1 1 3 TRP CG C -1.798 8.126 -1.165 1.00 . A A . 3 TRP CG 1 1 3 711 1 1 3 TRP CH2 C -5.803 9.300 -0.885 1.00 . A A . 3 TRP CH2 1 1 3 712 1 1 3 TRP CZ2 C -4.934 9.826 -1.802 1.00 . A A . 3 TRP CZ2 1 1 3 713 1 1 3 TRP CZ3 C -5.394 8.323 0.030 1.00 . A A . 3 TRP CZ3 1 1 3 714 1 1 3 TRP H H -0.518 6.769 -2.938 1.00 . A A . 3 TRP H 1 1 3 715 1 1 3 TRP HA H -0.043 5.202 -0.660 1.00 . A A . 3 TRP HA 1 1 3 716 1 1 3 TRP HB2 H -1.238 7.065 0.560 1.00 . A A . 3 TRP HB2 1 1 3 717 1 1 3 TRP HB3 H 0.104 7.577 -0.456 1.00 . A A . 3 TRP HB3 1 1 3 718 1 1 3 TRP HD1 H -0.481 9.008 -2.640 1.00 . A A . 3 TRP HD1 1 1 3 719 1 1 3 TRP HE1 H -2.570 10.354 -3.306 1.00 . A A . 3 TRP HE1 1 1 3 720 1 1 3 TRP HE3 H -3.798 7.097 0.753 1.00 . A A . 3 TRP HE3 1 1 3 721 1 1 3 TRP HH2 H -6.827 9.640 -0.856 1.00 . A A . 3 TRP HH2 1 1 3 722 1 1 3 TRP HZ2 H -5.264 10.580 -2.501 1.00 . A A . 3 TRP HZ2 1 1 3 723 1 1 3 TRP HZ3 H -6.111 7.935 0.738 1.00 . A A . 3 TRP HZ3 1 1 3 724 1 1 3 TRP N N -0.577 5.877 -2.535 1.00 . A A . 3 TRP N 1 1 3 725 1 1 3 TRP NE1 N -2.557 9.691 -2.585 1.00 . A A . 3 TRP NE1 1 1 3 726 1 1 3 TRP O O -2.384 4.481 0.229 1.00 . A A . 3 TRP O 1 1 3 727 1 1 4 ARG C C -4.101 2.833 -1.530 1.00 . A A . 4 ARG C 1 1 3 728 1 1 4 ARG CA C -4.292 4.316 -1.769 1.00 . A A . 4 ARG CA 1 1 3 729 1 1 4 ARG CB C -5.101 4.532 -3.041 1.00 . A A . 4 ARG CB 1 1 3 730 1 1 4 ARG CD C -6.273 6.265 -4.429 1.00 . A A . 4 ARG CD 1 1 3 731 1 1 4 ARG CG C -5.956 5.787 -3.021 1.00 . A A . 4 ARG CG 1 1 3 732 1 1 4 ARG CZ C -6.713 4.737 -6.325 1.00 . A A . 4 ARG CZ 1 1 3 733 1 1 4 ARG H H -2.762 5.435 -2.701 1.00 . A A . 4 ARG H 1 1 3 734 1 1 4 ARG HA H -4.817 4.729 -0.934 1.00 . A A . 4 ARG HA 1 1 3 735 1 1 4 ARG HB2 H -4.420 4.603 -3.876 1.00 . A A . 4 ARG HB2 1 1 3 736 1 1 4 ARG HB3 H -5.744 3.679 -3.188 1.00 . A A . 4 ARG HB3 1 1 3 737 1 1 4 ARG HD2 H -6.809 7.199 -4.366 1.00 . A A . 4 ARG HD2 1 1 3 738 1 1 4 ARG HD3 H -5.344 6.419 -4.959 1.00 . A A . 4 ARG HD3 1 1 3 739 1 1 4 ARG HE H -7.971 5.080 -4.801 1.00 . A A . 4 ARG HE 1 1 3 740 1 1 4 ARG HG2 H -6.881 5.573 -2.506 1.00 . A A . 4 ARG HG2 1 1 3 741 1 1 4 ARG HG3 H -5.421 6.565 -2.498 1.00 . A A . 4 ARG HG3 1 1 3 742 1 1 4 ARG HH11 H -4.875 5.603 -6.350 1.00 . A A . 4 ARG HH11 1 1 3 743 1 1 4 ARG HH12 H -5.227 4.573 -7.700 1.00 . A A . 4 ARG HH12 1 1 3 744 1 1 4 ARG HH21 H -8.440 3.699 -6.573 1.00 . A A . 4 ARG HH21 1 1 3 745 1 1 4 ARG HH22 H -7.262 3.483 -7.825 1.00 . A A . 4 ARG HH22 1 1 3 746 1 1 4 ARG N N -3.008 4.992 -1.866 1.00 . A A . 4 ARG N 1 1 3 747 1 1 4 ARG NE N -7.089 5.301 -5.174 1.00 . A A . 4 ARG NE 1 1 3 748 1 1 4 ARG NH1 N -5.509 4.990 -6.833 1.00 . A A . 4 ARG NH1 1 1 3 749 1 1 4 ARG NH2 N -7.537 3.906 -6.958 1.00 . A A . 4 ARG NH2 1 1 3 750 1 1 4 ARG O O -4.961 2.162 -0.968 1.00 . A A . 4 ARG O 1 1 3 751 1 1 5 CYS C C -2.568 0.590 -0.312 1.00 . A A . 5 CYS C 1 1 3 752 1 1 5 CYS CA C -2.612 0.942 -1.790 1.00 . A A . 5 CYS CA 1 1 3 753 1 1 5 CYS CB C -1.250 0.656 -2.412 1.00 . A A . 5 CYS CB 1 1 3 754 1 1 5 CYS H H -2.334 2.945 -2.414 1.00 . A A . 5 CYS H 1 1 3 755 1 1 5 CYS HA H -3.362 0.340 -2.277 1.00 . A A . 5 CYS HA 1 1 3 756 1 1 5 CYS HB2 H -0.635 1.539 -2.318 1.00 . A A . 5 CYS HB2 1 1 3 757 1 1 5 CYS HB3 H -0.782 -0.159 -1.878 1.00 . A A . 5 CYS HB3 1 1 3 758 1 1 5 CYS N N -2.962 2.341 -1.963 1.00 . A A . 5 CYS N 1 1 3 759 1 1 5 CYS O O -2.903 -0.520 0.083 1.00 . A A . 5 CYS O 1 1 3 760 1 1 5 CYS SG S -1.315 0.203 -4.175 1.00 . A A . 5 CYS SG 1 1 3 761 1 1 6 CYS C C -3.466 1.215 2.576 1.00 . A A . 6 CYS C 1 1 3 762 1 1 6 CYS CA C -2.087 1.356 1.941 1.00 . A A . 6 CYS CA 1 1 3 763 1 1 6 CYS CB C -1.316 2.511 2.577 1.00 . A A . 6 CYS CB 1 1 3 764 1 1 6 CYS H H -2.000 2.458 0.125 1.00 . A A . 6 CYS H 1 1 3 765 1 1 6 CYS HA H -1.539 0.436 2.102 1.00 . A A . 6 CYS HA 1 1 3 766 1 1 6 CYS HB2 H -1.993 3.329 2.768 1.00 . A A . 6 CYS HB2 1 1 3 767 1 1 6 CYS HB3 H -0.887 2.173 3.508 1.00 . A A . 6 CYS HB3 1 1 3 768 1 1 6 CYS N N -2.194 1.563 0.502 1.00 . A A . 6 CYS N 1 1 3 769 1 1 6 CYS O O -3.593 0.777 3.720 1.00 . A A . 6 CYS O 1 1 3 770 1 1 6 CYS SG S 0.044 3.137 1.537 1.00 . A A . 6 CYS SG 1 1 3 771 1 1 7 LEU C C -6.463 0.159 1.825 1.00 . A A . 7 LEU C 1 1 3 772 1 1 7 LEU CA C -5.862 1.470 2.310 1.00 . A A . 7 LEU CA 1 1 3 773 1 1 7 LEU CB C -6.699 2.656 1.824 1.00 . A A . 7 LEU CB 1 1 3 774 1 1 7 LEU CD1 C -6.930 5.132 1.486 1.00 . A A . 7 LEU CD1 1 1 3 775 1 1 7 LEU CD2 C -6.143 4.242 3.685 1.00 . A A . 7 LEU CD2 1 1 3 776 1 1 7 LEU CG C -6.136 4.035 2.178 1.00 . A A . 7 LEU CG 1 1 3 777 1 1 7 LEU H H -4.328 1.945 0.934 1.00 . A A . 7 LEU H 1 1 3 778 1 1 7 LEU HA H -5.837 1.465 3.385 1.00 . A A . 7 LEU HA 1 1 3 779 1 1 7 LEU HB2 H -6.788 2.590 0.749 1.00 . A A . 7 LEU HB2 1 1 3 780 1 1 7 LEU HB3 H -7.687 2.575 2.254 1.00 . A A . 7 LEU HB3 1 1 3 781 1 1 7 LEU HD11 H -6.865 5.003 0.415 1.00 . A A . 7 LEU HD11 1 1 3 782 1 1 7 LEU HD12 H -6.525 6.095 1.759 1.00 . A A . 7 LEU HD12 1 1 3 783 1 1 7 LEU HD13 H -7.965 5.077 1.793 1.00 . A A . 7 LEU HD13 1 1 3 784 1 1 7 LEU HD21 H -7.154 4.160 4.055 1.00 . A A . 7 LEU HD21 1 1 3 785 1 1 7 LEU HD22 H -5.752 5.222 3.915 1.00 . A A . 7 LEU HD22 1 1 3 786 1 1 7 LEU HD23 H -5.526 3.488 4.154 1.00 . A A . 7 LEU HD23 1 1 3 787 1 1 7 LEU HG H -5.114 4.097 1.835 1.00 . A A . 7 LEU HG 1 1 3 788 1 1 7 LEU N N -4.493 1.582 1.831 1.00 . A A . 7 LEU N 1 1 3 789 1 1 7 LEU O O -7.552 -0.239 2.236 1.00 . A A . 7 LEU O 1 1 3 790 1 1 8 ILE C C -5.202 -2.896 0.867 1.00 . A A . 8 ILE C 1 1 3 791 1 1 8 ILE CA C -6.141 -1.788 0.399 1.00 . A A . 8 ILE CA 1 1 3 792 1 1 8 ILE CB C -6.145 -1.744 -1.147 1.00 . A A . 8 ILE CB 1 1 3 793 1 1 8 ILE CD1 C -6.758 -0.249 -3.118 1.00 . A A . 8 ILE CD1 1 1 3 794 1 1 8 ILE CG1 C -6.946 -0.538 -1.643 1.00 . A A . 8 ILE CG1 1 1 3 795 1 1 8 ILE CG2 C -6.720 -3.034 -1.717 1.00 . A A . 8 ILE CG2 1 1 3 796 1 1 8 ILE H H -4.842 -0.153 0.713 1.00 . A A . 8 ILE H 1 1 3 797 1 1 8 ILE HA H -7.143 -2.000 0.744 1.00 . A A . 8 ILE HA 1 1 3 798 1 1 8 ILE HB H -5.124 -1.653 -1.485 1.00 . A A . 8 ILE HB 1 1 3 799 1 1 8 ILE HD11 H -5.718 -0.034 -3.313 1.00 . A A . 8 ILE HD11 1 1 3 800 1 1 8 ILE HD12 H -7.360 0.602 -3.398 1.00 . A A . 8 ILE HD12 1 1 3 801 1 1 8 ILE HD13 H -7.062 -1.111 -3.695 1.00 . A A . 8 ILE HD13 1 1 3 802 1 1 8 ILE HG12 H -7.997 -0.718 -1.474 1.00 . A A . 8 ILE HG12 1 1 3 803 1 1 8 ILE HG13 H -6.641 0.339 -1.092 1.00 . A A . 8 ILE HG13 1 1 3 804 1 1 8 ILE HG21 H -6.713 -2.986 -2.797 1.00 . A A . 8 ILE HG21 1 1 3 805 1 1 8 ILE HG22 H -7.734 -3.162 -1.369 1.00 . A A . 8 ILE HG22 1 1 3 806 1 1 8 ILE HG23 H -6.119 -3.872 -1.391 1.00 . A A . 8 ILE HG23 1 1 3 807 1 1 8 ILE N N -5.718 -0.517 0.964 1.00 . A A . 8 ILE N 1 1 3 808 1 1 8 ILE O O -4.049 -2.950 0.450 1.00 . A A . 8 ILE O 1 1 3 809 1 1 9 PRO C C -4.125 -5.695 1.222 1.00 . A A . 9 PRO C 1 1 3 810 1 1 9 PRO CA C -4.899 -4.910 2.283 1.00 . A A . 9 PRO CA 1 1 3 811 1 1 9 PRO CB C -5.956 -5.801 2.933 1.00 . A A . 9 PRO CB 1 1 3 812 1 1 9 PRO CD C -7.076 -3.806 2.247 1.00 . A A . 9 PRO CD 1 1 3 813 1 1 9 PRO CG C -7.046 -4.863 3.317 1.00 . A A . 9 PRO CG 1 1 3 814 1 1 9 PRO HA H -4.210 -4.562 3.038 1.00 . A A . 9 PRO HA 1 1 3 815 1 1 9 PRO HB2 H -6.300 -6.536 2.220 1.00 . A A . 9 PRO HB2 1 1 3 816 1 1 9 PRO HB3 H -5.537 -6.293 3.797 1.00 . A A . 9 PRO HB3 1 1 3 817 1 1 9 PRO HD2 H -7.776 -4.076 1.469 1.00 . A A . 9 PRO HD2 1 1 3 818 1 1 9 PRO HD3 H -7.335 -2.847 2.672 1.00 . A A . 9 PRO HD3 1 1 3 819 1 1 9 PRO HG2 H -7.989 -5.389 3.353 1.00 . A A . 9 PRO HG2 1 1 3 820 1 1 9 PRO HG3 H -6.826 -4.420 4.276 1.00 . A A . 9 PRO HG3 1 1 3 821 1 1 9 PRO N N -5.693 -3.799 1.732 1.00 . A A . 9 PRO N 1 1 3 822 1 1 9 PRO O O -3.055 -6.238 1.494 1.00 . A A . 9 PRO O 1 1 3 823 1 1 10 ALA C C -2.782 -5.740 -1.591 1.00 . A A . 10 ALA C 1 1 3 824 1 1 10 ALA CA C -4.027 -6.463 -1.080 1.00 . A A . 10 ALA CA 1 1 3 825 1 1 10 ALA CB C -5.017 -6.673 -2.216 1.00 . A A . 10 ALA CB 1 1 3 826 1 1 10 ALA H H -5.511 -5.278 -0.148 1.00 . A A . 10 ALA H 1 1 3 827 1 1 10 ALA HA H -3.736 -7.435 -0.709 1.00 . A A . 10 ALA HA 1 1 3 828 1 1 10 ALA HB1 H -5.892 -7.185 -1.841 1.00 . A A . 10 ALA HB1 1 1 3 829 1 1 10 ALA HB2 H -4.555 -7.267 -2.990 1.00 . A A . 10 ALA HB2 1 1 3 830 1 1 10 ALA HB3 H -5.307 -5.714 -2.621 1.00 . A A . 10 ALA HB3 1 1 3 831 1 1 10 ALA N N -4.664 -5.742 0.013 1.00 . A A . 10 ALA N 1 1 3 832 1 1 10 ALA O O -1.791 -6.376 -1.941 1.00 . A A . 10 ALA O 1 1 3 833 1 1 11 CYS C C -0.778 -3.182 -0.962 1.00 . A A . 11 CYS C 1 1 3 834 1 1 11 CYS CA C -1.695 -3.628 -2.100 1.00 . A A . 11 CYS CA 1 1 3 835 1 1 11 CYS CB C -2.203 -2.412 -2.882 1.00 . A A . 11 CYS CB 1 1 3 836 1 1 11 CYS H H -3.610 -3.950 -1.250 1.00 . A A . 11 CYS H 1 1 3 837 1 1 11 CYS HA H -1.130 -4.259 -2.770 1.00 . A A . 11 CYS HA 1 1 3 838 1 1 11 CYS HB2 H -3.132 -2.669 -3.369 1.00 . A A . 11 CYS HB2 1 1 3 839 1 1 11 CYS HB3 H -2.378 -1.598 -2.193 1.00 . A A . 11 CYS HB3 1 1 3 840 1 1 11 CYS N N -2.820 -4.413 -1.602 1.00 . A A . 11 CYS N 1 1 3 841 1 1 11 CYS O O 0.426 -3.005 -1.156 1.00 . A A . 11 CYS O 1 1 3 842 1 1 11 CYS SG S -1.052 -1.812 -4.167 1.00 . A A . 11 CYS SG 1 1 3 843 1 1 12 ARG C C 0.487 -3.598 1.745 1.00 . A A . 12 ARG C 1 1 3 844 1 1 12 ARG CA C -0.596 -2.587 1.401 1.00 . A A . 12 ARG CA 1 1 3 845 1 1 12 ARG CB C -1.528 -2.415 2.599 1.00 . A A . 12 ARG CB 1 1 3 846 1 1 12 ARG CD C -1.653 -2.223 5.112 1.00 . A A . 12 ARG CD 1 1 3 847 1 1 12 ARG CG C -0.816 -1.961 3.867 1.00 . A A . 12 ARG CG 1 1 3 848 1 1 12 ARG CZ C -3.300 -0.962 6.465 1.00 . A A . 12 ARG CZ 1 1 3 849 1 1 12 ARG H H -2.320 -3.163 0.313 1.00 . A A . 12 ARG H 1 1 3 850 1 1 12 ARG HA H -0.133 -1.637 1.174 1.00 . A A . 12 ARG HA 1 1 3 851 1 1 12 ARG HB2 H -2.280 -1.692 2.348 1.00 . A A . 12 ARG HB2 1 1 3 852 1 1 12 ARG HB3 H -2.007 -3.355 2.803 1.00 . A A . 12 ARG HB3 1 1 3 853 1 1 12 ARG HD2 H -2.120 -3.191 5.018 1.00 . A A . 12 ARG HD2 1 1 3 854 1 1 12 ARG HD3 H -0.998 -2.223 5.973 1.00 . A A . 12 ARG HD3 1 1 3 855 1 1 12 ARG HE H -2.948 -0.672 4.514 1.00 . A A . 12 ARG HE 1 1 3 856 1 1 12 ARG HG2 H 0.116 -2.499 3.955 1.00 . A A . 12 ARG HG2 1 1 3 857 1 1 12 ARG HG3 H -0.616 -0.903 3.794 1.00 . A A . 12 ARG HG3 1 1 3 858 1 1 12 ARG HH11 H -2.304 -2.391 7.500 1.00 . A A . 12 ARG HH11 1 1 3 859 1 1 12 ARG HH12 H -3.451 -1.475 8.421 1.00 . A A . 12 ARG HH12 1 1 3 860 1 1 12 ARG HH21 H -4.455 0.532 5.721 1.00 . A A . 12 ARG HH21 1 1 3 861 1 1 12 ARG HH22 H -4.681 0.189 7.409 1.00 . A A . 12 ARG HH22 1 1 3 862 1 1 12 ARG N N -1.353 -3.013 0.225 1.00 . A A . 12 ARG N 1 1 3 863 1 1 12 ARG NE N -2.692 -1.210 5.303 1.00 . A A . 12 ARG NE 1 1 3 864 1 1 12 ARG NH1 N -2.994 -1.667 7.550 1.00 . A A . 12 ARG NH1 1 1 3 865 1 1 12 ARG NH2 N -4.219 -0.005 6.540 1.00 . A A . 12 ARG NH2 1 1 3 866 1 1 12 ARG O O 1.586 -3.234 2.149 1.00 . A A . 12 ARG O 1 1 3 867 1 1 13 ARG C C 2.273 -5.942 0.906 1.00 . A A . 13 ARG C 1 1 3 868 1 1 13 ARG CA C 1.089 -5.950 1.871 1.00 . A A . 13 ARG CA 1 1 3 869 1 1 13 ARG CB C 0.378 -7.303 1.805 1.00 . A A . 13 ARG CB 1 1 3 870 1 1 13 ARG CD C -1.208 -8.927 2.886 1.00 . A A . 13 ARG CD 1 1 3 871 1 1 13 ARG CG C -0.581 -7.545 2.961 1.00 . A A . 13 ARG CG 1 1 3 872 1 1 13 ARG CZ C -2.841 -10.090 1.437 1.00 . A A . 13 ARG CZ 1 1 3 873 1 1 13 ARG H H -0.746 -5.078 1.256 1.00 . A A . 13 ARG H 1 1 3 874 1 1 13 ARG HA H 1.461 -5.802 2.874 1.00 . A A . 13 ARG HA 1 1 3 875 1 1 13 ARG HB2 H -0.184 -7.357 0.883 1.00 . A A . 13 ARG HB2 1 1 3 876 1 1 13 ARG HB3 H 1.120 -8.087 1.811 1.00 . A A . 13 ARG HB3 1 1 3 877 1 1 13 ARG HD2 H -0.425 -9.667 2.966 1.00 . A A . 13 ARG HD2 1 1 3 878 1 1 13 ARG HD3 H -1.896 -9.042 3.711 1.00 . A A . 13 ARG HD3 1 1 3 879 1 1 13 ARG HE H -1.716 -8.529 0.887 1.00 . A A . 13 ARG HE 1 1 3 880 1 1 13 ARG HG2 H -0.040 -7.456 3.890 1.00 . A A . 13 ARG HG2 1 1 3 881 1 1 13 ARG HG3 H -1.365 -6.802 2.926 1.00 . A A . 13 ARG HG3 1 1 3 882 1 1 13 ARG HH11 H -2.735 -10.817 3.326 1.00 . A A . 13 ARG HH11 1 1 3 883 1 1 13 ARG HH12 H -3.854 -11.630 2.285 1.00 . A A . 13 ARG HH12 1 1 3 884 1 1 13 ARG HH21 H -3.185 -9.600 -0.502 1.00 . A A . 13 ARG HH21 1 1 3 885 1 1 13 ARG HH22 H -4.111 -10.935 0.098 1.00 . A A . 13 ARG HH22 1 1 3 886 1 1 13 ARG N N 0.155 -4.867 1.578 1.00 . A A . 13 ARG N 1 1 3 887 1 1 13 ARG NE N -1.930 -9.136 1.629 1.00 . A A . 13 ARG NE 1 1 3 888 1 1 13 ARG NH1 N -3.171 -10.912 2.429 1.00 . A A . 13 ARG NH1 1 1 3 889 1 1 13 ARG NH2 N -3.427 -10.219 0.250 1.00 . A A . 13 ARG NH2 1 1 3 890 1 1 13 ARG O O 3.359 -6.406 1.243 1.00 . A A . 13 ARG O 1 1 3 891 1 1 14 ASN C C 3.924 -4.058 -1.160 1.00 . A A . 14 ASN C 1 1 3 892 1 1 14 ASN CA C 3.113 -5.343 -1.297 1.00 . A A . 14 ASN CA 1 1 3 893 1 1 14 ASN CB C 2.499 -5.438 -2.703 1.00 . A A . 14 ASN CB 1 1 3 894 1 1 14 ASN CG C 3.510 -5.207 -3.814 1.00 . A A . 14 ASN CG 1 1 3 895 1 1 14 ASN H H 1.179 -5.026 -0.490 1.00 . A A . 14 ASN H 1 1 3 896 1 1 14 ASN HA H 3.768 -6.186 -1.142 1.00 . A A . 14 ASN HA 1 1 3 897 1 1 14 ASN HB2 H 2.071 -6.419 -2.834 1.00 . A A . 14 ASN HB2 1 1 3 898 1 1 14 ASN HB3 H 1.719 -4.697 -2.794 1.00 . A A . 14 ASN HB3 1 1 3 899 1 1 14 ASN HD21 H 4.010 -7.128 -3.802 1.00 . A A . 14 ASN HD21 1 1 3 900 1 1 14 ASN HD22 H 4.849 -6.139 -4.942 1.00 . A A . 14 ASN HD22 1 1 3 901 1 1 14 ASN N N 2.061 -5.401 -0.287 1.00 . A A . 14 ASN N 1 1 3 902 1 1 14 ASN ND2 N 4.191 -6.265 -4.228 1.00 . A A . 14 ASN ND2 1 1 3 903 1 1 14 ASN O O 5.104 -4.009 -1.503 1.00 . A A . 14 ASN O 1 1 3 904 1 1 14 ASN OD1 O 3.671 -4.086 -4.301 1.00 . A A . 14 ASN OD1 1 1 3 905 1 1 15 HIS C C 4.089 -1.407 1.009 1.00 . A A . 15 HIS C 1 1 3 906 1 1 15 HIS CA C 3.960 -1.739 -0.468 1.00 . A A . 15 HIS CA 1 1 3 907 1 1 15 HIS CB C 3.206 -0.629 -1.207 1.00 . A A . 15 HIS CB 1 1 3 908 1 1 15 HIS CD2 C 2.180 -1.166 -3.527 1.00 . A A . 15 HIS CD2 1 1 3 909 1 1 15 HIS CE1 C 3.978 -0.903 -4.747 1.00 . A A . 15 HIS CE1 1 1 3 910 1 1 15 HIS CG C 3.185 -0.813 -2.694 1.00 . A A . 15 HIS CG 1 1 3 911 1 1 15 HIS H H 2.355 -3.116 -0.363 1.00 . A A . 15 HIS H 1 1 3 912 1 1 15 HIS HA H 4.951 -1.829 -0.888 1.00 . A A . 15 HIS HA 1 1 3 913 1 1 15 HIS HB2 H 2.183 -0.605 -0.860 1.00 . A A . 15 HIS HB2 1 1 3 914 1 1 15 HIS HB3 H 3.676 0.320 -0.994 1.00 . A A . 15 HIS HB3 1 1 3 915 1 1 15 HIS HD1 H 5.195 -0.408 -3.181 1.00 . A A . 15 HIS HD1 1 1 3 916 1 1 15 HIS HD2 H 1.157 -1.367 -3.244 1.00 . A A . 15 HIS HD2 1 1 3 917 1 1 15 HIS HE1 H 4.651 -0.859 -5.590 1.00 . A A . 15 HIS HE1 1 1 3 918 1 1 15 HIS HE2 H 2.268 -1.672 -5.558 1.00 . A A . 15 HIS HE2 1 1 3 919 1 1 15 HIS N N 3.291 -3.019 -0.642 1.00 . A A . 15 HIS N 1 1 3 920 1 1 15 HIS ND1 N 4.299 -0.654 -3.491 1.00 . A A . 15 HIS ND1 1 1 3 921 1 1 15 HIS NE2 N 2.697 -1.218 -4.799 1.00 . A A . 15 HIS NE2 1 1 3 922 1 1 15 HIS O O 3.998 -0.247 1.411 1.00 . A A . 15 HIS O 1 1 3 923 1 1 16 LYS C C 5.683 -1.424 3.597 1.00 . A A . 16 LYS C 1 1 3 924 1 1 16 LYS CA C 4.466 -2.283 3.257 1.00 . A A . 16 LYS CA 1 1 3 925 1 1 16 LYS CB C 4.579 -3.658 3.928 1.00 . A A . 16 LYS CB 1 1 3 926 1 1 16 LYS CD C 3.420 -2.925 6.039 1.00 . A A . 16 LYS CD 1 1 3 927 1 1 16 LYS CE C 3.750 -2.201 7.335 1.00 . A A . 16 LYS CE 1 1 3 928 1 1 16 LYS CG C 4.650 -3.597 5.447 1.00 . A A . 16 LYS CG 1 1 3 929 1 1 16 LYS H H 4.391 -3.337 1.424 1.00 . A A . 16 LYS H 1 1 3 930 1 1 16 LYS HA H 3.579 -1.786 3.625 1.00 . A A . 16 LYS HA 1 1 3 931 1 1 16 LYS HB2 H 3.720 -4.251 3.654 1.00 . A A . 16 LYS HB2 1 1 3 932 1 1 16 LYS HB3 H 5.472 -4.147 3.568 1.00 . A A . 16 LYS HB3 1 1 3 933 1 1 16 LYS HD2 H 3.035 -2.210 5.327 1.00 . A A . 16 LYS HD2 1 1 3 934 1 1 16 LYS HD3 H 2.671 -3.678 6.237 1.00 . A A . 16 LYS HD3 1 1 3 935 1 1 16 LYS HE2 H 2.828 -1.945 7.834 1.00 . A A . 16 LYS HE2 1 1 3 936 1 1 16 LYS HE3 H 4.327 -2.863 7.964 1.00 . A A . 16 LYS HE3 1 1 3 937 1 1 16 LYS HG2 H 4.720 -4.601 5.836 1.00 . A A . 16 LYS HG2 1 1 3 938 1 1 16 LYS HG3 H 5.528 -3.036 5.734 1.00 . A A . 16 LYS HG3 1 1 3 939 1 1 16 LYS HZ1 H 3.902 -0.192 6.767 1.00 . A A . 16 LYS HZ1 1 1 3 940 1 1 16 LYS HZ2 H 5.260 -1.122 6.367 1.00 . A A . 16 LYS HZ2 1 1 3 941 1 1 16 LYS HZ3 H 4.998 -0.652 7.970 1.00 . A A . 16 LYS HZ3 1 1 3 942 1 1 16 LYS N N 4.323 -2.438 1.814 1.00 . A A . 16 LYS N 1 1 3 943 1 1 16 LYS NZ N 4.532 -0.957 7.096 1.00 . A A . 16 LYS NZ 1 1 3 944 1 1 16 LYS O O 5.776 -0.856 4.688 1.00 . A A . 16 LYS O 1 1 3 945 1 1 17 LYS C C 7.521 0.942 2.668 1.00 . A A . 17 LYS C 1 1 3 946 1 1 17 LYS CA C 7.813 -0.539 2.848 1.00 . A A . 17 LYS CA 1 1 3 947 1 1 17 LYS CB C 8.899 -0.975 1.866 1.00 . A A . 17 LYS CB 1 1 3 948 1 1 17 LYS CD C 11.024 -2.255 1.481 1.00 . A A . 17 LYS CD 1 1 3 949 1 1 17 LYS CE C 12.129 -3.068 2.136 1.00 . A A . 17 LYS CE 1 1 3 950 1 1 17 LYS CG C 9.903 -1.946 2.460 1.00 . A A . 17 LYS CG 1 1 3 951 1 1 17 LYS H H 6.481 -1.814 1.815 1.00 . A A . 17 LYS H 1 1 3 952 1 1 17 LYS HA H 8.162 -0.703 3.854 1.00 . A A . 17 LYS HA 1 1 3 953 1 1 17 LYS HB2 H 8.428 -1.450 1.018 1.00 . A A . 17 LYS HB2 1 1 3 954 1 1 17 LYS HB3 H 9.431 -0.100 1.527 1.00 . A A . 17 LYS HB3 1 1 3 955 1 1 17 LYS HD2 H 10.621 -2.817 0.653 1.00 . A A . 17 LYS HD2 1 1 3 956 1 1 17 LYS HD3 H 11.438 -1.325 1.121 1.00 . A A . 17 LYS HD3 1 1 3 957 1 1 17 LYS HE2 H 11.695 -3.952 2.578 1.00 . A A . 17 LYS HE2 1 1 3 958 1 1 17 LYS HE3 H 12.842 -3.359 1.377 1.00 . A A . 17 LYS HE3 1 1 3 959 1 1 17 LYS HG2 H 10.327 -1.510 3.352 1.00 . A A . 17 LYS HG2 1 1 3 960 1 1 17 LYS HG3 H 9.394 -2.865 2.713 1.00 . A A . 17 LYS HG3 1 1 3 961 1 1 17 LYS HZ1 H 13.234 -1.421 2.791 1.00 . A A . 17 LYS HZ1 1 1 3 962 1 1 17 LYS HZ2 H 13.609 -2.861 3.596 1.00 . A A . 17 LYS HZ2 1 1 3 963 1 1 17 LYS HZ3 H 12.174 -2.039 3.955 1.00 . A A . 17 LYS HZ3 1 1 3 964 1 1 17 LYS N N 6.610 -1.333 2.658 1.00 . A A . 17 LYS N 1 1 3 965 1 1 17 LYS NZ N 12.837 -2.293 3.193 1.00 . A A . 17 LYS NZ 1 1 3 966 1 1 17 LYS O O 8.197 1.789 3.243 1.00 . A A . 17 LYS O 1 1 3 967 1 1 18 PHE C C 5.133 3.097 2.664 1.00 . A A . 18 PHE C 1 1 3 968 1 1 18 PHE CA C 6.123 2.620 1.612 1.00 . A A . 18 PHE CA 1 1 3 969 1 1 18 PHE CB C 5.505 2.752 0.217 1.00 . A A . 18 PHE CB 1 1 3 970 1 1 18 PHE CD1 C 7.316 3.476 -1.360 1.00 . A A . 18 PHE CD1 1 1 3 971 1 1 18 PHE CD2 C 6.531 1.228 -1.494 1.00 . A A . 18 PHE CD2 1 1 3 972 1 1 18 PHE CE1 C 8.205 3.231 -2.389 1.00 . A A . 18 PHE CE1 1 1 3 973 1 1 18 PHE CE2 C 7.418 0.976 -2.523 1.00 . A A . 18 PHE CE2 1 1 3 974 1 1 18 PHE CG C 6.471 2.478 -0.901 1.00 . A A . 18 PHE CG 1 1 3 975 1 1 18 PHE CZ C 8.256 1.979 -2.972 1.00 . A A . 18 PHE CZ 1 1 3 976 1 1 18 PHE H H 6.001 0.517 1.453 1.00 . A A . 18 PHE H 1 1 3 977 1 1 18 PHE HA H 7.012 3.229 1.665 1.00 . A A . 18 PHE HA 1 1 3 978 1 1 18 PHE HB2 H 4.688 2.052 0.126 1.00 . A A . 18 PHE HB2 1 1 3 979 1 1 18 PHE HB3 H 5.128 3.755 0.093 1.00 . A A . 18 PHE HB3 1 1 3 980 1 1 18 PHE HD1 H 7.278 4.455 -0.905 1.00 . A A . 18 PHE HD1 1 1 3 981 1 1 18 PHE HD2 H 5.876 0.444 -1.144 1.00 . A A . 18 PHE HD2 1 1 3 982 1 1 18 PHE HE1 H 8.859 4.016 -2.738 1.00 . A A . 18 PHE HE1 1 1 3 983 1 1 18 PHE HE2 H 7.456 -0.004 -2.976 1.00 . A A . 18 PHE HE2 1 1 3 984 1 1 18 PHE HZ H 8.950 1.784 -3.776 1.00 . A A . 18 PHE HZ 1 1 3 985 1 1 18 PHE N N 6.508 1.241 1.870 1.00 . A A . 18 PHE N 1 1 3 986 1 1 18 PHE O O 5.228 4.216 3.165 1.00 . A A . 18 PHE O 1 1 3 987 1 1 19 CYS C C 3.631 2.155 5.382 1.00 . A A . 19 CYS C 1 1 3 988 1 1 19 CYS CA C 3.176 2.574 3.989 1.00 . A A . 19 CYS CA 1 1 3 989 1 1 19 CYS CB C 1.839 1.916 3.635 1.00 . A A . 19 CYS CB 1 1 3 990 1 1 19 CYS H H 4.168 1.351 2.575 1.00 . A A . 19 CYS H 1 1 3 991 1 1 19 CYS HA H 3.051 3.647 3.976 1.00 . A A . 19 CYS HA 1 1 3 992 1 1 19 CYS HB2 H 1.809 0.919 4.042 1.00 . A A . 19 CYS HB2 1 1 3 993 1 1 19 CYS HB3 H 1.038 2.498 4.066 1.00 . A A . 19 CYS HB3 1 1 3 994 1 1 19 CYS N N 4.185 2.237 3.000 1.00 . A A . 19 CYS N 1 1 3 995 1 1 19 CYS O O 3.253 1.092 5.885 1.00 . A A . 19 CYS O 1 1 3 996 1 1 19 CYS SG S 1.529 1.793 1.844 1.00 . A A . 19 CYS SG 1 1 3 997 1 1 20 NH2 HN1 H 4.709 3.814 5.541 1.00 . A A . 20 NH2 HN1 1 1 3 998 1 1 20 NH2 HN2 H 4.770 2.746 6.898 1.00 . A A . 20 NH2 HN2 1 1 3 999 1 1 20 NH2 N N 4.453 2.987 6.005 1.00 . A A . 20 NH2 N 1 1 4 1000 1 1 1 PHE C C 1.692 6.463 -5.192 1.00 . A A . 1 PHE C 1 1 4 1001 1 1 1 PHE CA C 3.188 6.448 -5.476 1.00 . A A . 1 PHE CA 1 1 4 1002 1 1 1 PHE CB C 3.976 6.385 -4.160 1.00 . A A . 1 PHE CB 1 1 4 1003 1 1 1 PHE CD1 C 4.019 3.921 -3.685 1.00 . A A . 1 PHE CD1 1 1 4 1004 1 1 1 PHE CD2 C 2.942 5.358 -2.115 1.00 . A A . 1 PHE CD2 1 1 4 1005 1 1 1 PHE CE1 C 3.708 2.828 -2.900 1.00 . A A . 1 PHE CE1 1 1 4 1006 1 1 1 PHE CE2 C 2.629 4.269 -1.327 1.00 . A A . 1 PHE CE2 1 1 4 1007 1 1 1 PHE CG C 3.640 5.198 -3.303 1.00 . A A . 1 PHE CG 1 1 4 1008 1 1 1 PHE CZ C 3.012 3.002 -1.719 1.00 . A A . 1 PHE CZ 1 1 4 1009 1 1 1 PHE H1 H 4.581 7.653 -6.453 1.00 . A A . 1 PHE H1 1 1 4 1010 1 1 1 PHE H2 H 3.346 8.512 -5.680 1.00 . A A . 1 PHE H2 1 1 4 1011 1 1 1 PHE H3 H 3.031 7.703 -7.129 1.00 . A A . 1 PHE H3 1 1 4 1012 1 1 1 PHE HA H 3.422 5.581 -6.075 1.00 . A A . 1 PHE HA 1 1 4 1013 1 1 1 PHE HB2 H 5.031 6.342 -4.384 1.00 . A A . 1 PHE HB2 1 1 4 1014 1 1 1 PHE HB3 H 3.772 7.278 -3.586 1.00 . A A . 1 PHE HB3 1 1 4 1015 1 1 1 PHE HD1 H 4.564 3.783 -4.606 1.00 . A A . 1 PHE HD1 1 1 4 1016 1 1 1 PHE HD2 H 2.641 6.349 -1.808 1.00 . A A . 1 PHE HD2 1 1 4 1017 1 1 1 PHE HE1 H 4.009 1.838 -3.209 1.00 . A A . 1 PHE HE1 1 1 4 1018 1 1 1 PHE HE2 H 2.085 4.408 -0.404 1.00 . A A . 1 PHE HE2 1 1 4 1019 1 1 1 PHE HZ H 2.768 2.148 -1.104 1.00 . A A . 1 PHE HZ 1 1 4 1020 1 1 1 PHE N N 3.565 7.663 -6.238 1.00 . A A . 1 PHE N 1 1 4 1021 1 1 1 PHE O O 1.118 7.523 -4.959 1.00 . A A . 1 PHE O 1 1 4 1022 1 1 2 ASN C C -0.611 4.967 -3.481 1.00 . A A . 2 ASN C 1 1 4 1023 1 1 2 ASN CA C -0.365 5.191 -4.967 1.00 . A A . 2 ASN CA 1 1 4 1024 1 1 2 ASN CB C -0.989 4.053 -5.783 1.00 . A A . 2 ASN CB 1 1 4 1025 1 1 2 ASN CG C -2.487 3.935 -5.559 1.00 . A A . 2 ASN CG 1 1 4 1026 1 1 2 ASN H H 1.574 4.480 -5.427 1.00 . A A . 2 ASN H 1 1 4 1027 1 1 2 ASN HA H -0.820 6.126 -5.257 1.00 . A A . 2 ASN HA 1 1 4 1028 1 1 2 ASN HB2 H -0.815 4.234 -6.833 1.00 . A A . 2 ASN HB2 1 1 4 1029 1 1 2 ASN HB3 H -0.526 3.119 -5.500 1.00 . A A . 2 ASN HB3 1 1 4 1030 1 1 2 ASN HD21 H -2.424 1.993 -5.971 1.00 . A A . 2 ASN HD21 1 1 4 1031 1 1 2 ASN HD22 H -3.982 2.631 -5.589 1.00 . A A . 2 ASN HD22 1 1 4 1032 1 1 2 ASN N N 1.066 5.294 -5.229 1.00 . A A . 2 ASN N 1 1 4 1033 1 1 2 ASN ND2 N -3.018 2.733 -5.721 1.00 . A A . 2 ASN ND2 1 1 4 1034 1 1 2 ASN O O -0.603 3.831 -3.005 1.00 . A A . 2 ASN O 1 1 4 1035 1 1 2 ASN OD1 O -3.159 4.915 -5.238 1.00 . A A . 2 ASN OD1 1 1 4 1036 1 1 3 TRP C C -2.327 5.202 -1.000 1.00 . A A . 3 TRP C 1 1 4 1037 1 1 3 TRP CA C -1.071 6.007 -1.320 1.00 . A A . 3 TRP CA 1 1 4 1038 1 1 3 TRP CB C -1.187 7.425 -0.744 1.00 . A A . 3 TRP CB 1 1 4 1039 1 1 3 TRP CD1 C -1.839 9.096 -2.578 1.00 . A A . 3 TRP CD1 1 1 4 1040 1 1 3 TRP CD2 C -3.528 8.507 -1.232 1.00 . A A . 3 TRP CD2 1 1 4 1041 1 1 3 TRP CE2 C -4.015 9.416 -2.190 1.00 . A A . 3 TRP CE2 1 1 4 1042 1 1 3 TRP CE3 C -4.414 7.999 -0.277 1.00 . A A . 3 TRP CE3 1 1 4 1043 1 1 3 TRP CG C -2.135 8.310 -1.501 1.00 . A A . 3 TRP CG 1 1 4 1044 1 1 3 TRP CH2 C -6.188 9.314 -1.273 1.00 . A A . 3 TRP CH2 1 1 4 1045 1 1 3 TRP CZ2 C -5.344 9.828 -2.221 1.00 . A A . 3 TRP CZ2 1 1 4 1046 1 1 3 TRP CZ3 C -5.733 8.409 -0.307 1.00 . A A . 3 TRP CZ3 1 1 4 1047 1 1 3 TRP H H -0.827 6.932 -3.208 1.00 . A A . 3 TRP H 1 1 4 1048 1 1 3 TRP HA H -0.227 5.514 -0.867 1.00 . A A . 3 TRP HA 1 1 4 1049 1 1 3 TRP HB2 H -1.532 7.363 0.276 1.00 . A A . 3 TRP HB2 1 1 4 1050 1 1 3 TRP HB3 H -0.211 7.890 -0.760 1.00 . A A . 3 TRP HB3 1 1 4 1051 1 1 3 TRP HD1 H -0.859 9.170 -3.025 1.00 . A A . 3 TRP HD1 1 1 4 1052 1 1 3 TRP HE1 H -3.008 10.380 -3.759 1.00 . A A . 3 TRP HE1 1 1 4 1053 1 1 3 TRP HE3 H -4.082 7.299 0.476 1.00 . A A . 3 TRP HE3 1 1 4 1054 1 1 3 TRP HH2 H -7.227 9.607 -1.259 1.00 . A A . 3 TRP HH2 1 1 4 1055 1 1 3 TRP HZ2 H -5.710 10.525 -2.959 1.00 . A A . 3 TRP HZ2 1 1 4 1056 1 1 3 TRP HZ3 H -6.431 8.027 0.424 1.00 . A A . 3 TRP HZ3 1 1 4 1057 1 1 3 TRP N N -0.829 6.060 -2.760 1.00 . A A . 3 TRP N 1 1 4 1058 1 1 3 TRP NE1 N -2.965 9.759 -3.001 1.00 . A A . 3 TRP NE1 1 1 4 1059 1 1 3 TRP O O -2.476 4.670 0.102 1.00 . A A . 3 TRP O 1 1 4 1060 1 1 4 ARG C C -4.178 2.885 -1.549 1.00 . A A . 4 ARG C 1 1 4 1061 1 1 4 ARG CA C -4.456 4.351 -1.808 1.00 . A A . 4 ARG CA 1 1 4 1062 1 1 4 ARG CB C -5.354 4.503 -3.030 1.00 . A A . 4 ARG CB 1 1 4 1063 1 1 4 ARG CD C -7.226 5.753 -4.153 1.00 . A A . 4 ARG CD 1 1 4 1064 1 1 4 ARG CG C -6.314 5.677 -2.939 1.00 . A A . 4 ARG CG 1 1 4 1065 1 1 4 ARG CZ C -9.370 6.887 -4.646 1.00 . A A . 4 ARG CZ 1 1 4 1066 1 1 4 ARG H H -3.025 5.517 -2.840 1.00 . A A . 4 ARG H 1 1 4 1067 1 1 4 ARG HA H -4.952 4.752 -0.949 1.00 . A A . 4 ARG HA 1 1 4 1068 1 1 4 ARG HB2 H -4.731 4.645 -3.902 1.00 . A A . 4 ARG HB2 1 1 4 1069 1 1 4 ARG HB3 H -5.924 3.599 -3.152 1.00 . A A . 4 ARG HB3 1 1 4 1070 1 1 4 ARG HD2 H -6.619 5.883 -5.037 1.00 . A A . 4 ARG HD2 1 1 4 1071 1 1 4 ARG HD3 H -7.780 4.829 -4.231 1.00 . A A . 4 ARG HD3 1 1 4 1072 1 1 4 ARG HE H -7.894 7.645 -3.525 1.00 . A A . 4 ARG HE 1 1 4 1073 1 1 4 ARG HG2 H -6.922 5.565 -2.054 1.00 . A A . 4 ARG HG2 1 1 4 1074 1 1 4 ARG HG3 H -5.743 6.592 -2.872 1.00 . A A . 4 ARG HG3 1 1 4 1075 1 1 4 ARG HH11 H -9.181 5.053 -5.488 1.00 . A A . 4 ARG HH11 1 1 4 1076 1 1 4 ARG HH12 H -10.676 5.864 -5.816 1.00 . A A . 4 ARG HH12 1 1 4 1077 1 1 4 ARG HH21 H -9.864 8.729 -3.955 1.00 . A A . 4 ARG HH21 1 1 4 1078 1 1 4 ARG HH22 H -11.065 7.965 -4.941 1.00 . A A . 4 ARG HH22 1 1 4 1079 1 1 4 ARG N N -3.215 5.093 -1.979 1.00 . A A . 4 ARG N 1 1 4 1080 1 1 4 ARG NE N -8.172 6.868 -4.058 1.00 . A A . 4 ARG NE 1 1 4 1081 1 1 4 ARG NH1 N -9.775 5.852 -5.376 1.00 . A A . 4 ARG NH1 1 1 4 1082 1 1 4 ARG NH2 N -10.164 7.945 -4.502 1.00 . A A . 4 ARG NH2 1 1 4 1083 1 1 4 ARG O O -4.984 2.184 -0.944 1.00 . A A . 4 ARG O 1 1 4 1084 1 1 5 CYS C C -2.480 0.756 -0.332 1.00 . A A . 5 CYS C 1 1 4 1085 1 1 5 CYS CA C -2.609 1.060 -1.813 1.00 . A A . 5 CYS CA 1 1 4 1086 1 1 5 CYS CB C -1.270 0.806 -2.491 1.00 . A A . 5 CYS CB 1 1 4 1087 1 1 5 CYS H H -2.444 3.060 -2.490 1.00 . A A . 5 CYS H 1 1 4 1088 1 1 5 CYS HA H -3.358 0.413 -2.245 1.00 . A A . 5 CYS HA 1 1 4 1089 1 1 5 CYS HB2 H -0.679 1.708 -2.435 1.00 . A A . 5 CYS HB2 1 1 4 1090 1 1 5 CYS HB3 H -0.756 0.012 -1.969 1.00 . A A . 5 CYS HB3 1 1 4 1091 1 1 5 CYS N N -3.029 2.438 -2.006 1.00 . A A . 5 CYS N 1 1 4 1092 1 1 5 CYS O O -2.735 -0.363 0.107 1.00 . A A . 5 CYS O 1 1 4 1093 1 1 5 CYS SG S -1.401 0.326 -4.243 1.00 . A A . 5 CYS SG 1 1 4 1094 1 1 6 CYS C C -3.293 1.426 2.567 1.00 . A A . 6 CYS C 1 1 4 1095 1 1 6 CYS CA C -1.948 1.611 1.876 1.00 . A A . 6 CYS CA 1 1 4 1096 1 1 6 CYS CB C -1.203 2.810 2.460 1.00 . A A . 6 CYS CB 1 1 4 1097 1 1 6 CYS H H -1.987 2.665 0.031 1.00 . A A . 6 CYS H 1 1 4 1098 1 1 6 CYS HA H -1.356 0.722 2.036 1.00 . A A . 6 CYS HA 1 1 4 1099 1 1 6 CYS HB2 H -1.890 3.635 2.573 1.00 . A A . 6 CYS HB2 1 1 4 1100 1 1 6 CYS HB3 H -0.807 2.537 3.428 1.00 . A A . 6 CYS HB3 1 1 4 1101 1 1 6 CYS N N -2.122 1.773 0.440 1.00 . A A . 6 CYS N 1 1 4 1102 1 1 6 CYS O O -3.361 1.015 3.727 1.00 . A A . 6 CYS O 1 1 4 1103 1 1 6 CYS SG S 0.192 3.378 1.433 1.00 . A A . 6 CYS SG 1 1 4 1104 1 1 7 LEU C C -6.302 0.253 1.896 1.00 . A A . 7 LEU C 1 1 4 1105 1 1 7 LEU CA C -5.711 1.576 2.364 1.00 . A A . 7 LEU CA 1 1 4 1106 1 1 7 LEU CB C -6.589 2.742 1.901 1.00 . A A . 7 LEU CB 1 1 4 1107 1 1 7 LEU CD1 C -6.881 5.202 1.525 1.00 . A A . 7 LEU CD1 1 1 4 1108 1 1 7 LEU CD2 C -5.962 4.377 3.698 1.00 . A A . 7 LEU CD2 1 1 4 1109 1 1 7 LEU CG C -6.032 4.136 2.197 1.00 . A A . 7 LEU CG 1 1 4 1110 1 1 7 LEU H H -4.240 2.049 0.925 1.00 . A A . 7 LEU H 1 1 4 1111 1 1 7 LEU HA H -5.655 1.574 3.440 1.00 . A A . 7 LEU HA 1 1 4 1112 1 1 7 LEU HB2 H -6.733 2.654 0.834 1.00 . A A . 7 LEU HB2 1 1 4 1113 1 1 7 LEU HB3 H -7.552 2.654 2.385 1.00 . A A . 7 LEU HB3 1 1 4 1114 1 1 7 LEU HD11 H -7.889 5.156 1.910 1.00 . A A . 7 LEU HD11 1 1 4 1115 1 1 7 LEU HD12 H -6.895 5.032 0.458 1.00 . A A . 7 LEU HD12 1 1 4 1116 1 1 7 LEU HD13 H -6.462 6.178 1.727 1.00 . A A . 7 LEU HD13 1 1 4 1117 1 1 7 LEU HD21 H -5.332 3.627 4.154 1.00 . A A . 7 LEU HD21 1 1 4 1118 1 1 7 LEU HD22 H -6.955 4.316 4.119 1.00 . A A . 7 LEU HD22 1 1 4 1119 1 1 7 LEU HD23 H -5.551 5.357 3.888 1.00 . A A . 7 LEU HD23 1 1 4 1120 1 1 7 LEU HG H -5.029 4.208 1.799 1.00 . A A . 7 LEU HG 1 1 4 1121 1 1 7 LEU N N -4.362 1.722 1.841 1.00 . A A . 7 LEU N 1 1 4 1122 1 1 7 LEU O O -7.420 -0.112 2.255 1.00 . A A . 7 LEU O 1 1 4 1123 1 1 8 ILE C C -4.998 -2.850 1.027 1.00 . A A . 8 ILE C 1 1 4 1124 1 1 8 ILE CA C -5.947 -1.749 0.560 1.00 . A A . 8 ILE CA 1 1 4 1125 1 1 8 ILE CB C -5.988 -1.730 -0.987 1.00 . A A . 8 ILE CB 1 1 4 1126 1 1 8 ILE CD1 C -6.666 -0.282 -2.974 1.00 . A A . 8 ILE CD1 1 1 4 1127 1 1 8 ILE CG1 C -6.804 -0.533 -1.487 1.00 . A A . 8 ILE CG1 1 1 4 1128 1 1 8 ILE CG2 C -6.575 -3.030 -1.521 1.00 . A A . 8 ILE CG2 1 1 4 1129 1 1 8 ILE H H -4.633 -0.125 0.873 1.00 . A A . 8 ILE H 1 1 4 1130 1 1 8 ILE HA H -6.942 -1.959 0.928 1.00 . A A . 8 ILE HA 1 1 4 1131 1 1 8 ILE HB H -4.976 -1.645 -1.352 1.00 . A A . 8 ILE HB 1 1 4 1132 1 1 8 ILE HD11 H -7.262 0.575 -3.252 1.00 . A A . 8 ILE HD11 1 1 4 1133 1 1 8 ILE HD12 H -7.007 -1.149 -3.518 1.00 . A A . 8 ILE HD12 1 1 4 1134 1 1 8 ILE HD13 H -5.630 -0.091 -3.212 1.00 . A A . 8 ILE HD13 1 1 4 1135 1 1 8 ILE HG12 H -7.848 -0.704 -1.277 1.00 . A A . 8 ILE HG12 1 1 4 1136 1 1 8 ILE HG13 H -6.477 0.357 -0.967 1.00 . A A . 8 ILE HG13 1 1 4 1137 1 1 8 ILE HG21 H -7.562 -3.176 -1.110 1.00 . A A . 8 ILE HG21 1 1 4 1138 1 1 8 ILE HG22 H -5.940 -3.855 -1.238 1.00 . A A . 8 ILE HG22 1 1 4 1139 1 1 8 ILE HG23 H -6.639 -2.980 -2.599 1.00 . A A . 8 ILE HG23 1 1 4 1140 1 1 8 ILE N N -5.526 -0.466 1.096 1.00 . A A . 8 ILE N 1 1 4 1141 1 1 8 ILE O O -3.844 -2.902 0.599 1.00 . A A . 8 ILE O 1 1 4 1142 1 1 9 PRO C C -4.035 -5.753 1.382 1.00 . A A . 9 PRO C 1 1 4 1143 1 1 9 PRO CA C -4.683 -4.866 2.450 1.00 . A A . 9 PRO CA 1 1 4 1144 1 1 9 PRO CB C -5.705 -5.673 3.255 1.00 . A A . 9 PRO CB 1 1 4 1145 1 1 9 PRO CD C -6.863 -3.763 2.414 1.00 . A A . 9 PRO CD 1 1 4 1146 1 1 9 PRO CG C -6.786 -4.703 3.583 1.00 . A A . 9 PRO CG 1 1 4 1147 1 1 9 PRO HA H -3.916 -4.497 3.115 1.00 . A A . 9 PRO HA 1 1 4 1148 1 1 9 PRO HB2 H -6.076 -6.491 2.655 1.00 . A A . 9 PRO HB2 1 1 4 1149 1 1 9 PRO HB3 H -5.238 -6.059 4.150 1.00 . A A . 9 PRO HB3 1 1 4 1150 1 1 9 PRO HD2 H -7.554 -4.138 1.672 1.00 . A A . 9 PRO HD2 1 1 4 1151 1 1 9 PRO HD3 H -7.158 -2.777 2.741 1.00 . A A . 9 PRO HD3 1 1 4 1152 1 1 9 PRO HG2 H -7.723 -5.224 3.708 1.00 . A A . 9 PRO HG2 1 1 4 1153 1 1 9 PRO HG3 H -6.534 -4.160 4.483 1.00 . A A . 9 PRO HG3 1 1 4 1154 1 1 9 PRO N N -5.484 -3.756 1.895 1.00 . A A . 9 PRO N 1 1 4 1155 1 1 9 PRO O O -3.167 -6.575 1.685 1.00 . A A . 9 PRO O 1 1 4 1156 1 1 10 ALA C C -2.724 -5.658 -1.590 1.00 . A A . 10 ALA C 1 1 4 1157 1 1 10 ALA CA C -3.924 -6.368 -0.965 1.00 . A A . 10 ALA CA 1 1 4 1158 1 1 10 ALA CB C -4.997 -6.626 -2.012 1.00 . A A . 10 ALA CB 1 1 4 1159 1 1 10 ALA H H -5.178 -4.943 -0.035 1.00 . A A . 10 ALA H 1 1 4 1160 1 1 10 ALA HA H -3.601 -7.322 -0.574 1.00 . A A . 10 ALA HA 1 1 4 1161 1 1 10 ALA HB1 H -5.326 -5.686 -2.431 1.00 . A A . 10 ALA HB1 1 1 4 1162 1 1 10 ALA HB2 H -5.836 -7.127 -1.553 1.00 . A A . 10 ALA HB2 1 1 4 1163 1 1 10 ALA HB3 H -4.592 -7.248 -2.797 1.00 . A A . 10 ALA HB3 1 1 4 1164 1 1 10 ALA N N -4.469 -5.595 0.140 1.00 . A A . 10 ALA N 1 1 4 1165 1 1 10 ALA O O -1.770 -6.301 -2.016 1.00 . A A . 10 ALA O 1 1 4 1166 1 1 11 CYS C C -0.660 -3.153 -1.134 1.00 . A A . 11 CYS C 1 1 4 1167 1 1 11 CYS CA C -1.665 -3.560 -2.204 1.00 . A A . 11 CYS CA 1 1 4 1168 1 1 11 CYS CB C -2.198 -2.322 -2.936 1.00 . A A . 11 CYS CB 1 1 4 1169 1 1 11 CYS H H -3.517 -3.856 -1.207 1.00 . A A . 11 CYS H 1 1 4 1170 1 1 11 CYS HA H -1.167 -4.199 -2.917 1.00 . A A . 11 CYS HA 1 1 4 1171 1 1 11 CYS HB2 H -3.135 -2.570 -3.414 1.00 . A A . 11 CYS HB2 1 1 4 1172 1 1 11 CYS HB3 H -2.365 -1.531 -2.219 1.00 . A A . 11 CYS HB3 1 1 4 1173 1 1 11 CYS N N -2.757 -4.328 -1.613 1.00 . A A . 11 CYS N 1 1 4 1174 1 1 11 CYS O O 0.544 -3.076 -1.391 1.00 . A A . 11 CYS O 1 1 4 1175 1 1 11 CYS SG S -1.072 -1.680 -4.223 1.00 . A A . 11 CYS SG 1 1 4 1176 1 1 12 ARG C C 0.593 -3.684 1.593 1.00 . A A . 12 ARG C 1 1 4 1177 1 1 12 ARG CA C -0.296 -2.523 1.192 1.00 . A A . 12 ARG CA 1 1 4 1178 1 1 12 ARG CB C -1.132 -2.094 2.393 1.00 . A A . 12 ARG CB 1 1 4 1179 1 1 12 ARG CD C -1.144 -1.014 4.665 1.00 . A A . 12 ARG CD 1 1 4 1180 1 1 12 ARG CG C -0.353 -1.257 3.393 1.00 . A A . 12 ARG CG 1 1 4 1181 1 1 12 ARG CZ C -0.882 0.721 6.405 1.00 . A A . 12 ARG CZ 1 1 4 1182 1 1 12 ARG H H -2.125 -2.974 0.221 1.00 . A A . 12 ARG H 1 1 4 1183 1 1 12 ARG HA H 0.322 -1.696 0.874 1.00 . A A . 12 ARG HA 1 1 4 1184 1 1 12 ARG HB2 H -1.973 -1.523 2.042 1.00 . A A . 12 ARG HB2 1 1 4 1185 1 1 12 ARG HB3 H -1.493 -2.977 2.899 1.00 . A A . 12 ARG HB3 1 1 4 1186 1 1 12 ARG HD2 H -2.042 -0.467 4.417 1.00 . A A . 12 ARG HD2 1 1 4 1187 1 1 12 ARG HD3 H -1.411 -1.967 5.097 1.00 . A A . 12 ARG HD3 1 1 4 1188 1 1 12 ARG HE H 0.580 -0.475 5.741 1.00 . A A . 12 ARG HE 1 1 4 1189 1 1 12 ARG HG2 H 0.561 -1.774 3.646 1.00 . A A . 12 ARG HG2 1 1 4 1190 1 1 12 ARG HG3 H -0.115 -0.305 2.941 1.00 . A A . 12 ARG HG3 1 1 4 1191 1 1 12 ARG HH11 H -2.739 0.627 5.587 1.00 . A A . 12 ARG HH11 1 1 4 1192 1 1 12 ARG HH12 H -2.541 1.803 6.845 1.00 . A A . 12 ARG HH12 1 1 4 1193 1 1 12 ARG HH21 H 0.865 1.092 7.367 1.00 . A A . 12 ARG HH21 1 1 4 1194 1 1 12 ARG HH22 H -0.477 2.073 7.862 1.00 . A A . 12 ARG HH22 1 1 4 1195 1 1 12 ARG N N -1.154 -2.909 0.076 1.00 . A A . 12 ARG N 1 1 4 1196 1 1 12 ARG NE N -0.373 -0.247 5.643 1.00 . A A . 12 ARG NE 1 1 4 1197 1 1 12 ARG NH1 N -2.154 1.082 6.270 1.00 . A A . 12 ARG NH1 1 1 4 1198 1 1 12 ARG NH2 N -0.105 1.347 7.281 1.00 . A A . 12 ARG NH2 1 1 4 1199 1 1 12 ARG O O 1.631 -3.502 2.212 1.00 . A A . 12 ARG O 1 1 4 1200 1 1 13 ARG C C 2.242 -6.084 0.806 1.00 . A A . 13 ARG C 1 1 4 1201 1 1 13 ARG CA C 0.905 -6.088 1.540 1.00 . A A . 13 ARG CA 1 1 4 1202 1 1 13 ARG CB C 0.085 -7.313 1.139 1.00 . A A . 13 ARG CB 1 1 4 1203 1 1 13 ARG CD C -0.394 -9.751 1.454 1.00 . A A . 13 ARG CD 1 1 4 1204 1 1 13 ARG CG C 0.559 -8.610 1.770 1.00 . A A . 13 ARG CG 1 1 4 1205 1 1 13 ARG CZ C -2.718 -10.326 2.068 1.00 . A A . 13 ARG CZ 1 1 4 1206 1 1 13 ARG H H -0.698 -4.945 0.769 1.00 . A A . 13 ARG H 1 1 4 1207 1 1 13 ARG HA H 1.088 -6.112 2.601 1.00 . A A . 13 ARG HA 1 1 4 1208 1 1 13 ARG HB2 H -0.942 -7.152 1.432 1.00 . A A . 13 ARG HB2 1 1 4 1209 1 1 13 ARG HB3 H 0.129 -7.424 0.066 1.00 . A A . 13 ARG HB3 1 1 4 1210 1 1 13 ARG HD2 H -0.344 -9.963 0.396 1.00 . A A . 13 ARG HD2 1 1 4 1211 1 1 13 ARG HD3 H -0.087 -10.624 2.011 1.00 . A A . 13 ARG HD3 1 1 4 1212 1 1 13 ARG HE H -2.010 -8.465 1.855 1.00 . A A . 13 ARG HE 1 1 4 1213 1 1 13 ARG HG2 H 1.538 -8.852 1.385 1.00 . A A . 13 ARG HG2 1 1 4 1214 1 1 13 ARG HG3 H 0.611 -8.481 2.841 1.00 . A A . 13 ARG HG3 1 1 4 1215 1 1 13 ARG HH11 H -1.511 -11.925 1.762 1.00 . A A . 13 ARG HH11 1 1 4 1216 1 1 13 ARG HH12 H -3.142 -12.306 2.202 1.00 . A A . 13 ARG HH12 1 1 4 1217 1 1 13 ARG HH21 H -4.160 -8.950 2.431 1.00 . A A . 13 ARG HH21 1 1 4 1218 1 1 13 ARG HH22 H -4.660 -10.603 2.583 1.00 . A A . 13 ARG HH22 1 1 4 1219 1 1 13 ARG N N 0.158 -4.877 1.239 1.00 . A A . 13 ARG N 1 1 4 1220 1 1 13 ARG NE N -1.776 -9.421 1.809 1.00 . A A . 13 ARG NE 1 1 4 1221 1 1 13 ARG NH1 N -2.435 -11.624 2.005 1.00 . A A . 13 ARG NH1 1 1 4 1222 1 1 13 ARG NH2 N -3.945 -9.929 2.386 1.00 . A A . 13 ARG NH2 1 1 4 1223 1 1 13 ARG O O 3.259 -6.523 1.339 1.00 . A A . 13 ARG O 1 1 4 1224 1 1 14 ASN C C 4.148 -4.166 -1.015 1.00 . A A . 14 ASN C 1 1 4 1225 1 1 14 ASN CA C 3.422 -5.490 -1.240 1.00 . A A . 14 ASN CA 1 1 4 1226 1 1 14 ASN CB C 3.039 -5.647 -2.719 1.00 . A A . 14 ASN CB 1 1 4 1227 1 1 14 ASN CG C 4.131 -5.194 -3.674 1.00 . A A . 14 ASN CG 1 1 4 1228 1 1 14 ASN H H 1.379 -5.226 -0.771 1.00 . A A . 14 ASN H 1 1 4 1229 1 1 14 ASN HA H 4.076 -6.302 -0.956 1.00 . A A . 14 ASN HA 1 1 4 1230 1 1 14 ASN HB2 H 2.826 -6.687 -2.917 1.00 . A A . 14 ASN HB2 1 1 4 1231 1 1 14 ASN HB3 H 2.152 -5.063 -2.914 1.00 . A A . 14 ASN HB3 1 1 4 1232 1 1 14 ASN HD21 H 4.969 -6.992 -3.616 1.00 . A A . 14 ASN HD21 1 1 4 1233 1 1 14 ASN HD22 H 5.758 -5.826 -4.616 1.00 . A A . 14 ASN HD22 1 1 4 1234 1 1 14 ASN N N 2.224 -5.566 -0.413 1.00 . A A . 14 ASN N 1 1 4 1235 1 1 14 ASN ND2 N 5.044 -6.095 -4.002 1.00 . A A . 14 ASN ND2 1 1 4 1236 1 1 14 ASN O O 5.363 -4.068 -1.178 1.00 . A A . 14 ASN O 1 1 4 1237 1 1 14 ASN OD1 O 4.148 -4.044 -4.117 1.00 . A A . 14 ASN OD1 1 1 4 1238 1 1 15 HIS C C 4.036 -1.513 1.107 1.00 . A A . 15 HIS C 1 1 4 1239 1 1 15 HIS CA C 3.971 -1.831 -0.379 1.00 . A A . 15 HIS CA 1 1 4 1240 1 1 15 HIS CB C 3.159 -0.760 -1.115 1.00 . A A . 15 HIS CB 1 1 4 1241 1 1 15 HIS CD2 C 2.260 -1.324 -3.482 1.00 . A A . 15 HIS CD2 1 1 4 1242 1 1 15 HIS CE1 C 4.048 -0.814 -4.638 1.00 . A A . 15 HIS CE1 1 1 4 1243 1 1 15 HIS CG C 3.200 -0.898 -2.607 1.00 . A A . 15 HIS CG 1 1 4 1244 1 1 15 HIS H H 2.442 -3.302 -0.438 1.00 . A A . 15 HIS H 1 1 4 1245 1 1 15 HIS HA H 4.976 -1.837 -0.774 1.00 . A A . 15 HIS HA 1 1 4 1246 1 1 15 HIS HB2 H 2.126 -0.826 -0.804 1.00 . A A . 15 HIS HB2 1 1 4 1247 1 1 15 HIS HB3 H 3.545 0.215 -0.858 1.00 . A A . 15 HIS HB3 1 1 4 1248 1 1 15 HIS HD1 H 5.164 -0.255 -3.019 1.00 . A A . 15 HIS HD1 1 1 4 1249 1 1 15 HIS HD2 H 1.261 -1.656 -3.237 1.00 . A A . 15 HIS HD2 1 1 4 1250 1 1 15 HIS HE1 H 4.732 -0.659 -5.460 1.00 . A A . 15 HIS HE1 1 1 4 1251 1 1 15 HIS HE2 H 2.442 -1.708 -5.533 1.00 . A A . 15 HIS HE2 1 1 4 1252 1 1 15 HIS N N 3.399 -3.153 -0.607 1.00 . A A . 15 HIS N 1 1 4 1253 1 1 15 HIS ND1 N 4.309 -0.586 -3.364 1.00 . A A . 15 HIS ND1 1 1 4 1254 1 1 15 HIS NE2 N 2.811 -1.264 -4.739 1.00 . A A . 15 HIS NE2 1 1 4 1255 1 1 15 HIS O O 3.953 -0.352 1.512 1.00 . A A . 15 HIS O 1 1 4 1256 1 1 16 LYS C C 5.559 -1.662 3.777 1.00 . A A . 16 LYS C 1 1 4 1257 1 1 16 LYS CA C 4.291 -2.398 3.363 1.00 . A A . 16 LYS CA 1 1 4 1258 1 1 16 LYS CB C 4.237 -3.768 4.045 1.00 . A A . 16 LYS CB 1 1 4 1259 1 1 16 LYS CD C 5.207 -6.080 4.265 1.00 . A A . 16 LYS CD 1 1 4 1260 1 1 16 LYS CE C 5.546 -5.927 5.739 1.00 . A A . 16 LYS CE 1 1 4 1261 1 1 16 LYS CG C 5.282 -4.749 3.532 1.00 . A A . 16 LYS CG 1 1 4 1262 1 1 16 LYS H H 4.294 -3.445 1.523 1.00 . A A . 16 LYS H 1 1 4 1263 1 1 16 LYS HA H 3.437 -1.818 3.677 1.00 . A A . 16 LYS HA 1 1 4 1264 1 1 16 LYS HB2 H 4.391 -3.636 5.105 1.00 . A A . 16 LYS HB2 1 1 4 1265 1 1 16 LYS HB3 H 3.261 -4.199 3.883 1.00 . A A . 16 LYS HB3 1 1 4 1266 1 1 16 LYS HD2 H 4.206 -6.473 4.176 1.00 . A A . 16 LYS HD2 1 1 4 1267 1 1 16 LYS HD3 H 5.908 -6.767 3.814 1.00 . A A . 16 LYS HD3 1 1 4 1268 1 1 16 LYS HE2 H 6.549 -5.535 5.827 1.00 . A A . 16 LYS HE2 1 1 4 1269 1 1 16 LYS HE3 H 4.849 -5.234 6.185 1.00 . A A . 16 LYS HE3 1 1 4 1270 1 1 16 LYS HG2 H 5.112 -4.921 2.480 1.00 . A A . 16 LYS HG2 1 1 4 1271 1 1 16 LYS HG3 H 6.263 -4.321 3.676 1.00 . A A . 16 LYS HG3 1 1 4 1272 1 1 16 LYS HZ1 H 5.751 -7.098 7.455 1.00 . A A . 16 LYS HZ1 1 1 4 1273 1 1 16 LYS HZ2 H 6.104 -7.919 6.019 1.00 . A A . 16 LYS HZ2 1 1 4 1274 1 1 16 LYS HZ3 H 4.497 -7.593 6.434 1.00 . A A . 16 LYS HZ3 1 1 4 1275 1 1 16 LYS N N 4.218 -2.549 1.913 1.00 . A A . 16 LYS N 1 1 4 1276 1 1 16 LYS NZ N 5.469 -7.225 6.463 1.00 . A A . 16 LYS NZ 1 1 4 1277 1 1 16 LYS O O 5.677 -1.198 4.908 1.00 . A A . 16 LYS O 1 1 4 1278 1 1 17 LYS C C 7.581 0.621 3.048 1.00 . A A . 17 LYS C 1 1 4 1279 1 1 17 LYS CA C 7.758 -0.880 3.131 1.00 . A A . 17 LYS CA 1 1 4 1280 1 1 17 LYS CB C 8.836 -1.316 2.146 1.00 . A A . 17 LYS CB 1 1 4 1281 1 1 17 LYS CD C 11.333 -0.951 2.080 1.00 . A A . 17 LYS CD 1 1 4 1282 1 1 17 LYS CE C 11.210 0.569 2.072 1.00 . A A . 17 LYS CE 1 1 4 1283 1 1 17 LYS CG C 10.172 -1.618 2.809 1.00 . A A . 17 LYS CG 1 1 4 1284 1 1 17 LYS H H 6.360 -1.965 1.975 1.00 . A A . 17 LYS H 1 1 4 1285 1 1 17 LYS HA H 8.061 -1.138 4.129 1.00 . A A . 17 LYS HA 1 1 4 1286 1 1 17 LYS HB2 H 8.495 -2.200 1.633 1.00 . A A . 17 LYS HB2 1 1 4 1287 1 1 17 LYS HB3 H 8.986 -0.527 1.424 1.00 . A A . 17 LYS HB3 1 1 4 1288 1 1 17 LYS HD2 H 12.255 -1.220 2.573 1.00 . A A . 17 LYS HD2 1 1 4 1289 1 1 17 LYS HD3 H 11.354 -1.305 1.060 1.00 . A A . 17 LYS HD3 1 1 4 1290 1 1 17 LYS HE2 H 12.088 0.985 1.599 1.00 . A A . 17 LYS HE2 1 1 4 1291 1 1 17 LYS HE3 H 10.334 0.841 1.501 1.00 . A A . 17 LYS HE3 1 1 4 1292 1 1 17 LYS HG2 H 10.147 -1.257 3.827 1.00 . A A . 17 LYS HG2 1 1 4 1293 1 1 17 LYS HG3 H 10.327 -2.687 2.809 1.00 . A A . 17 LYS HG3 1 1 4 1294 1 1 17 LYS HZ1 H 11.448 2.113 3.461 1.00 . A A . 17 LYS HZ1 1 1 4 1295 1 1 17 LYS HZ2 H 11.636 0.566 4.121 1.00 . A A . 17 LYS HZ2 1 1 4 1296 1 1 17 LYS HZ3 H 10.088 1.147 3.743 1.00 . A A . 17 LYS HZ3 1 1 4 1297 1 1 17 LYS N N 6.507 -1.563 2.856 1.00 . A A . 17 LYS N 1 1 4 1298 1 1 17 LYS NZ N 11.089 1.137 3.445 1.00 . A A . 17 LYS NZ 1 1 4 1299 1 1 17 LYS O O 8.366 1.385 3.612 1.00 . A A . 17 LYS O 1 1 4 1300 1 1 18 PHE C C 5.178 2.864 3.117 1.00 . A A . 18 PHE C 1 1 4 1301 1 1 18 PHE CA C 6.270 2.440 2.146 1.00 . A A . 18 PHE CA 1 1 4 1302 1 1 18 PHE CB C 5.835 2.732 0.707 1.00 . A A . 18 PHE CB 1 1 4 1303 1 1 18 PHE CD1 C 7.853 3.648 -0.466 1.00 . A A . 18 PHE CD1 1 1 4 1304 1 1 18 PHE CD2 C 7.098 1.463 -1.054 1.00 . A A . 18 PHE CD2 1 1 4 1305 1 1 18 PHE CE1 C 8.882 3.542 -1.382 1.00 . A A . 18 PHE CE1 1 1 4 1306 1 1 18 PHE CE2 C 8.124 1.352 -1.972 1.00 . A A . 18 PHE CE2 1 1 4 1307 1 1 18 PHE CG C 6.952 2.612 -0.291 1.00 . A A . 18 PHE CG 1 1 4 1308 1 1 18 PHE CZ C 9.019 2.393 -2.135 1.00 . A A . 18 PHE CZ 1 1 4 1309 1 1 18 PHE H H 6.008 0.362 1.866 1.00 . A A . 18 PHE H 1 1 4 1310 1 1 18 PHE HA H 7.167 2.999 2.364 1.00 . A A . 18 PHE HA 1 1 4 1311 1 1 18 PHE HB2 H 5.061 2.037 0.424 1.00 . A A . 18 PHE HB2 1 1 4 1312 1 1 18 PHE HB3 H 5.447 3.739 0.654 1.00 . A A . 18 PHE HB3 1 1 4 1313 1 1 18 PHE HD1 H 7.749 4.547 0.123 1.00 . A A . 18 PHE HD1 1 1 4 1314 1 1 18 PHE HD2 H 6.400 0.649 -0.927 1.00 . A A . 18 PHE HD2 1 1 4 1315 1 1 18 PHE HE1 H 9.579 4.357 -1.509 1.00 . A A . 18 PHE HE1 1 1 4 1316 1 1 18 PHE HE2 H 8.229 0.452 -2.559 1.00 . A A . 18 PHE HE2 1 1 4 1317 1 1 18 PHE HZ H 9.822 2.308 -2.853 1.00 . A A . 18 PHE HZ 1 1 4 1318 1 1 18 PHE N N 6.570 1.030 2.311 1.00 . A A . 18 PHE N 1 1 4 1319 1 1 18 PHE O O 5.272 3.908 3.756 1.00 . A A . 18 PHE O 1 1 4 1320 1 1 19 CYS C C 3.271 1.743 5.515 1.00 . A A . 19 CYS C 1 1 4 1321 1 1 19 CYS CA C 3.040 2.336 4.127 1.00 . A A . 19 CYS CA 1 1 4 1322 1 1 19 CYS CB C 1.725 1.819 3.535 1.00 . A A . 19 CYS CB 1 1 4 1323 1 1 19 CYS H H 4.161 1.188 2.741 1.00 . A A . 19 CYS H 1 1 4 1324 1 1 19 CYS HA H 2.980 3.411 4.220 1.00 . A A . 19 CYS HA 1 1 4 1325 1 1 19 CYS HB2 H 1.603 0.780 3.791 1.00 . A A . 19 CYS HB2 1 1 4 1326 1 1 19 CYS HB3 H 0.907 2.384 3.957 1.00 . A A . 19 CYS HB3 1 1 4 1327 1 1 19 CYS N N 4.156 2.034 3.240 1.00 . A A . 19 CYS N 1 1 4 1328 1 1 19 CYS O O 2.477 0.930 5.999 1.00 . A A . 19 CYS O 1 1 4 1329 1 1 19 CYS SG S 1.615 1.959 1.720 1.00 . A A . 19 CYS SG 1 1 4 1330 1 1 20 NH2 HN1 H 4.940 2.800 5.707 1.00 . A A . 20 NH2 HN1 1 1 4 1331 1 1 20 NH2 HN2 H 4.532 1.786 7.047 1.00 . A A . 20 NH2 HN2 1 1 4 1332 1 1 20 NH2 N N 4.355 2.150 6.156 1.00 . A A . 20 NH2 N 1 1 5 1333 1 1 1 PHE C C 2.035 6.177 -4.759 1.00 . A A . 1 PHE C 1 1 5 1334 1 1 1 PHE CA C 3.517 5.910 -4.982 1.00 . A A . 1 PHE CA 1 1 5 1335 1 1 1 PHE CB C 4.032 4.866 -3.978 1.00 . A A . 1 PHE CB 1 1 5 1336 1 1 1 PHE CD1 C 4.830 6.066 -1.916 1.00 . A A . 1 PHE CD1 1 1 5 1337 1 1 1 PHE CD2 C 2.791 4.836 -1.790 1.00 . A A . 1 PHE CD2 1 1 5 1338 1 1 1 PHE CE1 C 4.695 6.430 -0.590 1.00 . A A . 1 PHE CE1 1 1 5 1339 1 1 1 PHE CE2 C 2.651 5.197 -0.465 1.00 . A A . 1 PHE CE2 1 1 5 1340 1 1 1 PHE CG C 3.880 5.266 -2.533 1.00 . A A . 1 PHE CG 1 1 5 1341 1 1 1 PHE CZ C 3.604 5.996 0.137 1.00 . A A . 1 PHE CZ 1 1 5 1342 1 1 1 PHE H1 H 4.152 7.570 -3.902 1.00 . A A . 1 PHE H1 1 1 5 1343 1 1 1 PHE H2 H 3.933 7.868 -5.550 1.00 . A A . 1 PHE H2 1 1 5 1344 1 1 1 PHE H3 H 5.290 7.006 -5.021 1.00 . A A . 1 PHE H3 1 1 5 1345 1 1 1 PHE HA H 3.653 5.533 -5.987 1.00 . A A . 1 PHE HA 1 1 5 1346 1 1 1 PHE HB2 H 3.488 3.945 -4.121 1.00 . A A . 1 PHE HB2 1 1 5 1347 1 1 1 PHE HB3 H 5.081 4.688 -4.165 1.00 . A A . 1 PHE HB3 1 1 5 1348 1 1 1 PHE HD1 H 5.683 6.409 -2.483 1.00 . A A . 1 PHE HD1 1 1 5 1349 1 1 1 PHE HD2 H 2.045 4.211 -2.259 1.00 . A A . 1 PHE HD2 1 1 5 1350 1 1 1 PHE HE1 H 5.443 7.053 -0.122 1.00 . A A . 1 PHE HE1 1 1 5 1351 1 1 1 PHE HE2 H 1.797 4.855 0.102 1.00 . A A . 1 PHE HE2 1 1 5 1352 1 1 1 PHE HZ H 3.497 6.278 1.173 1.00 . A A . 1 PHE HZ 1 1 5 1353 1 1 1 PHE N N 4.279 7.175 -4.857 1.00 . A A . 1 PHE N 1 1 5 1354 1 1 1 PHE O O 1.652 7.303 -4.450 1.00 . A A . 1 PHE O 1 1 5 1355 1 1 2 ASN C C -0.591 5.027 -3.269 1.00 . A A . 2 ASN C 1 1 5 1356 1 1 2 ASN CA C -0.227 5.293 -4.723 1.00 . A A . 2 ASN CA 1 1 5 1357 1 1 2 ASN CB C -0.994 4.332 -5.638 1.00 . A A . 2 ASN CB 1 1 5 1358 1 1 2 ASN CG C -2.461 4.702 -5.773 1.00 . A A . 2 ASN CG 1 1 5 1359 1 1 2 ASN H H 1.573 4.273 -5.157 1.00 . A A . 2 ASN H 1 1 5 1360 1 1 2 ASN HA H -0.497 6.309 -4.971 1.00 . A A . 2 ASN HA 1 1 5 1361 1 1 2 ASN HB2 H -0.547 4.348 -6.621 1.00 . A A . 2 ASN HB2 1 1 5 1362 1 1 2 ASN HB3 H -0.930 3.332 -5.234 1.00 . A A . 2 ASN HB3 1 1 5 1363 1 1 2 ASN HD21 H -2.570 3.751 -7.513 1.00 . A A . 2 ASN HD21 1 1 5 1364 1 1 2 ASN HD22 H -4.028 4.505 -6.974 1.00 . A A . 2 ASN HD22 1 1 5 1365 1 1 2 ASN N N 1.211 5.149 -4.915 1.00 . A A . 2 ASN N 1 1 5 1366 1 1 2 ASN ND2 N -3.083 4.276 -6.862 1.00 . A A . 2 ASN ND2 1 1 5 1367 1 1 2 ASN O O -0.607 3.876 -2.823 1.00 . A A . 2 ASN O 1 1 5 1368 1 1 2 ASN OD1 O -3.032 5.362 -4.905 1.00 . A A . 2 ASN OD1 1 1 5 1369 1 1 3 TRP C C -2.498 5.177 -0.905 1.00 . A A . 3 TRP C 1 1 5 1370 1 1 3 TRP CA C -1.240 6.011 -1.126 1.00 . A A . 3 TRP CA 1 1 5 1371 1 1 3 TRP CB C -1.423 7.413 -0.533 1.00 . A A . 3 TRP CB 1 1 5 1372 1 1 3 TRP CD1 C -2.349 8.960 -2.358 1.00 . A A . 3 TRP CD1 1 1 5 1373 1 1 3 TRP CD2 C -3.840 8.407 -0.783 1.00 . A A . 3 TRP CD2 1 1 5 1374 1 1 3 TRP CE2 C -4.468 9.251 -1.719 1.00 . A A . 3 TRP CE2 1 1 5 1375 1 1 3 TRP CE3 C -4.586 7.932 0.301 1.00 . A A . 3 TRP CE3 1 1 5 1376 1 1 3 TRP CG C -2.484 8.230 -1.213 1.00 . A A . 3 TRP CG 1 1 5 1377 1 1 3 TRP CH2 C -6.507 9.150 -0.531 1.00 . A A . 3 TRP CH2 1 1 5 1378 1 1 3 TRP CZ2 C -5.803 9.630 -1.602 1.00 . A A . 3 TRP CZ2 1 1 5 1379 1 1 3 TRP CZ3 C -5.909 8.308 0.415 1.00 . A A . 3 TRP CZ3 1 1 5 1380 1 1 3 TRP H H -0.871 6.980 -2.969 1.00 . A A . 3 TRP H 1 1 5 1381 1 1 3 TRP HA H -0.421 5.528 -0.621 1.00 . A A . 3 TRP HA 1 1 5 1382 1 1 3 TRP HB2 H -1.694 7.321 0.509 1.00 . A A . 3 TRP HB2 1 1 5 1383 1 1 3 TRP HB3 H -0.490 7.951 -0.608 1.00 . A A . 3 TRP HB3 1 1 5 1384 1 1 3 TRP HD1 H -1.433 9.032 -2.929 1.00 . A A . 3 TRP HD1 1 1 5 1385 1 1 3 TRP HE1 H -3.692 10.150 -3.448 1.00 . A A . 3 TRP HE1 1 1 5 1386 1 1 3 TRP HE3 H -4.142 7.282 1.041 1.00 . A A . 3 TRP HE3 1 1 5 1387 1 1 3 TRP HH2 H -7.546 9.418 -0.402 1.00 . A A . 3 TRP HH2 1 1 5 1388 1 1 3 TRP HZ2 H -6.279 10.276 -2.324 1.00 . A A . 3 TRP HZ2 1 1 5 1389 1 1 3 TRP HZ3 H -6.500 7.952 1.246 1.00 . A A . 3 TRP HZ3 1 1 5 1390 1 1 3 TRP N N -0.888 6.099 -2.541 1.00 . A A . 3 TRP N 1 1 5 1391 1 1 3 TRP NE1 N -3.537 9.573 -2.672 1.00 . A A . 3 TRP NE1 1 1 5 1392 1 1 3 TRP O O -2.720 4.646 0.182 1.00 . A A . 3 TRP O 1 1 5 1393 1 1 4 ARG C C -4.229 2.811 -1.555 1.00 . A A . 4 ARG C 1 1 5 1394 1 1 4 ARG CA C -4.536 4.264 -1.847 1.00 . A A . 4 ARG CA 1 1 5 1395 1 1 4 ARG CB C -5.367 4.381 -3.119 1.00 . A A . 4 ARG CB 1 1 5 1396 1 1 4 ARG CD C -7.406 5.298 -1.982 1.00 . A A . 4 ARG CD 1 1 5 1397 1 1 4 ARG CG C -6.378 5.513 -3.083 1.00 . A A . 4 ARG CG 1 1 5 1398 1 1 4 ARG CZ C -9.181 6.591 -0.852 1.00 . A A . 4 ARG CZ 1 1 5 1399 1 1 4 ARG H H -3.075 5.472 -2.795 1.00 . A A . 4 ARG H 1 1 5 1400 1 1 4 ARG HA H -5.095 4.654 -1.022 1.00 . A A . 4 ARG HA 1 1 5 1401 1 1 4 ARG HB2 H -4.702 4.548 -3.955 1.00 . A A . 4 ARG HB2 1 1 5 1402 1 1 4 ARG HB3 H -5.895 3.454 -3.273 1.00 . A A . 4 ARG HB3 1 1 5 1403 1 1 4 ARG HD2 H -7.957 4.395 -2.195 1.00 . A A . 4 ARG HD2 1 1 5 1404 1 1 4 ARG HD3 H -6.887 5.189 -1.042 1.00 . A A . 4 ARG HD3 1 1 5 1405 1 1 4 ARG HE H -8.354 7.065 -2.615 1.00 . A A . 4 ARG HE 1 1 5 1406 1 1 4 ARG HG2 H -5.859 6.443 -2.901 1.00 . A A . 4 ARG HG2 1 1 5 1407 1 1 4 ARG HG3 H -6.887 5.561 -4.035 1.00 . A A . 4 ARG HG3 1 1 5 1408 1 1 4 ARG HH11 H -8.576 4.932 0.147 1.00 . A A . 4 ARG HH11 1 1 5 1409 1 1 4 ARG HH12 H -9.818 5.853 0.928 1.00 . A A . 4 ARG HH12 1 1 5 1410 1 1 4 ARG HH21 H -9.998 8.295 -1.592 1.00 . A A . 4 ARG HH21 1 1 5 1411 1 1 4 ARG HH22 H -10.630 7.773 -0.065 1.00 . A A . 4 ARG HH22 1 1 5 1412 1 1 4 ARG N N -3.310 5.043 -1.944 1.00 . A A . 4 ARG N 1 1 5 1413 1 1 4 ARG NE N -8.347 6.414 -1.878 1.00 . A A . 4 ARG NE 1 1 5 1414 1 1 4 ARG NH1 N -9.193 5.723 0.155 1.00 . A A . 4 ARG NH1 1 1 5 1415 1 1 4 ARG NH2 N -10.002 7.636 -0.835 1.00 . A A . 4 ARG NH2 1 1 5 1416 1 1 4 ARG O O -5.028 2.105 -0.947 1.00 . A A . 4 ARG O 1 1 5 1417 1 1 5 CYS C C -2.494 0.754 -0.260 1.00 . A A . 5 CYS C 1 1 5 1418 1 1 5 CYS CA C -2.609 1.025 -1.748 1.00 . A A . 5 CYS CA 1 1 5 1419 1 1 5 CYS CB C -1.252 0.795 -2.398 1.00 . A A . 5 CYS CB 1 1 5 1420 1 1 5 CYS H H -2.471 3.020 -2.444 1.00 . A A . 5 CYS H 1 1 5 1421 1 1 5 CYS HA H -3.333 0.350 -2.180 1.00 . A A . 5 CYS HA 1 1 5 1422 1 1 5 CYS HB2 H -0.675 1.705 -2.323 1.00 . A A . 5 CYS HB2 1 1 5 1423 1 1 5 CYS HB3 H -0.738 0.005 -1.869 1.00 . A A . 5 CYS HB3 1 1 5 1424 1 1 5 CYS N N -3.056 2.389 -1.974 1.00 . A A . 5 CYS N 1 1 5 1425 1 1 5 CYS O O -2.712 -0.363 0.198 1.00 . A A . 5 CYS O 1 1 5 1426 1 1 5 CYS SG S -1.335 0.327 -4.154 1.00 . A A . 5 CYS SG 1 1 5 1427 1 1 6 CYS C C -3.380 1.469 2.608 1.00 . A A . 6 CYS C 1 1 5 1428 1 1 6 CYS CA C -2.030 1.679 1.933 1.00 . A A . 6 CYS CA 1 1 5 1429 1 1 6 CYS CB C -1.333 2.918 2.485 1.00 . A A . 6 CYS CB 1 1 5 1430 1 1 6 CYS H H -2.089 2.686 0.067 1.00 . A A . 6 CYS H 1 1 5 1431 1 1 6 CYS HA H -1.411 0.812 2.124 1.00 . A A . 6 CYS HA 1 1 5 1432 1 1 6 CYS HB2 H -2.061 3.699 2.643 1.00 . A A . 6 CYS HB2 1 1 5 1433 1 1 6 CYS HB3 H -0.866 2.665 3.427 1.00 . A A . 6 CYS HB3 1 1 5 1434 1 1 6 CYS N N -2.191 1.799 0.493 1.00 . A A . 6 CYS N 1 1 5 1435 1 1 6 CYS O O -3.452 1.059 3.768 1.00 . A A . 6 CYS O 1 1 5 1436 1 1 6 CYS SG S -0.037 3.573 1.384 1.00 . A A . 6 CYS SG 1 1 5 1437 1 1 7 LEU C C -6.365 0.256 1.848 1.00 . A A . 7 LEU C 1 1 5 1438 1 1 7 LEU CA C -5.797 1.567 2.371 1.00 . A A . 7 LEU CA 1 1 5 1439 1 1 7 LEU CB C -6.698 2.738 1.951 1.00 . A A . 7 LEU CB 1 1 5 1440 1 1 7 LEU CD1 C -6.578 3.683 4.278 1.00 . A A . 7 LEU CD1 1 1 5 1441 1 1 7 LEU CD2 C -5.315 4.788 2.420 1.00 . A A . 7 LEU CD2 1 1 5 1442 1 1 7 LEU CG C -6.571 4.014 2.793 1.00 . A A . 7 LEU CG 1 1 5 1443 1 1 7 LEU H H -4.315 2.078 0.953 1.00 . A A . 7 LEU H 1 1 5 1444 1 1 7 LEU HA H -5.748 1.522 3.447 1.00 . A A . 7 LEU HA 1 1 5 1445 1 1 7 LEU HB2 H -6.467 2.988 0.925 1.00 . A A . 7 LEU HB2 1 1 5 1446 1 1 7 LEU HB3 H -7.724 2.406 1.997 1.00 . A A . 7 LEU HB3 1 1 5 1447 1 1 7 LEU HD11 H -7.511 3.205 4.536 1.00 . A A . 7 LEU HD11 1 1 5 1448 1 1 7 LEU HD12 H -6.469 4.593 4.850 1.00 . A A . 7 LEU HD12 1 1 5 1449 1 1 7 LEU HD13 H -5.758 3.017 4.502 1.00 . A A . 7 LEU HD13 1 1 5 1450 1 1 7 LEU HD21 H -5.250 5.681 3.024 1.00 . A A . 7 LEU HD21 1 1 5 1451 1 1 7 LEU HD22 H -5.359 5.062 1.376 1.00 . A A . 7 LEU HD22 1 1 5 1452 1 1 7 LEU HD23 H -4.446 4.170 2.593 1.00 . A A . 7 LEU HD23 1 1 5 1453 1 1 7 LEU HG H -7.424 4.648 2.594 1.00 . A A . 7 LEU HG 1 1 5 1454 1 1 7 LEU N N -4.444 1.745 1.868 1.00 . A A . 7 LEU N 1 1 5 1455 1 1 7 LEU O O -7.501 -0.110 2.143 1.00 . A A . 7 LEU O 1 1 5 1456 1 1 8 ILE C C -4.996 -2.818 0.949 1.00 . A A . 8 ILE C 1 1 5 1457 1 1 8 ILE CA C -5.951 -1.721 0.493 1.00 . A A . 8 ILE CA 1 1 5 1458 1 1 8 ILE CB C -5.966 -1.668 -1.053 1.00 . A A . 8 ILE CB 1 1 5 1459 1 1 8 ILE CD1 C -6.725 -0.243 -3.025 1.00 . A A . 8 ILE CD1 1 1 5 1460 1 1 8 ILE CG1 C -6.851 -0.519 -1.542 1.00 . A A . 8 ILE CG1 1 1 5 1461 1 1 8 ILE CG2 C -6.452 -2.994 -1.627 1.00 . A A . 8 ILE CG2 1 1 5 1462 1 1 8 ILE H H -4.651 -0.103 0.888 1.00 . A A . 8 ILE H 1 1 5 1463 1 1 8 ILE HA H -6.948 -1.952 0.838 1.00 . A A . 8 ILE HA 1 1 5 1464 1 1 8 ILE HB H -4.955 -1.506 -1.394 1.00 . A A . 8 ILE HB 1 1 5 1465 1 1 8 ILE HD11 H -7.383 0.568 -3.298 1.00 . A A . 8 ILE HD11 1 1 5 1466 1 1 8 ILE HD12 H -6.998 -1.129 -3.581 1.00 . A A . 8 ILE HD12 1 1 5 1467 1 1 8 ILE HD13 H -5.705 0.028 -3.257 1.00 . A A . 8 ILE HD13 1 1 5 1468 1 1 8 ILE HG12 H -7.883 -0.756 -1.337 1.00 . A A . 8 ILE HG12 1 1 5 1469 1 1 8 ILE HG13 H -6.582 0.383 -1.013 1.00 . A A . 8 ILE HG13 1 1 5 1470 1 1 8 ILE HG21 H -7.452 -3.195 -1.272 1.00 . A A . 8 ILE HG21 1 1 5 1471 1 1 8 ILE HG22 H -5.791 -3.787 -1.308 1.00 . A A . 8 ILE HG22 1 1 5 1472 1 1 8 ILE HG23 H -6.455 -2.941 -2.705 1.00 . A A . 8 ILE HG23 1 1 5 1473 1 1 8 ILE N N -5.554 -0.448 1.069 1.00 . A A . 8 ILE N 1 1 5 1474 1 1 8 ILE O O -3.851 -2.878 0.500 1.00 . A A . 8 ILE O 1 1 5 1475 1 1 9 PRO C C -3.999 -5.677 1.309 1.00 . A A . 9 PRO C 1 1 5 1476 1 1 9 PRO CA C -4.656 -4.812 2.386 1.00 . A A . 9 PRO CA 1 1 5 1477 1 1 9 PRO CB C -5.672 -5.637 3.179 1.00 . A A . 9 PRO CB 1 1 5 1478 1 1 9 PRO CD C -6.829 -3.698 2.402 1.00 . A A . 9 PRO CD 1 1 5 1479 1 1 9 PRO CG C -6.741 -4.669 3.547 1.00 . A A . 9 PRO CG 1 1 5 1480 1 1 9 PRO HA H -3.894 -4.444 3.058 1.00 . A A . 9 PRO HA 1 1 5 1481 1 1 9 PRO HB2 H -6.057 -6.433 2.558 1.00 . A A . 9 PRO HB2 1 1 5 1482 1 1 9 PRO HB3 H -5.199 -6.053 4.055 1.00 . A A . 9 PRO HB3 1 1 5 1483 1 1 9 PRO HD2 H -7.549 -4.041 1.672 1.00 . A A . 9 PRO HD2 1 1 5 1484 1 1 9 PRO HD3 H -7.092 -2.715 2.761 1.00 . A A . 9 PRO HD3 1 1 5 1485 1 1 9 PRO HG2 H -7.680 -5.187 3.672 1.00 . A A . 9 PRO HG2 1 1 5 1486 1 1 9 PRO HG3 H -6.472 -4.153 4.455 1.00 . A A . 9 PRO HG3 1 1 5 1487 1 1 9 PRO N N -5.465 -3.707 1.840 1.00 . A A . 9 PRO N 1 1 5 1488 1 1 9 PRO O O -3.036 -6.394 1.579 1.00 . A A . 9 PRO O 1 1 5 1489 1 1 10 ALA C C -2.755 -5.699 -1.619 1.00 . A A . 10 ALA C 1 1 5 1490 1 1 10 ALA CA C -3.981 -6.381 -1.016 1.00 . A A . 10 ALA CA 1 1 5 1491 1 1 10 ALA CB C -5.047 -6.594 -2.081 1.00 . A A . 10 ALA CB 1 1 5 1492 1 1 10 ALA H H -5.295 -5.026 -0.061 1.00 . A A . 10 ALA H 1 1 5 1493 1 1 10 ALA HA H -3.690 -7.349 -0.635 1.00 . A A . 10 ALA HA 1 1 5 1494 1 1 10 ALA HB1 H -5.905 -7.079 -1.640 1.00 . A A . 10 ALA HB1 1 1 5 1495 1 1 10 ALA HB2 H -4.648 -7.216 -2.869 1.00 . A A . 10 ALA HB2 1 1 5 1496 1 1 10 ALA HB3 H -5.343 -5.640 -2.491 1.00 . A A . 10 ALA HB3 1 1 5 1497 1 1 10 ALA N N -4.524 -5.610 0.092 1.00 . A A . 10 ALA N 1 1 5 1498 1 1 10 ALA O O -1.808 -6.366 -2.027 1.00 . A A . 10 ALA O 1 1 5 1499 1 1 11 CYS C C -0.630 -3.256 -1.149 1.00 . A A . 11 CYS C 1 1 5 1500 1 1 11 CYS CA C -1.646 -3.624 -2.222 1.00 . A A . 11 CYS CA 1 1 5 1501 1 1 11 CYS CB C -2.143 -2.361 -2.938 1.00 . A A . 11 CYS CB 1 1 5 1502 1 1 11 CYS H H -3.518 -3.882 -1.258 1.00 . A A . 11 CYS H 1 1 5 1503 1 1 11 CYS HA H -1.163 -4.265 -2.946 1.00 . A A . 11 CYS HA 1 1 5 1504 1 1 11 CYS HB2 H -3.051 -2.591 -3.474 1.00 . A A . 11 CYS HB2 1 1 5 1505 1 1 11 CYS HB3 H -2.349 -1.598 -2.202 1.00 . A A . 11 CYS HB3 1 1 5 1506 1 1 11 CYS N N -2.761 -4.370 -1.647 1.00 . A A . 11 CYS N 1 1 5 1507 1 1 11 CYS O O 0.577 -3.259 -1.398 1.00 . A A . 11 CYS O 1 1 5 1508 1 1 11 CYS SG S -0.949 -1.669 -4.136 1.00 . A A . 11 CYS SG 1 1 5 1509 1 1 12 ARG C C 0.602 -3.778 1.592 1.00 . A A . 12 ARG C 1 1 5 1510 1 1 12 ARG CA C -0.240 -2.591 1.162 1.00 . A A . 12 ARG CA 1 1 5 1511 1 1 12 ARG CB C -1.049 -2.087 2.351 1.00 . A A . 12 ARG CB 1 1 5 1512 1 1 12 ARG CD C -1.001 -0.859 4.549 1.00 . A A . 12 ARG CD 1 1 5 1513 1 1 12 ARG CG C -0.251 -1.173 3.267 1.00 . A A . 12 ARG CG 1 1 5 1514 1 1 12 ARG CZ C -0.686 0.943 6.212 1.00 . A A . 12 ARG CZ 1 1 5 1515 1 1 12 ARG H H -2.090 -2.971 0.196 1.00 . A A . 12 ARG H 1 1 5 1516 1 1 12 ARG HA H 0.416 -1.803 0.823 1.00 . A A . 12 ARG HA 1 1 5 1517 1 1 12 ARG HB2 H -1.905 -1.550 1.982 1.00 . A A . 12 ARG HB2 1 1 5 1518 1 1 12 ARG HB3 H -1.387 -2.933 2.926 1.00 . A A . 12 ARG HB3 1 1 5 1519 1 1 12 ARG HD2 H -1.906 -0.324 4.301 1.00 . A A . 12 ARG HD2 1 1 5 1520 1 1 12 ARG HD3 H -1.255 -1.786 5.042 1.00 . A A . 12 ARG HD3 1 1 5 1521 1 1 12 ARG HE H 0.765 -0.245 5.511 1.00 . A A . 12 ARG HE 1 1 5 1522 1 1 12 ARG HG2 H 0.679 -1.658 3.519 1.00 . A A . 12 ARG HG2 1 1 5 1523 1 1 12 ARG HG3 H -0.046 -0.249 2.745 1.00 . A A . 12 ARG HG3 1 1 5 1524 1 1 12 ARG HH11 H -2.588 0.768 5.517 1.00 . A A . 12 ARG HH11 1 1 5 1525 1 1 12 ARG HH12 H -2.345 1.999 6.715 1.00 . A A . 12 ARG HH12 1 1 5 1526 1 1 12 ARG HH21 H 1.104 1.393 7.056 1.00 . A A . 12 ARG HH21 1 1 5 1527 1 1 12 ARG HH22 H -0.234 2.358 7.593 1.00 . A A . 12 ARG HH22 1 1 5 1528 1 1 12 ARG N N -1.116 -2.957 0.053 1.00 . A A . 12 ARG N 1 1 5 1529 1 1 12 ARG NE N -0.197 -0.041 5.459 1.00 . A A . 12 ARG NE 1 1 5 1530 1 1 12 ARG NH1 N -1.975 1.265 6.144 1.00 . A A . 12 ARG NH1 1 1 5 1531 1 1 12 ARG NH2 N 0.123 1.621 7.019 1.00 . A A . 12 ARG NH2 1 1 5 1532 1 1 12 ARG O O 1.626 -3.623 2.246 1.00 . A A . 12 ARG O 1 1 5 1533 1 1 13 ARG C C 2.249 -6.180 0.919 1.00 . A A . 13 ARG C 1 1 5 1534 1 1 13 ARG CA C 0.861 -6.190 1.553 1.00 . A A . 13 ARG CA 1 1 5 1535 1 1 13 ARG CB C 0.066 -7.405 1.073 1.00 . A A . 13 ARG CB 1 1 5 1536 1 1 13 ARG CD C -0.327 -9.878 1.225 1.00 . A A . 13 ARG CD 1 1 5 1537 1 1 13 ARG CG C 0.616 -8.734 1.560 1.00 . A A . 13 ARG CG 1 1 5 1538 1 1 13 ARG CZ C -2.793 -10.043 1.255 1.00 . A A . 13 ARG CZ 1 1 5 1539 1 1 13 ARG H H -0.702 -5.012 0.744 1.00 . A A . 13 ARG H 1 1 5 1540 1 1 13 ARG HA H 0.969 -6.236 2.625 1.00 . A A . 13 ARG HA 1 1 5 1541 1 1 13 ARG HB2 H -0.953 -7.314 1.421 1.00 . A A . 13 ARG HB2 1 1 5 1542 1 1 13 ARG HB3 H 0.066 -7.414 -0.007 1.00 . A A . 13 ARG HB3 1 1 5 1543 1 1 13 ARG HD2 H -0.443 -9.929 0.152 1.00 . A A . 13 ARG HD2 1 1 5 1544 1 1 13 ARG HD3 H 0.104 -10.800 1.584 1.00 . A A . 13 ARG HD3 1 1 5 1545 1 1 13 ARG HE H -1.669 -9.294 2.733 1.00 . A A . 13 ARG HE 1 1 5 1546 1 1 13 ARG HG2 H 1.569 -8.915 1.086 1.00 . A A . 13 ARG HG2 1 1 5 1547 1 1 13 ARG HG3 H 0.747 -8.689 2.631 1.00 . A A . 13 ARG HG3 1 1 5 1548 1 1 13 ARG HH11 H -1.926 -10.727 -0.445 1.00 . A A . 13 ARG HH11 1 1 5 1549 1 1 13 ARG HH12 H -3.653 -10.842 -0.401 1.00 . A A . 13 ARG HH12 1 1 5 1550 1 1 13 ARG HH21 H -3.953 -9.438 2.805 1.00 . A A . 13 ARG HH21 1 1 5 1551 1 1 13 ARG HH22 H -4.811 -10.107 1.458 1.00 . A A . 13 ARG HH22 1 1 5 1552 1 1 13 ARG N N 0.147 -4.963 1.229 1.00 . A A . 13 ARG N 1 1 5 1553 1 1 13 ARG NE N -1.645 -9.697 1.836 1.00 . A A . 13 ARG NE 1 1 5 1554 1 1 13 ARG NH1 N -2.792 -10.581 0.038 1.00 . A A . 13 ARG NH1 1 1 5 1555 1 1 13 ARG NH2 N -3.945 -9.846 1.890 1.00 . A A . 13 ARG NH2 1 1 5 1556 1 1 13 ARG O O 3.229 -6.600 1.532 1.00 . A A . 13 ARG O 1 1 5 1557 1 1 14 ASN C C 4.179 -4.203 -0.880 1.00 . A A . 14 ASN C 1 1 5 1558 1 1 14 ASN CA C 3.579 -5.599 -1.035 1.00 . A A . 14 ASN CA 1 1 5 1559 1 1 14 ASN CB C 3.351 -5.930 -2.518 1.00 . A A . 14 ASN CB 1 1 5 1560 1 1 14 ASN CG C 4.555 -5.630 -3.396 1.00 . A A . 14 ASN CG 1 1 5 1561 1 1 14 ASN H H 1.497 -5.367 -0.739 1.00 . A A . 14 ASN H 1 1 5 1562 1 1 14 ASN HA H 4.259 -6.322 -0.610 1.00 . A A . 14 ASN HA 1 1 5 1563 1 1 14 ASN HB2 H 3.121 -6.980 -2.611 1.00 . A A . 14 ASN HB2 1 1 5 1564 1 1 14 ASN HB3 H 2.513 -5.352 -2.880 1.00 . A A . 14 ASN HB3 1 1 5 1565 1 1 14 ASN HD21 H 5.340 -7.407 -2.990 1.00 . A A . 14 ASN HD21 1 1 5 1566 1 1 14 ASN HD22 H 6.263 -6.399 -4.046 1.00 . A A . 14 ASN HD22 1 1 5 1567 1 1 14 ASN N N 2.318 -5.684 -0.308 1.00 . A A . 14 ASN N 1 1 5 1568 1 1 14 ASN ND2 N 5.479 -6.574 -3.487 1.00 . A A . 14 ASN ND2 1 1 5 1569 1 1 14 ASN O O 5.386 -4.007 -0.996 1.00 . A A . 14 ASN O 1 1 5 1570 1 1 14 ASN OD1 O 4.648 -4.557 -3.993 1.00 . A A . 14 ASN OD1 1 1 5 1571 1 1 15 HIS C C 3.873 -1.502 1.069 1.00 . A A . 15 HIS C 1 1 5 1572 1 1 15 HIS CA C 3.757 -1.852 -0.409 1.00 . A A . 15 HIS CA 1 1 5 1573 1 1 15 HIS CB C 2.776 -0.892 -1.096 1.00 . A A . 15 HIS CB 1 1 5 1574 1 1 15 HIS CD2 C 3.401 -1.845 -3.432 1.00 . A A . 15 HIS CD2 1 1 5 1575 1 1 15 HIS CE1 C 2.295 -0.418 -4.670 1.00 . A A . 15 HIS CE1 1 1 5 1576 1 1 15 HIS CG C 2.788 -0.975 -2.595 1.00 . A A . 15 HIS CG 1 1 5 1577 1 1 15 HIS H H 2.376 -3.465 -0.437 1.00 . A A . 15 HIS H 1 1 5 1578 1 1 15 HIS HA H 4.728 -1.752 -0.868 1.00 . A A . 15 HIS HA 1 1 5 1579 1 1 15 HIS HB2 H 1.775 -1.114 -0.761 1.00 . A A . 15 HIS HB2 1 1 5 1580 1 1 15 HIS HB3 H 3.025 0.122 -0.817 1.00 . A A . 15 HIS HB3 1 1 5 1581 1 1 15 HIS HD1 H 1.548 0.654 -3.095 1.00 . A A . 15 HIS HD1 1 1 5 1582 1 1 15 HIS HD2 H 4.023 -2.680 -3.143 1.00 . A A . 15 HIS HD2 1 1 5 1583 1 1 15 HIS HE1 H 1.881 0.098 -5.524 1.00 . A A . 15 HIS HE1 1 1 5 1584 1 1 15 HIS HE2 H 3.249 -2.017 -5.516 1.00 . A A . 15 HIS HE2 1 1 5 1585 1 1 15 HIS N N 3.324 -3.237 -0.573 1.00 . A A . 15 HIS N 1 1 5 1586 1 1 15 HIS ND1 N 2.103 -0.092 -3.403 1.00 . A A . 15 HIS ND1 1 1 5 1587 1 1 15 HIS NE2 N 3.080 -1.476 -4.714 1.00 . A A . 15 HIS NE2 1 1 5 1588 1 1 15 HIS O O 3.703 -0.348 1.464 1.00 . A A . 15 HIS O 1 1 5 1589 1 1 16 LYS C C 5.523 -1.474 3.669 1.00 . A A . 16 LYS C 1 1 5 1590 1 1 16 LYS CA C 4.317 -2.335 3.319 1.00 . A A . 16 LYS CA 1 1 5 1591 1 1 16 LYS CB C 4.428 -3.701 4.002 1.00 . A A . 16 LYS CB 1 1 5 1592 1 1 16 LYS CD C 5.457 -5.998 3.969 1.00 . A A . 16 LYS CD 1 1 5 1593 1 1 16 LYS CE C 5.623 -6.066 5.479 1.00 . A A . 16 LYS CE 1 1 5 1594 1 1 16 LYS CG C 5.552 -4.570 3.456 1.00 . A A . 16 LYS CG 1 1 5 1595 1 1 16 LYS H H 4.320 -3.397 1.489 1.00 . A A . 16 LYS H 1 1 5 1596 1 1 16 LYS HA H 3.425 -1.841 3.673 1.00 . A A . 16 LYS HA 1 1 5 1597 1 1 16 LYS HB2 H 4.600 -3.549 5.057 1.00 . A A . 16 LYS HB2 1 1 5 1598 1 1 16 LYS HB3 H 3.496 -4.232 3.872 1.00 . A A . 16 LYS HB3 1 1 5 1599 1 1 16 LYS HD2 H 4.490 -6.401 3.707 1.00 . A A . 16 LYS HD2 1 1 5 1600 1 1 16 LYS HD3 H 6.233 -6.589 3.504 1.00 . A A . 16 LYS HD3 1 1 5 1601 1 1 16 LYS HE2 H 6.604 -5.697 5.738 1.00 . A A . 16 LYS HE2 1 1 5 1602 1 1 16 LYS HE3 H 4.872 -5.440 5.939 1.00 . A A . 16 LYS HE3 1 1 5 1603 1 1 16 LYS HG2 H 5.493 -4.582 2.378 1.00 . A A . 16 LYS HG2 1 1 5 1604 1 1 16 LYS HG3 H 6.499 -4.149 3.761 1.00 . A A . 16 LYS HG3 1 1 5 1605 1 1 16 LYS HZ1 H 4.528 -7.818 5.770 1.00 . A A . 16 LYS HZ1 1 1 5 1606 1 1 16 LYS HZ2 H 5.615 -7.474 7.020 1.00 . A A . 16 LYS HZ2 1 1 5 1607 1 1 16 LYS HZ3 H 6.184 -8.075 5.545 1.00 . A A . 16 LYS HZ3 1 1 5 1608 1 1 16 LYS N N 4.184 -2.507 1.875 1.00 . A A . 16 LYS N 1 1 5 1609 1 1 16 LYS NZ N 5.477 -7.455 5.989 1.00 . A A . 16 LYS NZ 1 1 5 1610 1 1 16 LYS O O 5.604 -0.915 4.761 1.00 . A A . 16 LYS O 1 1 5 1611 1 1 17 LYS C C 7.343 0.892 2.782 1.00 . A A . 17 LYS C 1 1 5 1612 1 1 17 LYS CA C 7.655 -0.576 2.966 1.00 . A A . 17 LYS CA 1 1 5 1613 1 1 17 LYS CB C 8.766 -0.985 2.006 1.00 . A A . 17 LYS CB 1 1 5 1614 1 1 17 LYS CD C 10.450 -0.942 3.882 1.00 . A A . 17 LYS CD 1 1 5 1615 1 1 17 LYS CE C 11.013 0.216 4.697 1.00 . A A . 17 LYS CE 1 1 5 1616 1 1 17 LYS CG C 10.148 -0.524 2.449 1.00 . A A . 17 LYS CG 1 1 5 1617 1 1 17 LYS H H 6.353 -1.853 1.896 1.00 . A A . 17 LYS H 1 1 5 1618 1 1 17 LYS HA H 7.979 -0.738 3.979 1.00 . A A . 17 LYS HA 1 1 5 1619 1 1 17 LYS HB2 H 8.767 -2.054 1.914 1.00 . A A . 17 LYS HB2 1 1 5 1620 1 1 17 LYS HB3 H 8.562 -0.551 1.038 1.00 . A A . 17 LYS HB3 1 1 5 1621 1 1 17 LYS HD2 H 9.537 -1.283 4.346 1.00 . A A . 17 LYS HD2 1 1 5 1622 1 1 17 LYS HD3 H 11.171 -1.746 3.868 1.00 . A A . 17 LYS HD3 1 1 5 1623 1 1 17 LYS HE2 H 11.518 -0.184 5.563 1.00 . A A . 17 LYS HE2 1 1 5 1624 1 1 17 LYS HE3 H 11.723 0.757 4.086 1.00 . A A . 17 LYS HE3 1 1 5 1625 1 1 17 LYS HG2 H 10.888 -0.962 1.796 1.00 . A A . 17 LYS HG2 1 1 5 1626 1 1 17 LYS HG3 H 10.198 0.552 2.379 1.00 . A A . 17 LYS HG3 1 1 5 1627 1 1 17 LYS HZ1 H 9.329 0.692 5.843 1.00 . A A . 17 LYS HZ1 1 1 5 1628 1 1 17 LYS HZ2 H 9.368 1.467 4.337 1.00 . A A . 17 LYS HZ2 1 1 5 1629 1 1 17 LYS HZ3 H 10.374 1.995 5.591 1.00 . A A . 17 LYS HZ3 1 1 5 1630 1 1 17 LYS N N 6.464 -1.375 2.744 1.00 . A A . 17 LYS N 1 1 5 1631 1 1 17 LYS NZ N 9.948 1.157 5.149 1.00 . A A . 17 LYS NZ 1 1 5 1632 1 1 17 LYS O O 7.835 1.744 3.524 1.00 . A A . 17 LYS O 1 1 5 1633 1 1 18 PHE C C 5.147 3.036 2.503 1.00 . A A . 18 PHE C 1 1 5 1634 1 1 18 PHE CA C 6.138 2.529 1.465 1.00 . A A . 18 PHE CA 1 1 5 1635 1 1 18 PHE CB C 5.505 2.594 0.073 1.00 . A A . 18 PHE CB 1 1 5 1636 1 1 18 PHE CD1 C 7.427 2.866 -1.517 1.00 . A A . 18 PHE CD1 1 1 5 1637 1 1 18 PHE CD2 C 6.205 0.819 -1.557 1.00 . A A . 18 PHE CD2 1 1 5 1638 1 1 18 PHE CE1 C 8.249 2.398 -2.524 1.00 . A A . 18 PHE CE1 1 1 5 1639 1 1 18 PHE CE2 C 7.023 0.345 -2.564 1.00 . A A . 18 PHE CE2 1 1 5 1640 1 1 18 PHE CG C 6.397 2.082 -1.023 1.00 . A A . 18 PHE CG 1 1 5 1641 1 1 18 PHE CZ C 8.047 1.136 -3.048 1.00 . A A . 18 PHE CZ 1 1 5 1642 1 1 18 PHE H H 6.218 0.431 1.218 1.00 . A A . 18 PHE H 1 1 5 1643 1 1 18 PHE HA H 7.018 3.154 1.485 1.00 . A A . 18 PHE HA 1 1 5 1644 1 1 18 PHE HB2 H 4.603 2.000 0.068 1.00 . A A . 18 PHE HB2 1 1 5 1645 1 1 18 PHE HB3 H 5.255 3.620 -0.153 1.00 . A A . 18 PHE HB3 1 1 5 1646 1 1 18 PHE HD1 H 7.587 3.852 -1.107 1.00 . A A . 18 PHE HD1 1 1 5 1647 1 1 18 PHE HD2 H 5.404 0.200 -1.178 1.00 . A A . 18 PHE HD2 1 1 5 1648 1 1 18 PHE HE1 H 9.050 3.018 -2.901 1.00 . A A . 18 PHE HE1 1 1 5 1649 1 1 18 PHE HE2 H 6.863 -0.642 -2.972 1.00 . A A . 18 PHE HE2 1 1 5 1650 1 1 18 PHE HZ H 8.688 0.768 -3.835 1.00 . A A . 18 PHE HZ 1 1 5 1651 1 1 18 PHE N N 6.543 1.169 1.774 1.00 . A A . 18 PHE N 1 1 5 1652 1 1 18 PHE O O 5.311 4.119 3.058 1.00 . A A . 18 PHE O 1 1 5 1653 1 1 19 CYS C C 3.454 2.113 5.139 1.00 . A A . 19 CYS C 1 1 5 1654 1 1 19 CYS CA C 3.105 2.609 3.738 1.00 . A A . 19 CYS CA 1 1 5 1655 1 1 19 CYS CB C 1.743 2.067 3.301 1.00 . A A . 19 CYS CB 1 1 5 1656 1 1 19 CYS H H 4.083 1.354 2.340 1.00 . A A . 19 CYS H 1 1 5 1657 1 1 19 CYS HA H 3.058 3.688 3.759 1.00 . A A . 19 CYS HA 1 1 5 1658 1 1 19 CYS HB2 H 1.664 1.028 3.579 1.00 . A A . 19 CYS HB2 1 1 5 1659 1 1 19 CYS HB3 H 0.966 2.625 3.803 1.00 . A A . 19 CYS HB3 1 1 5 1660 1 1 19 CYS N N 4.132 2.232 2.778 1.00 . A A . 19 CYS N 1 1 5 1661 1 1 19 CYS O O 2.714 1.323 5.735 1.00 . A A . 19 CYS O 1 1 5 1662 1 1 19 CYS SG S 1.437 2.187 1.509 1.00 . A A . 19 CYS SG 1 1 5 1663 1 1 20 NH2 HN1 H 5.111 3.205 5.131 1.00 . A A . 20 NH2 HN1 1 1 5 1664 1 1 20 NH2 HN2 H 4.823 2.282 6.564 1.00 . A A . 20 NH2 HN2 1 1 5 1665 1 1 20 NH2 N N 4.575 2.579 5.666 1.00 . A A . 20 NH2 N 1 1 6 1666 1 1 1 PHE C C 1.177 6.964 -5.523 1.00 . A A . 1 PHE C 1 1 6 1667 1 1 1 PHE CA C 2.568 7.484 -5.859 1.00 . A A . 1 PHE CA 1 1 6 1668 1 1 1 PHE CB C 3.416 7.587 -4.585 1.00 . A A . 1 PHE CB 1 1 6 1669 1 1 1 PHE CD1 C 4.750 5.461 -4.501 1.00 . A A . 1 PHE CD1 1 1 6 1670 1 1 1 PHE CD2 C 3.063 5.805 -2.850 1.00 . A A . 1 PHE CD2 1 1 6 1671 1 1 1 PHE CE1 C 5.058 4.239 -3.935 1.00 . A A . 1 PHE CE1 1 1 6 1672 1 1 1 PHE CE2 C 3.367 4.584 -2.281 1.00 . A A . 1 PHE CE2 1 1 6 1673 1 1 1 PHE CG C 3.750 6.258 -3.966 1.00 . A A . 1 PHE CG 1 1 6 1674 1 1 1 PHE CZ C 4.366 3.800 -2.825 1.00 . A A . 1 PHE CZ 1 1 6 1675 1 1 1 PHE H1 H 3.410 9.193 -6.704 1.00 . A A . 1 PHE H1 1 1 6 1676 1 1 1 PHE H2 H 1.951 9.470 -5.892 1.00 . A A . 1 PHE H2 1 1 6 1677 1 1 1 PHE H3 H 1.943 8.725 -7.408 1.00 . A A . 1 PHE H3 1 1 6 1678 1 1 1 PHE HA H 3.040 6.800 -6.549 1.00 . A A . 1 PHE HA 1 1 6 1679 1 1 1 PHE HB2 H 4.347 8.084 -4.821 1.00 . A A . 1 PHE HB2 1 1 6 1680 1 1 1 PHE HB3 H 2.880 8.171 -3.851 1.00 . A A . 1 PHE HB3 1 1 6 1681 1 1 1 PHE HD1 H 5.292 5.803 -5.371 1.00 . A A . 1 PHE HD1 1 1 6 1682 1 1 1 PHE HD2 H 2.283 6.418 -2.425 1.00 . A A . 1 PHE HD2 1 1 6 1683 1 1 1 PHE HE1 H 5.838 3.627 -4.363 1.00 . A A . 1 PHE HE1 1 1 6 1684 1 1 1 PHE HE2 H 2.825 4.243 -1.412 1.00 . A A . 1 PHE HE2 1 1 6 1685 1 1 1 PHE HZ H 4.605 2.845 -2.380 1.00 . A A . 1 PHE HZ 1 1 6 1686 1 1 1 PHE N N 2.463 8.810 -6.511 1.00 . A A . 1 PHE N 1 1 6 1687 1 1 1 PHE O O 0.266 7.747 -5.264 1.00 . A A . 1 PHE O 1 1 6 1688 1 1 2 ASN C C -0.368 4.692 -3.744 1.00 . A A . 2 ASN C 1 1 6 1689 1 1 2 ASN CA C -0.267 5.027 -5.229 1.00 . A A . 2 ASN CA 1 1 6 1690 1 1 2 ASN CB C -0.484 3.760 -6.074 1.00 . A A . 2 ASN CB 1 1 6 1691 1 1 2 ASN CG C 0.778 2.932 -6.268 1.00 . A A . 2 ASN CG 1 1 6 1692 1 1 2 ASN H H 1.785 5.071 -5.738 1.00 . A A . 2 ASN H 1 1 6 1693 1 1 2 ASN HA H -1.040 5.742 -5.471 1.00 . A A . 2 ASN HA 1 1 6 1694 1 1 2 ASN HB2 H -1.222 3.139 -5.591 1.00 . A A . 2 ASN HB2 1 1 6 1695 1 1 2 ASN HB3 H -0.852 4.050 -7.049 1.00 . A A . 2 ASN HB3 1 1 6 1696 1 1 2 ASN HD21 H 0.001 2.093 -7.893 1.00 . A A . 2 ASN HD21 1 1 6 1697 1 1 2 ASN HD22 H 1.591 1.573 -7.465 1.00 . A A . 2 ASN HD22 1 1 6 1698 1 1 2 ASN N N 1.016 5.649 -5.533 1.00 . A A . 2 ASN N 1 1 6 1699 1 1 2 ASN ND2 N 0.792 2.118 -7.313 1.00 . A A . 2 ASN ND2 1 1 6 1700 1 1 2 ASN O O -0.456 3.526 -3.360 1.00 . A A . 2 ASN O 1 1 6 1701 1 1 2 ASN OD1 O 1.730 3.019 -5.491 1.00 . A A . 2 ASN OD1 1 1 6 1702 1 1 3 TRP C C -1.769 4.886 -1.073 1.00 . A A . 3 TRP C 1 1 6 1703 1 1 3 TRP CA C -0.463 5.570 -1.462 1.00 . A A . 3 TRP CA 1 1 6 1704 1 1 3 TRP CB C -0.349 6.932 -0.764 1.00 . A A . 3 TRP CB 1 1 6 1705 1 1 3 TRP CD1 C -0.985 8.855 -2.339 1.00 . A A . 3 TRP CD1 1 1 6 1706 1 1 3 TRP CD2 C -2.607 8.268 -0.912 1.00 . A A . 3 TRP CD2 1 1 6 1707 1 1 3 TRP CE2 C -3.077 9.321 -1.718 1.00 . A A . 3 TRP CE2 1 1 6 1708 1 1 3 TRP CE3 C -3.457 7.734 0.063 1.00 . A A . 3 TRP CE3 1 1 6 1709 1 1 3 TRP CG C -1.265 7.981 -1.329 1.00 . A A . 3 TRP CG 1 1 6 1710 1 1 3 TRP CH2 C -5.168 9.310 -0.618 1.00 . A A . 3 TRP CH2 1 1 6 1711 1 1 3 TRP CZ2 C -4.358 9.851 -1.579 1.00 . A A . 3 TRP CZ2 1 1 6 1712 1 1 3 TRP CZ3 C -4.727 8.261 0.199 1.00 . A A . 3 TRP CZ3 1 1 6 1713 1 1 3 TRP H H -0.314 6.636 -3.287 1.00 . A A . 3 TRP H 1 1 6 1714 1 1 3 TRP HA H 0.359 4.946 -1.150 1.00 . A A . 3 TRP HA 1 1 6 1715 1 1 3 TRP HB2 H -0.587 6.813 0.282 1.00 . A A . 3 TRP HB2 1 1 6 1716 1 1 3 TRP HB3 H 0.666 7.291 -0.857 1.00 . A A . 3 TRP HB3 1 1 6 1717 1 1 3 TRP HD1 H -0.044 8.891 -2.867 1.00 . A A . 3 TRP HD1 1 1 6 1718 1 1 3 TRP HE1 H -2.116 10.365 -3.262 1.00 . A A . 3 TRP HE1 1 1 6 1719 1 1 3 TRP HE3 H -3.135 6.926 0.702 1.00 . A A . 3 TRP HE3 1 1 6 1720 1 1 3 TRP HH2 H -6.167 9.691 -0.475 1.00 . A A . 3 TRP HH2 1 1 6 1721 1 1 3 TRP HZ2 H -4.712 10.658 -2.202 1.00 . A A . 3 TRP HZ2 1 1 6 1722 1 1 3 TRP HZ3 H -5.396 7.862 0.947 1.00 . A A . 3 TRP HZ3 1 1 6 1723 1 1 3 TRP N N -0.373 5.731 -2.914 1.00 . A A . 3 TRP N 1 1 6 1724 1 1 3 TRP NE1 N -2.071 9.659 -2.583 1.00 . A A . 3 TRP NE1 1 1 6 1725 1 1 3 TRP O O -1.885 4.295 0.001 1.00 . A A . 3 TRP O 1 1 6 1726 1 1 4 ARG C C -3.932 2.849 -1.575 1.00 . A A . 4 ARG C 1 1 6 1727 1 1 4 ARG CA C -4.049 4.347 -1.760 1.00 . A A . 4 ARG CA 1 1 6 1728 1 1 4 ARG CB C -4.977 4.656 -2.927 1.00 . A A . 4 ARG CB 1 1 6 1729 1 1 4 ARG CD C -6.625 6.239 -3.972 1.00 . A A . 4 ARG CD 1 1 6 1730 1 1 4 ARG CG C -5.789 5.927 -2.743 1.00 . A A . 4 ARG CG 1 1 6 1731 1 1 4 ARG CZ C -7.481 8.419 -4.763 1.00 . A A . 4 ARG CZ 1 1 6 1732 1 1 4 ARG H H -2.570 5.427 -2.812 1.00 . A A . 4 ARG H 1 1 6 1733 1 1 4 ARG HA H -4.455 4.765 -0.861 1.00 . A A . 4 ARG HA 1 1 6 1734 1 1 4 ARG HB2 H -4.383 4.764 -3.823 1.00 . A A . 4 ARG HB2 1 1 6 1735 1 1 4 ARG HB3 H -5.654 3.829 -3.055 1.00 . A A . 4 ARG HB3 1 1 6 1736 1 1 4 ARG HD2 H -5.967 6.333 -4.824 1.00 . A A . 4 ARG HD2 1 1 6 1737 1 1 4 ARG HD3 H -7.315 5.426 -4.139 1.00 . A A . 4 ARG HD3 1 1 6 1738 1 1 4 ARG HE H -7.849 7.620 -2.963 1.00 . A A . 4 ARG HE 1 1 6 1739 1 1 4 ARG HG2 H -6.447 5.802 -1.895 1.00 . A A . 4 ARG HG2 1 1 6 1740 1 1 4 ARG HG3 H -5.113 6.750 -2.557 1.00 . A A . 4 ARG HG3 1 1 6 1741 1 1 4 ARG HH11 H -6.318 7.436 -6.103 1.00 . A A . 4 ARG HH11 1 1 6 1742 1 1 4 ARG HH12 H -6.929 8.963 -6.641 1.00 . A A . 4 ARG HH12 1 1 6 1743 1 1 4 ARG HH21 H -8.674 9.638 -3.665 1.00 . A A . 4 ARG HH21 1 1 6 1744 1 1 4 ARG HH22 H -8.279 10.220 -5.248 1.00 . A A . 4 ARG HH22 1 1 6 1745 1 1 4 ARG N N -2.742 4.953 -1.975 1.00 . A A . 4 ARG N 1 1 6 1746 1 1 4 ARG NE N -7.384 7.482 -3.819 1.00 . A A . 4 ARG NE 1 1 6 1747 1 1 4 ARG NH1 N -6.859 8.260 -5.929 1.00 . A A . 4 ARG NH1 1 1 6 1748 1 1 4 ARG NH2 N -8.201 9.514 -4.542 1.00 . A A . 4 ARG NH2 1 1 6 1749 1 1 4 ARG O O -4.801 2.212 -0.988 1.00 . A A . 4 ARG O 1 1 6 1750 1 1 5 CYS C C -2.503 0.479 -0.504 1.00 . A A . 5 CYS C 1 1 6 1751 1 1 5 CYS CA C -2.578 0.882 -1.965 1.00 . A A . 5 CYS CA 1 1 6 1752 1 1 5 CYS CB C -1.255 0.539 -2.635 1.00 . A A . 5 CYS CB 1 1 6 1753 1 1 5 CYS H H -2.226 2.876 -2.573 1.00 . A A . 5 CYS H 1 1 6 1754 1 1 5 CYS HA H -3.374 0.333 -2.446 1.00 . A A . 5 CYS HA 1 1 6 1755 1 1 5 CYS HB2 H -0.607 1.401 -2.583 1.00 . A A . 5 CYS HB2 1 1 6 1756 1 1 5 CYS HB3 H -0.796 -0.282 -2.105 1.00 . A A . 5 CYS HB3 1 1 6 1757 1 1 5 CYS N N -2.854 2.302 -2.089 1.00 . A A . 5 CYS N 1 1 6 1758 1 1 5 CYS O O -2.912 -0.613 -0.130 1.00 . A A . 5 CYS O 1 1 6 1759 1 1 5 CYS SG S -1.406 0.057 -4.381 1.00 . A A . 5 CYS SG 1 1 6 1760 1 1 6 CYS C C -3.214 1.111 2.453 1.00 . A A . 6 CYS C 1 1 6 1761 1 1 6 CYS CA C -1.862 1.114 1.746 1.00 . A A . 6 CYS CA 1 1 6 1762 1 1 6 CYS CB C -0.908 2.129 2.373 1.00 . A A . 6 CYS CB 1 1 6 1763 1 1 6 CYS H H -1.761 2.275 -0.029 1.00 . A A . 6 CYS H 1 1 6 1764 1 1 6 CYS HA H -1.430 0.126 1.844 1.00 . A A . 6 CYS HA 1 1 6 1765 1 1 6 CYS HB2 H -1.366 3.106 2.360 1.00 . A A . 6 CYS HB2 1 1 6 1766 1 1 6 CYS HB3 H -0.707 1.842 3.393 1.00 . A A . 6 CYS HB3 1 1 6 1767 1 1 6 CYS N N -2.012 1.386 0.323 1.00 . A A . 6 CYS N 1 1 6 1768 1 1 6 CYS O O -3.314 0.762 3.629 1.00 . A A . 6 CYS O 1 1 6 1769 1 1 6 CYS SG S 0.690 2.244 1.501 1.00 . A A . 6 CYS SG 1 1 6 1770 1 1 7 LEU C C -6.299 0.200 1.850 1.00 . A A . 7 LEU C 1 1 6 1771 1 1 7 LEU CA C -5.604 1.488 2.266 1.00 . A A . 7 LEU CA 1 1 6 1772 1 1 7 LEU CB C -6.388 2.706 1.772 1.00 . A A . 7 LEU CB 1 1 6 1773 1 1 7 LEU CD1 C -6.528 5.182 1.404 1.00 . A A . 7 LEU CD1 1 1 6 1774 1 1 7 LEU CD2 C -5.658 4.293 3.574 1.00 . A A . 7 LEU CD2 1 1 6 1775 1 1 7 LEU CG C -5.744 4.062 2.071 1.00 . A A . 7 LEU CG 1 1 6 1776 1 1 7 LEU H H -4.109 1.786 0.802 1.00 . A A . 7 LEU H 1 1 6 1777 1 1 7 LEU HA H -5.531 1.514 3.339 1.00 . A A . 7 LEU HA 1 1 6 1778 1 1 7 LEU HB2 H -6.511 2.618 0.702 1.00 . A A . 7 LEU HB2 1 1 6 1779 1 1 7 LEU HB3 H -7.366 2.688 2.231 1.00 . A A . 7 LEU HB3 1 1 6 1780 1 1 7 LEU HD11 H -7.539 5.189 1.783 1.00 . A A . 7 LEU HD11 1 1 6 1781 1 1 7 LEU HD12 H -6.545 5.023 0.336 1.00 . A A . 7 LEU HD12 1 1 6 1782 1 1 7 LEU HD13 H -6.055 6.130 1.620 1.00 . A A . 7 LEU HD13 1 1 6 1783 1 1 7 LEU HD21 H -6.650 4.267 4.000 1.00 . A A . 7 LEU HD21 1 1 6 1784 1 1 7 LEU HD22 H -5.210 5.256 3.764 1.00 . A A . 7 LEU HD22 1 1 6 1785 1 1 7 LEU HD23 H -5.053 3.519 4.022 1.00 . A A . 7 LEU HD23 1 1 6 1786 1 1 7 LEU HG H -4.741 4.073 1.671 1.00 . A A . 7 LEU HG 1 1 6 1787 1 1 7 LEU N N -4.254 1.490 1.727 1.00 . A A . 7 LEU N 1 1 6 1788 1 1 7 LEU O O -7.368 -0.145 2.348 1.00 . A A . 7 LEU O 1 1 6 1789 1 1 8 ILE C C -5.226 -2.902 0.857 1.00 . A A . 8 ILE C 1 1 6 1790 1 1 8 ILE CA C -6.155 -1.775 0.424 1.00 . A A . 8 ILE CA 1 1 6 1791 1 1 8 ILE CB C -6.238 -1.757 -1.120 1.00 . A A . 8 ILE CB 1 1 6 1792 1 1 8 ILE CD1 C -6.875 -0.266 -3.087 1.00 . A A . 8 ILE CD1 1 1 6 1793 1 1 8 ILE CG1 C -7.003 -0.519 -1.600 1.00 . A A . 8 ILE CG1 1 1 6 1794 1 1 8 ILE CG2 C -6.905 -3.027 -1.632 1.00 . A A . 8 ILE CG2 1 1 6 1795 1 1 8 ILE H H -4.784 -0.182 0.622 1.00 . A A . 8 ILE H 1 1 6 1796 1 1 8 ILE HA H -7.142 -1.944 0.828 1.00 . A A . 8 ILE HA 1 1 6 1797 1 1 8 ILE HB H -5.229 -1.725 -1.512 1.00 . A A . 8 ILE HB 1 1 6 1798 1 1 8 ILE HD11 H -5.837 -0.114 -3.340 1.00 . A A . 8 ILE HD11 1 1 6 1799 1 1 8 ILE HD12 H -7.443 0.614 -3.352 1.00 . A A . 8 ILE HD12 1 1 6 1800 1 1 8 ILE HD13 H -7.257 -1.118 -3.631 1.00 . A A . 8 ILE HD13 1 1 6 1801 1 1 8 ILE HG12 H -8.051 -0.642 -1.374 1.00 . A A . 8 ILE HG12 1 1 6 1802 1 1 8 ILE HG13 H -6.626 0.351 -1.081 1.00 . A A . 8 ILE HG13 1 1 6 1803 1 1 8 ILE HG21 H -6.328 -3.887 -1.324 1.00 . A A . 8 ILE HG21 1 1 6 1804 1 1 8 ILE HG22 H -6.956 -2.997 -2.710 1.00 . A A . 8 ILE HG22 1 1 6 1805 1 1 8 ILE HG23 H -7.903 -3.099 -1.226 1.00 . A A . 8 ILE HG23 1 1 6 1806 1 1 8 ILE N N -5.650 -0.513 0.943 1.00 . A A . 8 ILE N 1 1 6 1807 1 1 8 ILE O O -4.114 -3.011 0.356 1.00 . A A . 8 ILE O 1 1 6 1808 1 1 9 PRO C C -4.101 -5.659 1.281 1.00 . A A . 9 PRO C 1 1 6 1809 1 1 9 PRO CA C -4.899 -4.881 2.331 1.00 . A A . 9 PRO CA 1 1 6 1810 1 1 9 PRO CB C -5.968 -5.771 2.955 1.00 . A A . 9 PRO CB 1 1 6 1811 1 1 9 PRO CD C -7.037 -3.704 2.385 1.00 . A A . 9 PRO CD 1 1 6 1812 1 1 9 PRO CG C -7.029 -4.823 3.395 1.00 . A A . 9 PRO CG 1 1 6 1813 1 1 9 PRO HA H -4.224 -4.542 3.103 1.00 . A A . 9 PRO HA 1 1 6 1814 1 1 9 PRO HB2 H -6.338 -6.469 2.218 1.00 . A A . 9 PRO HB2 1 1 6 1815 1 1 9 PRO HB3 H -5.549 -6.311 3.793 1.00 . A A . 9 PRO HB3 1 1 6 1816 1 1 9 PRO HD2 H -7.794 -3.880 1.636 1.00 . A A . 9 PRO HD2 1 1 6 1817 1 1 9 PRO HD3 H -7.201 -2.757 2.876 1.00 . A A . 9 PRO HD3 1 1 6 1818 1 1 9 PRO HG2 H -7.986 -5.324 3.405 1.00 . A A . 9 PRO HG2 1 1 6 1819 1 1 9 PRO HG3 H -6.795 -4.440 4.376 1.00 . A A . 9 PRO HG3 1 1 6 1820 1 1 9 PRO N N -5.686 -3.759 1.786 1.00 . A A . 9 PRO N 1 1 6 1821 1 1 9 PRO O O -2.980 -6.092 1.545 1.00 . A A . 9 PRO O 1 1 6 1822 1 1 10 ALA C C -2.789 -5.802 -1.508 1.00 . A A . 10 ALA C 1 1 6 1823 1 1 10 ALA CA C -4.018 -6.548 -0.985 1.00 . A A . 10 ALA CA 1 1 6 1824 1 1 10 ALA CB C -4.999 -6.808 -2.118 1.00 . A A . 10 ALA CB 1 1 6 1825 1 1 10 ALA H H -5.565 -5.440 -0.058 1.00 . A A . 10 ALA H 1 1 6 1826 1 1 10 ALA HA H -3.701 -7.504 -0.592 1.00 . A A . 10 ALA HA 1 1 6 1827 1 1 10 ALA HB1 H -5.859 -7.334 -1.735 1.00 . A A . 10 ALA HB1 1 1 6 1828 1 1 10 ALA HB2 H -4.519 -7.407 -2.878 1.00 . A A . 10 ALA HB2 1 1 6 1829 1 1 10 ALA HB3 H -5.311 -5.867 -2.546 1.00 . A A . 10 ALA HB3 1 1 6 1830 1 1 10 ALA N N -4.676 -5.820 0.095 1.00 . A A . 10 ALA N 1 1 6 1831 1 1 10 ALA O O -1.749 -6.404 -1.758 1.00 . A A . 10 ALA O 1 1 6 1832 1 1 11 CYS C C -0.902 -3.213 -1.009 1.00 . A A . 11 CYS C 1 1 6 1833 1 1 11 CYS CA C -1.792 -3.688 -2.156 1.00 . A A . 11 CYS CA 1 1 6 1834 1 1 11 CYS CB C -2.315 -2.495 -2.968 1.00 . A A . 11 CYS CB 1 1 6 1835 1 1 11 CYS H H -3.734 -4.040 -1.378 1.00 . A A . 11 CYS H 1 1 6 1836 1 1 11 CYS HA H -1.206 -4.322 -2.806 1.00 . A A . 11 CYS HA 1 1 6 1837 1 1 11 CYS HB2 H -3.263 -2.758 -3.412 1.00 . A A . 11 CYS HB2 1 1 6 1838 1 1 11 CYS HB3 H -2.459 -1.653 -2.305 1.00 . A A . 11 CYS HB3 1 1 6 1839 1 1 11 CYS N N -2.901 -4.486 -1.646 1.00 . A A . 11 CYS N 1 1 6 1840 1 1 11 CYS O O 0.282 -2.931 -1.197 1.00 . A A . 11 CYS O 1 1 6 1841 1 1 11 CYS SG S -1.198 -1.964 -4.314 1.00 . A A . 11 CYS SG 1 1 6 1842 1 1 12 ARG C C 0.325 -3.724 1.708 1.00 . A A . 12 ARG C 1 1 6 1843 1 1 12 ARG CA C -0.762 -2.719 1.379 1.00 . A A . 12 ARG CA 1 1 6 1844 1 1 12 ARG CB C -1.725 -2.600 2.560 1.00 . A A . 12 ARG CB 1 1 6 1845 1 1 12 ARG CD C -1.955 -2.387 5.060 1.00 . A A . 12 ARG CD 1 1 6 1846 1 1 12 ARG CG C -1.065 -2.137 3.852 1.00 . A A . 12 ARG CG 1 1 6 1847 1 1 12 ARG CZ C -3.887 -1.329 6.192 1.00 . A A . 12 ARG CZ 1 1 6 1848 1 1 12 ARG H H -2.439 -3.359 0.260 1.00 . A A . 12 ARG H 1 1 6 1849 1 1 12 ARG HA H -0.312 -1.757 1.185 1.00 . A A . 12 ARG HA 1 1 6 1850 1 1 12 ARG HB2 H -2.497 -1.901 2.301 1.00 . A A . 12 ARG HB2 1 1 6 1851 1 1 12 ARG HB3 H -2.174 -3.561 2.738 1.00 . A A . 12 ARG HB3 1 1 6 1852 1 1 12 ARG HD2 H -2.425 -3.353 4.951 1.00 . A A . 12 ARG HD2 1 1 6 1853 1 1 12 ARG HD3 H -1.341 -2.385 5.948 1.00 . A A . 12 ARG HD3 1 1 6 1854 1 1 12 ARG HE H -3.026 -0.659 4.511 1.00 . A A . 12 ARG HE 1 1 6 1855 1 1 12 ARG HG2 H -0.138 -2.675 3.983 1.00 . A A . 12 ARG HG2 1 1 6 1856 1 1 12 ARG HG3 H -0.861 -1.078 3.779 1.00 . A A . 12 ARG HG3 1 1 6 1857 1 1 12 ARG HH11 H -3.211 -3.006 7.110 1.00 . A A . 12 ARG HH11 1 1 6 1858 1 1 12 ARG HH12 H -4.552 -2.233 7.884 1.00 . A A . 12 ARG HH12 1 1 6 1859 1 1 12 ARG HH21 H -4.786 0.360 5.521 1.00 . A A . 12 ARG HH21 1 1 6 1860 1 1 12 ARG HH22 H -5.457 -0.309 6.973 1.00 . A A . 12 ARG HH22 1 1 6 1861 1 1 12 ARG N N -1.483 -3.139 0.184 1.00 . A A . 12 ARG N 1 1 6 1862 1 1 12 ARG NE N -2.995 -1.368 5.201 1.00 . A A . 12 ARG NE 1 1 6 1863 1 1 12 ARG NH1 N -3.883 -2.266 7.138 1.00 . A A . 12 ARG NH1 1 1 6 1864 1 1 12 ARG NH2 N -4.782 -0.348 6.234 1.00 . A A . 12 ARG NH2 1 1 6 1865 1 1 12 ARG O O 1.381 -3.371 2.218 1.00 . A A . 12 ARG O 1 1 6 1866 1 1 13 ARG C C 2.261 -5.869 0.839 1.00 . A A . 13 ARG C 1 1 6 1867 1 1 13 ARG CA C 0.982 -6.066 1.652 1.00 . A A . 13 ARG CA 1 1 6 1868 1 1 13 ARG CB C 0.339 -7.411 1.301 1.00 . A A . 13 ARG CB 1 1 6 1869 1 1 13 ARG CD C 1.294 -8.716 3.223 1.00 . A A . 13 ARG CD 1 1 6 1870 1 1 13 ARG CG C 1.175 -8.613 1.711 1.00 . A A . 13 ARG CG 1 1 6 1871 1 1 13 ARG CZ C 1.979 -10.688 4.543 1.00 . A A . 13 ARG CZ 1 1 6 1872 1 1 13 ARG H H -0.843 -5.184 1.033 1.00 . A A . 13 ARG H 1 1 6 1873 1 1 13 ARG HA H 1.233 -6.058 2.700 1.00 . A A . 13 ARG HA 1 1 6 1874 1 1 13 ARG HB2 H -0.618 -7.480 1.798 1.00 . A A . 13 ARG HB2 1 1 6 1875 1 1 13 ARG HB3 H 0.183 -7.454 0.233 1.00 . A A . 13 ARG HB3 1 1 6 1876 1 1 13 ARG HD2 H 1.627 -7.766 3.611 1.00 . A A . 13 ARG HD2 1 1 6 1877 1 1 13 ARG HD3 H 0.323 -8.951 3.631 1.00 . A A . 13 ARG HD3 1 1 6 1878 1 1 13 ARG HE H 3.125 -9.746 3.198 1.00 . A A . 13 ARG HE 1 1 6 1879 1 1 13 ARG HG2 H 0.707 -9.510 1.333 1.00 . A A . 13 ARG HG2 1 1 6 1880 1 1 13 ARG HG3 H 2.163 -8.513 1.285 1.00 . A A . 13 ARG HG3 1 1 6 1881 1 1 13 ARG HH11 H 0.090 -10.046 4.901 1.00 . A A . 13 ARG HH11 1 1 6 1882 1 1 13 ARG HH12 H 0.588 -11.422 5.827 1.00 . A A . 13 ARG HH12 1 1 6 1883 1 1 13 ARG HH21 H 3.801 -11.568 4.414 1.00 . A A . 13 ARG HH21 1 1 6 1884 1 1 13 ARG HH22 H 2.710 -12.292 5.549 1.00 . A A . 13 ARG HH22 1 1 6 1885 1 1 13 ARG N N 0.039 -4.979 1.411 1.00 . A A . 13 ARG N 1 1 6 1886 1 1 13 ARG NE N 2.243 -9.753 3.630 1.00 . A A . 13 ARG NE 1 1 6 1887 1 1 13 ARG NH1 N 0.790 -10.722 5.138 1.00 . A A . 13 ARG NH1 1 1 6 1888 1 1 13 ARG NH2 N 2.904 -11.588 4.861 1.00 . A A . 13 ARG NH2 1 1 6 1889 1 1 13 ARG O O 3.349 -6.234 1.279 1.00 . A A . 13 ARG O 1 1 6 1890 1 1 14 ASN C C 3.889 -3.671 -0.907 1.00 . A A . 14 ASN C 1 1 6 1891 1 1 14 ASN CA C 3.257 -5.026 -1.216 1.00 . A A . 14 ASN CA 1 1 6 1892 1 1 14 ASN CB C 2.807 -5.081 -2.683 1.00 . A A . 14 ASN CB 1 1 6 1893 1 1 14 ASN CG C 3.865 -4.582 -3.655 1.00 . A A . 14 ASN CG 1 1 6 1894 1 1 14 ASN H H 1.224 -4.997 -0.626 1.00 . A A . 14 ASN H 1 1 6 1895 1 1 14 ASN HA H 3.988 -5.801 -1.042 1.00 . A A . 14 ASN HA 1 1 6 1896 1 1 14 ASN HB2 H 2.569 -6.102 -2.939 1.00 . A A . 14 ASN HB2 1 1 6 1897 1 1 14 ASN HB3 H 1.922 -4.472 -2.802 1.00 . A A . 14 ASN HB3 1 1 6 1898 1 1 14 ASN HD21 H 4.661 -6.396 -3.771 1.00 . A A . 14 ASN HD21 1 1 6 1899 1 1 14 ASN HD22 H 5.433 -5.175 -4.717 1.00 . A A . 14 ASN HD22 1 1 6 1900 1 1 14 ASN N N 2.119 -5.274 -0.337 1.00 . A A . 14 ASN N 1 1 6 1901 1 1 14 ASN ND2 N 4.740 -5.474 -4.092 1.00 . A A . 14 ASN ND2 1 1 6 1902 1 1 14 ASN O O 5.086 -3.467 -1.101 1.00 . A A . 14 ASN O 1 1 6 1903 1 1 14 ASN OD1 O 3.887 -3.404 -4.016 1.00 . A A . 14 ASN OD1 1 1 6 1904 1 1 15 HIS C C 3.750 -1.263 1.433 1.00 . A A . 15 HIS C 1 1 6 1905 1 1 15 HIS CA C 3.567 -1.416 -0.069 1.00 . A A . 15 HIS CA 1 1 6 1906 1 1 15 HIS CB C 2.601 -0.350 -0.599 1.00 . A A . 15 HIS CB 1 1 6 1907 1 1 15 HIS CD2 C 2.003 -1.081 -3.015 1.00 . A A . 15 HIS CD2 1 1 6 1908 1 1 15 HIS CE1 C 2.990 0.544 -4.099 1.00 . A A . 15 HIS CE1 1 1 6 1909 1 1 15 HIS CG C 2.569 -0.267 -2.095 1.00 . A A . 15 HIS CG 1 1 6 1910 1 1 15 HIS H H 2.146 -2.986 -0.214 1.00 . A A . 15 HIS H 1 1 6 1911 1 1 15 HIS HA H 4.526 -1.288 -0.547 1.00 . A A . 15 HIS HA 1 1 6 1912 1 1 15 HIS HB2 H 1.602 -0.578 -0.259 1.00 . A A . 15 HIS HB2 1 1 6 1913 1 1 15 HIS HB3 H 2.895 0.616 -0.217 1.00 . A A . 15 HIS HB3 1 1 6 1914 1 1 15 HIS HD1 H 3.673 1.498 -2.424 1.00 . A A . 15 HIS HD1 1 1 6 1915 1 1 15 HIS HD2 H 1.436 -1.980 -2.813 1.00 . A A . 15 HIS HD2 1 1 6 1916 1 1 15 HIS HE1 H 3.355 1.174 -4.896 1.00 . A A . 15 HIS HE1 1 1 6 1917 1 1 15 HIS HE2 H 2.126 -1.014 -5.105 1.00 . A A . 15 HIS HE2 1 1 6 1918 1 1 15 HIS N N 3.085 -2.753 -0.393 1.00 . A A . 15 HIS N 1 1 6 1919 1 1 15 HIS ND1 N 3.179 0.743 -2.807 1.00 . A A . 15 HIS ND1 1 1 6 1920 1 1 15 HIS NE2 N 2.279 -0.556 -4.251 1.00 . A A . 15 HIS NE2 1 1 6 1921 1 1 15 HIS O O 3.698 -0.157 1.975 1.00 . A A . 15 HIS O 1 1 6 1922 1 1 16 LYS C C 5.503 -1.759 3.925 1.00 . A A . 16 LYS C 1 1 6 1923 1 1 16 LYS CA C 4.179 -2.407 3.536 1.00 . A A . 16 LYS CA 1 1 6 1924 1 1 16 LYS CB C 4.119 -3.850 4.052 1.00 . A A . 16 LYS CB 1 1 6 1925 1 1 16 LYS CD C 2.908 -3.262 6.176 1.00 . A A . 16 LYS CD 1 1 6 1926 1 1 16 LYS CE C 3.247 -2.640 7.521 1.00 . A A . 16 LYS CE 1 1 6 1927 1 1 16 LYS CG C 4.115 -3.960 5.567 1.00 . A A . 16 LYS CG 1 1 6 1928 1 1 16 LYS H H 4.038 -3.227 1.593 1.00 . A A . 16 LYS H 1 1 6 1929 1 1 16 LYS HA H 3.372 -1.843 3.982 1.00 . A A . 16 LYS HA 1 1 6 1930 1 1 16 LYS HB2 H 3.219 -4.315 3.677 1.00 . A A . 16 LYS HB2 1 1 6 1931 1 1 16 LYS HB3 H 4.975 -4.389 3.675 1.00 . A A . 16 LYS HB3 1 1 6 1932 1 1 16 LYS HD2 H 2.576 -2.484 5.504 1.00 . A A . 16 LYS HD2 1 1 6 1933 1 1 16 LYS HD3 H 2.116 -3.984 6.311 1.00 . A A . 16 LYS HD3 1 1 6 1934 1 1 16 LYS HE2 H 2.338 -2.272 7.973 1.00 . A A . 16 LYS HE2 1 1 6 1935 1 1 16 LYS HE3 H 3.680 -3.400 8.155 1.00 . A A . 16 LYS HE3 1 1 6 1936 1 1 16 LYS HG2 H 4.091 -5.002 5.844 1.00 . A A . 16 LYS HG2 1 1 6 1937 1 1 16 LYS HG3 H 5.014 -3.503 5.953 1.00 . A A . 16 LYS HG3 1 1 6 1938 1 1 16 LYS HZ1 H 3.737 -0.680 6.973 1.00 . A A . 16 LYS HZ1 1 1 6 1939 1 1 16 LYS HZ2 H 4.999 -1.790 6.759 1.00 . A A . 16 LYS HZ2 1 1 6 1940 1 1 16 LYS HZ3 H 4.596 -1.257 8.314 1.00 . A A . 16 LYS HZ3 1 1 6 1941 1 1 16 LYS N N 3.993 -2.384 2.093 1.00 . A A . 16 LYS N 1 1 6 1942 1 1 16 LYS NZ N 4.212 -1.515 7.384 1.00 . A A . 16 LYS NZ 1 1 6 1943 1 1 16 LYS O O 5.684 -1.322 5.066 1.00 . A A . 16 LYS O 1 1 6 1944 1 1 17 LYS C C 7.615 0.406 3.257 1.00 . A A . 17 LYS C 1 1 6 1945 1 1 17 LYS CA C 7.726 -1.101 3.225 1.00 . A A . 17 LYS CA 1 1 6 1946 1 1 17 LYS CB C 8.725 -1.514 2.147 1.00 . A A . 17 LYS CB 1 1 6 1947 1 1 17 LYS CD C 10.539 -1.486 3.899 1.00 . A A . 17 LYS CD 1 1 6 1948 1 1 17 LYS CE C 11.493 -0.467 4.504 1.00 . A A . 17 LYS CE 1 1 6 1949 1 1 17 LYS CG C 10.163 -1.126 2.469 1.00 . A A . 17 LYS CG 1 1 6 1950 1 1 17 LYS H H 6.229 -2.076 2.094 1.00 . A A . 17 LYS H 1 1 6 1951 1 1 17 LYS HA H 8.072 -1.442 4.183 1.00 . A A . 17 LYS HA 1 1 6 1952 1 1 17 LYS HB2 H 8.674 -2.578 2.018 1.00 . A A . 17 LYS HB2 1 1 6 1953 1 1 17 LYS HB3 H 8.448 -1.036 1.219 1.00 . A A . 17 LYS HB3 1 1 6 1954 1 1 17 LYS HD2 H 9.641 -1.522 4.497 1.00 . A A . 17 LYS HD2 1 1 6 1955 1 1 17 LYS HD3 H 11.013 -2.457 3.902 1.00 . A A . 17 LYS HD3 1 1 6 1956 1 1 17 LYS HE2 H 11.731 -0.770 5.512 1.00 . A A . 17 LYS HE2 1 1 6 1957 1 1 17 LYS HE3 H 12.398 -0.445 3.913 1.00 . A A . 17 LYS HE3 1 1 6 1958 1 1 17 LYS HG2 H 10.826 -1.646 1.793 1.00 . A A . 17 LYS HG2 1 1 6 1959 1 1 17 LYS HG3 H 10.275 -0.060 2.334 1.00 . A A . 17 LYS HG3 1 1 6 1960 1 1 17 LYS HZ1 H 11.013 1.363 3.612 1.00 . A A . 17 LYS HZ1 1 1 6 1961 1 1 17 LYS HZ2 H 11.385 1.482 5.258 1.00 . A A . 17 LYS HZ2 1 1 6 1962 1 1 17 LYS HZ3 H 9.887 0.855 4.769 1.00 . A A . 17 LYS HZ3 1 1 6 1963 1 1 17 LYS N N 6.426 -1.701 2.978 1.00 . A A . 17 LYS N 1 1 6 1964 1 1 17 LYS NZ N 10.904 0.903 4.539 1.00 . A A . 17 LYS NZ 1 1 6 1965 1 1 17 LYS O O 8.168 1.064 4.142 1.00 . A A . 17 LYS O 1 1 6 1966 1 1 18 PHE C C 5.838 2.860 3.303 1.00 . A A . 18 PHE C 1 1 6 1967 1 1 18 PHE CA C 6.722 2.373 2.163 1.00 . A A . 18 PHE CA 1 1 6 1968 1 1 18 PHE CB C 6.081 2.721 0.817 1.00 . A A . 18 PHE CB 1 1 6 1969 1 1 18 PHE CD1 C 7.209 4.724 -0.191 1.00 . A A . 18 PHE CD1 1 1 6 1970 1 1 18 PHE CD2 C 5.086 5.028 0.855 1.00 . A A . 18 PHE CD2 1 1 6 1971 1 1 18 PHE CE1 C 7.254 6.072 -0.496 1.00 . A A . 18 PHE CE1 1 1 6 1972 1 1 18 PHE CE2 C 5.127 6.375 0.552 1.00 . A A . 18 PHE CE2 1 1 6 1973 1 1 18 PHE CG C 6.126 4.187 0.488 1.00 . A A . 18 PHE CG 1 1 6 1974 1 1 18 PHE CZ C 6.212 6.899 -0.125 1.00 . A A . 18 PHE CZ 1 1 6 1975 1 1 18 PHE H H 6.557 0.344 1.582 1.00 . A A . 18 PHE H 1 1 6 1976 1 1 18 PHE HA H 7.685 2.856 2.233 1.00 . A A . 18 PHE HA 1 1 6 1977 1 1 18 PHE HB2 H 6.596 2.188 0.034 1.00 . A A . 18 PHE HB2 1 1 6 1978 1 1 18 PHE HB3 H 5.046 2.415 0.831 1.00 . A A . 18 PHE HB3 1 1 6 1979 1 1 18 PHE HD1 H 8.025 4.079 -0.482 1.00 . A A . 18 PHE HD1 1 1 6 1980 1 1 18 PHE HD2 H 4.238 4.621 1.383 1.00 . A A . 18 PHE HD2 1 1 6 1981 1 1 18 PHE HE1 H 8.103 6.477 -1.025 1.00 . A A . 18 PHE HE1 1 1 6 1982 1 1 18 PHE HE2 H 4.310 7.020 0.844 1.00 . A A . 18 PHE HE2 1 1 6 1983 1 1 18 PHE HZ H 6.246 7.951 -0.363 1.00 . A A . 18 PHE HZ 1 1 6 1984 1 1 18 PHE N N 6.929 0.938 2.268 1.00 . A A . 18 PHE N 1 1 6 1985 1 1 18 PHE O O 6.186 3.796 4.019 1.00 . A A . 18 PHE O 1 1 6 1986 1 1 19 CYS C C 4.057 1.809 5.816 1.00 . A A . 19 CYS C 1 1 6 1987 1 1 19 CYS CA C 3.768 2.573 4.528 1.00 . A A . 19 CYS CA 1 1 6 1988 1 1 19 CYS CB C 2.323 2.348 4.068 1.00 . A A . 19 CYS CB 1 1 6 1989 1 1 19 CYS H H 4.511 1.418 2.914 1.00 . A A . 19 CYS H 1 1 6 1990 1 1 19 CYS HA H 3.907 3.626 4.722 1.00 . A A . 19 CYS HA 1 1 6 1991 1 1 19 CYS HB2 H 2.206 1.327 3.738 1.00 . A A . 19 CYS HB2 1 1 6 1992 1 1 19 CYS HB3 H 1.656 2.531 4.897 1.00 . A A . 19 CYS HB3 1 1 6 1993 1 1 19 CYS N N 4.706 2.196 3.483 1.00 . A A . 19 CYS N 1 1 6 1994 1 1 19 CYS O O 3.473 0.751 6.077 1.00 . A A . 19 CYS O 1 1 6 1995 1 1 19 CYS SG S 1.815 3.438 2.696 1.00 . A A . 19 CYS SG 1 1 6 1996 1 1 20 NH2 HN1 H 5.388 3.185 6.343 1.00 . A A . 20 NH2 HN1 1 1 6 1997 1 1 20 NH2 HN2 H 5.180 1.877 7.452 1.00 . A A . 20 NH2 HN2 1 1 6 1998 1 1 20 NH2 N N 4.966 2.341 6.620 1.00 . A A . 20 NH2 N 1 1 7 1999 1 1 1 PHE C C 1.673 6.366 -5.271 1.00 . A A . 1 PHE C 1 1 7 2000 1 1 1 PHE CA C 3.162 6.295 -5.579 1.00 . A A . 1 PHE CA 1 1 7 2001 1 1 1 PHE CB C 3.971 6.216 -4.275 1.00 . A A . 1 PHE CB 1 1 7 2002 1 1 1 PHE CD1 C 3.870 3.763 -3.747 1.00 . A A . 1 PHE CD1 1 1 7 2003 1 1 1 PHE CD2 C 2.935 5.298 -2.180 1.00 . A A . 1 PHE CD2 1 1 7 2004 1 1 1 PHE CE1 C 3.516 2.708 -2.929 1.00 . A A . 1 PHE CE1 1 1 7 2005 1 1 1 PHE CE2 C 2.579 4.247 -1.357 1.00 . A A . 1 PHE CE2 1 1 7 2006 1 1 1 PHE CG C 3.585 5.069 -3.384 1.00 . A A . 1 PHE CG 1 1 7 2007 1 1 1 PHE CZ C 2.868 2.950 -1.733 1.00 . A A . 1 PHE CZ 1 1 7 2008 1 1 1 PHE H1 H 4.582 7.426 -6.603 1.00 . A A . 1 PHE H1 1 1 7 2009 1 1 1 PHE H2 H 3.410 8.348 -5.805 1.00 . A A . 1 PHE H2 1 1 7 2010 1 1 1 PHE H3 H 3.017 7.543 -7.238 1.00 . A A . 1 PHE H3 1 1 7 2011 1 1 1 PHE HA H 3.355 5.413 -6.172 1.00 . A A . 1 PHE HA 1 1 7 2012 1 1 1 PHE HB2 H 5.017 6.108 -4.517 1.00 . A A . 1 PHE HB2 1 1 7 2013 1 1 1 PHE HB3 H 3.830 7.132 -3.719 1.00 . A A . 1 PHE HB3 1 1 7 2014 1 1 1 PHE HD1 H 4.375 3.571 -4.683 1.00 . A A . 1 PHE HD1 1 1 7 2015 1 1 1 PHE HD2 H 2.708 6.311 -1.887 1.00 . A A . 1 PHE HD2 1 1 7 2016 1 1 1 PHE HE1 H 3.744 1.694 -3.224 1.00 . A A . 1 PHE HE1 1 1 7 2017 1 1 1 PHE HE2 H 2.072 4.440 -0.423 1.00 . A A . 1 PHE HE2 1 1 7 2018 1 1 1 PHE HZ H 2.590 2.128 -1.092 1.00 . A A . 1 PHE HZ 1 1 7 2019 1 1 1 PHE N N 3.574 7.484 -6.361 1.00 . A A . 1 PHE N 1 1 7 2020 1 1 1 PHE O O 1.136 7.450 -5.056 1.00 . A A . 1 PHE O 1 1 7 2021 1 1 2 ASN C C -0.641 4.939 -3.494 1.00 . A A . 2 ASN C 1 1 7 2022 1 1 2 ASN CA C -0.419 5.168 -4.982 1.00 . A A . 2 ASN CA 1 1 7 2023 1 1 2 ASN CB C -1.099 4.057 -5.789 1.00 . A A . 2 ASN CB 1 1 7 2024 1 1 2 ASN CG C -2.607 4.047 -5.610 1.00 . A A . 2 ASN CG 1 1 7 2025 1 1 2 ASN H H 1.486 4.385 -5.462 1.00 . A A . 2 ASN H 1 1 7 2026 1 1 2 ASN HA H -0.849 6.120 -5.257 1.00 . A A . 2 ASN HA 1 1 7 2027 1 1 2 ASN HB2 H -0.881 4.198 -6.838 1.00 . A A . 2 ASN HB2 1 1 7 2028 1 1 2 ASN HB3 H -0.710 3.101 -5.471 1.00 . A A . 2 ASN HB3 1 1 7 2029 1 1 2 ASN HD21 H -2.648 2.073 -5.822 1.00 . A A . 2 ASN HD21 1 1 7 2030 1 1 2 ASN HD22 H -4.177 2.832 -5.560 1.00 . A A . 2 ASN HD22 1 1 7 2031 1 1 2 ASN N N 1.008 5.219 -5.271 1.00 . A A . 2 ASN N 1 1 7 2032 1 1 2 ASN ND2 N -3.204 2.867 -5.668 1.00 . A A . 2 ASN ND2 1 1 7 2033 1 1 2 ASN O O -0.679 3.797 -3.034 1.00 . A A . 2 ASN O 1 1 7 2034 1 1 2 ASN OD1 O -3.230 5.094 -5.415 1.00 . A A . 2 ASN OD1 1 1 7 2035 1 1 3 TRP C C -2.271 5.199 -0.959 1.00 . A A . 3 TRP C 1 1 7 2036 1 1 3 TRP CA C -0.997 5.966 -1.304 1.00 . A A . 3 TRP CA 1 1 7 2037 1 1 3 TRP CB C -1.047 7.378 -0.708 1.00 . A A . 3 TRP CB 1 1 7 2038 1 1 3 TRP CD1 C -1.581 9.154 -2.481 1.00 . A A . 3 TRP CD1 1 1 7 2039 1 1 3 TRP CD2 C -3.337 8.558 -1.226 1.00 . A A . 3 TRP CD2 1 1 7 2040 1 1 3 TRP CE2 C -3.758 9.530 -2.154 1.00 . A A . 3 TRP CE2 1 1 7 2041 1 1 3 TRP CE3 C -4.274 8.034 -0.329 1.00 . A A . 3 TRP CE3 1 1 7 2042 1 1 3 TRP CG C -1.941 8.327 -1.455 1.00 . A A . 3 TRP CG 1 1 7 2043 1 1 3 TRP CH2 C -5.965 9.459 -1.319 1.00 . A A . 3 TRP CH2 1 1 7 2044 1 1 3 TRP CZ2 C -5.071 9.988 -2.208 1.00 . A A . 3 TRP CZ2 1 1 7 2045 1 1 3 TRP CZ3 C -5.577 8.491 -0.384 1.00 . A A . 3 TRP CZ3 1 1 7 2046 1 1 3 TRP H H -0.742 6.908 -3.183 1.00 . A A . 3 TRP H 1 1 7 2047 1 1 3 TRP HA H -0.158 5.440 -0.878 1.00 . A A . 3 TRP HA 1 1 7 2048 1 1 3 TRP HB2 H -1.406 7.318 0.307 1.00 . A A . 3 TRP HB2 1 1 7 2049 1 1 3 TRP HB3 H -0.050 7.793 -0.707 1.00 . A A . 3 TRP HB3 1 1 7 2050 1 1 3 TRP HD1 H -0.583 9.217 -2.889 1.00 . A A . 3 TRP HD1 1 1 7 2051 1 1 3 TRP HE1 H -2.663 10.537 -3.634 1.00 . A A . 3 TRP HE1 1 1 7 2052 1 1 3 TRP HE3 H -3.994 7.286 0.398 1.00 . A A . 3 TRP HE3 1 1 7 2053 1 1 3 TRP HH2 H -6.993 9.788 -1.325 1.00 . A A . 3 TRP HH2 1 1 7 2054 1 1 3 TRP HZ2 H -5.387 10.733 -2.923 1.00 . A A . 3 TRP HZ2 1 1 7 2055 1 1 3 TRP HZ3 H -6.312 8.098 0.302 1.00 . A A . 3 TRP HZ3 1 1 7 2056 1 1 3 TRP N N -0.785 6.029 -2.751 1.00 . A A . 3 TRP N 1 1 7 2057 1 1 3 TRP NE1 N -2.668 9.876 -2.909 1.00 . A A . 3 TRP NE1 1 1 7 2058 1 1 3 TRP O O -2.423 4.687 0.148 1.00 . A A . 3 TRP O 1 1 7 2059 1 1 4 ARG C C -4.185 2.924 -1.445 1.00 . A A . 4 ARG C 1 1 7 2060 1 1 4 ARG CA C -4.431 4.390 -1.733 1.00 . A A . 4 ARG CA 1 1 7 2061 1 1 4 ARG CB C -5.320 4.536 -2.960 1.00 . A A . 4 ARG CB 1 1 7 2062 1 1 4 ARG CD C -6.795 6.081 -4.277 1.00 . A A . 4 ARG CD 1 1 7 2063 1 1 4 ARG CG C -6.248 5.736 -2.903 1.00 . A A . 4 ARG CG 1 1 7 2064 1 1 4 ARG CZ C -5.777 7.288 -6.177 1.00 . A A . 4 ARG CZ 1 1 7 2065 1 1 4 ARG H H -2.983 5.515 -2.791 1.00 . A A . 4 ARG H 1 1 7 2066 1 1 4 ARG HA H -4.919 4.823 -0.885 1.00 . A A . 4 ARG HA 1 1 7 2067 1 1 4 ARG HB2 H -4.691 4.634 -3.833 1.00 . A A . 4 ARG HB2 1 1 7 2068 1 1 4 ARG HB3 H -5.917 3.643 -3.059 1.00 . A A . 4 ARG HB3 1 1 7 2069 1 1 4 ARG HD2 H -7.390 5.252 -4.630 1.00 . A A . 4 ARG HD2 1 1 7 2070 1 1 4 ARG HD3 H -7.417 6.960 -4.193 1.00 . A A . 4 ARG HD3 1 1 7 2071 1 1 4 ARG HE H -4.920 5.774 -5.188 1.00 . A A . 4 ARG HE 1 1 7 2072 1 1 4 ARG HG2 H -7.072 5.511 -2.244 1.00 . A A . 4 ARG HG2 1 1 7 2073 1 1 4 ARG HG3 H -5.700 6.585 -2.520 1.00 . A A . 4 ARG HG3 1 1 7 2074 1 1 4 ARG HH11 H -7.613 7.958 -5.645 1.00 . A A . 4 ARG HH11 1 1 7 2075 1 1 4 ARG HH12 H -6.884 8.786 -6.979 1.00 . A A . 4 ARG HH12 1 1 7 2076 1 1 4 ARG HH21 H -3.952 6.849 -6.943 1.00 . A A . 4 ARG HH21 1 1 7 2077 1 1 4 ARG HH22 H -4.789 8.150 -7.726 1.00 . A A . 4 ARG HH22 1 1 7 2078 1 1 4 ARG N N -3.172 5.101 -1.927 1.00 . A A . 4 ARG N 1 1 7 2079 1 1 4 ARG NE N -5.725 6.343 -5.242 1.00 . A A . 4 ARG NE 1 1 7 2080 1 1 4 ARG NH1 N -6.843 8.074 -6.275 1.00 . A A . 4 ARG NH1 1 1 7 2081 1 1 4 ARG NH2 N -4.758 7.443 -7.016 1.00 . A A . 4 ARG NH2 1 1 7 2082 1 1 4 ARG O O -4.999 2.255 -0.817 1.00 . A A . 4 ARG O 1 1 7 2083 1 1 5 CYS C C -2.519 0.773 -0.211 1.00 . A A . 5 CYS C 1 1 7 2084 1 1 5 CYS CA C -2.655 1.063 -1.695 1.00 . A A . 5 CYS CA 1 1 7 2085 1 1 5 CYS CB C -1.325 0.784 -2.382 1.00 . A A . 5 CYS CB 1 1 7 2086 1 1 5 CYS H H -2.460 3.047 -2.403 1.00 . A A . 5 CYS H 1 1 7 2087 1 1 5 CYS HA H -3.414 0.420 -2.116 1.00 . A A . 5 CYS HA 1 1 7 2088 1 1 5 CYS HB2 H -0.689 1.650 -2.269 1.00 . A A . 5 CYS HB2 1 1 7 2089 1 1 5 CYS HB3 H -0.856 -0.065 -1.908 1.00 . A A . 5 CYS HB3 1 1 7 2090 1 1 5 CYS N N -3.051 2.445 -1.907 1.00 . A A . 5 CYS N 1 1 7 2091 1 1 5 CYS O O -2.767 -0.339 0.238 1.00 . A A . 5 CYS O 1 1 7 2092 1 1 5 CYS SG S -1.469 0.423 -4.161 1.00 . A A . 5 CYS SG 1 1 7 2093 1 1 6 CYS C C -3.320 1.446 2.683 1.00 . A A . 6 CYS C 1 1 7 2094 1 1 6 CYS CA C -1.977 1.640 1.987 1.00 . A A . 6 CYS CA 1 1 7 2095 1 1 6 CYS CB C -1.240 2.849 2.560 1.00 . A A . 6 CYS CB 1 1 7 2096 1 1 6 CYS H H -2.016 2.677 0.134 1.00 . A A . 6 CYS H 1 1 7 2097 1 1 6 CYS HA H -1.376 0.755 2.149 1.00 . A A . 6 CYS HA 1 1 7 2098 1 1 6 CYS HB2 H -1.929 3.673 2.660 1.00 . A A . 6 CYS HB2 1 1 7 2099 1 1 6 CYS HB3 H -0.846 2.589 3.534 1.00 . A A . 6 CYS HB3 1 1 7 2100 1 1 6 CYS N N -2.156 1.792 0.549 1.00 . A A . 6 CYS N 1 1 7 2101 1 1 6 CYS O O -3.381 1.007 3.833 1.00 . A A . 6 CYS O 1 1 7 2102 1 1 6 CYS SG S 0.158 3.404 1.532 1.00 . A A . 6 CYS SG 1 1 7 2103 1 1 7 LEU C C -6.325 0.291 2.010 1.00 . A A . 7 LEU C 1 1 7 2104 1 1 7 LEU CA C -5.740 1.605 2.506 1.00 . A A . 7 LEU CA 1 1 7 2105 1 1 7 LEU CB C -6.635 2.770 2.071 1.00 . A A . 7 LEU CB 1 1 7 2106 1 1 7 LEU CD1 C -6.966 5.230 1.736 1.00 . A A . 7 LEU CD1 1 1 7 2107 1 1 7 LEU CD2 C -6.027 4.386 3.892 1.00 . A A . 7 LEU CD2 1 1 7 2108 1 1 7 LEU CG C -6.097 4.167 2.388 1.00 . A A . 7 LEU CG 1 1 7 2109 1 1 7 LEU H H -4.281 2.120 1.067 1.00 . A A . 7 LEU H 1 1 7 2110 1 1 7 LEU HA H -5.677 1.581 3.580 1.00 . A A . 7 LEU HA 1 1 7 2111 1 1 7 LEU HB2 H -6.785 2.699 1.004 1.00 . A A . 7 LEU HB2 1 1 7 2112 1 1 7 LEU HB3 H -7.593 2.661 2.558 1.00 . A A . 7 LEU HB3 1 1 7 2113 1 1 7 LEU HD11 H -6.567 6.209 1.961 1.00 . A A . 7 LEU HD11 1 1 7 2114 1 1 7 LEU HD12 H -7.974 5.155 2.117 1.00 . A A . 7 LEU HD12 1 1 7 2115 1 1 7 LEU HD13 H -6.973 5.082 0.666 1.00 . A A . 7 LEU HD13 1 1 7 2116 1 1 7 LEU HD21 H -5.589 5.353 4.095 1.00 . A A . 7 LEU HD21 1 1 7 2117 1 1 7 LEU HD22 H -5.419 3.615 4.340 1.00 . A A . 7 LEU HD22 1 1 7 2118 1 1 7 LEU HD23 H -7.022 4.347 4.308 1.00 . A A . 7 LEU HD23 1 1 7 2119 1 1 7 LEU HG H -5.099 4.260 1.988 1.00 . A A . 7 LEU HG 1 1 7 2120 1 1 7 LEU N N -4.395 1.766 1.976 1.00 . A A . 7 LEU N 1 1 7 2121 1 1 7 LEU O O -7.418 -0.112 2.400 1.00 . A A . 7 LEU O 1 1 7 2122 1 1 8 ILE C C -4.984 -2.740 0.923 1.00 . A A . 8 ILE C 1 1 7 2123 1 1 8 ILE CA C -5.984 -1.644 0.574 1.00 . A A . 8 ILE CA 1 1 7 2124 1 1 8 ILE CB C -6.109 -1.548 -0.963 1.00 . A A . 8 ILE CB 1 1 7 2125 1 1 8 ILE CD1 C -6.960 -0.038 -2.833 1.00 . A A . 8 ILE CD1 1 1 7 2126 1 1 8 ILE CG1 C -6.993 -0.361 -1.355 1.00 . A A . 8 ILE CG1 1 1 7 2127 1 1 8 ILE CG2 C -6.671 -2.846 -1.530 1.00 . A A . 8 ILE CG2 1 1 7 2128 1 1 8 ILE H H -4.685 -0.015 0.919 1.00 . A A . 8 ILE H 1 1 7 2129 1 1 8 ILE HA H -6.950 -1.901 0.982 1.00 . A A . 8 ILE HA 1 1 7 2130 1 1 8 ILE HB H -5.121 -1.404 -1.373 1.00 . A A . 8 ILE HB 1 1 7 2131 1 1 8 ILE HD11 H -7.621 0.792 -3.036 1.00 . A A . 8 ILE HD11 1 1 7 2132 1 1 8 ILE HD12 H -7.282 -0.901 -3.396 1.00 . A A . 8 ILE HD12 1 1 7 2133 1 1 8 ILE HD13 H -5.952 0.225 -3.123 1.00 . A A . 8 ILE HD13 1 1 7 2134 1 1 8 ILE HG12 H -8.015 -0.579 -1.087 1.00 . A A . 8 ILE HG12 1 1 7 2135 1 1 8 ILE HG13 H -6.665 0.515 -0.816 1.00 . A A . 8 ILE HG13 1 1 7 2136 1 1 8 ILE HG21 H -6.746 -2.766 -2.605 1.00 . A A . 8 ILE HG21 1 1 7 2137 1 1 8 ILE HG22 H -7.650 -3.026 -1.112 1.00 . A A . 8 ILE HG22 1 1 7 2138 1 1 8 ILE HG23 H -6.014 -3.664 -1.275 1.00 . A A . 8 ILE HG23 1 1 7 2139 1 1 8 ILE N N -5.566 -0.378 1.153 1.00 . A A . 8 ILE N 1 1 7 2140 1 1 8 ILE O O -3.895 -2.801 0.351 1.00 . A A . 8 ILE O 1 1 7 2141 1 1 9 PRO C C -3.827 -5.505 1.186 1.00 . A A . 9 PRO C 1 1 7 2142 1 1 9 PRO CA C -4.506 -4.734 2.321 1.00 . A A . 9 PRO CA 1 1 7 2143 1 1 9 PRO CB C -5.486 -5.641 3.064 1.00 . A A . 9 PRO CB 1 1 7 2144 1 1 9 PRO CD C -6.669 -3.624 2.542 1.00 . A A . 9 PRO CD 1 1 7 2145 1 1 9 PRO CG C -6.546 -4.722 3.564 1.00 . A A . 9 PRO CG 1 1 7 2146 1 1 9 PRO HA H -3.753 -4.382 3.011 1.00 . A A . 9 PRO HA 1 1 7 2147 1 1 9 PRO HB2 H -5.889 -6.375 2.380 1.00 . A A . 9 PRO HB2 1 1 7 2148 1 1 9 PRO HB3 H -4.979 -6.137 3.877 1.00 . A A . 9 PRO HB3 1 1 7 2149 1 1 9 PRO HD2 H -7.466 -3.845 1.847 1.00 . A A . 9 PRO HD2 1 1 7 2150 1 1 9 PRO HD3 H -6.844 -2.676 3.029 1.00 . A A . 9 PRO HD3 1 1 7 2151 1 1 9 PRO HG2 H -7.480 -5.256 3.654 1.00 . A A . 9 PRO HG2 1 1 7 2152 1 1 9 PRO HG3 H -6.253 -4.312 4.520 1.00 . A A . 9 PRO HG3 1 1 7 2153 1 1 9 PRO N N -5.360 -3.630 1.857 1.00 . A A . 9 PRO N 1 1 7 2154 1 1 9 PRO O O -2.685 -5.940 1.323 1.00 . A A . 9 PRO O 1 1 7 2155 1 1 10 ALA C C -2.789 -5.665 -1.708 1.00 . A A . 10 ALA C 1 1 7 2156 1 1 10 ALA CA C -3.992 -6.375 -1.084 1.00 . A A . 10 ALA CA 1 1 7 2157 1 1 10 ALA CB C -5.080 -6.578 -2.126 1.00 . A A . 10 ALA CB 1 1 7 2158 1 1 10 ALA H H -5.421 -5.261 0.011 1.00 . A A . 10 ALA H 1 1 7 2159 1 1 10 ALA HA H -3.678 -7.350 -0.741 1.00 . A A . 10 ALA HA 1 1 7 2160 1 1 10 ALA HB1 H -4.695 -7.182 -2.935 1.00 . A A . 10 ALA HB1 1 1 7 2161 1 1 10 ALA HB2 H -5.394 -5.619 -2.510 1.00 . A A . 10 ALA HB2 1 1 7 2162 1 1 10 ALA HB3 H -5.922 -7.079 -1.674 1.00 . A A . 10 ALA HB3 1 1 7 2163 1 1 10 ALA N N -4.524 -5.650 0.065 1.00 . A A . 10 ALA N 1 1 7 2164 1 1 10 ALA O O -1.823 -6.313 -2.114 1.00 . A A . 10 ALA O 1 1 7 2165 1 1 11 CYS C C -0.700 -3.219 -1.307 1.00 . A A . 11 CYS C 1 1 7 2166 1 1 11 CYS CA C -1.746 -3.570 -2.358 1.00 . A A . 11 CYS CA 1 1 7 2167 1 1 11 CYS CB C -2.279 -2.290 -3.017 1.00 . A A . 11 CYS CB 1 1 7 2168 1 1 11 CYS H H -3.604 -3.865 -1.373 1.00 . A A . 11 CYS H 1 1 7 2169 1 1 11 CYS HA H -1.284 -4.187 -3.114 1.00 . A A . 11 CYS HA 1 1 7 2170 1 1 11 CYS HB2 H -3.221 -2.504 -3.498 1.00 . A A . 11 CYS HB2 1 1 7 2171 1 1 11 CYS HB3 H -2.433 -1.541 -2.254 1.00 . A A . 11 CYS HB3 1 1 7 2172 1 1 11 CYS N N -2.835 -4.339 -1.762 1.00 . A A . 11 CYS N 1 1 7 2173 1 1 11 CYS O O 0.500 -3.197 -1.589 1.00 . A A . 11 CYS O 1 1 7 2174 1 1 11 CYS SG S -1.159 -1.582 -4.276 1.00 . A A . 11 CYS SG 1 1 7 2175 1 1 12 ARG C C 0.603 -3.787 1.397 1.00 . A A . 12 ARG C 1 1 7 2176 1 1 12 ARG CA C -0.280 -2.611 1.018 1.00 . A A . 12 ARG CA 1 1 7 2177 1 1 12 ARG CB C -1.101 -2.173 2.224 1.00 . A A . 12 ARG CB 1 1 7 2178 1 1 12 ARG CD C -1.121 -1.165 4.517 1.00 . A A . 12 ARG CD 1 1 7 2179 1 1 12 ARG CG C -0.298 -1.418 3.267 1.00 . A A . 12 ARG CG 1 1 7 2180 1 1 12 ARG CZ C -0.933 0.383 6.431 1.00 . A A . 12 ARG CZ 1 1 7 2181 1 1 12 ARG H H -2.134 -2.999 0.069 1.00 . A A . 12 ARG H 1 1 7 2182 1 1 12 ARG HA H 0.345 -1.791 0.698 1.00 . A A . 12 ARG HA 1 1 7 2183 1 1 12 ARG HB2 H -1.901 -1.540 1.883 1.00 . A A . 12 ARG HB2 1 1 7 2184 1 1 12 ARG HB3 H -1.524 -3.047 2.693 1.00 . A A . 12 ARG HB3 1 1 7 2185 1 1 12 ARG HD2 H -1.998 -0.596 4.246 1.00 . A A . 12 ARG HD2 1 1 7 2186 1 1 12 ARG HD3 H -1.423 -2.116 4.930 1.00 . A A . 12 ARG HD3 1 1 7 2187 1 1 12 ARG HE H 0.606 -0.546 5.547 1.00 . A A . 12 ARG HE 1 1 7 2188 1 1 12 ARG HG2 H 0.572 -2.001 3.532 1.00 . A A . 12 ARG HG2 1 1 7 2189 1 1 12 ARG HG3 H 0.014 -0.469 2.852 1.00 . A A . 12 ARG HG3 1 1 7 2190 1 1 12 ARG HH11 H -2.817 0.166 5.704 1.00 . A A . 12 ARG HH11 1 1 7 2191 1 1 12 ARG HH12 H -2.673 1.201 7.087 1.00 . A A . 12 ARG HH12 1 1 7 2192 1 1 12 ARG HH21 H 0.819 0.843 7.341 1.00 . A A . 12 ARG HH21 1 1 7 2193 1 1 12 ARG HH22 H -0.590 1.593 8.021 1.00 . A A . 12 ARG HH22 1 1 7 2194 1 1 12 ARG N N -1.163 -2.962 -0.089 1.00 . A A . 12 ARG N 1 1 7 2195 1 1 12 ARG NE N -0.371 -0.424 5.531 1.00 . A A . 12 ARG NE 1 1 7 2196 1 1 12 ARG NH1 N -2.245 0.602 6.407 1.00 . A A . 12 ARG NH1 1 1 7 2197 1 1 12 ARG NH2 N -0.176 0.990 7.336 1.00 . A A . 12 ARG NH2 1 1 7 2198 1 1 12 ARG O O 1.701 -3.608 1.917 1.00 . A A . 12 ARG O 1 1 7 2199 1 1 13 ARG C C 2.231 -6.181 0.787 1.00 . A A . 13 ARG C 1 1 7 2200 1 1 13 ARG CA C 0.844 -6.213 1.431 1.00 . A A . 13 ARG CA 1 1 7 2201 1 1 13 ARG CB C 0.062 -7.431 0.930 1.00 . A A . 13 ARG CB 1 1 7 2202 1 1 13 ARG CD C -0.064 -9.931 0.668 1.00 . A A . 13 ARG CD 1 1 7 2203 1 1 13 ARG CG C 0.749 -8.762 1.200 1.00 . A A . 13 ARG CG 1 1 7 2204 1 1 13 ARG CZ C -0.462 -10.788 -1.618 1.00 . A A . 13 ARG CZ 1 1 7 2205 1 1 13 ARG H H -0.795 -5.052 0.755 1.00 . A A . 13 ARG H 1 1 7 2206 1 1 13 ARG HA H 0.958 -6.285 2.502 1.00 . A A . 13 ARG HA 1 1 7 2207 1 1 13 ARG HB2 H -0.904 -7.447 1.414 1.00 . A A . 13 ARG HB2 1 1 7 2208 1 1 13 ARG HB3 H -0.083 -7.336 -0.135 1.00 . A A . 13 ARG HB3 1 1 7 2209 1 1 13 ARG HD2 H 0.507 -10.838 0.797 1.00 . A A . 13 ARG HD2 1 1 7 2210 1 1 13 ARG HD3 H -0.982 -10.003 1.234 1.00 . A A . 13 ARG HD3 1 1 7 2211 1 1 13 ARG HE H -0.579 -8.864 -1.071 1.00 . A A . 13 ARG HE 1 1 7 2212 1 1 13 ARG HG2 H 1.716 -8.760 0.718 1.00 . A A . 13 ARG HG2 1 1 7 2213 1 1 13 ARG HG3 H 0.878 -8.879 2.267 1.00 . A A . 13 ARG HG3 1 1 7 2214 1 1 13 ARG HH11 H 0.030 -12.212 -0.259 1.00 . A A . 13 ARG HH11 1 1 7 2215 1 1 13 ARG HH12 H -0.261 -12.794 -1.864 1.00 . A A . 13 ARG HH12 1 1 7 2216 1 1 13 ARG HH21 H -0.979 -9.619 -3.194 1.00 . A A . 13 ARG HH21 1 1 7 2217 1 1 13 ARG HH22 H -0.837 -11.310 -3.544 1.00 . A A . 13 ARG HH22 1 1 7 2218 1 1 13 ARG N N 0.107 -4.988 1.138 1.00 . A A . 13 ARG N 1 1 7 2219 1 1 13 ARG NE N -0.394 -9.775 -0.752 1.00 . A A . 13 ARG NE 1 1 7 2220 1 1 13 ARG NH1 N -0.211 -12.033 -1.216 1.00 . A A . 13 ARG NH1 1 1 7 2221 1 1 13 ARG NH2 N -0.785 -10.555 -2.887 1.00 . A A . 13 ARG NH2 1 1 7 2222 1 1 13 ARG O O 3.219 -6.579 1.402 1.00 . A A . 13 ARG O 1 1 7 2223 1 1 14 ASN C C 4.095 -4.162 -1.166 1.00 . A A . 14 ASN C 1 1 7 2224 1 1 14 ASN CA C 3.559 -5.595 -1.174 1.00 . A A . 14 ASN CA 1 1 7 2225 1 1 14 ASN CB C 3.362 -6.084 -2.616 1.00 . A A . 14 ASN CB 1 1 7 2226 1 1 14 ASN CG C 4.670 -6.408 -3.316 1.00 . A A . 14 ASN CG 1 1 7 2227 1 1 14 ASN H H 1.477 -5.342 -0.864 1.00 . A A . 14 ASN H 1 1 7 2228 1 1 14 ASN HA H 4.272 -6.235 -0.679 1.00 . A A . 14 ASN HA 1 1 7 2229 1 1 14 ASN HB2 H 2.755 -6.976 -2.604 1.00 . A A . 14 ASN HB2 1 1 7 2230 1 1 14 ASN HB3 H 2.852 -5.317 -3.182 1.00 . A A . 14 ASN HB3 1 1 7 2231 1 1 14 ASN HD21 H 3.848 -6.047 -5.085 1.00 . A A . 14 ASN HD21 1 1 7 2232 1 1 14 ASN HD22 H 5.509 -6.520 -5.111 1.00 . A A . 14 ASN HD22 1 1 7 2233 1 1 14 ASN N N 2.296 -5.676 -0.441 1.00 . A A . 14 ASN N 1 1 7 2234 1 1 14 ASN ND2 N 4.675 -6.315 -4.638 1.00 . A A . 14 ASN ND2 1 1 7 2235 1 1 14 ASN O O 5.017 -3.814 -1.904 1.00 . A A . 14 ASN O 1 1 7 2236 1 1 14 ASN OD1 O 5.663 -6.747 -2.680 1.00 . A A . 14 ASN OD1 1 1 7 2237 1 1 15 HIS C C 4.053 -1.553 1.250 1.00 . A A . 15 HIS C 1 1 7 2238 1 1 15 HIS CA C 3.908 -1.926 -0.217 1.00 . A A . 15 HIS CA 1 1 7 2239 1 1 15 HIS CB C 2.888 -0.994 -0.883 1.00 . A A . 15 HIS CB 1 1 7 2240 1 1 15 HIS CD2 C 1.985 -0.527 -3.267 1.00 . A A . 15 HIS CD2 1 1 7 2241 1 1 15 HIS CE1 C 3.468 -1.651 -4.417 1.00 . A A . 15 HIS CE1 1 1 7 2242 1 1 15 HIS CG C 2.852 -1.071 -2.383 1.00 . A A . 15 HIS CG 1 1 7 2243 1 1 15 HIS H H 2.764 -3.653 0.233 1.00 . A A . 15 HIS H 1 1 7 2244 1 1 15 HIS HA H 4.865 -1.816 -0.702 1.00 . A A . 15 HIS HA 1 1 7 2245 1 1 15 HIS HB2 H 1.903 -1.243 -0.519 1.00 . A A . 15 HIS HB2 1 1 7 2246 1 1 15 HIS HB3 H 3.117 0.026 -0.608 1.00 . A A . 15 HIS HB3 1 1 7 2247 1 1 15 HIS HD1 H 4.528 -2.297 -2.785 1.00 . A A . 15 HIS HD1 1 1 7 2248 1 1 15 HIS HD2 H 1.132 0.091 -3.028 1.00 . A A . 15 HIS HD2 1 1 7 2249 1 1 15 HIS HE1 H 4.013 -2.094 -5.239 1.00 . A A . 15 HIS HE1 1 1 7 2250 1 1 15 HIS HE2 H 1.839 -0.826 -5.336 1.00 . A A . 15 HIS HE2 1 1 7 2251 1 1 15 HIS N N 3.498 -3.323 -0.332 1.00 . A A . 15 HIS N 1 1 7 2252 1 1 15 HIS ND1 N 3.771 -1.770 -3.139 1.00 . A A . 15 HIS ND1 1 1 7 2253 1 1 15 HIS NE2 N 2.387 -0.903 -4.525 1.00 . A A . 15 HIS NE2 1 1 7 2254 1 1 15 HIS O O 3.957 -0.384 1.622 1.00 . A A . 15 HIS O 1 1 7 2255 1 1 16 LYS C C 5.631 -1.502 3.857 1.00 . A A . 16 LYS C 1 1 7 2256 1 1 16 LYS CA C 4.437 -2.383 3.512 1.00 . A A . 16 LYS CA 1 1 7 2257 1 1 16 LYS CB C 4.584 -3.747 4.188 1.00 . A A . 16 LYS CB 1 1 7 2258 1 1 16 LYS CD C 4.689 -5.067 6.328 1.00 . A A . 16 LYS CD 1 1 7 2259 1 1 16 LYS CE C 3.744 -6.140 5.806 1.00 . A A . 16 LYS CE 1 1 7 2260 1 1 16 LYS CG C 4.404 -3.712 5.699 1.00 . A A . 16 LYS CG 1 1 7 2261 1 1 16 LYS H H 4.386 -3.463 1.694 1.00 . A A . 16 LYS H 1 1 7 2262 1 1 16 LYS HA H 3.538 -1.908 3.874 1.00 . A A . 16 LYS HA 1 1 7 2263 1 1 16 LYS HB2 H 3.847 -4.420 3.776 1.00 . A A . 16 LYS HB2 1 1 7 2264 1 1 16 LYS HB3 H 5.570 -4.136 3.975 1.00 . A A . 16 LYS HB3 1 1 7 2265 1 1 16 LYS HD2 H 5.705 -5.353 6.098 1.00 . A A . 16 LYS HD2 1 1 7 2266 1 1 16 LYS HD3 H 4.572 -4.987 7.399 1.00 . A A . 16 LYS HD3 1 1 7 2267 1 1 16 LYS HE2 H 2.742 -5.912 6.137 1.00 . A A . 16 LYS HE2 1 1 7 2268 1 1 16 LYS HE3 H 3.777 -6.134 4.727 1.00 . A A . 16 LYS HE3 1 1 7 2269 1 1 16 LYS HG2 H 5.082 -2.983 6.118 1.00 . A A . 16 LYS HG2 1 1 7 2270 1 1 16 LYS HG3 H 3.385 -3.429 5.922 1.00 . A A . 16 LYS HG3 1 1 7 2271 1 1 16 LYS HZ1 H 4.086 -7.523 7.334 1.00 . A A . 16 LYS HZ1 1 1 7 2272 1 1 16 LYS HZ2 H 5.080 -7.734 5.983 1.00 . A A . 16 LYS HZ2 1 1 7 2273 1 1 16 LYS HZ3 H 3.458 -8.205 5.920 1.00 . A A . 16 LYS HZ3 1 1 7 2274 1 1 16 LYS N N 4.299 -2.562 2.070 1.00 . A A . 16 LYS N 1 1 7 2275 1 1 16 LYS NZ N 4.118 -7.494 6.295 1.00 . A A . 16 LYS NZ 1 1 7 2276 1 1 16 LYS O O 5.646 -0.840 4.892 1.00 . A A . 16 LYS O 1 1 7 2277 1 1 17 LYS C C 7.535 0.786 3.052 1.00 . A A . 17 LYS C 1 1 7 2278 1 1 17 LYS CA C 7.821 -0.694 3.206 1.00 . A A . 17 LYS CA 1 1 7 2279 1 1 17 LYS CB C 8.923 -1.099 2.235 1.00 . A A . 17 LYS CB 1 1 7 2280 1 1 17 LYS CD C 11.361 -0.458 2.068 1.00 . A A . 17 LYS CD 1 1 7 2281 1 1 17 LYS CE C 11.087 1.040 1.972 1.00 . A A . 17 LYS CE 1 1 7 2282 1 1 17 LYS CG C 10.298 -1.185 2.883 1.00 . A A . 17 LYS CG 1 1 7 2283 1 1 17 LYS H H 6.549 -2.024 2.165 1.00 . A A . 17 LYS H 1 1 7 2284 1 1 17 LYS HA H 8.147 -0.875 4.212 1.00 . A A . 17 LYS HA 1 1 7 2285 1 1 17 LYS HB2 H 8.674 -2.060 1.815 1.00 . A A . 17 LYS HB2 1 1 7 2286 1 1 17 LYS HB3 H 8.970 -0.372 1.438 1.00 . A A . 17 LYS HB3 1 1 7 2287 1 1 17 LYS HD2 H 12.324 -0.607 2.535 1.00 . A A . 17 LYS HD2 1 1 7 2288 1 1 17 LYS HD3 H 11.378 -0.874 1.072 1.00 . A A . 17 LYS HD3 1 1 7 2289 1 1 17 LYS HE2 H 11.905 1.510 1.446 1.00 . A A . 17 LYS HE2 1 1 7 2290 1 1 17 LYS HE3 H 10.172 1.191 1.418 1.00 . A A . 17 LYS HE3 1 1 7 2291 1 1 17 LYS HG2 H 10.248 -0.741 3.864 1.00 . A A . 17 LYS HG2 1 1 7 2292 1 1 17 LYS HG3 H 10.576 -2.227 2.973 1.00 . A A . 17 LYS HG3 1 1 7 2293 1 1 17 LYS HZ1 H 11.240 2.674 3.269 1.00 . A A . 17 LYS HZ1 1 1 7 2294 1 1 17 LYS HZ2 H 11.545 1.183 4.007 1.00 . A A . 17 LYS HZ2 1 1 7 2295 1 1 17 LYS HZ3 H 9.955 1.634 3.631 1.00 . A A . 17 LYS HZ3 1 1 7 2296 1 1 17 LYS N N 6.623 -1.488 2.980 1.00 . A A . 17 LYS N 1 1 7 2297 1 1 17 LYS NZ N 10.949 1.676 3.314 1.00 . A A . 17 LYS NZ 1 1 7 2298 1 1 17 LYS O O 8.246 1.625 3.606 1.00 . A A . 17 LYS O 1 1 7 2299 1 1 18 PHE C C 5.088 2.900 3.066 1.00 . A A . 18 PHE C 1 1 7 2300 1 1 18 PHE CA C 6.133 2.474 2.048 1.00 . A A . 18 PHE CA 1 1 7 2301 1 1 18 PHE CB C 5.580 2.651 0.632 1.00 . A A . 18 PHE CB 1 1 7 2302 1 1 18 PHE CD1 C 7.535 3.287 -0.807 1.00 . A A . 18 PHE CD1 1 1 7 2303 1 1 18 PHE CD2 C 6.558 1.132 -1.112 1.00 . A A . 18 PHE CD2 1 1 7 2304 1 1 18 PHE CE1 C 8.452 3.016 -1.803 1.00 . A A . 18 PHE CE1 1 1 7 2305 1 1 18 PHE CE2 C 7.474 0.856 -2.110 1.00 . A A . 18 PHE CE2 1 1 7 2306 1 1 18 PHE CG C 6.578 2.350 -0.450 1.00 . A A . 18 PHE CG 1 1 7 2307 1 1 18 PHE CZ C 8.423 1.799 -2.455 1.00 . A A . 18 PHE CZ 1 1 7 2308 1 1 18 PHE H H 6.015 0.372 1.846 1.00 . A A . 18 PHE H 1 1 7 2309 1 1 18 PHE HA H 7.012 3.091 2.165 1.00 . A A . 18 PHE HA 1 1 7 2310 1 1 18 PHE HB2 H 4.737 1.990 0.497 1.00 . A A . 18 PHE HB2 1 1 7 2311 1 1 18 PHE HB3 H 5.251 3.674 0.509 1.00 . A A . 18 PHE HB3 1 1 7 2312 1 1 18 PHE HD1 H 7.559 4.239 -0.297 1.00 . A A . 18 PHE HD1 1 1 7 2313 1 1 18 PHE HD2 H 5.817 0.394 -0.843 1.00 . A A . 18 PHE HD2 1 1 7 2314 1 1 18 PHE HE1 H 9.194 3.755 -2.071 1.00 . A A . 18 PHE HE1 1 1 7 2315 1 1 18 PHE HE2 H 7.449 -0.097 -2.618 1.00 . A A . 18 PHE HE2 1 1 7 2316 1 1 18 PHE HZ H 9.138 1.586 -3.236 1.00 . A A . 18 PHE HZ 1 1 7 2317 1 1 18 PHE N N 6.521 1.094 2.275 1.00 . A A . 18 PHE N 1 1 7 2318 1 1 18 PHE O O 5.198 3.955 3.685 1.00 . A A . 18 PHE O 1 1 7 2319 1 1 19 CYS C C 3.280 1.766 5.554 1.00 . A A . 19 CYS C 1 1 7 2320 1 1 19 CYS CA C 3.003 2.349 4.172 1.00 . A A . 19 CYS CA 1 1 7 2321 1 1 19 CYS CB C 1.679 1.826 3.615 1.00 . A A . 19 CYS CB 1 1 7 2322 1 1 19 CYS H H 4.098 1.194 2.772 1.00 . A A . 19 CYS H 1 1 7 2323 1 1 19 CYS HA H 2.939 3.423 4.263 1.00 . A A . 19 CYS HA 1 1 7 2324 1 1 19 CYS HB2 H 1.559 0.790 3.887 1.00 . A A . 19 CYS HB2 1 1 7 2325 1 1 19 CYS HB3 H 0.870 2.399 4.043 1.00 . A A . 19 CYS HB3 1 1 7 2326 1 1 19 CYS N N 4.088 2.055 3.247 1.00 . A A . 19 CYS N 1 1 7 2327 1 1 19 CYS O O 2.513 0.936 6.059 1.00 . A A . 19 CYS O 1 1 7 2328 1 1 19 CYS SG S 1.541 1.947 1.801 1.00 . A A . 19 CYS SG 1 1 7 2329 1 1 20 NH2 HN1 H 4.925 2.864 5.703 1.00 . A A . 20 NH2 HN1 1 1 7 2330 1 1 20 NH2 HN2 H 4.569 1.855 7.060 1.00 . A A . 20 NH2 HN2 1 1 7 2331 1 1 20 NH2 N N 4.366 2.205 6.169 1.00 . A A . 20 NH2 N 1 1 8 2332 1 1 1 PHE C C 1.668 6.410 -5.193 1.00 . A A . 1 PHE C 1 1 8 2333 1 1 1 PHE CA C 3.149 6.289 -5.527 1.00 . A A . 1 PHE CA 1 1 8 2334 1 1 1 PHE CB C 3.973 6.135 -4.240 1.00 . A A . 1 PHE CB 1 1 8 2335 1 1 1 PHE CD1 C 3.765 3.691 -3.695 1.00 . A A . 1 PHE CD1 1 1 8 2336 1 1 1 PHE CD2 C 2.833 5.273 -2.172 1.00 . A A . 1 PHE CD2 1 1 8 2337 1 1 1 PHE CE1 C 3.344 2.657 -2.881 1.00 . A A . 1 PHE CE1 1 1 8 2338 1 1 1 PHE CE2 C 2.409 4.243 -1.355 1.00 . A A . 1 PHE CE2 1 1 8 2339 1 1 1 PHE CG C 3.515 5.010 -3.350 1.00 . A A . 1 PHE CG 1 1 8 2340 1 1 1 PHE CZ C 2.665 2.934 -1.710 1.00 . A A . 1 PHE CZ 1 1 8 2341 1 1 1 PHE H1 H 3.107 7.535 -7.193 1.00 . A A . 1 PHE H1 1 1 8 2342 1 1 1 PHE H2 H 4.620 7.447 -6.442 1.00 . A A . 1 PHE H2 1 1 8 2343 1 1 1 PHE H3 H 3.374 8.345 -5.734 1.00 . A A . 1 PHE H3 1 1 8 2344 1 1 1 PHE HA H 3.297 5.420 -6.151 1.00 . A A . 1 PHE HA 1 1 8 2345 1 1 1 PHE HB2 H 5.002 5.951 -4.501 1.00 . A A . 1 PHE HB2 1 1 8 2346 1 1 1 PHE HB3 H 3.911 7.053 -3.672 1.00 . A A . 1 PHE HB3 1 1 8 2347 1 1 1 PHE HD1 H 4.296 3.474 -4.610 1.00 . A A . 1 PHE HD1 1 1 8 2348 1 1 1 PHE HD2 H 2.633 6.297 -1.894 1.00 . A A . 1 PHE HD2 1 1 8 2349 1 1 1 PHE HE1 H 3.545 1.633 -3.161 1.00 . A A . 1 PHE HE1 1 1 8 2350 1 1 1 PHE HE2 H 1.879 4.462 -0.441 1.00 . A A . 1 PHE HE2 1 1 8 2351 1 1 1 PHE HZ H 2.335 2.126 -1.073 1.00 . A A . 1 PHE HZ 1 1 8 2352 1 1 1 PHE N N 3.596 7.485 -6.277 1.00 . A A . 1 PHE N 1 1 8 2353 1 1 1 PHE O O 1.178 7.506 -4.940 1.00 . A A . 1 PHE O 1 1 8 2354 1 1 2 ASN C C -0.672 5.030 -3.414 1.00 . A A . 2 ASN C 1 1 8 2355 1 1 2 ASN CA C -0.461 5.274 -4.903 1.00 . A A . 2 ASN CA 1 1 8 2356 1 1 2 ASN CB C -1.179 4.195 -5.718 1.00 . A A . 2 ASN CB 1 1 8 2357 1 1 2 ASN CG C -2.668 4.142 -5.427 1.00 . A A . 2 ASN CG 1 1 8 2358 1 1 2 ASN H H 1.408 4.442 -5.428 1.00 . A A . 2 ASN H 1 1 8 2359 1 1 2 ASN HA H -0.866 6.241 -5.160 1.00 . A A . 2 ASN HA 1 1 8 2360 1 1 2 ASN HB2 H -1.044 4.396 -6.770 1.00 . A A . 2 ASN HB2 1 1 8 2361 1 1 2 ASN HB3 H -0.751 3.232 -5.481 1.00 . A A . 2 ASN HB3 1 1 8 2362 1 1 2 ASN HD21 H -2.715 2.205 -5.868 1.00 . A A . 2 ASN HD21 1 1 8 2363 1 1 2 ASN HD22 H -4.223 2.911 -5.411 1.00 . A A . 2 ASN HD22 1 1 8 2364 1 1 2 ASN N N 0.963 5.287 -5.212 1.00 . A A . 2 ASN N 1 1 8 2365 1 1 2 ASN ND2 N -3.261 2.968 -5.581 1.00 . A A . 2 ASN ND2 1 1 8 2366 1 1 2 ASN O O -0.642 3.888 -2.955 1.00 . A A . 2 ASN O 1 1 8 2367 1 1 2 ASN OD1 O -3.276 5.146 -5.060 1.00 . A A . 2 ASN OD1 1 1 8 2368 1 1 3 TRP C C -2.333 5.198 -0.892 1.00 . A A . 3 TRP C 1 1 8 2369 1 1 3 TRP CA C -1.096 6.025 -1.224 1.00 . A A . 3 TRP CA 1 1 8 2370 1 1 3 TRP CB C -1.218 7.428 -0.618 1.00 . A A . 3 TRP CB 1 1 8 2371 1 1 3 TRP CD1 C -2.196 9.024 -2.372 1.00 . A A . 3 TRP CD1 1 1 8 2372 1 1 3 TRP CD2 C -3.635 8.444 -0.756 1.00 . A A . 3 TRP CD2 1 1 8 2373 1 1 3 TRP CE2 C -4.289 9.314 -1.650 1.00 . A A . 3 TRP CE2 1 1 8 2374 1 1 3 TRP CE3 C -4.344 7.949 0.343 1.00 . A A . 3 TRP CE3 1 1 8 2375 1 1 3 TRP CG C -2.297 8.268 -1.239 1.00 . A A . 3 TRP CG 1 1 8 2376 1 1 3 TRP CH2 C -6.286 9.197 -0.394 1.00 . A A . 3 TRP CH2 1 1 8 2377 1 1 3 TRP CZ2 C -5.617 9.697 -1.478 1.00 . A A . 3 TRP CZ2 1 1 8 2378 1 1 3 TRP CZ3 C -5.662 8.332 0.511 1.00 . A A . 3 TRP CZ3 1 1 8 2379 1 1 3 TRP H H -0.902 6.989 -3.101 1.00 . A A . 3 TRP H 1 1 8 2380 1 1 3 TRP HA H -0.236 5.536 -0.800 1.00 . A A . 3 TRP HA 1 1 8 2381 1 1 3 TRP HB2 H -1.435 7.339 0.436 1.00 . A A . 3 TRP HB2 1 1 8 2382 1 1 3 TRP HB3 H -0.278 7.947 -0.742 1.00 . A A . 3 TRP HB3 1 1 8 2383 1 1 3 TRP HD1 H -1.303 9.105 -2.972 1.00 . A A . 3 TRP HD1 1 1 8 2384 1 1 3 TRP HE1 H -3.570 10.247 -3.386 1.00 . A A . 3 TRP HE1 1 1 8 2385 1 1 3 TRP HE3 H -3.880 7.279 1.051 1.00 . A A . 3 TRP HE3 1 1 8 2386 1 1 3 TRP HH2 H -7.317 9.470 -0.222 1.00 . A A . 3 TRP HH2 1 1 8 2387 1 1 3 TRP HZ2 H -6.113 10.364 -2.167 1.00 . A A . 3 TRP HZ2 1 1 8 2388 1 1 3 TRP HZ3 H -6.225 7.959 1.354 1.00 . A A . 3 TRP HZ3 1 1 8 2389 1 1 3 TRP N N -0.886 6.108 -2.669 1.00 . A A . 3 TRP N 1 1 8 2390 1 1 3 TRP NE1 N -3.391 9.652 -2.628 1.00 . A A . 3 TRP NE1 1 1 8 2391 1 1 3 TRP O O -2.447 4.632 0.196 1.00 . A A . 3 TRP O 1 1 8 2392 1 1 4 ARG C C -4.180 2.882 -1.447 1.00 . A A . 4 ARG C 1 1 8 2393 1 1 4 ARG CA C -4.476 4.349 -1.666 1.00 . A A . 4 ARG CA 1 1 8 2394 1 1 4 ARG CB C -5.401 4.519 -2.865 1.00 . A A . 4 ARG CB 1 1 8 2395 1 1 4 ARG CD C -7.419 5.390 -1.653 1.00 . A A . 4 ARG CD 1 1 8 2396 1 1 4 ARG CG C -6.382 5.671 -2.728 1.00 . A A . 4 ARG CG 1 1 8 2397 1 1 4 ARG CZ C -9.528 6.403 -0.857 1.00 . A A . 4 ARG CZ 1 1 8 2398 1 1 4 ARG H H -3.086 5.564 -2.702 1.00 . A A . 4 ARG H 1 1 8 2399 1 1 4 ARG HA H -4.959 4.726 -0.788 1.00 . A A . 4 ARG HA 1 1 8 2400 1 1 4 ARG HB2 H -4.797 4.694 -3.745 1.00 . A A . 4 ARG HB2 1 1 8 2401 1 1 4 ARG HB3 H -5.957 3.607 -3.000 1.00 . A A . 4 ARG HB3 1 1 8 2402 1 1 4 ARG HD2 H -7.977 4.509 -1.932 1.00 . A A . 4 ARG HD2 1 1 8 2403 1 1 4 ARG HD3 H -6.911 5.210 -0.717 1.00 . A A . 4 ARG HD3 1 1 8 2404 1 1 4 ARG HE H -8.082 7.375 -1.847 1.00 . A A . 4 ARG HE 1 1 8 2405 1 1 4 ARG HG2 H -5.837 6.566 -2.463 1.00 . A A . 4 ARG HG2 1 1 8 2406 1 1 4 ARG HG3 H -6.884 5.819 -3.672 1.00 . A A . 4 ARG HG3 1 1 8 2407 1 1 4 ARG HH11 H -9.334 4.427 -0.444 1.00 . A A . 4 ARG HH11 1 1 8 2408 1 1 4 ARG HH12 H -10.804 5.155 0.110 1.00 . A A . 4 ARG HH12 1 1 8 2409 1 1 4 ARG HH21 H -10.025 8.354 -1.115 1.00 . A A . 4 ARG HH21 1 1 8 2410 1 1 4 ARG HH22 H -11.198 7.398 -0.274 1.00 . A A . 4 ARG HH22 1 1 8 2411 1 1 4 ARG N N -3.248 5.109 -1.849 1.00 . A A . 4 ARG N 1 1 8 2412 1 1 4 ARG NE N -8.352 6.505 -1.480 1.00 . A A . 4 ARG NE 1 1 8 2413 1 1 4 ARG NH1 N -9.921 5.235 -0.357 1.00 . A A . 4 ARG NH1 1 1 8 2414 1 1 4 ARG NH2 N -10.314 7.471 -0.739 1.00 . A A . 4 ARG NH2 1 1 8 2415 1 1 4 ARG O O -4.977 2.156 -0.857 1.00 . A A . 4 ARG O 1 1 8 2416 1 1 5 CYS C C -2.477 0.735 -0.294 1.00 . A A . 5 CYS C 1 1 8 2417 1 1 5 CYS CA C -2.588 1.087 -1.766 1.00 . A A . 5 CYS CA 1 1 8 2418 1 1 5 CYS CB C -1.233 0.878 -2.434 1.00 . A A . 5 CYS CB 1 1 8 2419 1 1 5 CYS H H -2.456 3.103 -2.394 1.00 . A A . 5 CYS H 1 1 8 2420 1 1 5 CYS HA H -3.317 0.442 -2.231 1.00 . A A . 5 CYS HA 1 1 8 2421 1 1 5 CYS HB2 H -0.664 1.793 -2.354 1.00 . A A . 5 CYS HB2 1 1 8 2422 1 1 5 CYS HB3 H -0.705 0.087 -1.920 1.00 . A A . 5 CYS HB3 1 1 8 2423 1 1 5 CYS N N -3.028 2.462 -1.921 1.00 . A A . 5 CYS N 1 1 8 2424 1 1 5 CYS O O -2.760 -0.388 0.109 1.00 . A A . 5 CYS O 1 1 8 2425 1 1 5 CYS SG S -1.330 0.429 -4.195 1.00 . A A . 5 CYS SG 1 1 8 2426 1 1 6 CYS C C -3.299 1.312 2.624 1.00 . A A . 6 CYS C 1 1 8 2427 1 1 6 CYS CA C -1.947 1.504 1.945 1.00 . A A . 6 CYS CA 1 1 8 2428 1 1 6 CYS CB C -1.185 2.669 2.572 1.00 . A A . 6 CYS CB 1 1 8 2429 1 1 6 CYS H H -1.970 2.625 0.138 1.00 . A A . 6 CYS H 1 1 8 2430 1 1 6 CYS HA H -1.371 0.597 2.074 1.00 . A A . 6 CYS HA 1 1 8 2431 1 1 6 CYS HB2 H -1.865 3.489 2.744 1.00 . A A . 6 CYS HB2 1 1 8 2432 1 1 6 CYS HB3 H -0.767 2.345 3.514 1.00 . A A . 6 CYS HB3 1 1 8 2433 1 1 6 CYS N N -2.114 1.720 0.513 1.00 . A A . 6 CYS N 1 1 8 2434 1 1 6 CYS O O -3.377 0.877 3.772 1.00 . A A . 6 CYS O 1 1 8 2435 1 1 6 CYS SG S 0.186 3.283 1.540 1.00 . A A . 6 CYS SG 1 1 8 2436 1 1 7 LEU C C -6.303 0.166 1.898 1.00 . A A . 7 LEU C 1 1 8 2437 1 1 7 LEU CA C -5.710 1.464 2.425 1.00 . A A . 7 LEU CA 1 1 8 2438 1 1 7 LEU CB C -6.591 2.655 2.034 1.00 . A A . 7 LEU CB 1 1 8 2439 1 1 7 LEU CD1 C -7.033 5.122 2.065 1.00 . A A . 7 LEU CD1 1 1 8 2440 1 1 7 LEU CD2 C -6.044 4.012 4.074 1.00 . A A . 7 LEU CD2 1 1 8 2441 1 1 7 LEU CG C -6.115 4.014 2.553 1.00 . A A . 7 LEU CG 1 1 8 2442 1 1 7 LEU H H -4.236 1.988 1.001 1.00 . A A . 7 LEU H 1 1 8 2443 1 1 7 LEU HA H -5.644 1.403 3.497 1.00 . A A . 7 LEU HA 1 1 8 2444 1 1 7 LEU HB2 H -6.640 2.701 0.956 1.00 . A A . 7 LEU HB2 1 1 8 2445 1 1 7 LEU HB3 H -7.586 2.479 2.416 1.00 . A A . 7 LEU HB3 1 1 8 2446 1 1 7 LEU HD11 H -6.680 6.072 2.438 1.00 . A A . 7 LEU HD11 1 1 8 2447 1 1 7 LEU HD12 H -8.036 4.943 2.424 1.00 . A A . 7 LEU HD12 1 1 8 2448 1 1 7 LEU HD13 H -7.035 5.137 0.985 1.00 . A A . 7 LEU HD13 1 1 8 2449 1 1 7 LEU HD21 H -5.353 3.250 4.401 1.00 . A A . 7 LEU HD21 1 1 8 2450 1 1 7 LEU HD22 H -7.024 3.806 4.479 1.00 . A A . 7 LEU HD22 1 1 8 2451 1 1 7 LEU HD23 H -5.706 4.978 4.420 1.00 . A A . 7 LEU HD23 1 1 8 2452 1 1 7 LEU HG H -5.123 4.210 2.171 1.00 . A A . 7 LEU HG 1 1 8 2453 1 1 7 LEU N N -4.362 1.629 1.906 1.00 . A A . 7 LEU N 1 1 8 2454 1 1 7 LEU O O -7.358 -0.282 2.338 1.00 . A A . 7 LEU O 1 1 8 2455 1 1 8 ILE C C -5.056 -2.810 0.781 1.00 . A A . 8 ILE C 1 1 8 2456 1 1 8 ILE CA C -6.004 -1.695 0.357 1.00 . A A . 8 ILE CA 1 1 8 2457 1 1 8 ILE CB C -6.017 -1.597 -1.185 1.00 . A A . 8 ILE CB 1 1 8 2458 1 1 8 ILE CD1 C -6.741 -0.084 -3.108 1.00 . A A . 8 ILE CD1 1 1 8 2459 1 1 8 ILE CG1 C -6.886 -0.418 -1.638 1.00 . A A . 8 ILE CG1 1 1 8 2460 1 1 8 ILE CG2 C -6.523 -2.896 -1.799 1.00 . A A . 8 ILE CG2 1 1 8 2461 1 1 8 ILE H H -4.727 -0.046 0.698 1.00 . A A . 8 ILE H 1 1 8 2462 1 1 8 ILE HA H -7.003 -1.925 0.700 1.00 . A A . 8 ILE HA 1 1 8 2463 1 1 8 ILE HB H -5.004 -1.438 -1.523 1.00 . A A . 8 ILE HB 1 1 8 2464 1 1 8 ILE HD11 H -7.382 0.750 -3.353 1.00 . A A . 8 ILE HD11 1 1 8 2465 1 1 8 ILE HD12 H -7.021 -0.941 -3.701 1.00 . A A . 8 ILE HD12 1 1 8 2466 1 1 8 ILE HD13 H -5.714 0.178 -3.317 1.00 . A A . 8 ILE HD13 1 1 8 2467 1 1 8 ILE HG12 H -7.923 -0.651 -1.453 1.00 . A A . 8 ILE HG12 1 1 8 2468 1 1 8 ILE HG13 H -6.613 0.459 -1.069 1.00 . A A . 8 ILE HG13 1 1 8 2469 1 1 8 ILE HG21 H -5.872 -3.708 -1.506 1.00 . A A . 8 ILE HG21 1 1 8 2470 1 1 8 ILE HG22 H -6.527 -2.809 -2.875 1.00 . A A . 8 ILE HG22 1 1 8 2471 1 1 8 ILE HG23 H -7.525 -3.095 -1.449 1.00 . A A . 8 ILE HG23 1 1 8 2472 1 1 8 ILE N N -5.584 -0.444 0.969 1.00 . A A . 8 ILE N 1 1 8 2473 1 1 8 ILE O O -3.913 -2.861 0.335 1.00 . A A . 8 ILE O 1 1 8 2474 1 1 9 PRO C C -3.913 -5.573 1.110 1.00 . A A . 9 PRO C 1 1 8 2475 1 1 9 PRO CA C -4.738 -4.843 2.170 1.00 . A A . 9 PRO CA 1 1 8 2476 1 1 9 PRO CB C -5.801 -5.775 2.748 1.00 . A A . 9 PRO CB 1 1 8 2477 1 1 9 PRO CD C -6.913 -3.736 2.176 1.00 . A A . 9 PRO CD 1 1 8 2478 1 1 9 PRO CG C -6.902 -4.867 3.168 1.00 . A A . 9 PRO CG 1 1 8 2479 1 1 9 PRO HA H -4.084 -4.517 2.964 1.00 . A A . 9 PRO HA 1 1 8 2480 1 1 9 PRO HB2 H -6.128 -6.470 1.988 1.00 . A A . 9 PRO HB2 1 1 8 2481 1 1 9 PRO HB3 H -5.394 -6.316 3.589 1.00 . A A . 9 PRO HB3 1 1 8 2482 1 1 9 PRO HD2 H -7.626 -3.932 1.389 1.00 . A A . 9 PRO HD2 1 1 8 2483 1 1 9 PRO HD3 H -7.143 -2.803 2.669 1.00 . A A . 9 PRO HD3 1 1 8 2484 1 1 9 PRO HG2 H -7.844 -5.395 3.144 1.00 . A A . 9 PRO HG2 1 1 8 2485 1 1 9 PRO HG3 H -6.709 -4.490 4.163 1.00 . A A . 9 PRO HG3 1 1 8 2486 1 1 9 PRO N N -5.534 -3.723 1.643 1.00 . A A . 9 PRO N 1 1 8 2487 1 1 9 PRO O O -2.786 -5.984 1.376 1.00 . A A . 9 PRO O 1 1 8 2488 1 1 10 ALA C C -2.564 -5.626 -1.672 1.00 . A A . 10 ALA C 1 1 8 2489 1 1 10 ALA CA C -3.789 -6.400 -1.179 1.00 . A A . 10 ALA CA 1 1 8 2490 1 1 10 ALA CB C -4.756 -6.643 -2.327 1.00 . A A . 10 ALA CB 1 1 8 2491 1 1 10 ALA H H -5.363 -5.342 -0.241 1.00 . A A . 10 ALA H 1 1 8 2492 1 1 10 ALA HA H -3.464 -7.361 -0.809 1.00 . A A . 10 ALA HA 1 1 8 2493 1 1 10 ALA HB1 H -5.615 -7.189 -1.967 1.00 . A A . 10 ALA HB1 1 1 8 2494 1 1 10 ALA HB2 H -4.262 -7.216 -3.098 1.00 . A A . 10 ALA HB2 1 1 8 2495 1 1 10 ALA HB3 H -5.078 -5.694 -2.734 1.00 . A A . 10 ALA HB3 1 1 8 2496 1 1 10 ALA N N -4.470 -5.711 -0.088 1.00 . A A . 10 ALA N 1 1 8 2497 1 1 10 ALA O O -1.533 -6.219 -1.984 1.00 . A A . 10 ALA O 1 1 8 2498 1 1 11 CYS C C -0.636 -3.095 -1.050 1.00 . A A . 11 CYS C 1 1 8 2499 1 1 11 CYS CA C -1.561 -3.482 -2.200 1.00 . A A . 11 CYS CA 1 1 8 2500 1 1 11 CYS CB C -2.092 -2.231 -2.908 1.00 . A A . 11 CYS CB 1 1 8 2501 1 1 11 CYS H H -3.489 -3.871 -1.404 1.00 . A A . 11 CYS H 1 1 8 2502 1 1 11 CYS HA H -1.000 -4.073 -2.909 1.00 . A A . 11 CYS HA 1 1 8 2503 1 1 11 CYS HB2 H -3.034 -2.466 -3.380 1.00 . A A . 11 CYS HB2 1 1 8 2504 1 1 11 CYS HB3 H -2.246 -1.451 -2.176 1.00 . A A . 11 CYS HB3 1 1 8 2505 1 1 11 CYS N N -2.666 -4.304 -1.719 1.00 . A A . 11 CYS N 1 1 8 2506 1 1 11 CYS O O 0.576 -2.961 -1.229 1.00 . A A . 11 CYS O 1 1 8 2507 1 1 11 CYS SG S -0.976 -1.572 -4.196 1.00 . A A . 11 CYS SG 1 1 8 2508 1 1 12 ARG C C 0.498 -3.679 1.718 1.00 . A A . 12 ARG C 1 1 8 2509 1 1 12 ARG CA C -0.453 -2.563 1.324 1.00 . A A . 12 ARG CA 1 1 8 2510 1 1 12 ARG CB C -1.398 -2.263 2.483 1.00 . A A . 12 ARG CB 1 1 8 2511 1 1 12 ARG CD C -1.690 -1.360 4.817 1.00 . A A . 12 ARG CD 1 1 8 2512 1 1 12 ARG CG C -0.698 -1.722 3.722 1.00 . A A . 12 ARG CG 1 1 8 2513 1 1 12 ARG CZ C -3.859 -2.449 5.289 1.00 . A A . 12 ARG CZ 1 1 8 2514 1 1 12 ARG H H -2.188 -3.048 0.210 1.00 . A A . 12 ARG H 1 1 8 2515 1 1 12 ARG HA H 0.121 -1.677 1.094 1.00 . A A . 12 ARG HA 1 1 8 2516 1 1 12 ARG HB2 H -2.124 -1.541 2.155 1.00 . A A . 12 ARG HB2 1 1 8 2517 1 1 12 ARG HB3 H -1.910 -3.169 2.755 1.00 . A A . 12 ARG HB3 1 1 8 2518 1 1 12 ARG HD2 H -1.141 -1.014 5.678 1.00 . A A . 12 ARG HD2 1 1 8 2519 1 1 12 ARG HD3 H -2.328 -0.567 4.456 1.00 . A A . 12 ARG HD3 1 1 8 2520 1 1 12 ARG HE H -2.065 -3.329 5.454 1.00 . A A . 12 ARG HE 1 1 8 2521 1 1 12 ARG HG2 H -0.023 -2.476 4.097 1.00 . A A . 12 ARG HG2 1 1 8 2522 1 1 12 ARG HG3 H -0.138 -0.839 3.449 1.00 . A A . 12 ARG HG3 1 1 8 2523 1 1 12 ARG HH11 H -3.999 -0.531 4.624 1.00 . A A . 12 ARG HH11 1 1 8 2524 1 1 12 ARG HH12 H -5.509 -1.303 5.000 1.00 . A A . 12 ARG HH12 1 1 8 2525 1 1 12 ARG HH21 H -4.057 -4.353 5.958 1.00 . A A . 12 ARG HH21 1 1 8 2526 1 1 12 ARG HH22 H -5.540 -3.480 5.765 1.00 . A A . 12 ARG HH22 1 1 8 2527 1 1 12 ARG N N -1.213 -2.930 0.134 1.00 . A A . 12 ARG N 1 1 8 2528 1 1 12 ARG NE N -2.525 -2.496 5.214 1.00 . A A . 12 ARG NE 1 1 8 2529 1 1 12 ARG NH1 N -4.510 -1.342 4.944 1.00 . A A . 12 ARG NH1 1 1 8 2530 1 1 12 ARG NH2 N -4.540 -3.515 5.701 1.00 . A A . 12 ARG NH2 1 1 8 2531 1 1 12 ARG O O 1.566 -3.434 2.265 1.00 . A A . 12 ARG O 1 1 8 2532 1 1 13 ARG C C 2.192 -6.082 0.952 1.00 . A A . 13 ARG C 1 1 8 2533 1 1 13 ARG CA C 0.904 -6.071 1.768 1.00 . A A . 13 ARG CA 1 1 8 2534 1 1 13 ARG CB C 0.121 -7.362 1.523 1.00 . A A . 13 ARG CB 1 1 8 2535 1 1 13 ARG CD C 0.781 -8.512 3.658 1.00 . A A . 13 ARG CD 1 1 8 2536 1 1 13 ARG CG C -0.375 -8.020 2.799 1.00 . A A . 13 ARG CG 1 1 8 2537 1 1 13 ARG CZ C 2.755 -9.828 2.954 1.00 . A A . 13 ARG CZ 1 1 8 2538 1 1 13 ARG H H -0.795 -5.030 1.036 1.00 . A A . 13 ARG H 1 1 8 2539 1 1 13 ARG HA H 1.163 -6.011 2.812 1.00 . A A . 13 ARG HA 1 1 8 2540 1 1 13 ARG HB2 H -0.733 -7.137 0.901 1.00 . A A . 13 ARG HB2 1 1 8 2541 1 1 13 ARG HB3 H 0.758 -8.064 1.005 1.00 . A A . 13 ARG HB3 1 1 8 2542 1 1 13 ARG HD2 H 1.509 -7.719 3.748 1.00 . A A . 13 ARG HD2 1 1 8 2543 1 1 13 ARG HD3 H 0.402 -8.764 4.637 1.00 . A A . 13 ARG HD3 1 1 8 2544 1 1 13 ARG HE H 0.849 -10.425 2.789 1.00 . A A . 13 ARG HE 1 1 8 2545 1 1 13 ARG HG2 H -0.951 -7.302 3.364 1.00 . A A . 13 ARG HG2 1 1 8 2546 1 1 13 ARG HG3 H -1.002 -8.861 2.539 1.00 . A A . 13 ARG HG3 1 1 8 2547 1 1 13 ARG HH11 H 3.194 -7.994 3.694 1.00 . A A . 13 ARG HH11 1 1 8 2548 1 1 13 ARG HH12 H 4.561 -8.943 3.222 1.00 . A A . 13 ARG HH12 1 1 8 2549 1 1 13 ARG HH21 H 2.654 -11.691 2.161 1.00 . A A . 13 ARG HH21 1 1 8 2550 1 1 13 ARG HH22 H 4.253 -11.055 2.348 1.00 . A A . 13 ARG HH22 1 1 8 2551 1 1 13 ARG N N 0.088 -4.905 1.448 1.00 . A A . 13 ARG N 1 1 8 2552 1 1 13 ARG NE N 1.433 -9.691 3.083 1.00 . A A . 13 ARG NE 1 1 8 2553 1 1 13 ARG NH1 N 3.569 -8.843 3.321 1.00 . A A . 13 ARG NH1 1 1 8 2554 1 1 13 ARG NH2 N 3.261 -10.947 2.446 1.00 . A A . 13 ARG NH2 1 1 8 2555 1 1 13 ARG O O 3.232 -6.538 1.427 1.00 . A A . 13 ARG O 1 1 8 2556 1 1 14 ASN C C 4.056 -4.222 -0.949 1.00 . A A . 14 ASN C 1 1 8 2557 1 1 14 ASN CA C 3.277 -5.520 -1.149 1.00 . A A . 14 ASN CA 1 1 8 2558 1 1 14 ASN CB C 2.826 -5.651 -2.612 1.00 . A A . 14 ASN CB 1 1 8 2559 1 1 14 ASN CG C 3.921 -5.316 -3.610 1.00 . A A . 14 ASN CG 1 1 8 2560 1 1 14 ASN H H 1.262 -5.213 -0.582 1.00 . A A . 14 ASN H 1 1 8 2561 1 1 14 ASN HA H 3.918 -6.354 -0.903 1.00 . A A . 14 ASN HA 1 1 8 2562 1 1 14 ASN HB2 H 2.505 -6.666 -2.791 1.00 . A A . 14 ASN HB2 1 1 8 2563 1 1 14 ASN HB3 H 1.994 -4.984 -2.782 1.00 . A A . 14 ASN HB3 1 1 8 2564 1 1 14 ASN HD21 H 4.580 -7.189 -3.567 1.00 . A A . 14 ASN HD21 1 1 8 2565 1 1 14 ASN HD22 H 5.444 -6.112 -4.603 1.00 . A A . 14 ASN HD22 1 1 8 2566 1 1 14 ASN N N 2.119 -5.568 -0.265 1.00 . A A . 14 ASN N 1 1 8 2567 1 1 14 ASN ND2 N 4.729 -6.306 -3.962 1.00 . A A . 14 ASN ND2 1 1 8 2568 1 1 14 ASN O O 5.270 -4.172 -1.141 1.00 . A A . 14 ASN O 1 1 8 2569 1 1 14 ASN OD1 O 4.034 -4.178 -4.068 1.00 . A A . 14 ASN OD1 1 1 8 2570 1 1 15 HIS C C 4.037 -1.526 1.156 1.00 . A A . 15 HIS C 1 1 8 2571 1 1 15 HIS CA C 3.987 -1.882 -0.322 1.00 . A A . 15 HIS CA 1 1 8 2572 1 1 15 HIS CB C 3.240 -0.793 -1.099 1.00 . A A . 15 HIS CB 1 1 8 2573 1 1 15 HIS CD2 C 2.344 -1.436 -3.448 1.00 . A A . 15 HIS CD2 1 1 8 2574 1 1 15 HIS CE1 C 4.127 -0.948 -4.621 1.00 . A A . 15 HIS CE1 1 1 8 2575 1 1 15 HIS CG C 3.282 -0.977 -2.587 1.00 . A A . 15 HIS CG 1 1 8 2576 1 1 15 HIS H H 2.398 -3.289 -0.340 1.00 . A A . 15 HIS H 1 1 8 2577 1 1 15 HIS HA H 4.998 -1.945 -0.696 1.00 . A A . 15 HIS HA 1 1 8 2578 1 1 15 HIS HB2 H 2.204 -0.791 -0.796 1.00 . A A . 15 HIS HB2 1 1 8 2579 1 1 15 HIS HB3 H 3.679 0.167 -0.870 1.00 . A A . 15 HIS HB3 1 1 8 2580 1 1 15 HIS HD1 H 5.240 -0.329 -3.020 1.00 . A A . 15 HIS HD1 1 1 8 2581 1 1 15 HIS HD2 H 1.346 -1.764 -3.192 1.00 . A A . 15 HIS HD2 1 1 8 2582 1 1 15 HIS HE1 H 4.809 -0.813 -5.447 1.00 . A A . 15 HIS HE1 1 1 8 2583 1 1 15 HIS HE2 H 2.526 -1.873 -5.488 1.00 . A A . 15 HIS HE2 1 1 8 2584 1 1 15 HIS N N 3.358 -3.180 -0.529 1.00 . A A . 15 HIS N 1 1 8 2585 1 1 15 HIS ND1 N 4.389 -0.679 -3.354 1.00 . A A . 15 HIS ND1 1 1 8 2586 1 1 15 HIS NE2 N 2.893 -1.409 -4.706 1.00 . A A . 15 HIS NE2 1 1 8 2587 1 1 15 HIS O O 3.957 -0.355 1.524 1.00 . A A . 15 HIS O 1 1 8 2588 1 1 16 LYS C C 5.507 -1.544 3.824 1.00 . A A . 16 LYS C 1 1 8 2589 1 1 16 LYS CA C 4.253 -2.324 3.443 1.00 . A A . 16 LYS CA 1 1 8 2590 1 1 16 LYS CB C 4.210 -3.662 4.189 1.00 . A A . 16 LYS CB 1 1 8 2591 1 1 16 LYS CD C 4.893 -3.475 6.610 1.00 . A A . 16 LYS CD 1 1 8 2592 1 1 16 LYS CE C 4.594 -2.542 7.777 1.00 . A A . 16 LYS CE 1 1 8 2593 1 1 16 LYS CG C 3.729 -3.542 5.630 1.00 . A A . 16 LYS CG 1 1 8 2594 1 1 16 LYS H H 4.261 -3.449 1.647 1.00 . A A . 16 LYS H 1 1 8 2595 1 1 16 LYS HA H 3.388 -1.740 3.721 1.00 . A A . 16 LYS HA 1 1 8 2596 1 1 16 LYS HB2 H 3.545 -4.333 3.665 1.00 . A A . 16 LYS HB2 1 1 8 2597 1 1 16 LYS HB3 H 5.202 -4.088 4.198 1.00 . A A . 16 LYS HB3 1 1 8 2598 1 1 16 LYS HD2 H 5.083 -4.465 6.996 1.00 . A A . 16 LYS HD2 1 1 8 2599 1 1 16 LYS HD3 H 5.769 -3.116 6.090 1.00 . A A . 16 LYS HD3 1 1 8 2600 1 1 16 LYS HE2 H 3.638 -2.810 8.198 1.00 . A A . 16 LYS HE2 1 1 8 2601 1 1 16 LYS HE3 H 5.364 -2.665 8.524 1.00 . A A . 16 LYS HE3 1 1 8 2602 1 1 16 LYS HG2 H 3.140 -2.643 5.727 1.00 . A A . 16 LYS HG2 1 1 8 2603 1 1 16 LYS HG3 H 3.119 -4.400 5.868 1.00 . A A . 16 LYS HG3 1 1 8 2604 1 1 16 LYS HZ1 H 3.596 -0.857 7.032 1.00 . A A . 16 LYS HZ1 1 1 8 2605 1 1 16 LYS HZ2 H 5.223 -0.952 6.567 1.00 . A A . 16 LYS HZ2 1 1 8 2606 1 1 16 LYS HZ3 H 4.816 -0.497 8.145 1.00 . A A . 16 LYS HZ3 1 1 8 2607 1 1 16 LYS N N 4.196 -2.537 2.000 1.00 . A A . 16 LYS N 1 1 8 2608 1 1 16 LYS NZ N 4.553 -1.113 7.353 1.00 . A A . 16 LYS NZ 1 1 8 2609 1 1 16 LYS O O 5.569 -0.927 4.887 1.00 . A A . 16 LYS O 1 1 8 2610 1 1 17 LYS C C 7.530 0.632 3.041 1.00 . A A . 17 LYS C 1 1 8 2611 1 1 17 LYS CA C 7.746 -0.865 3.189 1.00 . A A . 17 LYS CA 1 1 8 2612 1 1 17 LYS CB C 8.824 -1.333 2.213 1.00 . A A . 17 LYS CB 1 1 8 2613 1 1 17 LYS CD C 11.262 -1.825 1.806 1.00 . A A . 17 LYS CD 1 1 8 2614 1 1 17 LYS CE C 11.118 -3.302 1.468 1.00 . A A . 17 LYS CE 1 1 8 2615 1 1 17 LYS CG C 10.220 -1.373 2.818 1.00 . A A . 17 LYS CG 1 1 8 2616 1 1 17 LYS H H 6.392 -2.090 2.123 1.00 . A A . 17 LYS H 1 1 8 2617 1 1 17 LYS HA H 8.061 -1.074 4.197 1.00 . A A . 17 LYS HA 1 1 8 2618 1 1 17 LYS HB2 H 8.572 -2.323 1.866 1.00 . A A . 17 LYS HB2 1 1 8 2619 1 1 17 LYS HB3 H 8.842 -0.662 1.367 1.00 . A A . 17 LYS HB3 1 1 8 2620 1 1 17 LYS HD2 H 11.146 -1.248 0.901 1.00 . A A . 17 LYS HD2 1 1 8 2621 1 1 17 LYS HD3 H 12.247 -1.655 2.218 1.00 . A A . 17 LYS HD3 1 1 8 2622 1 1 17 LYS HE2 H 11.185 -3.875 2.381 1.00 . A A . 17 LYS HE2 1 1 8 2623 1 1 17 LYS HE3 H 10.150 -3.461 1.016 1.00 . A A . 17 LYS HE3 1 1 8 2624 1 1 17 LYS HG2 H 10.477 -0.384 3.167 1.00 . A A . 17 LYS HG2 1 1 8 2625 1 1 17 LYS HG3 H 10.219 -2.060 3.652 1.00 . A A . 17 LYS HG3 1 1 8 2626 1 1 17 LYS HZ1 H 13.115 -3.633 0.953 1.00 . A A . 17 LYS HZ1 1 1 8 2627 1 1 17 LYS HZ2 H 12.129 -3.219 -0.359 1.00 . A A . 17 LYS HZ2 1 1 8 2628 1 1 17 LYS HZ3 H 12.044 -4.771 0.308 1.00 . A A . 17 LYS HZ3 1 1 8 2629 1 1 17 LYS N N 6.501 -1.576 2.949 1.00 . A A . 17 LYS N 1 1 8 2630 1 1 17 LYS NZ N 12.175 -3.764 0.526 1.00 . A A . 17 LYS NZ 1 1 8 2631 1 1 17 LYS O O 8.125 1.430 3.757 1.00 . A A . 17 LYS O 1 1 8 2632 1 1 18 PHE C C 5.320 2.893 2.854 1.00 . A A . 18 PHE C 1 1 8 2633 1 1 18 PHE CA C 6.359 2.393 1.856 1.00 . A A . 18 PHE CA 1 1 8 2634 1 1 18 PHE CB C 5.842 2.574 0.425 1.00 . A A . 18 PHE CB 1 1 8 2635 1 1 18 PHE CD1 C 5.600 5.069 0.238 1.00 . A A . 18 PHE CD1 1 1 8 2636 1 1 18 PHE CD2 C 7.161 3.969 -1.190 1.00 . A A . 18 PHE CD2 1 1 8 2637 1 1 18 PHE CE1 C 5.935 6.285 -0.325 1.00 . A A . 18 PHE CE1 1 1 8 2638 1 1 18 PHE CE2 C 7.501 5.184 -1.758 1.00 . A A . 18 PHE CE2 1 1 8 2639 1 1 18 PHE CG C 6.207 3.898 -0.188 1.00 . A A . 18 PHE CG 1 1 8 2640 1 1 18 PHE CZ C 6.887 6.342 -1.324 1.00 . A A . 18 PHE CZ 1 1 8 2641 1 1 18 PHE H H 6.219 0.302 1.582 1.00 . A A . 18 PHE H 1 1 8 2642 1 1 18 PHE HA H 7.267 2.962 1.980 1.00 . A A . 18 PHE HA 1 1 8 2643 1 1 18 PHE HB2 H 6.255 1.796 -0.199 1.00 . A A . 18 PHE HB2 1 1 8 2644 1 1 18 PHE HB3 H 4.765 2.494 0.426 1.00 . A A . 18 PHE HB3 1 1 8 2645 1 1 18 PHE HD1 H 4.855 5.024 1.019 1.00 . A A . 18 PHE HD1 1 1 8 2646 1 1 18 PHE HD2 H 7.641 3.064 -1.531 1.00 . A A . 18 PHE HD2 1 1 8 2647 1 1 18 PHE HE1 H 5.453 7.189 0.016 1.00 . A A . 18 PHE HE1 1 1 8 2648 1 1 18 PHE HE2 H 8.246 5.226 -2.538 1.00 . A A . 18 PHE HE2 1 1 8 2649 1 1 18 PHE HZ H 7.151 7.292 -1.766 1.00 . A A . 18 PHE HZ 1 1 8 2650 1 1 18 PHE N N 6.666 0.994 2.107 1.00 . A A . 18 PHE N 1 1 8 2651 1 1 18 PHE O O 5.439 3.991 3.395 1.00 . A A . 18 PHE O 1 1 8 2652 1 1 19 CYS C C 3.605 1.992 5.450 1.00 . A A . 19 CYS C 1 1 8 2653 1 1 19 CYS CA C 3.254 2.451 4.037 1.00 . A A . 19 CYS CA 1 1 8 2654 1 1 19 CYS CB C 1.907 1.870 3.597 1.00 . A A . 19 CYS CB 1 1 8 2655 1 1 19 CYS H H 4.272 1.201 2.660 1.00 . A A . 19 CYS H 1 1 8 2656 1 1 19 CYS HA H 3.187 3.529 4.035 1.00 . A A . 19 CYS HA 1 1 8 2657 1 1 19 CYS HB2 H 1.830 0.849 3.930 1.00 . A A . 19 CYS HB2 1 1 8 2658 1 1 19 CYS HB3 H 1.114 2.447 4.050 1.00 . A A . 19 CYS HB3 1 1 8 2659 1 1 19 CYS N N 4.307 2.076 3.106 1.00 . A A . 19 CYS N 1 1 8 2660 1 1 19 CYS O O 3.168 0.928 5.904 1.00 . A A . 19 CYS O 1 1 8 2661 1 1 19 CYS SG S 1.640 1.889 1.793 1.00 . A A . 19 CYS SG 1 1 8 2662 1 1 20 NH2 HN1 H 4.710 3.620 5.714 1.00 . A A . 20 NH2 HN1 1 1 8 2663 1 1 20 NH2 HN2 H 4.650 2.527 7.051 1.00 . A A . 20 NH2 HN2 1 1 8 2664 1 1 20 NH2 N N 4.402 2.792 6.143 1.00 . A A . 20 NH2 N 1 1 9 2665 1 1 1 PHE C C 1.616 6.489 -5.221 1.00 . A A . 1 PHE C 1 1 9 2666 1 1 1 PHE CA C 3.102 6.468 -5.549 1.00 . A A . 1 PHE CA 1 1 9 2667 1 1 1 PHE CB C 3.927 6.355 -4.258 1.00 . A A . 1 PHE CB 1 1 9 2668 1 1 1 PHE CD1 C 3.850 3.897 -3.741 1.00 . A A . 1 PHE CD1 1 1 9 2669 1 1 1 PHE CD2 C 2.849 5.412 -2.194 1.00 . A A . 1 PHE CD2 1 1 9 2670 1 1 1 PHE CE1 C 3.488 2.833 -2.936 1.00 . A A . 1 PHE CE1 1 1 9 2671 1 1 1 PHE CE2 C 2.484 4.352 -1.387 1.00 . A A . 1 PHE CE2 1 1 9 2672 1 1 1 PHE CG C 3.536 5.197 -3.380 1.00 . A A . 1 PHE CG 1 1 9 2673 1 1 1 PHE CZ C 2.803 3.061 -1.759 1.00 . A A . 1 PHE CZ 1 1 9 2674 1 1 1 PHE H1 H 4.495 7.715 -6.468 1.00 . A A . 1 PHE H1 1 1 9 2675 1 1 1 PHE H2 H 3.217 8.537 -5.723 1.00 . A A . 1 PHE H2 1 1 9 2676 1 1 1 PHE H3 H 2.966 7.738 -7.192 1.00 . A A . 1 PHE H3 1 1 9 2677 1 1 1 PHE HA H 3.309 5.616 -6.181 1.00 . A A . 1 PHE HA 1 1 9 2678 1 1 1 PHE HB2 H 4.969 6.234 -4.517 1.00 . A A . 1 PHE HB2 1 1 9 2679 1 1 1 PHE HB3 H 3.809 7.263 -3.685 1.00 . A A . 1 PHE HB3 1 1 9 2680 1 1 1 PHE HD1 H 4.385 3.716 -4.661 1.00 . A A . 1 PHE HD1 1 1 9 2681 1 1 1 PHE HD2 H 2.598 6.421 -1.903 1.00 . A A . 1 PHE HD2 1 1 9 2682 1 1 1 PHE HE1 H 3.739 1.824 -3.228 1.00 . A A . 1 PHE HE1 1 1 9 2683 1 1 1 PHE HE2 H 1.950 4.533 -0.466 1.00 . A A . 1 PHE HE2 1 1 9 2684 1 1 1 PHE HZ H 2.519 2.231 -1.129 1.00 . A A . 1 PHE HZ 1 1 9 2685 1 1 1 PHE N N 3.473 7.699 -6.285 1.00 . A A . 1 PHE N 1 1 9 2686 1 1 1 PHE O O 1.054 7.547 -4.953 1.00 . A A . 1 PHE O 1 1 9 2687 1 1 2 ASN C C -0.634 4.968 -3.470 1.00 . A A . 2 ASN C 1 1 9 2688 1 1 2 ASN CA C -0.437 5.218 -4.959 1.00 . A A . 2 ASN CA 1 1 9 2689 1 1 2 ASN CB C -1.079 4.085 -5.766 1.00 . A A . 2 ASN CB 1 1 9 2690 1 1 2 ASN CG C -2.579 3.990 -5.548 1.00 . A A . 2 ASN CG 1 1 9 2691 1 1 2 ASN H H 1.482 4.513 -5.491 1.00 . A A . 2 ASN H 1 1 9 2692 1 1 2 ASN HA H -0.907 6.154 -5.223 1.00 . A A . 2 ASN HA 1 1 9 2693 1 1 2 ASN HB2 H -0.897 4.253 -6.817 1.00 . A A . 2 ASN HB2 1 1 9 2694 1 1 2 ASN HB3 H -0.631 3.147 -5.473 1.00 . A A . 2 ASN HB3 1 1 9 2695 1 1 2 ASN HD21 H -2.494 2.007 -5.667 1.00 . A A . 2 ASN HD21 1 1 9 2696 1 1 2 ASN HD22 H -4.062 2.680 -5.399 1.00 . A A . 2 ASN HD22 1 1 9 2697 1 1 2 ASN N N 0.983 5.324 -5.261 1.00 . A A . 2 ASN N 1 1 9 2698 1 1 2 ASN ND2 N -3.100 2.771 -5.536 1.00 . A A . 2 ASN ND2 1 1 9 2699 1 1 2 ASN O O -0.632 3.823 -3.020 1.00 . A A . 2 ASN O 1 1 9 2700 1 1 2 ASN OD1 O -3.264 5.001 -5.382 1.00 . A A . 2 ASN OD1 1 1 9 2701 1 1 3 TRP C C -2.247 5.161 -0.926 1.00 . A A . 3 TRP C 1 1 9 2702 1 1 3 TRP CA C -0.993 5.961 -1.265 1.00 . A A . 3 TRP CA 1 1 9 2703 1 1 3 TRP CB C -1.077 7.364 -0.653 1.00 . A A . 3 TRP CB 1 1 9 2704 1 1 3 TRP CD1 C -1.923 9.044 -2.399 1.00 . A A . 3 TRP CD1 1 1 9 2705 1 1 3 TRP CD2 C -3.463 8.436 -0.892 1.00 . A A . 3 TRP CD2 1 1 9 2706 1 1 3 TRP CE2 C -4.047 9.350 -1.787 1.00 . A A . 3 TRP CE2 1 1 9 2707 1 1 3 TRP CE3 C -4.244 7.916 0.145 1.00 . A A . 3 TRP CE3 1 1 9 2708 1 1 3 TRP CG C -2.102 8.249 -1.303 1.00 . A A . 3 TRP CG 1 1 9 2709 1 1 3 TRP CH2 C -6.116 9.231 -0.653 1.00 . A A . 3 TRP CH2 1 1 9 2710 1 1 3 TRP CZ2 C -5.376 9.756 -1.677 1.00 . A A . 3 TRP CZ2 1 1 9 2711 1 1 3 TRP CZ3 C -5.562 8.319 0.253 1.00 . A A . 3 TRP CZ3 1 1 9 2712 1 1 3 TRP H H -0.781 6.931 -3.136 1.00 . A A . 3 TRP H 1 1 9 2713 1 1 3 TRP HA H -0.139 5.450 -0.851 1.00 . A A . 3 TRP HA 1 1 9 2714 1 1 3 TRP HB2 H -1.331 7.278 0.393 1.00 . A A . 3 TRP HB2 1 1 9 2715 1 1 3 TRP HB3 H -0.114 7.846 -0.745 1.00 . A A . 3 TRP HB3 1 1 9 2716 1 1 3 TRP HD1 H -0.995 9.127 -2.945 1.00 . A A . 3 TRP HD1 1 1 9 2717 1 1 3 TRP HE1 H -3.212 10.331 -3.443 1.00 . A A . 3 TRP HE1 1 1 9 2718 1 1 3 TRP HE3 H -3.835 7.212 0.853 1.00 . A A . 3 TRP HE3 1 1 9 2719 1 1 3 TRP HH2 H -7.149 9.518 -0.530 1.00 . A A . 3 TRP HH2 1 1 9 2720 1 1 3 TRP HZ2 H -5.818 10.458 -2.368 1.00 . A A . 3 TRP HZ2 1 1 9 2721 1 1 3 TRP HZ3 H -6.179 7.929 1.048 1.00 . A A . 3 TRP HZ3 1 1 9 2722 1 1 3 TRP N N -0.797 6.047 -2.712 1.00 . A A . 3 TRP N 1 1 9 2723 1 1 3 TRP NE1 N -3.089 9.704 -2.700 1.00 . A A . 3 TRP NE1 1 1 9 2724 1 1 3 TRP O O -2.377 4.610 0.167 1.00 . A A . 3 TRP O 1 1 9 2725 1 1 4 ARG C C -4.143 2.882 -1.478 1.00 . A A . 4 ARG C 1 1 9 2726 1 1 4 ARG CA C -4.403 4.355 -1.718 1.00 . A A . 4 ARG CA 1 1 9 2727 1 1 4 ARG CB C -5.286 4.531 -2.944 1.00 . A A . 4 ARG CB 1 1 9 2728 1 1 4 ARG CD C -6.514 6.266 -4.279 1.00 . A A . 4 ARG CD 1 1 9 2729 1 1 4 ARG CG C -6.178 5.758 -2.886 1.00 . A A . 4 ARG CG 1 1 9 2730 1 1 4 ARG CZ C -7.051 4.829 -6.220 1.00 . A A . 4 ARG CZ 1 1 9 2731 1 1 4 ARG H H -2.976 5.531 -2.739 1.00 . A A . 4 ARG H 1 1 9 2732 1 1 4 ARG HA H -4.899 4.754 -0.858 1.00 . A A . 4 ARG HA 1 1 9 2733 1 1 4 ARG HB2 H -4.652 4.616 -3.816 1.00 . A A . 4 ARG HB2 1 1 9 2734 1 1 4 ARG HB3 H -5.906 3.657 -3.048 1.00 . A A . 4 ARG HB3 1 1 9 2735 1 1 4 ARG HD2 H -7.031 7.209 -4.188 1.00 . A A . 4 ARG HD2 1 1 9 2736 1 1 4 ARG HD3 H -5.594 6.413 -4.825 1.00 . A A . 4 ARG HD3 1 1 9 2737 1 1 4 ARG HE H -8.219 5.081 -4.610 1.00 . A A . 4 ARG HE 1 1 9 2738 1 1 4 ARG HG2 H -7.094 5.501 -2.376 1.00 . A A . 4 ARG HG2 1 1 9 2739 1 1 4 ARG HG3 H -5.666 6.537 -2.341 1.00 . A A . 4 ARG HG3 1 1 9 2740 1 1 4 ARG HH11 H -5.225 5.712 -6.309 1.00 . A A . 4 ARG HH11 1 1 9 2741 1 1 4 ARG HH12 H -5.648 4.747 -7.684 1.00 . A A . 4 ARG HH12 1 1 9 2742 1 1 4 ARG HH21 H -8.780 3.788 -6.418 1.00 . A A . 4 ARG HH21 1 1 9 2743 1 1 4 ARG HH22 H -7.675 3.645 -7.744 1.00 . A A . 4 ARG HH22 1 1 9 2744 1 1 4 ARG N N -3.155 5.083 -1.889 1.00 . A A . 4 ARG N 1 1 9 2745 1 1 4 ARG NE N -7.362 5.330 -5.022 1.00 . A A . 4 ARG NE 1 1 9 2746 1 1 4 ARG NH1 N -5.881 5.117 -6.783 1.00 . A A . 4 ARG NH1 1 1 9 2747 1 1 4 ARG NH2 N -7.903 4.022 -6.844 1.00 . A A . 4 ARG NH2 1 1 9 2748 1 1 4 ARG O O -4.960 2.178 -0.891 1.00 . A A . 4 ARG O 1 1 9 2749 1 1 5 CYS C C -2.493 0.715 -0.292 1.00 . A A . 5 CYS C 1 1 9 2750 1 1 5 CYS CA C -2.587 1.052 -1.769 1.00 . A A . 5 CYS CA 1 1 9 2751 1 1 5 CYS CB C -1.233 0.811 -2.424 1.00 . A A . 5 CYS CB 1 1 9 2752 1 1 5 CYS H H -2.414 3.056 -2.419 1.00 . A A . 5 CYS H 1 1 9 2753 1 1 5 CYS HA H -3.326 0.417 -2.232 1.00 . A A . 5 CYS HA 1 1 9 2754 1 1 5 CYS HB2 H -0.641 1.710 -2.336 1.00 . A A . 5 CYS HB2 1 1 9 2755 1 1 5 CYS HB3 H -0.731 0.005 -1.909 1.00 . A A . 5 CYS HB3 1 1 9 2756 1 1 5 CYS N N -3.000 2.433 -1.942 1.00 . A A . 5 CYS N 1 1 9 2757 1 1 5 CYS O O -2.798 -0.399 0.121 1.00 . A A . 5 CYS O 1 1 9 2758 1 1 5 CYS SG S -1.326 0.372 -4.189 1.00 . A A . 5 CYS SG 1 1 9 2759 1 1 6 CYS C C -3.329 1.313 2.606 1.00 . A A . 6 CYS C 1 1 9 2760 1 1 6 CYS CA C -1.969 1.501 1.942 1.00 . A A . 6 CYS CA 1 1 9 2761 1 1 6 CYS CB C -1.216 2.674 2.567 1.00 . A A . 6 CYS CB 1 1 9 2762 1 1 6 CYS H H -1.958 2.601 0.123 1.00 . A A . 6 CYS H 1 1 9 2763 1 1 6 CYS HA H -1.391 0.597 2.086 1.00 . A A . 6 CYS HA 1 1 9 2764 1 1 6 CYS HB2 H -1.899 3.495 2.722 1.00 . A A . 6 CYS HB2 1 1 9 2765 1 1 6 CYS HB3 H -0.810 2.362 3.518 1.00 . A A . 6 CYS HB3 1 1 9 2766 1 1 6 CYS N N -2.119 1.703 0.507 1.00 . A A . 6 CYS N 1 1 9 2767 1 1 6 CYS O O -3.421 0.868 3.751 1.00 . A A . 6 CYS O 1 1 9 2768 1 1 6 CYS SG S 0.168 3.282 1.546 1.00 . A A . 6 CYS SG 1 1 9 2769 1 1 7 LEU C C -6.305 0.152 1.913 1.00 . A A . 7 LEU C 1 1 9 2770 1 1 7 LEU CA C -5.738 1.483 2.384 1.00 . A A . 7 LEU CA 1 1 9 2771 1 1 7 LEU CB C -6.631 2.635 1.911 1.00 . A A . 7 LEU CB 1 1 9 2772 1 1 7 LEU CD1 C -6.983 5.092 1.575 1.00 . A A . 7 LEU CD1 1 1 9 2773 1 1 7 LEU CD2 C -6.085 4.251 3.751 1.00 . A A . 7 LEU CD2 1 1 9 2774 1 1 7 LEU CG C -6.117 4.038 2.245 1.00 . A A . 7 LEU CG 1 1 9 2775 1 1 7 LEU H H -4.249 2.008 0.978 1.00 . A A . 7 LEU H 1 1 9 2776 1 1 7 LEU HA H -5.693 1.481 3.456 1.00 . A A . 7 LEU HA 1 1 9 2777 1 1 7 LEU HB2 H -6.740 2.560 0.840 1.00 . A A . 7 LEU HB2 1 1 9 2778 1 1 7 LEU HB3 H -7.604 2.517 2.364 1.00 . A A . 7 LEU HB3 1 1 9 2779 1 1 7 LEU HD11 H -8.000 5.000 1.927 1.00 . A A . 7 LEU HD11 1 1 9 2780 1 1 7 LEU HD12 H -6.957 4.953 0.505 1.00 . A A . 7 LEU HD12 1 1 9 2781 1 1 7 LEU HD13 H -6.606 6.076 1.820 1.00 . A A . 7 LEU HD13 1 1 9 2782 1 1 7 LEU HD21 H -5.434 3.518 4.205 1.00 . A A . 7 LEU HD21 1 1 9 2783 1 1 7 LEU HD22 H -7.083 4.145 4.152 1.00 . A A . 7 LEU HD22 1 1 9 2784 1 1 7 LEU HD23 H -5.715 5.243 3.966 1.00 . A A . 7 LEU HD23 1 1 9 2785 1 1 7 LEU HG H -5.110 4.144 1.869 1.00 . A A . 7 LEU HG 1 1 9 2786 1 1 7 LEU N N -4.384 1.643 1.879 1.00 . A A . 7 LEU N 1 1 9 2787 1 1 7 LEU O O -7.307 -0.338 2.429 1.00 . A A . 7 LEU O 1 1 9 2788 1 1 8 ILE C C -5.058 -2.809 0.817 1.00 . A A . 8 ILE C 1 1 9 2789 1 1 8 ILE CA C -6.025 -1.716 0.380 1.00 . A A . 8 ILE CA 1 1 9 2790 1 1 8 ILE CB C -6.063 -1.658 -1.167 1.00 . A A . 8 ILE CB 1 1 9 2791 1 1 8 ILE CD1 C -8.410 -0.641 -1.201 1.00 . A A . 8 ILE CD1 1 1 9 2792 1 1 8 ILE CG1 C -6.965 -0.513 -1.643 1.00 . A A . 8 ILE CG1 1 1 9 2793 1 1 8 ILE CG2 C -6.536 -2.988 -1.742 1.00 . A A . 8 ILE CG2 1 1 9 2794 1 1 8 ILE H H -4.792 -0.016 0.631 1.00 . A A . 8 ILE H 1 1 9 2795 1 1 8 ILE HA H -7.015 -1.950 0.742 1.00 . A A . 8 ILE HA 1 1 9 2796 1 1 8 ILE HB H -5.057 -1.483 -1.519 1.00 . A A . 8 ILE HB 1 1 9 2797 1 1 8 ILE HD11 H -8.456 -0.651 -0.122 1.00 . A A . 8 ILE HD11 1 1 9 2798 1 1 8 ILE HD12 H -8.824 -1.560 -1.587 1.00 . A A . 8 ILE HD12 1 1 9 2799 1 1 8 ILE HD13 H -8.977 0.197 -1.579 1.00 . A A . 8 ILE HD13 1 1 9 2800 1 1 8 ILE HG12 H -6.584 0.420 -1.258 1.00 . A A . 8 ILE HG12 1 1 9 2801 1 1 8 ILE HG13 H -6.951 -0.481 -2.724 1.00 . A A . 8 ILE HG13 1 1 9 2802 1 1 8 ILE HG21 H -6.550 -2.928 -2.820 1.00 . A A . 8 ILE HG21 1 1 9 2803 1 1 8 ILE HG22 H -7.530 -3.204 -1.379 1.00 . A A . 8 ILE HG22 1 1 9 2804 1 1 8 ILE HG23 H -5.862 -3.774 -1.433 1.00 . A A . 8 ILE HG23 1 1 9 2805 1 1 8 ILE N N -5.618 -0.441 0.951 1.00 . A A . 8 ILE N 1 1 9 2806 1 1 8 ILE O O -3.923 -2.860 0.352 1.00 . A A . 8 ILE O 1 1 9 2807 1 1 9 PRO C C -3.889 -5.557 1.192 1.00 . A A . 9 PRO C 1 1 9 2808 1 1 9 PRO CA C -4.696 -4.805 2.251 1.00 . A A . 9 PRO CA 1 1 9 2809 1 1 9 PRO CB C -5.737 -5.727 2.880 1.00 . A A . 9 PRO CB 1 1 9 2810 1 1 9 PRO CD C -6.882 -3.719 2.263 1.00 . A A . 9 PRO CD 1 1 9 2811 1 1 9 PRO CG C -6.841 -4.819 3.292 1.00 . A A . 9 PRO CG 1 1 9 2812 1 1 9 PRO HA H -4.025 -4.449 3.019 1.00 . A A . 9 PRO HA 1 1 9 2813 1 1 9 PRO HB2 H -6.069 -6.452 2.150 1.00 . A A . 9 PRO HB2 1 1 9 2814 1 1 9 PRO HB3 H -5.307 -6.235 3.730 1.00 . A A . 9 PRO HB3 1 1 9 2815 1 1 9 PRO HD2 H -7.605 -3.950 1.495 1.00 . A A . 9 PRO HD2 1 1 9 2816 1 1 9 PRO HD3 H -7.117 -2.775 2.732 1.00 . A A . 9 PRO HD3 1 1 9 2817 1 1 9 PRO HG2 H -7.776 -5.359 3.301 1.00 . A A . 9 PRO HG2 1 1 9 2818 1 1 9 PRO HG3 H -6.635 -4.409 4.269 1.00 . A A . 9 PRO HG3 1 1 9 2819 1 1 9 PRO N N -5.513 -3.706 1.710 1.00 . A A . 9 PRO N 1 1 9 2820 1 1 9 PRO O O -2.760 -5.972 1.448 1.00 . A A . 9 PRO O 1 1 9 2821 1 1 10 ALA C C -2.588 -5.659 -1.611 1.00 . A A . 10 ALA C 1 1 9 2822 1 1 10 ALA CA C -3.804 -6.423 -1.084 1.00 . A A . 10 ALA CA 1 1 9 2823 1 1 10 ALA CB C -4.791 -6.685 -2.212 1.00 . A A . 10 ALA CB 1 1 9 2824 1 1 10 ALA H H -5.358 -5.343 -0.140 1.00 . A A . 10 ALA H 1 1 9 2825 1 1 10 ALA HA H -3.474 -7.378 -0.703 1.00 . A A . 10 ALA HA 1 1 9 2826 1 1 10 ALA HB1 H -5.643 -7.225 -1.826 1.00 . A A . 10 ALA HB1 1 1 9 2827 1 1 10 ALA HB2 H -4.311 -7.273 -2.980 1.00 . A A . 10 ALA HB2 1 1 9 2828 1 1 10 ALA HB3 H -5.119 -5.745 -2.629 1.00 . A A . 10 ALA HB3 1 1 9 2829 1 1 10 ALA N N -4.464 -5.713 0.006 1.00 . A A . 10 ALA N 1 1 9 2830 1 1 10 ALA O O -1.563 -6.257 -1.928 1.00 . A A . 10 ALA O 1 1 9 2831 1 1 11 CYS C C -0.660 -3.117 -1.060 1.00 . A A . 11 CYS C 1 1 9 2832 1 1 11 CYS CA C -1.593 -3.528 -2.195 1.00 . A A . 11 CYS CA 1 1 9 2833 1 1 11 CYS CB C -2.127 -2.291 -2.926 1.00 . A A . 11 CYS CB 1 1 9 2834 1 1 11 CYS H H -3.512 -3.900 -1.370 1.00 . A A . 11 CYS H 1 1 9 2835 1 1 11 CYS HA H -1.038 -4.134 -2.895 1.00 . A A . 11 CYS HA 1 1 9 2836 1 1 11 CYS HB2 H -3.058 -2.544 -3.412 1.00 . A A . 11 CYS HB2 1 1 9 2837 1 1 11 CYS HB3 H -2.305 -1.505 -2.206 1.00 . A A . 11 CYS HB3 1 1 9 2838 1 1 11 CYS N N -2.692 -4.339 -1.685 1.00 . A A . 11 CYS N 1 1 9 2839 1 1 11 CYS O O 0.549 -2.978 -1.254 1.00 . A A . 11 CYS O 1 1 9 2840 1 1 11 CYS SG S -0.996 -1.634 -4.200 1.00 . A A . 11 CYS SG 1 1 9 2841 1 1 12 ARG C C 0.501 -3.672 1.692 1.00 . A A . 12 ARG C 1 1 9 2842 1 1 12 ARG CA C -0.455 -2.559 1.303 1.00 . A A . 12 ARG CA 1 1 9 2843 1 1 12 ARG CB C -1.387 -2.254 2.473 1.00 . A A . 12 ARG CB 1 1 9 2844 1 1 12 ARG CD C -1.652 -1.319 4.796 1.00 . A A . 12 ARG CD 1 1 9 2845 1 1 12 ARG CG C -0.675 -1.679 3.689 1.00 . A A . 12 ARG CG 1 1 9 2846 1 1 12 ARG CZ C -3.781 -2.451 5.337 1.00 . A A . 12 ARG CZ 1 1 9 2847 1 1 12 ARG H H -2.201 -3.057 0.213 1.00 . A A . 12 ARG H 1 1 9 2848 1 1 12 ARG HA H 0.112 -1.674 1.061 1.00 . A A . 12 ARG HA 1 1 9 2849 1 1 12 ARG HB2 H -2.129 -1.551 2.144 1.00 . A A . 12 ARG HB2 1 1 9 2850 1 1 12 ARG HB3 H -1.880 -3.165 2.771 1.00 . A A . 12 ARG HB3 1 1 9 2851 1 1 12 ARG HD2 H -1.095 -0.940 5.639 1.00 . A A . 12 ARG HD2 1 1 9 2852 1 1 12 ARG HD3 H -2.318 -0.550 4.432 1.00 . A A . 12 ARG HD3 1 1 9 2853 1 1 12 ARG HE H -1.963 -3.282 5.484 1.00 . A A . 12 ARG HE 1 1 9 2854 1 1 12 ARG HG2 H 0.023 -2.412 4.064 1.00 . A A . 12 ARG HG2 1 1 9 2855 1 1 12 ARG HG3 H -0.139 -0.789 3.391 1.00 . A A . 12 ARG HG3 1 1 9 2856 1 1 12 ARG HH11 H -3.986 -0.555 4.631 1.00 . A A . 12 ARG HH11 1 1 9 2857 1 1 12 ARG HH12 H -5.468 -1.356 5.053 1.00 . A A . 12 ARG HH12 1 1 9 2858 1 1 12 ARG HH21 H -3.916 -4.344 6.052 1.00 . A A . 12 ARG HH21 1 1 9 2859 1 1 12 ARG HH22 H -5.425 -3.515 5.869 1.00 . A A . 12 ARG HH22 1 1 9 2860 1 1 12 ARG N N -1.227 -2.941 0.127 1.00 . A A . 12 ARG N 1 1 9 2861 1 1 12 ARG NE N -2.450 -2.467 5.235 1.00 . A A . 12 ARG NE 1 1 9 2862 1 1 12 ARG NH1 N -4.468 -1.370 4.979 1.00 . A A . 12 ARG NH1 1 1 9 2863 1 1 12 ARG NH2 N -4.426 -3.524 5.787 1.00 . A A . 12 ARG NH2 1 1 9 2864 1 1 12 ARG O O 1.567 -3.425 2.242 1.00 . A A . 12 ARG O 1 1 9 2865 1 1 13 ARG C C 2.202 -6.058 0.889 1.00 . A A . 13 ARG C 1 1 9 2866 1 1 13 ARG CA C 0.919 -6.064 1.717 1.00 . A A . 13 ARG CA 1 1 9 2867 1 1 13 ARG CB C 0.135 -7.355 1.459 1.00 . A A . 13 ARG CB 1 1 9 2868 1 1 13 ARG CD C 1.109 -8.626 3.397 1.00 . A A . 13 ARG CD 1 1 9 2869 1 1 13 ARG CG C 0.870 -8.613 1.895 1.00 . A A . 13 ARG CG 1 1 9 2870 1 1 13 ARG CZ C 2.041 -10.383 4.865 1.00 . A A . 13 ARG CZ 1 1 9 2871 1 1 13 ARG H H -0.787 -5.023 1.002 1.00 . A A . 13 ARG H 1 1 9 2872 1 1 13 ARG HA H 1.182 -6.016 2.762 1.00 . A A . 13 ARG HA 1 1 9 2873 1 1 13 ARG HB2 H -0.801 -7.307 1.994 1.00 . A A . 13 ARG HB2 1 1 9 2874 1 1 13 ARG HB3 H -0.069 -7.432 0.401 1.00 . A A . 13 ARG HB3 1 1 9 2875 1 1 13 ARG HD2 H 1.437 -7.644 3.705 1.00 . A A . 13 ARG HD2 1 1 9 2876 1 1 13 ARG HD3 H 0.181 -8.867 3.895 1.00 . A A . 13 ARG HD3 1 1 9 2877 1 1 13 ARG HE H 2.913 -9.685 3.200 1.00 . A A . 13 ARG HE 1 1 9 2878 1 1 13 ARG HG2 H 0.277 -9.475 1.629 1.00 . A A . 13 ARG HG2 1 1 9 2879 1 1 13 ARG HG3 H 1.823 -8.657 1.387 1.00 . A A . 13 ARG HG3 1 1 9 2880 1 1 13 ARG HH11 H 0.246 -9.655 5.461 1.00 . A A . 13 ARG HH11 1 1 9 2881 1 1 13 ARG HH12 H 0.918 -10.881 6.481 1.00 . A A . 13 ARG HH12 1 1 9 2882 1 1 13 ARG HH21 H 3.816 -11.311 4.540 1.00 . A A . 13 ARG HH21 1 1 9 2883 1 1 13 ARG HH22 H 2.960 -11.828 5.955 1.00 . A A . 13 ARG HH22 1 1 9 2884 1 1 13 ARG N N 0.097 -4.899 1.412 1.00 . A A . 13 ARG N 1 1 9 2885 1 1 13 ARG NE N 2.124 -9.607 3.783 1.00 . A A . 13 ARG NE 1 1 9 2886 1 1 13 ARG NH1 N 0.983 -10.300 5.668 1.00 . A A . 13 ARG NH1 1 1 9 2887 1 1 13 ARG NH2 N 3.016 -11.244 5.143 1.00 . A A . 13 ARG NH2 1 1 9 2888 1 1 13 ARG O O 3.249 -6.514 1.344 1.00 . A A . 13 ARG O 1 1 9 2889 1 1 14 ASN C C 4.035 -4.161 -1.004 1.00 . A A . 14 ASN C 1 1 9 2890 1 1 14 ASN CA C 3.258 -5.456 -1.218 1.00 . A A . 14 ASN CA 1 1 9 2891 1 1 14 ASN CB C 2.786 -5.561 -2.675 1.00 . A A . 14 ASN CB 1 1 9 2892 1 1 14 ASN CG C 3.874 -5.226 -3.683 1.00 . A A . 14 ASN CG 1 1 9 2893 1 1 14 ASN H H 1.249 -5.167 -0.620 1.00 . A A . 14 ASN H 1 1 9 2894 1 1 14 ASN HA H 3.904 -6.292 -0.996 1.00 . A A . 14 ASN HA 1 1 9 2895 1 1 14 ASN HB2 H 2.449 -6.569 -2.864 1.00 . A A . 14 ASN HB2 1 1 9 2896 1 1 14 ASN HB3 H 1.962 -4.879 -2.826 1.00 . A A . 14 ASN HB3 1 1 9 2897 1 1 14 ASN HD21 H 4.517 -7.104 -3.663 1.00 . A A . 14 ASN HD21 1 1 9 2898 1 1 14 ASN HD22 H 5.379 -6.025 -4.698 1.00 . A A . 14 ASN HD22 1 1 9 2899 1 1 14 ASN N N 2.111 -5.524 -0.320 1.00 . A A . 14 ASN N 1 1 9 2900 1 1 14 ASN ND2 N 4.669 -6.219 -4.053 1.00 . A A . 14 ASN ND2 1 1 9 2901 1 1 14 ASN O O 5.242 -4.097 -1.230 1.00 . A A . 14 ASN O 1 1 9 2902 1 1 14 ASN OD1 O 3.991 -4.085 -4.132 1.00 . A A . 14 ASN OD1 1 1 9 2903 1 1 15 HIS C C 4.033 -1.514 1.173 1.00 . A A . 15 HIS C 1 1 9 2904 1 1 15 HIS CA C 3.973 -1.839 -0.313 1.00 . A A . 15 HIS CA 1 1 9 2905 1 1 15 HIS CB C 3.218 -0.737 -1.063 1.00 . A A . 15 HIS CB 1 1 9 2906 1 1 15 HIS CD2 C 2.316 -1.315 -3.423 1.00 . A A . 15 HIS CD2 1 1 9 2907 1 1 15 HIS CE1 C 4.113 -0.840 -4.581 1.00 . A A . 15 HIS CE1 1 1 9 2908 1 1 15 HIS CG C 3.260 -0.889 -2.551 1.00 . A A . 15 HIS CG 1 1 9 2909 1 1 15 HIS H H 2.389 -3.249 -0.334 1.00 . A A . 15 HIS H 1 1 9 2910 1 1 15 HIS HA H 4.981 -1.892 -0.695 1.00 . A A . 15 HIS HA 1 1 9 2911 1 1 15 HIS HB2 H 2.182 -0.747 -0.756 1.00 . A A . 15 HIS HB2 1 1 9 2912 1 1 15 HIS HB3 H 3.652 0.221 -0.812 1.00 . A A . 15 HIS HB3 1 1 9 2913 1 1 15 HIS HD1 H 5.232 -0.274 -2.965 1.00 . A A . 15 HIS HD1 1 1 9 2914 1 1 15 HIS HD2 H 1.311 -1.628 -3.177 1.00 . A A . 15 HIS HD2 1 1 9 2915 1 1 15 HIS HE1 H 4.801 -0.705 -5.402 1.00 . A A . 15 HIS HE1 1 1 9 2916 1 1 15 HIS HE2 H 2.501 -1.731 -5.467 1.00 . A A . 15 HIS HE2 1 1 9 2917 1 1 15 HIS N N 3.344 -3.133 -0.540 1.00 . A A . 15 HIS N 1 1 9 2918 1 1 15 HIS ND1 N 4.374 -0.600 -3.309 1.00 . A A . 15 HIS ND1 1 1 9 2919 1 1 15 HIS NE2 N 2.870 -1.277 -4.680 1.00 . A A . 15 HIS NE2 1 1 9 2920 1 1 15 HIS O O 3.953 -0.352 1.568 1.00 . A A . 15 HIS O 1 1 9 2921 1 1 16 LYS C C 5.522 -1.597 3.831 1.00 . A A . 16 LYS C 1 1 9 2922 1 1 16 LYS CA C 4.266 -2.366 3.439 1.00 . A A . 16 LYS CA 1 1 9 2923 1 1 16 LYS CB C 4.226 -3.724 4.150 1.00 . A A . 16 LYS CB 1 1 9 2924 1 1 16 LYS CD C 4.866 -3.581 6.583 1.00 . A A . 16 LYS CD 1 1 9 2925 1 1 16 LYS CE C 4.542 -2.659 7.750 1.00 . A A . 16 LYS CE 1 1 9 2926 1 1 16 LYS CG C 3.721 -3.648 5.584 1.00 . A A . 16 LYS CG 1 1 9 2927 1 1 16 LYS H H 4.265 -3.447 1.617 1.00 . A A . 16 LYS H 1 1 9 2928 1 1 16 LYS HA H 3.402 -1.790 3.737 1.00 . A A . 16 LYS HA 1 1 9 2929 1 1 16 LYS HB2 H 3.577 -4.388 3.597 1.00 . A A . 16 LYS HB2 1 1 9 2930 1 1 16 LYS HB3 H 5.223 -4.139 4.164 1.00 . A A . 16 LYS HB3 1 1 9 2931 1 1 16 LYS HD2 H 5.056 -4.573 6.965 1.00 . A A . 16 LYS HD2 1 1 9 2932 1 1 16 LYS HD3 H 5.748 -3.212 6.079 1.00 . A A . 16 LYS HD3 1 1 9 2933 1 1 16 LYS HE2 H 3.593 -2.957 8.174 1.00 . A A . 16 LYS HE2 1 1 9 2934 1 1 16 LYS HE3 H 5.315 -2.761 8.497 1.00 . A A . 16 LYS HE3 1 1 9 2935 1 1 16 LYS HG2 H 3.111 -2.764 5.694 1.00 . A A . 16 LYS HG2 1 1 9 2936 1 1 16 LYS HG3 H 3.124 -4.525 5.792 1.00 . A A . 16 LYS HG3 1 1 9 2937 1 1 16 LYS HZ1 H 3.515 -1.024 6.942 1.00 . A A . 16 LYS HZ1 1 1 9 2938 1 1 16 LYS HZ2 H 5.171 -1.032 6.593 1.00 . A A . 16 LYS HZ2 1 1 9 2939 1 1 16 LYS HZ3 H 4.631 -0.607 8.139 1.00 . A A . 16 LYS HZ3 1 1 9 2940 1 1 16 LYS N N 4.199 -2.544 1.993 1.00 . A A . 16 LYS N 1 1 9 2941 1 1 16 LYS NZ N 4.458 -1.233 7.329 1.00 . A A . 16 LYS NZ 1 1 9 2942 1 1 16 LYS O O 5.588 -0.998 4.906 1.00 . A A . 16 LYS O 1 1 9 2943 1 1 17 LYS C C 7.582 0.588 3.023 1.00 . A A . 17 LYS C 1 1 9 2944 1 1 17 LYS CA C 7.762 -0.910 3.208 1.00 . A A . 17 LYS CA 1 1 9 2945 1 1 17 LYS CB C 8.864 -1.422 2.283 1.00 . A A . 17 LYS CB 1 1 9 2946 1 1 17 LYS CD C 10.925 -2.835 2.015 1.00 . A A . 17 LYS CD 1 1 9 2947 1 1 17 LYS CE C 11.966 -3.675 2.739 1.00 . A A . 17 LYS CE 1 1 9 2948 1 1 17 LYS CG C 9.799 -2.419 2.948 1.00 . A A . 17 LYS CG 1 1 9 2949 1 1 17 LYS H H 6.407 -2.114 2.120 1.00 . A A . 17 LYS H 1 1 9 2950 1 1 17 LYS HA H 8.042 -1.098 4.231 1.00 . A A . 17 LYS HA 1 1 9 2951 1 1 17 LYS HB2 H 8.407 -1.901 1.430 1.00 . A A . 17 LYS HB2 1 1 9 2952 1 1 17 LYS HB3 H 9.449 -0.581 1.942 1.00 . A A . 17 LYS HB3 1 1 9 2953 1 1 17 LYS HD2 H 10.513 -3.414 1.204 1.00 . A A . 17 LYS HD2 1 1 9 2954 1 1 17 LYS HD3 H 11.401 -1.948 1.623 1.00 . A A . 17 LYS HD3 1 1 9 2955 1 1 17 LYS HE2 H 11.475 -4.527 3.187 1.00 . A A . 17 LYS HE2 1 1 9 2956 1 1 17 LYS HE3 H 12.696 -4.019 2.021 1.00 . A A . 17 LYS HE3 1 1 9 2957 1 1 17 LYS HG2 H 10.224 -1.966 3.830 1.00 . A A . 17 LYS HG2 1 1 9 2958 1 1 17 LYS HG3 H 9.233 -3.296 3.228 1.00 . A A . 17 LYS HG3 1 1 9 2959 1 1 17 LYS HZ1 H 13.373 -3.501 4.276 1.00 . A A . 17 LYS HZ1 1 1 9 2960 1 1 17 LYS HZ2 H 11.977 -2.575 4.517 1.00 . A A . 17 LYS HZ2 1 1 9 2961 1 1 17 LYS HZ3 H 13.141 -2.075 3.395 1.00 . A A . 17 LYS HZ3 1 1 9 2962 1 1 17 LYS N N 6.515 -1.614 2.955 1.00 . A A . 17 LYS N 1 1 9 2963 1 1 17 LYS NZ N 12.663 -2.903 3.806 1.00 . A A . 17 LYS NZ 1 1 9 2964 1 1 17 LYS O O 8.299 1.385 3.619 1.00 . A A . 17 LYS O 1 1 9 2965 1 1 18 PHE C C 5.299 2.875 2.919 1.00 . A A . 18 PHE C 1 1 9 2966 1 1 18 PHE CA C 6.337 2.359 1.931 1.00 . A A . 18 PHE CA 1 1 9 2967 1 1 18 PHE CB C 5.835 2.541 0.496 1.00 . A A . 18 PHE CB 1 1 9 2968 1 1 18 PHE CD1 C 5.672 5.032 0.213 1.00 . A A . 18 PHE CD1 1 1 9 2969 1 1 18 PHE CD2 C 7.279 3.844 -1.088 1.00 . A A . 18 PHE CD2 1 1 9 2970 1 1 18 PHE CE1 C 6.071 6.219 -0.372 1.00 . A A . 18 PHE CE1 1 1 9 2971 1 1 18 PHE CE2 C 7.683 5.028 -1.677 1.00 . A A . 18 PHE CE2 1 1 9 2972 1 1 18 PHE CG C 6.270 3.832 -0.138 1.00 . A A . 18 PHE CG 1 1 9 2973 1 1 18 PHE CZ C 7.078 6.217 -1.317 1.00 . A A . 18 PHE CZ 1 1 9 2974 1 1 18 PHE H H 6.083 0.271 1.753 1.00 . A A . 18 PHE H 1 1 9 2975 1 1 18 PHE HA H 7.254 2.915 2.060 1.00 . A A . 18 PHE HA 1 1 9 2976 1 1 18 PHE HB2 H 6.208 1.730 -0.113 1.00 . A A . 18 PHE HB2 1 1 9 2977 1 1 18 PHE HB3 H 4.755 2.517 0.496 1.00 . A A . 18 PHE HB3 1 1 9 2978 1 1 18 PHE HD1 H 4.885 5.035 0.953 1.00 . A A . 18 PHE HD1 1 1 9 2979 1 1 18 PHE HD2 H 7.752 2.915 -1.369 1.00 . A A . 18 PHE HD2 1 1 9 2980 1 1 18 PHE HE1 H 5.596 7.147 -0.091 1.00 . A A . 18 PHE HE1 1 1 9 2981 1 1 18 PHE HE2 H 8.470 5.023 -2.415 1.00 . A A . 18 PHE HE2 1 1 9 2982 1 1 18 PHE HZ H 7.392 7.143 -1.776 1.00 . A A . 18 PHE HZ 1 1 9 2983 1 1 18 PHE N N 6.619 0.958 2.194 1.00 . A A . 18 PHE N 1 1 9 2984 1 1 18 PHE O O 5.424 3.973 3.458 1.00 . A A . 18 PHE O 1 1 9 2985 1 1 19 CYS C C 3.550 1.985 5.498 1.00 . A A . 19 CYS C 1 1 9 2986 1 1 19 CYS CA C 3.217 2.451 4.085 1.00 . A A . 19 CYS CA 1 1 9 2987 1 1 19 CYS CB C 1.868 1.884 3.632 1.00 . A A . 19 CYS CB 1 1 9 2988 1 1 19 CYS H H 4.238 1.192 2.721 1.00 . A A . 19 CYS H 1 1 9 2989 1 1 19 CYS HA H 3.161 3.531 4.084 1.00 . A A . 19 CYS HA 1 1 9 2990 1 1 19 CYS HB2 H 1.776 0.865 3.970 1.00 . A A . 19 CYS HB2 1 1 9 2991 1 1 19 CYS HB3 H 1.076 2.473 4.071 1.00 . A A . 19 CYS HB3 1 1 9 2992 1 1 19 CYS N N 4.276 2.069 3.164 1.00 . A A . 19 CYS N 1 1 9 2993 1 1 19 CYS O O 3.139 0.900 5.927 1.00 . A A . 19 CYS O 1 1 9 2994 1 1 19 CYS SG S 1.622 1.893 1.825 1.00 . A A . 19 CYS SG 1 1 9 2995 1 1 20 NH2 HN1 H 4.591 3.646 5.814 1.00 . A A . 20 NH2 HN1 1 1 9 2996 1 1 20 NH2 HN2 H 4.540 2.530 7.131 1.00 . A A . 20 NH2 HN2 1 1 9 2997 1 1 20 NH2 N N 4.302 2.801 6.222 1.00 . A A . 20 NH2 N 1 1 10 2998 1 1 1 PHE C C 1.485 6.514 -5.386 1.00 . A A . 1 PHE C 1 1 10 2999 1 1 1 PHE CA C 2.958 6.433 -5.761 1.00 . A A . 1 PHE CA 1 1 10 3000 1 1 1 PHE CB C 3.828 6.379 -4.497 1.00 . A A . 1 PHE CB 1 1 10 3001 1 1 1 PHE CD1 C 3.712 3.966 -3.802 1.00 . A A . 1 PHE CD1 1 1 10 3002 1 1 1 PHE CD2 C 2.785 5.609 -2.344 1.00 . A A . 1 PHE CD2 1 1 10 3003 1 1 1 PHE CE1 C 3.350 2.971 -2.914 1.00 . A A . 1 PHE CE1 1 1 10 3004 1 1 1 PHE CE2 C 2.420 4.619 -1.453 1.00 . A A . 1 PHE CE2 1 1 10 3005 1 1 1 PHE CG C 3.434 5.296 -3.528 1.00 . A A . 1 PHE CG 1 1 10 3006 1 1 1 PHE CZ C 2.703 3.298 -1.739 1.00 . A A . 1 PHE CZ 1 1 10 3007 1 1 1 PHE H1 H 2.813 7.586 -7.487 1.00 . A A . 1 PHE H1 1 1 10 3008 1 1 1 PHE H2 H 4.353 7.592 -6.786 1.00 . A A . 1 PHE H2 1 1 10 3009 1 1 1 PHE H3 H 3.098 8.482 -6.082 1.00 . A A . 1 PHE H3 1 1 10 3010 1 1 1 PHE HA H 3.121 5.538 -6.344 1.00 . A A . 1 PHE HA 1 1 10 3011 1 1 1 PHE HB2 H 4.854 6.207 -4.783 1.00 . A A . 1 PHE HB2 1 1 10 3012 1 1 1 PHE HB3 H 3.758 7.326 -3.982 1.00 . A A . 1 PHE HB3 1 1 10 3013 1 1 1 PHE HD1 H 4.218 3.709 -4.720 1.00 . A A . 1 PHE HD1 1 1 10 3014 1 1 1 PHE HD2 H 2.562 6.643 -2.121 1.00 . A A . 1 PHE HD2 1 1 10 3015 1 1 1 PHE HE1 H 3.573 1.938 -3.140 1.00 . A A . 1 PHE HE1 1 1 10 3016 1 1 1 PHE HE2 H 1.914 4.876 -0.535 1.00 . A A . 1 PHE HE2 1 1 10 3017 1 1 1 PHE HZ H 2.419 2.521 -1.044 1.00 . A A . 1 PHE HZ 1 1 10 3018 1 1 1 PHE N N 3.334 7.604 -6.588 1.00 . A A . 1 PHE N 1 1 10 3019 1 1 1 PHE O O 0.969 7.601 -5.135 1.00 . A A . 1 PHE O 1 1 10 3020 1 1 2 ASN C C -0.753 5.090 -3.518 1.00 . A A . 2 ASN C 1 1 10 3021 1 1 2 ASN CA C -0.598 5.322 -5.015 1.00 . A A . 2 ASN CA 1 1 10 3022 1 1 2 ASN CB C -1.314 4.214 -5.791 1.00 . A A . 2 ASN CB 1 1 10 3023 1 1 2 ASN CG C -2.798 4.149 -5.477 1.00 . A A . 2 ASN CG 1 1 10 3024 1 1 2 ASN H H 1.277 4.537 -5.590 1.00 . A A . 2 ASN H 1 1 10 3025 1 1 2 ASN HA H -1.038 6.275 -5.269 1.00 . A A . 2 ASN HA 1 1 10 3026 1 1 2 ASN HB2 H -1.196 4.391 -6.850 1.00 . A A . 2 ASN HB2 1 1 10 3027 1 1 2 ASN HB3 H -0.869 3.262 -5.538 1.00 . A A . 2 ASN HB3 1 1 10 3028 1 1 2 ASN HD21 H -2.795 2.180 -5.747 1.00 . A A . 2 ASN HD21 1 1 10 3029 1 1 2 ASN HD22 H -4.318 2.881 -5.328 1.00 . A A . 2 ASN HD22 1 1 10 3030 1 1 2 ASN N N 0.814 5.371 -5.369 1.00 . A A . 2 ASN N 1 1 10 3031 1 1 2 ASN ND2 N -3.361 2.950 -5.519 1.00 . A A . 2 ASN ND2 1 1 10 3032 1 1 2 ASN O O -0.702 3.952 -3.051 1.00 . A A . 2 ASN O 1 1 10 3033 1 1 2 ASN OD1 O -3.432 5.166 -5.190 1.00 . A A . 2 ASN OD1 1 1 10 3034 1 1 3 TRP C C -2.319 5.279 -0.940 1.00 . A A . 3 TRP C 1 1 10 3035 1 1 3 TRP CA C -1.096 6.104 -1.323 1.00 . A A . 3 TRP CA 1 1 10 3036 1 1 3 TRP CB C -1.198 7.513 -0.726 1.00 . A A . 3 TRP CB 1 1 10 3037 1 1 3 TRP CD1 C -1.918 9.214 -2.505 1.00 . A A . 3 TRP CD1 1 1 10 3038 1 1 3 TRP CD2 C -3.564 8.586 -1.123 1.00 . A A . 3 TRP CD2 1 1 10 3039 1 1 3 TRP CE2 C -4.082 9.514 -2.046 1.00 . A A . 3 TRP CE2 1 1 10 3040 1 1 3 TRP CE3 C -4.417 8.052 -0.152 1.00 . A A . 3 TRP CE3 1 1 10 3041 1 1 3 TRP CG C -2.176 8.405 -1.436 1.00 . A A . 3 TRP CG 1 1 10 3042 1 1 3 TRP CH2 C -6.227 9.378 -1.067 1.00 . A A . 3 TRP CH2 1 1 10 3043 1 1 3 TRP CZ2 C -5.414 9.917 -2.027 1.00 . A A . 3 TRP CZ2 1 1 10 3044 1 1 3 TRP CZ3 C -5.739 8.454 -0.135 1.00 . A A . 3 TRP CZ3 1 1 10 3045 1 1 3 TRP H H -0.966 7.052 -3.212 1.00 . A A . 3 TRP H 1 1 10 3046 1 1 3 TRP HA H -0.219 5.620 -0.924 1.00 . A A . 3 TRP HA 1 1 10 3047 1 1 3 TRP HB2 H -1.508 7.436 0.305 1.00 . A A . 3 TRP HB2 1 1 10 3048 1 1 3 TRP HB3 H -0.226 7.984 -0.769 1.00 . A A . 3 TRP HB3 1 1 10 3049 1 1 3 TRP HD1 H -0.953 9.304 -2.980 1.00 . A A . 3 TRP HD1 1 1 10 3050 1 1 3 TRP HE1 H -3.128 10.517 -3.622 1.00 . A A . 3 TRP HE1 1 1 10 3051 1 1 3 TRP HE3 H -4.060 7.338 0.574 1.00 . A A . 3 TRP HE3 1 1 10 3052 1 1 3 TRP HH2 H -7.267 9.665 -1.015 1.00 . A A . 3 TRP HH2 1 1 10 3053 1 1 3 TRP HZ2 H -5.807 10.629 -2.738 1.00 . A A . 3 TRP HZ2 1 1 10 3054 1 1 3 TRP HZ3 H -6.413 8.053 0.608 1.00 . A A . 3 TRP HZ3 1 1 10 3055 1 1 3 TRP N N -0.938 6.175 -2.774 1.00 . A A . 3 TRP N 1 1 10 3056 1 1 3 TRP NE1 N -3.059 9.880 -2.880 1.00 . A A . 3 TRP NE1 1 1 10 3057 1 1 3 TRP O O -2.404 4.742 0.165 1.00 . A A . 3 TRP O 1 1 10 3058 1 1 4 ARG C C -4.161 2.939 -1.403 1.00 . A A . 4 ARG C 1 1 10 3059 1 1 4 ARG CA C -4.472 4.400 -1.647 1.00 . A A . 4 ARG CA 1 1 10 3060 1 1 4 ARG CB C -5.415 4.541 -2.834 1.00 . A A . 4 ARG CB 1 1 10 3061 1 1 4 ARG CD C -7.036 6.021 -4.047 1.00 . A A . 4 ARG CD 1 1 10 3062 1 1 4 ARG CG C -6.376 5.709 -2.715 1.00 . A A . 4 ARG CG 1 1 10 3063 1 1 4 ARG CZ C -7.703 8.241 -4.898 1.00 . A A . 4 ARG CZ 1 1 10 3064 1 1 4 ARG H H -3.111 5.593 -2.741 1.00 . A A . 4 ARG H 1 1 10 3065 1 1 4 ARG HA H -4.942 4.795 -0.770 1.00 . A A . 4 ARG HA 1 1 10 3066 1 1 4 ARG HB2 H -4.826 4.678 -3.729 1.00 . A A . 4 ARG HB2 1 1 10 3067 1 1 4 ARG HB3 H -5.986 3.632 -2.928 1.00 . A A . 4 ARG HB3 1 1 10 3068 1 1 4 ARG HD2 H -6.270 6.115 -4.801 1.00 . A A . 4 ARG HD2 1 1 10 3069 1 1 4 ARG HD3 H -7.696 5.205 -4.307 1.00 . A A . 4 ARG HD3 1 1 10 3070 1 1 4 ARG HE H -8.445 7.364 -3.257 1.00 . A A . 4 ARG HE 1 1 10 3071 1 1 4 ARG HG2 H -7.142 5.462 -1.995 1.00 . A A . 4 ARG HG2 1 1 10 3072 1 1 4 ARG HG3 H -5.831 6.579 -2.382 1.00 . A A . 4 ARG HG3 1 1 10 3073 1 1 4 ARG HH11 H -6.277 7.306 -5.998 1.00 . A A . 4 ARG HH11 1 1 10 3074 1 1 4 ARG HH12 H -6.764 8.861 -6.587 1.00 . A A . 4 ARG HH12 1 1 10 3075 1 1 4 ARG HH21 H -9.095 9.426 -4.021 1.00 . A A . 4 ARG HH21 1 1 10 3076 1 1 4 ARG HH22 H -8.373 10.073 -5.456 1.00 . A A . 4 ARG HH22 1 1 10 3077 1 1 4 ARG N N -3.253 5.160 -1.874 1.00 . A A . 4 ARG N 1 1 10 3078 1 1 4 ARG NE N -7.811 7.261 -4.000 1.00 . A A . 4 ARG NE 1 1 10 3079 1 1 4 ARG NH1 N -6.846 8.128 -5.910 1.00 . A A . 4 ARG NH1 1 1 10 3080 1 1 4 ARG NH2 N -8.451 9.335 -4.783 1.00 . A A . 4 ARG NH2 1 1 10 3081 1 1 4 ARG O O -4.931 2.223 -0.771 1.00 . A A . 4 ARG O 1 1 10 3082 1 1 5 CYS C C -2.400 0.825 -0.264 1.00 . A A . 5 CYS C 1 1 10 3083 1 1 5 CYS CA C -2.564 1.146 -1.738 1.00 . A A . 5 CYS CA 1 1 10 3084 1 1 5 CYS CB C -1.228 0.940 -2.443 1.00 . A A . 5 CYS CB 1 1 10 3085 1 1 5 CYS H H -2.472 3.150 -2.411 1.00 . A A . 5 CYS H 1 1 10 3086 1 1 5 CYS HA H -3.301 0.484 -2.169 1.00 . A A . 5 CYS HA 1 1 10 3087 1 1 5 CYS HB2 H -0.668 1.863 -2.396 1.00 . A A . 5 CYS HB2 1 1 10 3088 1 1 5 CYS HB3 H -0.676 0.166 -1.929 1.00 . A A . 5 CYS HB3 1 1 10 3089 1 1 5 CYS N N -3.022 2.516 -1.908 1.00 . A A . 5 CYS N 1 1 10 3090 1 1 5 CYS O O -2.625 -0.304 0.165 1.00 . A A . 5 CYS O 1 1 10 3091 1 1 5 CYS SG S -1.368 0.455 -4.192 1.00 . A A . 5 CYS SG 1 1 10 3092 1 1 6 CYS C C -3.156 1.432 2.663 1.00 . A A . 6 CYS C 1 1 10 3093 1 1 6 CYS CA C -1.832 1.663 1.942 1.00 . A A . 6 CYS CA 1 1 10 3094 1 1 6 CYS CB C -1.106 2.877 2.522 1.00 . A A . 6 CYS CB 1 1 10 3095 1 1 6 CYS H H -1.934 2.736 0.112 1.00 . A A . 6 CYS H 1 1 10 3096 1 1 6 CYS HA H -1.211 0.788 2.076 1.00 . A A . 6 CYS HA 1 1 10 3097 1 1 6 CYS HB2 H -1.812 3.682 2.659 1.00 . A A . 6 CYS HB2 1 1 10 3098 1 1 6 CYS HB3 H -0.683 2.606 3.478 1.00 . A A . 6 CYS HB3 1 1 10 3099 1 1 6 CYS N N -2.043 1.838 0.511 1.00 . A A . 6 CYS N 1 1 10 3100 1 1 6 CYS O O -3.184 0.995 3.814 1.00 . A A . 6 CYS O 1 1 10 3101 1 1 6 CYS SG S 0.250 3.494 1.470 1.00 . A A . 6 CYS SG 1 1 10 3102 1 1 7 LEU C C -6.183 0.232 2.005 1.00 . A A . 7 LEU C 1 1 10 3103 1 1 7 LEU CA C -5.579 1.526 2.534 1.00 . A A . 7 LEU CA 1 1 10 3104 1 1 7 LEU CB C -6.481 2.713 2.181 1.00 . A A . 7 LEU CB 1 1 10 3105 1 1 7 LEU CD1 C -6.811 5.192 2.014 1.00 . A A . 7 LEU CD1 1 1 10 3106 1 1 7 LEU CD2 C -5.868 4.200 4.106 1.00 . A A . 7 LEU CD2 1 1 10 3107 1 1 7 LEU CG C -5.942 4.085 2.590 1.00 . A A . 7 LEU CG 1 1 10 3108 1 1 7 LEU H H -4.163 2.066 1.063 1.00 . A A . 7 LEU H 1 1 10 3109 1 1 7 LEU HA H -5.484 1.456 3.605 1.00 . A A . 7 LEU HA 1 1 10 3110 1 1 7 LEU HB2 H -6.635 2.714 1.112 1.00 . A A . 7 LEU HB2 1 1 10 3111 1 1 7 LEU HB3 H -7.436 2.568 2.664 1.00 . A A . 7 LEU HB3 1 1 10 3112 1 1 7 LEU HD11 H -6.414 6.152 2.305 1.00 . A A . 7 LEU HD11 1 1 10 3113 1 1 7 LEU HD12 H -7.819 5.090 2.389 1.00 . A A . 7 LEU HD12 1 1 10 3114 1 1 7 LEU HD13 H -6.820 5.118 0.936 1.00 . A A . 7 LEU HD13 1 1 10 3115 1 1 7 LEU HD21 H -6.856 4.081 4.525 1.00 . A A . 7 LEU HD21 1 1 10 3116 1 1 7 LEU HD22 H -5.477 5.169 4.375 1.00 . A A . 7 LEU HD22 1 1 10 3117 1 1 7 LEU HD23 H -5.219 3.429 4.493 1.00 . A A . 7 LEU HD23 1 1 10 3118 1 1 7 LEU HG H -4.943 4.205 2.195 1.00 . A A . 7 LEU HG 1 1 10 3119 1 1 7 LEU N N -4.251 1.716 1.975 1.00 . A A . 7 LEU N 1 1 10 3120 1 1 7 LEU O O -7.292 -0.150 2.368 1.00 . A A . 7 LEU O 1 1 10 3121 1 1 8 ILE C C -4.933 -2.827 0.942 1.00 . A A . 8 ILE C 1 1 10 3122 1 1 8 ILE CA C -5.872 -1.690 0.551 1.00 . A A . 8 ILE CA 1 1 10 3123 1 1 8 ILE CB C -5.935 -1.585 -0.990 1.00 . A A . 8 ILE CB 1 1 10 3124 1 1 8 ILE CD1 C -6.676 -0.052 -2.887 1.00 . A A . 8 ILE CD1 1 1 10 3125 1 1 8 ILE CG1 C -6.769 -0.373 -1.409 1.00 . A A . 8 ILE CG1 1 1 10 3126 1 1 8 ILE CG2 C -6.512 -2.862 -1.589 1.00 . A A . 8 ILE CG2 1 1 10 3127 1 1 8 ILE H H -4.536 -0.096 0.926 1.00 . A A . 8 ILE H 1 1 10 3128 1 1 8 ILE HA H -6.863 -1.908 0.922 1.00 . A A . 8 ILE HA 1 1 10 3129 1 1 8 ILE HB H -4.928 -1.467 -1.361 1.00 . A A . 8 ILE HB 1 1 10 3130 1 1 8 ILE HD11 H -7.291 0.808 -3.109 1.00 . A A . 8 ILE HD11 1 1 10 3131 1 1 8 ILE HD12 H -7.022 -0.899 -3.461 1.00 . A A . 8 ILE HD12 1 1 10 3132 1 1 8 ILE HD13 H -5.650 0.163 -3.143 1.00 . A A . 8 ILE HD13 1 1 10 3133 1 1 8 ILE HG12 H -7.807 -0.558 -1.177 1.00 . A A . 8 ILE HG12 1 1 10 3134 1 1 8 ILE HG13 H -6.432 0.495 -0.860 1.00 . A A . 8 ILE HG13 1 1 10 3135 1 1 8 ILE HG21 H -6.667 -2.724 -2.650 1.00 . A A . 8 ILE HG21 1 1 10 3136 1 1 8 ILE HG22 H -7.454 -3.090 -1.114 1.00 . A A . 8 ILE HG22 1 1 10 3137 1 1 8 ILE HG23 H -5.821 -3.677 -1.430 1.00 . A A . 8 ILE HG23 1 1 10 3138 1 1 8 ILE N N -5.428 -0.442 1.150 1.00 . A A . 8 ILE N 1 1 10 3139 1 1 8 ILE O O -3.781 -2.864 0.507 1.00 . A A . 8 ILE O 1 1 10 3140 1 1 9 PRO C C -4.047 -5.775 1.086 1.00 . A A . 9 PRO C 1 1 10 3141 1 1 9 PRO CA C -4.628 -4.933 2.225 1.00 . A A . 9 PRO CA 1 1 10 3142 1 1 9 PRO CB C -5.632 -5.763 3.038 1.00 . A A . 9 PRO CB 1 1 10 3143 1 1 9 PRO CD C -6.793 -3.818 2.283 1.00 . A A . 9 PRO CD 1 1 10 3144 1 1 9 PRO CG C -6.978 -5.264 2.635 1.00 . A A . 9 PRO CG 1 1 10 3145 1 1 9 PRO HA H -3.824 -4.611 2.870 1.00 . A A . 9 PRO HA 1 1 10 3146 1 1 9 PRO HB2 H -5.513 -6.809 2.798 1.00 . A A . 9 PRO HB2 1 1 10 3147 1 1 9 PRO HB3 H -5.456 -5.610 4.093 1.00 . A A . 9 PRO HB3 1 1 10 3148 1 1 9 PRO HD2 H -7.508 -3.515 1.531 1.00 . A A . 9 PRO HD2 1 1 10 3149 1 1 9 PRO HD3 H -6.881 -3.199 3.164 1.00 . A A . 9 PRO HD3 1 1 10 3150 1 1 9 PRO HG2 H -7.334 -5.817 1.777 1.00 . A A . 9 PRO HG2 1 1 10 3151 1 1 9 PRO HG3 H -7.669 -5.364 3.460 1.00 . A A . 9 PRO HG3 1 1 10 3152 1 1 9 PRO N N -5.422 -3.783 1.752 1.00 . A A . 9 PRO N 1 1 10 3153 1 1 9 PRO O O -3.177 -6.621 1.304 1.00 . A A . 9 PRO O 1 1 10 3154 1 1 10 ALA C C -2.824 -5.603 -1.882 1.00 . A A . 10 ALA C 1 1 10 3155 1 1 10 ALA CA C -4.058 -6.277 -1.288 1.00 . A A . 10 ALA CA 1 1 10 3156 1 1 10 ALA CB C -5.160 -6.384 -2.331 1.00 . A A . 10 ALA CB 1 1 10 3157 1 1 10 ALA H H -5.242 -4.881 -0.233 1.00 . A A . 10 ALA H 1 1 10 3158 1 1 10 ALA HA H -3.795 -7.276 -0.973 1.00 . A A . 10 ALA HA 1 1 10 3159 1 1 10 ALA HB1 H -4.809 -6.971 -3.168 1.00 . A A . 10 ALA HB1 1 1 10 3160 1 1 10 ALA HB2 H -5.430 -5.396 -2.674 1.00 . A A . 10 ALA HB2 1 1 10 3161 1 1 10 ALA HB3 H -6.025 -6.862 -1.895 1.00 . A A . 10 ALA HB3 1 1 10 3162 1 1 10 ALA N N -4.538 -5.551 -0.123 1.00 . A A . 10 ALA N 1 1 10 3163 1 1 10 ALA O O -1.942 -6.270 -2.419 1.00 . A A . 10 ALA O 1 1 10 3164 1 1 11 CYS C C -0.601 -3.216 -1.216 1.00 . A A . 11 CYS C 1 1 10 3165 1 1 11 CYS CA C -1.623 -3.531 -2.304 1.00 . A A . 11 CYS CA 1 1 10 3166 1 1 11 CYS CB C -2.109 -2.239 -2.970 1.00 . A A . 11 CYS CB 1 1 10 3167 1 1 11 CYS H H -3.458 -3.803 -1.276 1.00 . A A . 11 CYS H 1 1 10 3168 1 1 11 CYS HA H -1.148 -4.151 -3.050 1.00 . A A . 11 CYS HA 1 1 10 3169 1 1 11 CYS HB2 H -3.032 -2.437 -3.494 1.00 . A A . 11 CYS HB2 1 1 10 3170 1 1 11 CYS HB3 H -2.289 -1.495 -2.207 1.00 . A A . 11 CYS HB3 1 1 10 3171 1 1 11 CYS N N -2.749 -4.281 -1.758 1.00 . A A . 11 CYS N 1 1 10 3172 1 1 11 CYS O O 0.609 -3.263 -1.454 1.00 . A A . 11 CYS O 1 1 10 3173 1 1 11 CYS SG S -0.930 -1.529 -4.171 1.00 . A A . 11 CYS SG 1 1 10 3174 1 1 12 ARG C C 0.577 -3.828 1.523 1.00 . A A . 12 ARG C 1 1 10 3175 1 1 12 ARG CA C -0.209 -2.599 1.111 1.00 . A A . 12 ARG CA 1 1 10 3176 1 1 12 ARG CB C -1.013 -2.097 2.303 1.00 . A A . 12 ARG CB 1 1 10 3177 1 1 12 ARG CD C -0.933 -1.002 4.569 1.00 . A A . 12 ARG CD 1 1 10 3178 1 1 12 ARG CG C -0.193 -1.253 3.267 1.00 . A A . 12 ARG CG 1 1 10 3179 1 1 12 ARG CZ C -0.668 0.693 6.348 1.00 . A A . 12 ARG CZ 1 1 10 3180 1 1 12 ARG H H -2.061 -2.889 0.120 1.00 . A A . 12 ARG H 1 1 10 3181 1 1 12 ARG HA H 0.479 -1.829 0.797 1.00 . A A . 12 ARG HA 1 1 10 3182 1 1 12 ARG HB2 H -1.838 -1.508 1.939 1.00 . A A . 12 ARG HB2 1 1 10 3183 1 1 12 ARG HB3 H -1.402 -2.946 2.843 1.00 . A A . 12 ARG HB3 1 1 10 3184 1 1 12 ARG HD2 H -1.856 -0.487 4.350 1.00 . A A . 12 ARG HD2 1 1 10 3185 1 1 12 ARG HD3 H -1.153 -1.953 5.033 1.00 . A A . 12 ARG HD3 1 1 10 3186 1 1 12 ARG HE H 0.831 -0.320 5.490 1.00 . A A . 12 ARG HE 1 1 10 3187 1 1 12 ARG HG2 H 0.730 -1.770 3.485 1.00 . A A . 12 ARG HG2 1 1 10 3188 1 1 12 ARG HG3 H 0.026 -0.303 2.800 1.00 . A A . 12 ARG HG3 1 1 10 3189 1 1 12 ARG HH11 H -2.579 0.441 5.707 1.00 . A A . 12 ARG HH11 1 1 10 3190 1 1 12 ARG HH12 H -2.373 1.584 6.994 1.00 . A A . 12 ARG HH12 1 1 10 3191 1 1 12 ARG HH21 H 1.122 1.210 7.154 1.00 . A A . 12 ARG HH21 1 1 10 3192 1 1 12 ARG HH22 H -0.258 2.026 7.820 1.00 . A A . 12 ARG HH22 1 1 10 3193 1 1 12 ARG N N -1.085 -2.913 -0.014 1.00 . A A . 12 ARG N 1 1 10 3194 1 1 12 ARG NE N -0.145 -0.189 5.498 1.00 . A A . 12 ARG NE 1 1 10 3195 1 1 12 ARG NH1 N -1.977 0.927 6.352 1.00 . A A . 12 ARG NH1 1 1 10 3196 1 1 12 ARG NH2 N 0.126 1.365 7.174 1.00 . A A . 12 ARG NH2 1 1 10 3197 1 1 12 ARG O O 1.580 -3.733 2.216 1.00 . A A . 12 ARG O 1 1 10 3198 1 1 13 ARG C C 2.203 -6.224 0.962 1.00 . A A . 13 ARG C 1 1 10 3199 1 1 13 ARG CA C 0.737 -6.253 1.394 1.00 . A A . 13 ARG CA 1 1 10 3200 1 1 13 ARG CB C 0.001 -7.383 0.677 1.00 . A A . 13 ARG CB 1 1 10 3201 1 1 13 ARG CD C -0.398 -9.843 0.408 1.00 . A A . 13 ARG CD 1 1 10 3202 1 1 13 ARG CG C 0.403 -8.774 1.135 1.00 . A A . 13 ARG CG 1 1 10 3203 1 1 13 ARG CZ C -2.727 -10.049 -0.397 1.00 . A A . 13 ARG CZ 1 1 10 3204 1 1 13 ARG H H -0.745 -4.973 0.591 1.00 . A A . 13 ARG H 1 1 10 3205 1 1 13 ARG HA H 0.689 -6.414 2.458 1.00 . A A . 13 ARG HA 1 1 10 3206 1 1 13 ARG HB2 H -1.060 -7.267 0.845 1.00 . A A . 13 ARG HB2 1 1 10 3207 1 1 13 ARG HB3 H 0.196 -7.307 -0.383 1.00 . A A . 13 ARG HB3 1 1 10 3208 1 1 13 ARG HD2 H -0.101 -9.853 -0.631 1.00 . A A . 13 ARG HD2 1 1 10 3209 1 1 13 ARG HD3 H -0.182 -10.802 0.852 1.00 . A A . 13 ARG HD3 1 1 10 3210 1 1 13 ARG HE H -2.157 -9.055 1.246 1.00 . A A . 13 ARG HE 1 1 10 3211 1 1 13 ARG HG2 H 1.453 -8.923 0.931 1.00 . A A . 13 ARG HG2 1 1 10 3212 1 1 13 ARG HG3 H 0.223 -8.861 2.197 1.00 . A A . 13 ARG HG3 1 1 10 3213 1 1 13 ARG HH11 H -1.350 -10.980 -1.559 1.00 . A A . 13 ARG HH11 1 1 10 3214 1 1 13 ARG HH12 H -2.988 -11.115 -2.103 1.00 . A A . 13 ARG HH12 1 1 10 3215 1 1 13 ARG HH21 H -4.325 -9.225 0.539 1.00 . A A . 13 ARG HH21 1 1 10 3216 1 1 13 ARG HH22 H -4.690 -10.113 -0.902 1.00 . A A . 13 ARG HH22 1 1 10 3217 1 1 13 ARG N N 0.090 -4.981 1.101 1.00 . A A . 13 ARG N 1 1 10 3218 1 1 13 ARG NE N -1.838 -9.594 0.488 1.00 . A A . 13 ARG NE 1 1 10 3219 1 1 13 ARG NH1 N -2.324 -10.773 -1.438 1.00 . A A . 13 ARG NH1 1 1 10 3220 1 1 13 ARG NH2 N -4.017 -9.773 -0.242 1.00 . A A . 13 ARG NH2 1 1 10 3221 1 1 13 ARG O O 3.097 -6.583 1.727 1.00 . A A . 13 ARG O 1 1 10 3222 1 1 14 ASN C C 4.354 -4.282 -0.629 1.00 . A A . 14 ASN C 1 1 10 3223 1 1 14 ASN CA C 3.801 -5.696 -0.788 1.00 . A A . 14 ASN CA 1 1 10 3224 1 1 14 ASN CB C 3.826 -6.119 -2.262 1.00 . A A . 14 ASN CB 1 1 10 3225 1 1 14 ASN CG C 5.236 -6.242 -2.820 1.00 . A A . 14 ASN CG 1 1 10 3226 1 1 14 ASN H H 1.691 -5.495 -0.826 1.00 . A A . 14 ASN H 1 1 10 3227 1 1 14 ASN HA H 4.416 -6.376 -0.217 1.00 . A A . 14 ASN HA 1 1 10 3228 1 1 14 ASN HB2 H 3.338 -7.076 -2.364 1.00 . A A . 14 ASN HB2 1 1 10 3229 1 1 14 ASN HB3 H 3.291 -5.385 -2.847 1.00 . A A . 14 ASN HB3 1 1 10 3230 1 1 14 ASN HD21 H 4.556 -5.999 -4.670 1.00 . A A . 14 ASN HD21 1 1 10 3231 1 1 14 ASN HD22 H 6.262 -6.229 -4.521 1.00 . A A . 14 ASN HD22 1 1 10 3232 1 1 14 ASN N N 2.444 -5.776 -0.263 1.00 . A A . 14 ASN N 1 1 10 3233 1 1 14 ASN ND2 N 5.364 -6.143 -4.135 1.00 . A A . 14 ASN ND2 1 1 10 3234 1 1 14 ASN O O 5.564 -4.056 -0.702 1.00 . A A . 14 ASN O 1 1 10 3235 1 1 14 ASN OD1 O 6.200 -6.433 -2.077 1.00 . A A . 14 ASN OD1 1 1 10 3236 1 1 15 HIS C C 3.897 -1.545 1.255 1.00 . A A . 15 HIS C 1 1 10 3237 1 1 15 HIS CA C 3.860 -1.934 -0.214 1.00 . A A . 15 HIS CA 1 1 10 3238 1 1 15 HIS CB C 2.911 -1.002 -0.976 1.00 . A A . 15 HIS CB 1 1 10 3239 1 1 15 HIS CD2 C 2.457 -1.701 -3.434 1.00 . A A . 15 HIS CD2 1 1 10 3240 1 1 15 HIS CE1 C 3.995 -0.483 -4.407 1.00 . A A . 15 HIS CE1 1 1 10 3241 1 1 15 HIS CG C 3.106 -1.018 -2.462 1.00 . A A . 15 HIS CG 1 1 10 3242 1 1 15 HIS H H 2.516 -3.578 -0.273 1.00 . A A . 15 HIS H 1 1 10 3243 1 1 15 HIS HA H 4.853 -1.830 -0.619 1.00 . A A . 15 HIS HA 1 1 10 3244 1 1 15 HIS HB2 H 1.893 -1.297 -0.775 1.00 . A A . 15 HIS HB2 1 1 10 3245 1 1 15 HIS HB3 H 3.061 0.011 -0.631 1.00 . A A . 15 HIS HB3 1 1 10 3246 1 1 15 HIS HD1 H 4.698 0.350 -2.674 1.00 . A A . 15 HIS HD1 1 1 10 3247 1 1 15 HIS HD2 H 1.639 -2.395 -3.292 1.00 . A A . 15 HIS HD2 1 1 10 3248 1 1 15 HIS HE1 H 4.626 -0.031 -5.157 1.00 . A A . 15 HIS HE1 1 1 10 3249 1 1 15 HIS HE2 H 2.651 -1.553 -5.517 1.00 . A A . 15 HIS HE2 1 1 10 3250 1 1 15 HIS N N 3.463 -3.331 -0.376 1.00 . A A . 15 HIS N 1 1 10 3251 1 1 15 HIS ND1 N 4.066 -0.264 -3.106 1.00 . A A . 15 HIS ND1 1 1 10 3252 1 1 15 HIS NE2 N 3.028 -1.351 -4.633 1.00 . A A . 15 HIS NE2 1 1 10 3253 1 1 15 HIS O O 3.826 -0.368 1.600 1.00 . A A . 15 HIS O 1 1 10 3254 1 1 16 LYS C C 5.331 -1.569 3.944 1.00 . A A . 16 LYS C 1 1 10 3255 1 1 16 LYS CA C 4.078 -2.340 3.553 1.00 . A A . 16 LYS CA 1 1 10 3256 1 1 16 LYS CB C 4.043 -3.690 4.277 1.00 . A A . 16 LYS CB 1 1 10 3257 1 1 16 LYS CD C 3.959 -4.942 6.451 1.00 . A A . 16 LYS CD 1 1 10 3258 1 1 16 LYS CE C 3.912 -4.826 7.965 1.00 . A A . 16 LYS CE 1 1 10 3259 1 1 16 LYS CG C 3.883 -3.579 5.785 1.00 . A A . 16 LYS CG 1 1 10 3260 1 1 16 LYS H H 4.086 -3.459 1.759 1.00 . A A . 16 LYS H 1 1 10 3261 1 1 16 LYS HA H 3.209 -1.765 3.837 1.00 . A A . 16 LYS HA 1 1 10 3262 1 1 16 LYS HB2 H 3.216 -4.269 3.893 1.00 . A A . 16 LYS HB2 1 1 10 3263 1 1 16 LYS HB3 H 4.963 -4.217 4.073 1.00 . A A . 16 LYS HB3 1 1 10 3264 1 1 16 LYS HD2 H 3.123 -5.540 6.120 1.00 . A A . 16 LYS HD2 1 1 10 3265 1 1 16 LYS HD3 H 4.884 -5.421 6.163 1.00 . A A . 16 LYS HD3 1 1 10 3266 1 1 16 LYS HE2 H 4.720 -4.189 8.290 1.00 . A A . 16 LYS HE2 1 1 10 3267 1 1 16 LYS HE3 H 2.969 -4.385 8.251 1.00 . A A . 16 LYS HE3 1 1 10 3268 1 1 16 LYS HG2 H 4.672 -2.953 6.175 1.00 . A A . 16 LYS HG2 1 1 10 3269 1 1 16 LYS HG3 H 2.923 -3.133 6.003 1.00 . A A . 16 LYS HG3 1 1 10 3270 1 1 16 LYS HZ1 H 4.938 -6.605 8.341 1.00 . A A . 16 LYS HZ1 1 1 10 3271 1 1 16 LYS HZ2 H 3.254 -6.769 8.357 1.00 . A A . 16 LYS HZ2 1 1 10 3272 1 1 16 LYS HZ3 H 4.046 -6.038 9.661 1.00 . A A . 16 LYS HZ3 1 1 10 3273 1 1 16 LYS N N 4.031 -2.548 2.109 1.00 . A A . 16 LYS N 1 1 10 3274 1 1 16 LYS NZ N 4.047 -6.153 8.627 1.00 . A A . 16 LYS NZ 1 1 10 3275 1 1 16 LYS O O 5.382 -0.933 4.993 1.00 . A A . 16 LYS O 1 1 10 3276 1 1 17 LYS C C 7.406 0.556 3.233 1.00 . A A . 17 LYS C 1 1 10 3277 1 1 17 LYS CA C 7.594 -0.951 3.311 1.00 . A A . 17 LYS CA 1 1 10 3278 1 1 17 LYS CB C 8.629 -1.397 2.276 1.00 . A A . 17 LYS CB 1 1 10 3279 1 1 17 LYS CD C 8.419 -3.543 0.983 1.00 . A A . 17 LYS CD 1 1 10 3280 1 1 17 LYS CE C 8.471 -5.061 1.060 1.00 . A A . 17 LYS CE 1 1 10 3281 1 1 17 LYS CG C 8.891 -2.896 2.278 1.00 . A A . 17 LYS CG 1 1 10 3282 1 1 17 LYS H H 6.218 -2.157 2.265 1.00 . A A . 17 LYS H 1 1 10 3283 1 1 17 LYS HA H 7.939 -1.210 4.297 1.00 . A A . 17 LYS HA 1 1 10 3284 1 1 17 LYS HB2 H 8.277 -1.117 1.295 1.00 . A A . 17 LYS HB2 1 1 10 3285 1 1 17 LYS HB3 H 9.556 -0.886 2.472 1.00 . A A . 17 LYS HB3 1 1 10 3286 1 1 17 LYS HD2 H 7.401 -3.239 0.790 1.00 . A A . 17 LYS HD2 1 1 10 3287 1 1 17 LYS HD3 H 9.055 -3.210 0.174 1.00 . A A . 17 LYS HD3 1 1 10 3288 1 1 17 LYS HE2 H 9.481 -5.364 1.298 1.00 . A A . 17 LYS HE2 1 1 10 3289 1 1 17 LYS HE3 H 7.804 -5.393 1.842 1.00 . A A . 17 LYS HE3 1 1 10 3290 1 1 17 LYS HG2 H 9.952 -3.065 2.388 1.00 . A A . 17 LYS HG2 1 1 10 3291 1 1 17 LYS HG3 H 8.364 -3.343 3.107 1.00 . A A . 17 LYS HG3 1 1 10 3292 1 1 17 LYS HZ1 H 8.031 -6.735 -0.115 1.00 . A A . 17 LYS HZ1 1 1 10 3293 1 1 17 LYS HZ2 H 8.746 -5.465 -0.973 1.00 . A A . 17 LYS HZ2 1 1 10 3294 1 1 17 LYS HZ3 H 7.121 -5.365 -0.514 1.00 . A A . 17 LYS HZ3 1 1 10 3295 1 1 17 LYS N N 6.334 -1.635 3.080 1.00 . A A . 17 LYS N 1 1 10 3296 1 1 17 LYS NZ N 8.066 -5.700 -0.224 1.00 . A A . 17 LYS NZ 1 1 10 3297 1 1 17 LYS O O 7.883 1.301 4.085 1.00 . A A . 17 LYS O 1 1 10 3298 1 1 18 PHE C C 5.381 2.892 2.970 1.00 . A A . 18 PHE C 1 1 10 3299 1 1 18 PHE CA C 6.444 2.405 1.992 1.00 . A A . 18 PHE CA 1 1 10 3300 1 1 18 PHE CB C 5.989 2.656 0.552 1.00 . A A . 18 PHE CB 1 1 10 3301 1 1 18 PHE CD1 C 5.444 5.100 0.342 1.00 . A A . 18 PHE CD1 1 1 10 3302 1 1 18 PHE CD2 C 7.428 4.285 -0.699 1.00 . A A . 18 PHE CD2 1 1 10 3303 1 1 18 PHE CE1 C 5.723 6.373 -0.114 1.00 . A A . 18 PHE CE1 1 1 10 3304 1 1 18 PHE CE2 C 7.713 5.558 -1.158 1.00 . A A . 18 PHE CE2 1 1 10 3305 1 1 18 PHE CG C 6.292 4.042 0.055 1.00 . A A . 18 PHE CG 1 1 10 3306 1 1 18 PHE CZ C 6.859 6.602 -0.866 1.00 . A A . 18 PHE CZ 1 1 10 3307 1 1 18 PHE H H 6.365 0.343 1.556 1.00 . A A . 18 PHE H 1 1 10 3308 1 1 18 PHE HA H 7.361 2.946 2.173 1.00 . A A . 18 PHE HA 1 1 10 3309 1 1 18 PHE HB2 H 6.485 1.954 -0.101 1.00 . A A . 18 PHE HB2 1 1 10 3310 1 1 18 PHE HB3 H 4.922 2.506 0.488 1.00 . A A . 18 PHE HB3 1 1 10 3311 1 1 18 PHE HD1 H 4.555 4.920 0.929 1.00 . A A . 18 PHE HD1 1 1 10 3312 1 1 18 PHE HD2 H 8.096 3.469 -0.930 1.00 . A A . 18 PHE HD2 1 1 10 3313 1 1 18 PHE HE1 H 5.053 7.189 0.116 1.00 . A A . 18 PHE HE1 1 1 10 3314 1 1 18 PHE HE2 H 8.601 5.734 -1.745 1.00 . A A . 18 PHE HE2 1 1 10 3315 1 1 18 PHE HZ H 7.079 7.597 -1.223 1.00 . A A . 18 PHE HZ 1 1 10 3316 1 1 18 PHE N N 6.708 0.990 2.197 1.00 . A A . 18 PHE N 1 1 10 3317 1 1 18 PHE O O 5.512 3.958 3.567 1.00 . A A . 18 PHE O 1 1 10 3318 1 1 19 CYS C C 3.503 1.901 5.436 1.00 . A A . 19 CYS C 1 1 10 3319 1 1 19 CYS CA C 3.249 2.461 4.038 1.00 . A A . 19 CYS CA 1 1 10 3320 1 1 19 CYS CB C 1.904 1.961 3.500 1.00 . A A . 19 CYS CB 1 1 10 3321 1 1 19 CYS H H 4.296 1.243 2.657 1.00 . A A . 19 CYS H 1 1 10 3322 1 1 19 CYS HA H 3.221 3.539 4.100 1.00 . A A . 19 CYS HA 1 1 10 3323 1 1 19 CYS HB2 H 1.781 0.923 3.759 1.00 . A A . 19 CYS HB2 1 1 10 3324 1 1 19 CYS HB3 H 1.111 2.534 3.957 1.00 . A A . 19 CYS HB3 1 1 10 3325 1 1 19 CYS N N 4.332 2.099 3.136 1.00 . A A . 19 CYS N 1 1 10 3326 1 1 19 CYS O O 2.677 1.163 5.985 1.00 . A A . 19 CYS O 1 1 10 3327 1 1 19 CYS SG S 1.717 2.107 1.693 1.00 . A A . 19 CYS SG 1 1 10 3328 1 1 20 NH2 HN1 H 5.249 2.845 5.514 1.00 . A A . 20 NH2 HN1 1 1 10 3329 1 1 20 NH2 HN2 H 4.836 1.910 6.908 1.00 . A A . 20 NH2 HN2 1 1 10 3330 1 1 20 NH2 N N 4.642 2.254 6.012 1.00 . A A . 20 NH2 N 1 1 11 3331 1 1 1 PHE C C 1.807 6.240 -5.228 1.00 . A A . 1 PHE C 1 1 11 3332 1 1 1 PHE CA C 3.297 6.132 -5.517 1.00 . A A . 1 PHE CA 1 1 11 3333 1 1 1 PHE CB C 4.095 6.131 -4.207 1.00 . A A . 1 PHE CB 1 1 11 3334 1 1 1 PHE CD1 C 3.886 3.739 -3.467 1.00 . A A . 1 PHE CD1 1 1 11 3335 1 1 1 PHE CD2 C 3.004 5.445 -2.052 1.00 . A A . 1 PHE CD2 1 1 11 3336 1 1 1 PHE CE1 C 3.478 2.777 -2.565 1.00 . A A . 1 PHE CE1 1 1 11 3337 1 1 1 PHE CE2 C 2.594 4.485 -1.146 1.00 . A A . 1 PHE CE2 1 1 11 3338 1 1 1 PHE CG C 3.654 5.084 -3.222 1.00 . A A . 1 PHE CG 1 1 11 3339 1 1 1 PHE CZ C 2.831 3.150 -1.403 1.00 . A A . 1 PHE CZ 1 1 11 3340 1 1 1 PHE H1 H 3.515 8.163 -5.900 1.00 . A A . 1 PHE H1 1 1 11 3341 1 1 1 PHE H2 H 3.221 7.233 -7.281 1.00 . A A . 1 PHE H2 1 1 11 3342 1 1 1 PHE H3 H 4.750 7.206 -6.554 1.00 . A A . 1 PHE H3 1 1 11 3343 1 1 1 PHE HA H 3.483 5.209 -6.049 1.00 . A A . 1 PHE HA 1 1 11 3344 1 1 1 PHE HB2 H 5.136 5.957 -4.430 1.00 . A A . 1 PHE HB2 1 1 11 3345 1 1 1 PHE HB3 H 3.991 7.097 -3.733 1.00 . A A . 1 PHE HB3 1 1 11 3346 1 1 1 PHE HD1 H 4.392 3.445 -4.375 1.00 . A A . 1 PHE HD1 1 1 11 3347 1 1 1 PHE HD2 H 2.818 6.489 -1.850 1.00 . A A . 1 PHE HD2 1 1 11 3348 1 1 1 PHE HE1 H 3.663 1.732 -2.767 1.00 . A A . 1 PHE HE1 1 1 11 3349 1 1 1 PHE HE2 H 2.088 4.780 -0.239 1.00 . A A . 1 PHE HE2 1 1 11 3350 1 1 1 PHE HZ H 2.510 2.399 -0.697 1.00 . A A . 1 PHE HZ 1 1 11 3351 1 1 1 PHE N N 3.728 7.261 -6.373 1.00 . A A . 1 PHE N 1 1 11 3352 1 1 1 PHE O O 1.287 7.342 -5.061 1.00 . A A . 1 PHE O 1 1 11 3353 1 1 2 ASN C C -0.556 4.890 -3.424 1.00 . A A . 2 ASN C 1 1 11 3354 1 1 2 ASN CA C -0.306 5.084 -4.914 1.00 . A A . 2 ASN CA 1 1 11 3355 1 1 2 ASN CB C -0.992 3.971 -5.711 1.00 . A A . 2 ASN CB 1 1 11 3356 1 1 2 ASN CG C -2.492 3.933 -5.481 1.00 . A A . 2 ASN CG 1 1 11 3357 1 1 2 ASN H H 1.592 4.257 -5.332 1.00 . A A . 2 ASN H 1 1 11 3358 1 1 2 ASN HA H -0.715 6.037 -5.215 1.00 . A A . 2 ASN HA 1 1 11 3359 1 1 2 ASN HB2 H -0.812 4.127 -6.764 1.00 . A A . 2 ASN HB2 1 1 11 3360 1 1 2 ASN HB3 H -0.577 3.018 -5.416 1.00 . A A . 2 ASN HB3 1 1 11 3361 1 1 2 ASN HD21 H -2.534 1.994 -5.908 1.00 . A A . 2 ASN HD21 1 1 11 3362 1 1 2 ASN HD22 H -4.056 2.713 -5.521 1.00 . A A . 2 ASN HD22 1 1 11 3363 1 1 2 ASN N N 1.125 5.105 -5.186 1.00 . A A . 2 ASN N 1 1 11 3364 1 1 2 ASN ND2 N -3.087 2.762 -5.650 1.00 . A A . 2 ASN ND2 1 1 11 3365 1 1 2 ASN O O -0.549 3.764 -2.925 1.00 . A A . 2 ASN O 1 1 11 3366 1 1 2 ASN OD1 O -3.109 4.944 -5.149 1.00 . A A . 2 ASN OD1 1 1 11 3367 1 1 3 TRP C C -2.276 5.166 -0.954 1.00 . A A . 3 TRP C 1 1 11 3368 1 1 3 TRP CA C -1.023 5.971 -1.286 1.00 . A A . 3 TRP CA 1 1 11 3369 1 1 3 TRP CB C -1.146 7.398 -0.737 1.00 . A A . 3 TRP CB 1 1 11 3370 1 1 3 TRP CD1 C -2.019 8.934 -2.600 1.00 . A A . 3 TRP CD1 1 1 11 3371 1 1 3 TRP CD2 C -3.531 8.457 -1.021 1.00 . A A . 3 TRP CD2 1 1 11 3372 1 1 3 TRP CE2 C -4.131 9.296 -1.978 1.00 . A A . 3 TRP CE2 1 1 11 3373 1 1 3 TRP CE3 C -4.295 8.026 0.068 1.00 . A A . 3 TRP CE3 1 1 11 3374 1 1 3 TRP CG C -2.180 8.232 -1.439 1.00 . A A . 3 TRP CG 1 1 11 3375 1 1 3 TRP CH2 C -6.178 9.277 -0.800 1.00 . A A . 3 TRP CH2 1 1 11 3376 1 1 3 TRP CZ2 C -5.456 9.714 -1.876 1.00 . A A . 3 TRP CZ2 1 1 11 3377 1 1 3 TRP CZ3 C -5.609 8.442 0.168 1.00 . A A . 3 TRP CZ3 1 1 11 3378 1 1 3 TRP H H -0.775 6.860 -3.190 1.00 . A A . 3 TRP H 1 1 11 3379 1 1 3 TRP HA H -0.178 5.491 -0.822 1.00 . A A . 3 TRP HA 1 1 11 3380 1 1 3 TRP HB2 H -1.413 7.351 0.308 1.00 . A A . 3 TRP HB2 1 1 11 3381 1 1 3 TRP HB3 H -0.193 7.896 -0.837 1.00 . A A . 3 TRP HB3 1 1 11 3382 1 1 3 TRP HD1 H -1.099 8.967 -3.167 1.00 . A A . 3 TRP HD1 1 1 11 3383 1 1 3 TRP HE1 H -3.324 10.136 -3.723 1.00 . A A . 3 TRP HE1 1 1 11 3384 1 1 3 TRP HE3 H -3.873 7.381 0.825 1.00 . A A . 3 TRP HE3 1 1 11 3385 1 1 3 TRP HH2 H -7.209 9.578 -0.682 1.00 . A A . 3 TRP HH2 1 1 11 3386 1 1 3 TRP HZ2 H -5.910 10.359 -2.615 1.00 . A A . 3 TRP HZ2 1 1 11 3387 1 1 3 TRP HZ3 H -6.213 8.119 1.003 1.00 . A A . 3 TRP HZ3 1 1 11 3388 1 1 3 TRP N N -0.777 5.997 -2.726 1.00 . A A . 3 TRP N 1 1 11 3389 1 1 3 TRP NE1 N -3.188 9.572 -2.932 1.00 . A A . 3 TRP NE1 1 1 11 3390 1 1 3 TRP O O -2.415 4.635 0.147 1.00 . A A . 3 TRP O 1 1 11 3391 1 1 4 ARG C C -4.138 2.849 -1.453 1.00 . A A . 4 ARG C 1 1 11 3392 1 1 4 ARG CA C -4.411 4.310 -1.737 1.00 . A A . 4 ARG CA 1 1 11 3393 1 1 4 ARG CB C -5.319 4.436 -2.956 1.00 . A A . 4 ARG CB 1 1 11 3394 1 1 4 ARG CD C -7.201 5.492 -1.654 1.00 . A A . 4 ARG CD 1 1 11 3395 1 1 4 ARG CG C -6.302 5.594 -2.880 1.00 . A A . 4 ARG CG 1 1 11 3396 1 1 4 ARG CZ C -8.729 3.856 -0.599 1.00 . A A . 4 ARG CZ 1 1 11 3397 1 1 4 ARG H H -2.993 5.478 -2.789 1.00 . A A . 4 ARG H 1 1 11 3398 1 1 4 ARG HA H -4.906 4.726 -0.884 1.00 . A A . 4 ARG HA 1 1 11 3399 1 1 4 ARG HB2 H -4.702 4.576 -3.832 1.00 . A A . 4 ARG HB2 1 1 11 3400 1 1 4 ARG HB3 H -5.873 3.518 -3.063 1.00 . A A . 4 ARG HB3 1 1 11 3401 1 1 4 ARG HD2 H -6.614 5.713 -0.774 1.00 . A A . 4 ARG HD2 1 1 11 3402 1 1 4 ARG HD3 H -7.994 6.220 -1.746 1.00 . A A . 4 ARG HD3 1 1 11 3403 1 1 4 ARG HE H -7.467 3.453 -2.102 1.00 . A A . 4 ARG HE 1 1 11 3404 1 1 4 ARG HG2 H -5.749 6.519 -2.831 1.00 . A A . 4 ARG HG2 1 1 11 3405 1 1 4 ARG HG3 H -6.917 5.588 -3.768 1.00 . A A . 4 ARG HG3 1 1 11 3406 1 1 4 ARG HH11 H -8.861 5.735 0.148 1.00 . A A . 4 ARG HH11 1 1 11 3407 1 1 4 ARG HH12 H -9.903 4.569 0.892 1.00 . A A . 4 ARG HH12 1 1 11 3408 1 1 4 ARG HH21 H -8.837 1.897 -1.118 1.00 . A A . 4 ARG HH21 1 1 11 3409 1 1 4 ARG HH22 H -9.886 2.377 0.172 1.00 . A A . 4 ARG HH22 1 1 11 3410 1 1 4 ARG N N -3.173 5.054 -1.926 1.00 . A A . 4 ARG N 1 1 11 3411 1 1 4 ARG NE N -7.794 4.160 -1.503 1.00 . A A . 4 ARG NE 1 1 11 3412 1 1 4 ARG NH1 N -9.204 4.795 0.211 1.00 . A A . 4 ARG NH1 1 1 11 3413 1 1 4 ARG NH2 N -9.189 2.611 -0.509 1.00 . A A . 4 ARG NH2 1 1 11 3414 1 1 4 ARG O O -4.957 2.161 -0.847 1.00 . A A . 4 ARG O 1 1 11 3415 1 1 5 CYS C C -2.475 0.722 -0.188 1.00 . A A . 5 CYS C 1 1 11 3416 1 1 5 CYS CA C -2.575 1.015 -1.675 1.00 . A A . 5 CYS CA 1 1 11 3417 1 1 5 CYS CB C -1.227 0.747 -2.330 1.00 . A A . 5 CYS CB 1 1 11 3418 1 1 5 CYS H H -2.393 3.004 -2.376 1.00 . A A . 5 CYS H 1 1 11 3419 1 1 5 CYS HA H -3.319 0.368 -2.113 1.00 . A A . 5 CYS HA 1 1 11 3420 1 1 5 CYS HB2 H -0.602 1.619 -2.207 1.00 . A A . 5 CYS HB2 1 1 11 3421 1 1 5 CYS HB3 H -0.759 -0.096 -1.843 1.00 . A A . 5 CYS HB3 1 1 11 3422 1 1 5 CYS N N -2.987 2.392 -1.891 1.00 . A A . 5 CYS N 1 1 11 3423 1 1 5 CYS O O -2.745 -0.389 0.254 1.00 . A A . 5 CYS O 1 1 11 3424 1 1 5 CYS SG S -1.326 0.376 -4.112 1.00 . A A . 5 CYS SG 1 1 11 3425 1 1 6 CYS C C -3.340 1.403 2.688 1.00 . A A . 6 CYS C 1 1 11 3426 1 1 6 CYS CA C -1.980 1.577 2.023 1.00 . A A . 6 CYS CA 1 1 11 3427 1 1 6 CYS CB C -1.234 2.770 2.615 1.00 . A A . 6 CYS CB 1 1 11 3428 1 1 6 CYS H H -1.973 2.625 0.175 1.00 . A A . 6 CYS H 1 1 11 3429 1 1 6 CYS HA H -1.398 0.680 2.195 1.00 . A A . 6 CYS HA 1 1 11 3430 1 1 6 CYS HB2 H -1.921 3.591 2.748 1.00 . A A . 6 CYS HB2 1 1 11 3431 1 1 6 CYS HB3 H -0.824 2.484 3.574 1.00 . A A . 6 CYS HB3 1 1 11 3432 1 1 6 CYS N N -2.125 1.738 0.583 1.00 . A A . 6 CYS N 1 1 11 3433 1 1 6 CYS O O -3.434 0.948 3.829 1.00 . A A . 6 CYS O 1 1 11 3434 1 1 6 CYS SG S 0.147 3.352 1.578 1.00 . A A . 6 CYS SG 1 1 11 3435 1 1 7 LEU C C -6.378 0.358 1.878 1.00 . A A . 7 LEU C 1 1 11 3436 1 1 7 LEU CA C -5.747 1.614 2.464 1.00 . A A . 7 LEU CA 1 1 11 3437 1 1 7 LEU CB C -6.588 2.846 2.115 1.00 . A A . 7 LEU CB 1 1 11 3438 1 1 7 LEU CD1 C -5.196 4.935 2.026 1.00 . A A . 7 LEU CD1 1 1 11 3439 1 1 7 LEU CD2 C -7.428 4.969 3.156 1.00 . A A . 7 LEU CD2 1 1 11 3440 1 1 7 LEU CG C -6.195 4.133 2.847 1.00 . A A . 7 LEU CG 1 1 11 3441 1 1 7 LEU H H -4.249 2.111 1.057 1.00 . A A . 7 LEU H 1 1 11 3442 1 1 7 LEU HA H -5.695 1.510 3.537 1.00 . A A . 7 LEU HA 1 1 11 3443 1 1 7 LEU HB2 H -6.506 3.022 1.052 1.00 . A A . 7 LEU HB2 1 1 11 3444 1 1 7 LEU HB3 H -7.620 2.628 2.349 1.00 . A A . 7 LEU HB3 1 1 11 3445 1 1 7 LEU HD11 H -4.918 5.827 2.569 1.00 . A A . 7 LEU HD11 1 1 11 3446 1 1 7 LEU HD12 H -5.644 5.213 1.084 1.00 . A A . 7 LEU HD12 1 1 11 3447 1 1 7 LEU HD13 H -4.316 4.337 1.844 1.00 . A A . 7 LEU HD13 1 1 11 3448 1 1 7 LEU HD21 H -7.930 5.223 2.234 1.00 . A A . 7 LEU HD21 1 1 11 3449 1 1 7 LEU HD22 H -7.131 5.874 3.665 1.00 . A A . 7 LEU HD22 1 1 11 3450 1 1 7 LEU HD23 H -8.097 4.403 3.787 1.00 . A A . 7 LEU HD23 1 1 11 3451 1 1 7 LEU HG H -5.722 3.874 3.783 1.00 . A A . 7 LEU HG 1 1 11 3452 1 1 7 LEU N N -4.390 1.753 1.961 1.00 . A A . 7 LEU N 1 1 11 3453 1 1 7 LEU O O -7.558 0.078 2.082 1.00 . A A . 7 LEU O 1 1 11 3454 1 1 8 ILE C C -5.042 -2.745 0.890 1.00 . A A . 8 ILE C 1 1 11 3455 1 1 8 ILE CA C -6.007 -1.628 0.511 1.00 . A A . 8 ILE CA 1 1 11 3456 1 1 8 ILE CB C -6.073 -1.508 -1.029 1.00 . A A . 8 ILE CB 1 1 11 3457 1 1 8 ILE CD1 C -6.896 0.005 -2.911 1.00 . A A . 8 ILE CD1 1 1 11 3458 1 1 8 ILE CG1 C -6.980 -0.343 -1.440 1.00 . A A . 8 ILE CG1 1 1 11 3459 1 1 8 ILE CG2 C -6.571 -2.811 -1.644 1.00 . A A . 8 ILE CG2 1 1 11 3460 1 1 8 ILE H H -4.639 -0.099 1.003 1.00 . A A . 8 ILE H 1 1 11 3461 1 1 8 ILE HA H -6.993 -1.866 0.885 1.00 . A A . 8 ILE HA 1 1 11 3462 1 1 8 ILE HB H -5.074 -1.325 -1.396 1.00 . A A . 8 ILE HB 1 1 11 3463 1 1 8 ILE HD11 H -5.888 0.307 -3.152 1.00 . A A . 8 ILE HD11 1 1 11 3464 1 1 8 ILE HD12 H -7.576 0.816 -3.128 1.00 . A A . 8 ILE HD12 1 1 11 3465 1 1 8 ILE HD13 H -7.164 -0.858 -3.501 1.00 . A A . 8 ILE HD13 1 1 11 3466 1 1 8 ILE HG12 H -8.005 -0.600 -1.219 1.00 . A A . 8 ILE HG12 1 1 11 3467 1 1 8 ILE HG13 H -6.704 0.534 -0.874 1.00 . A A . 8 ILE HG13 1 1 11 3468 1 1 8 ILE HG21 H -5.892 -3.612 -1.388 1.00 . A A . 8 ILE HG21 1 1 11 3469 1 1 8 ILE HG22 H -6.619 -2.708 -2.718 1.00 . A A . 8 ILE HG22 1 1 11 3470 1 1 8 ILE HG23 H -7.555 -3.038 -1.260 1.00 . A A . 8 ILE HG23 1 1 11 3471 1 1 8 ILE N N -5.570 -0.389 1.133 1.00 . A A . 8 ILE N 1 1 11 3472 1 1 8 ILE O O -3.938 -2.826 0.352 1.00 . A A . 8 ILE O 1 1 11 3473 1 1 9 PRO C C -3.908 -5.507 1.219 1.00 . A A . 9 PRO C 1 1 11 3474 1 1 9 PRO CA C -4.635 -4.735 2.320 1.00 . A A . 9 PRO CA 1 1 11 3475 1 1 9 PRO CB C -5.662 -5.633 3.006 1.00 . A A . 9 PRO CB 1 1 11 3476 1 1 9 PRO CD C -6.774 -3.575 2.491 1.00 . A A . 9 PRO CD 1 1 11 3477 1 1 9 PRO CG C -6.706 -4.694 3.498 1.00 . A A . 9 PRO CG 1 1 11 3478 1 1 9 PRO HA H -3.914 -4.399 3.049 1.00 . A A . 9 PRO HA 1 1 11 3479 1 1 9 PRO HB2 H -6.065 -6.337 2.291 1.00 . A A . 9 PRO HB2 1 1 11 3480 1 1 9 PRO HB3 H -5.194 -6.166 3.821 1.00 . A A . 9 PRO HB3 1 1 11 3481 1 1 9 PRO HD2 H -7.566 -3.757 1.780 1.00 . A A . 9 PRO HD2 1 1 11 3482 1 1 9 PRO HD3 H -6.922 -2.629 2.989 1.00 . A A . 9 PRO HD3 1 1 11 3483 1 1 9 PRO HG2 H -7.657 -5.202 3.558 1.00 . A A . 9 PRO HG2 1 1 11 3484 1 1 9 PRO HG3 H -6.424 -4.307 4.466 1.00 . A A . 9 PRO HG3 1 1 11 3485 1 1 9 PRO N N -5.454 -3.618 1.826 1.00 . A A . 9 PRO N 1 1 11 3486 1 1 9 PRO O O -2.780 -5.951 1.410 1.00 . A A . 9 PRO O 1 1 11 3487 1 1 10 ALA C C -2.743 -5.662 -1.623 1.00 . A A . 10 ALA C 1 1 11 3488 1 1 10 ALA CA C -3.970 -6.376 -1.054 1.00 . A A . 10 ALA CA 1 1 11 3489 1 1 10 ALA CB C -5.012 -6.581 -2.142 1.00 . A A . 10 ALA CB 1 1 11 3490 1 1 10 ALA H H -5.444 -5.258 -0.029 1.00 . A A . 10 ALA H 1 1 11 3491 1 1 10 ALA HA H -3.670 -7.351 -0.696 1.00 . A A . 10 ALA HA 1 1 11 3492 1 1 10 ALA HB1 H -5.873 -7.084 -1.727 1.00 . A A . 10 ALA HB1 1 1 11 3493 1 1 10 ALA HB2 H -4.592 -7.182 -2.936 1.00 . A A . 10 ALA HB2 1 1 11 3494 1 1 10 ALA HB3 H -5.312 -5.621 -2.537 1.00 . A A . 10 ALA HB3 1 1 11 3495 1 1 10 ALA N N -4.553 -5.651 0.069 1.00 . A A . 10 ALA N 1 1 11 3496 1 1 10 ALA O O -1.752 -6.302 -1.970 1.00 . A A . 10 ALA O 1 1 11 3497 1 1 11 CYS C C -0.694 -3.179 -1.152 1.00 . A A . 11 CYS C 1 1 11 3498 1 1 11 CYS CA C -1.688 -3.567 -2.243 1.00 . A A . 11 CYS CA 1 1 11 3499 1 1 11 CYS CB C -2.208 -2.312 -2.954 1.00 . A A . 11 CYS CB 1 1 11 3500 1 1 11 CYS H H -3.587 -3.870 -1.347 1.00 . A A . 11 CYS H 1 1 11 3501 1 1 11 CYS HA H -1.182 -4.191 -2.964 1.00 . A A . 11 CYS HA 1 1 11 3502 1 1 11 CYS HB2 H -3.138 -2.547 -3.449 1.00 . A A . 11 CYS HB2 1 1 11 3503 1 1 11 CYS HB3 H -2.383 -1.538 -2.220 1.00 . A A . 11 CYS HB3 1 1 11 3504 1 1 11 CYS N N -2.796 -4.339 -1.692 1.00 . A A . 11 CYS N 1 1 11 3505 1 1 11 CYS O O 0.510 -3.082 -1.401 1.00 . A A . 11 CYS O 1 1 11 3506 1 1 11 CYS SG S -1.066 -1.638 -4.209 1.00 . A A . 11 CYS SG 1 1 11 3507 1 1 12 ARG C C 0.601 -3.719 1.549 1.00 . A A . 12 ARG C 1 1 11 3508 1 1 12 ARG CA C -0.348 -2.590 1.184 1.00 . A A . 12 ARG CA 1 1 11 3509 1 1 12 ARG CB C -1.190 -2.218 2.399 1.00 . A A . 12 ARG CB 1 1 11 3510 1 1 12 ARG CD C -1.243 -1.178 4.686 1.00 . A A . 12 ARG CD 1 1 11 3511 1 1 12 ARG CG C -0.412 -1.443 3.446 1.00 . A A . 12 ARG CG 1 1 11 3512 1 1 12 ARG CZ C -0.988 0.472 6.505 1.00 . A A . 12 ARG CZ 1 1 11 3513 1 1 12 ARG H H -2.167 -3.056 0.200 1.00 . A A . 12 ARG H 1 1 11 3514 1 1 12 ARG HA H 0.233 -1.731 0.884 1.00 . A A . 12 ARG HA 1 1 11 3515 1 1 12 ARG HB2 H -2.022 -1.619 2.072 1.00 . A A . 12 ARG HB2 1 1 11 3516 1 1 12 ARG HB3 H -1.565 -3.119 2.855 1.00 . A A . 12 ARG HB3 1 1 11 3517 1 1 12 ARG HD2 H -2.103 -0.584 4.409 1.00 . A A . 12 ARG HD2 1 1 11 3518 1 1 12 ARG HD3 H -1.572 -2.122 5.092 1.00 . A A . 12 ARG HD3 1 1 11 3519 1 1 12 ARG HE H 0.474 -0.699 5.800 1.00 . A A . 12 ARG HE 1 1 11 3520 1 1 12 ARG HG2 H 0.460 -2.014 3.727 1.00 . A A . 12 ARG HG2 1 1 11 3521 1 1 12 ARG HG3 H -0.102 -0.498 3.022 1.00 . A A . 12 ARG HG3 1 1 11 3522 1 1 12 ARG HH11 H -2.840 0.421 5.670 1.00 . A A . 12 ARG HH11 1 1 11 3523 1 1 12 ARG HH12 H -2.647 1.541 6.980 1.00 . A A . 12 ARG HH12 1 1 11 3524 1 1 12 ARG HH21 H 0.751 0.788 7.499 1.00 . A A . 12 ARG HH21 1 1 11 3525 1 1 12 ARG HH22 H -0.591 1.753 8.027 1.00 . A A . 12 ARG HH22 1 1 11 3526 1 1 12 ARG N N -1.197 -2.968 0.060 1.00 . A A . 12 ARG N 1 1 11 3527 1 1 12 ARG NE N -0.478 -0.462 5.705 1.00 . A A . 12 ARG NE 1 1 11 3528 1 1 12 ARG NH1 N -2.259 0.843 6.377 1.00 . A A . 12 ARG NH1 1 1 11 3529 1 1 12 ARG NH2 N -0.216 1.053 7.416 1.00 . A A . 12 ARG NH2 1 1 11 3530 1 1 12 ARG O O 1.690 -3.485 2.062 1.00 . A A . 12 ARG O 1 1 11 3531 1 1 13 ARG C C 2.287 -6.075 0.768 1.00 . A A . 13 ARG C 1 1 11 3532 1 1 13 ARG CA C 0.993 -6.115 1.572 1.00 . A A . 13 ARG CA 1 1 11 3533 1 1 13 ARG CB C 0.227 -7.400 1.260 1.00 . A A . 13 ARG CB 1 1 11 3534 1 1 13 ARG CD C -1.459 -9.101 2.004 1.00 . A A . 13 ARG CD 1 1 11 3535 1 1 13 ARG CG C -0.629 -7.896 2.412 1.00 . A A . 13 ARG CG 1 1 11 3536 1 1 13 ARG CZ C -2.777 -10.853 3.141 1.00 . A A . 13 ARG CZ 1 1 11 3537 1 1 13 ARG H H -0.724 -5.060 0.906 1.00 . A A . 13 ARG H 1 1 11 3538 1 1 13 ARG HA H 1.239 -6.096 2.622 1.00 . A A . 13 ARG HA 1 1 11 3539 1 1 13 ARG HB2 H -0.417 -7.224 0.411 1.00 . A A . 13 ARG HB2 1 1 11 3540 1 1 13 ARG HB3 H 0.936 -8.175 1.008 1.00 . A A . 13 ARG HB3 1 1 11 3541 1 1 13 ARG HD2 H -2.125 -8.810 1.205 1.00 . A A . 13 ARG HD2 1 1 11 3542 1 1 13 ARG HD3 H -0.794 -9.876 1.652 1.00 . A A . 13 ARG HD3 1 1 11 3543 1 1 13 ARG HE H -2.406 -9.027 3.878 1.00 . A A . 13 ARG HE 1 1 11 3544 1 1 13 ARG HG2 H 0.014 -8.175 3.233 1.00 . A A . 13 ARG HG2 1 1 11 3545 1 1 13 ARG HG3 H -1.292 -7.102 2.723 1.00 . A A . 13 ARG HG3 1 1 11 3546 1 1 13 ARG HH11 H -2.047 -11.389 1.327 1.00 . A A . 13 ARG HH11 1 1 11 3547 1 1 13 ARG HH12 H -2.979 -12.604 2.136 1.00 . A A . 13 ARG HH12 1 1 11 3548 1 1 13 ARG HH21 H -3.639 -10.628 4.963 1.00 . A A . 13 ARG HH21 1 1 11 3549 1 1 13 ARG HH22 H -3.888 -12.169 4.213 1.00 . A A . 13 ARG HH22 1 1 11 3550 1 1 13 ARG N N 0.173 -4.943 1.287 1.00 . A A . 13 ARG N 1 1 11 3551 1 1 13 ARG NE N -2.254 -9.626 3.114 1.00 . A A . 13 ARG NE 1 1 11 3552 1 1 13 ARG NH1 N -2.586 -11.682 2.119 1.00 . A A . 13 ARG NH1 1 1 11 3553 1 1 13 ARG NH2 N -3.492 -11.248 4.190 1.00 . A A . 13 ARG NH2 1 1 11 3554 1 1 13 ARG O O 3.334 -6.520 1.237 1.00 . A A . 13 ARG O 1 1 11 3555 1 1 14 ASN C C 4.090 -4.104 -1.086 1.00 . A A . 14 ASN C 1 1 11 3556 1 1 14 ASN CA C 3.362 -5.427 -1.315 1.00 . A A . 14 ASN CA 1 1 11 3557 1 1 14 ASN CB C 2.920 -5.543 -2.781 1.00 . A A . 14 ASN CB 1 1 11 3558 1 1 14 ASN CG C 4.012 -5.155 -3.764 1.00 . A A . 14 ASN CG 1 1 11 3559 1 1 14 ASN H H 1.337 -5.198 -0.750 1.00 . A A . 14 ASN H 1 1 11 3560 1 1 14 ASN HA H 4.033 -6.240 -1.083 1.00 . A A . 14 ASN HA 1 1 11 3561 1 1 14 ASN HB2 H 2.631 -6.562 -2.982 1.00 . A A . 14 ASN HB2 1 1 11 3562 1 1 14 ASN HB3 H 2.071 -4.895 -2.943 1.00 . A A . 14 ASN HB3 1 1 11 3563 1 1 14 ASN HD21 H 4.714 -7.013 -3.763 1.00 . A A . 14 ASN HD21 1 1 11 3564 1 1 14 ASN HD22 H 5.560 -5.890 -4.765 1.00 . A A . 14 ASN HD22 1 1 11 3565 1 1 14 ASN N N 2.203 -5.533 -0.438 1.00 . A A . 14 ASN N 1 1 11 3566 1 1 14 ASN ND2 N 4.845 -6.116 -4.136 1.00 . A A . 14 ASN ND2 1 1 11 3567 1 1 14 ASN O O 5.299 -4.001 -1.282 1.00 . A A . 14 ASN O 1 1 11 3568 1 1 14 ASN OD1 O 4.101 -4.003 -4.190 1.00 . A A . 14 ASN OD1 1 1 11 3569 1 1 15 HIS C C 4.044 -1.482 1.079 1.00 . A A . 15 HIS C 1 1 11 3570 1 1 15 HIS CA C 3.935 -1.782 -0.410 1.00 . A A . 15 HIS CA 1 1 11 3571 1 1 15 HIS CB C 3.111 -0.704 -1.120 1.00 . A A . 15 HIS CB 1 1 11 3572 1 1 15 HIS CD2 C 2.169 -1.206 -3.484 1.00 . A A . 15 HIS CD2 1 1 11 3573 1 1 15 HIS CE1 C 3.971 -0.778 -4.649 1.00 . A A . 15 HIS CE1 1 1 11 3574 1 1 15 HIS CG C 3.133 -0.829 -2.612 1.00 . A A . 15 HIS CG 1 1 11 3575 1 1 15 HIS H H 2.402 -3.249 -0.446 1.00 . A A . 15 HIS H 1 1 11 3576 1 1 15 HIS HA H 4.929 -1.789 -0.830 1.00 . A A . 15 HIS HA 1 1 11 3577 1 1 15 HIS HB2 H 2.083 -0.772 -0.794 1.00 . A A . 15 HIS HB2 1 1 11 3578 1 1 15 HIS HB3 H 3.502 0.270 -0.859 1.00 . A A . 15 HIS HB3 1 1 11 3579 1 1 15 HIS HD1 H 5.124 -0.278 -3.035 1.00 . A A . 15 HIS HD1 1 1 11 3580 1 1 15 HIS HD2 H 1.155 -1.485 -3.233 1.00 . A A . 15 HIS HD2 1 1 11 3581 1 1 15 HIS HE1 H 4.656 -0.652 -5.475 1.00 . A A . 15 HIS HE1 1 1 11 3582 1 1 15 HIS HE2 H 2.320 -1.589 -5.537 1.00 . A A . 15 HIS HE2 1 1 11 3583 1 1 15 HIS N N 3.353 -3.099 -0.640 1.00 . A A . 15 HIS N 1 1 11 3584 1 1 15 HIS ND1 N 4.251 -0.567 -3.377 1.00 . A A . 15 HIS ND1 1 1 11 3585 1 1 15 HIS NE2 N 2.714 -1.167 -4.744 1.00 . A A . 15 HIS NE2 1 1 11 3586 1 1 15 HIS O O 3.896 -0.339 1.511 1.00 . A A . 15 HIS O 1 1 11 3587 1 1 16 LYS C C 5.742 -1.626 3.667 1.00 . A A . 16 LYS C 1 1 11 3588 1 1 16 LYS CA C 4.474 -2.392 3.303 1.00 . A A . 16 LYS CA 1 1 11 3589 1 1 16 LYS CB C 4.499 -3.775 3.959 1.00 . A A . 16 LYS CB 1 1 11 3590 1 1 16 LYS CD C 5.729 -5.955 4.260 1.00 . A A . 16 LYS CD 1 1 11 3591 1 1 16 LYS CE C 4.473 -6.800 4.131 1.00 . A A . 16 LYS CE 1 1 11 3592 1 1 16 LYS CG C 5.626 -4.666 3.457 1.00 . A A . 16 LYS CG 1 1 11 3593 1 1 16 LYS H H 4.453 -3.401 1.442 1.00 . A A . 16 LYS H 1 1 11 3594 1 1 16 LYS HA H 3.619 -1.845 3.670 1.00 . A A . 16 LYS HA 1 1 11 3595 1 1 16 LYS HB2 H 4.613 -3.653 5.026 1.00 . A A . 16 LYS HB2 1 1 11 3596 1 1 16 LYS HB3 H 3.561 -4.271 3.761 1.00 . A A . 16 LYS HB3 1 1 11 3597 1 1 16 LYS HD2 H 6.571 -6.525 3.898 1.00 . A A . 16 LYS HD2 1 1 11 3598 1 1 16 LYS HD3 H 5.882 -5.708 5.300 1.00 . A A . 16 LYS HD3 1 1 11 3599 1 1 16 LYS HE2 H 3.657 -6.287 4.618 1.00 . A A . 16 LYS HE2 1 1 11 3600 1 1 16 LYS HE3 H 4.244 -6.925 3.083 1.00 . A A . 16 LYS HE3 1 1 11 3601 1 1 16 LYS HG2 H 5.442 -4.914 2.423 1.00 . A A . 16 LYS HG2 1 1 11 3602 1 1 16 LYS HG3 H 6.559 -4.128 3.538 1.00 . A A . 16 LYS HG3 1 1 11 3603 1 1 16 LYS HZ1 H 3.802 -8.728 4.570 1.00 . A A . 16 LYS HZ1 1 1 11 3604 1 1 16 LYS HZ2 H 4.765 -8.044 5.782 1.00 . A A . 16 LYS HZ2 1 1 11 3605 1 1 16 LYS HZ3 H 5.476 -8.617 4.359 1.00 . A A . 16 LYS HZ3 1 1 11 3606 1 1 16 LYS N N 4.338 -2.519 1.854 1.00 . A A . 16 LYS N 1 1 11 3607 1 1 16 LYS NZ N 4.640 -8.141 4.754 1.00 . A A . 16 LYS NZ 1 1 11 3608 1 1 16 LYS O O 5.974 -1.308 4.831 1.00 . A A . 16 LYS O 1 1 11 3609 1 1 17 LYS C C 7.543 0.874 2.947 1.00 . A A . 17 LYS C 1 1 11 3610 1 1 17 LYS CA C 7.804 -0.620 2.888 1.00 . A A . 17 LYS CA 1 1 11 3611 1 1 17 LYS CB C 8.818 -0.936 1.789 1.00 . A A . 17 LYS CB 1 1 11 3612 1 1 17 LYS CD C 10.872 -0.852 3.239 1.00 . A A . 17 LYS CD 1 1 11 3613 1 1 17 LYS CE C 12.008 -1.653 3.855 1.00 . A A . 17 LYS CE 1 1 11 3614 1 1 17 LYS CG C 10.040 -1.696 2.285 1.00 . A A . 17 LYS CG 1 1 11 3615 1 1 17 LYS H H 6.336 -1.640 1.763 1.00 . A A . 17 LYS H 1 1 11 3616 1 1 17 LYS HA H 8.199 -0.933 3.837 1.00 . A A . 17 LYS HA 1 1 11 3617 1 1 17 LYS HB2 H 8.331 -1.530 1.031 1.00 . A A . 17 LYS HB2 1 1 11 3618 1 1 17 LYS HB3 H 9.151 -0.009 1.347 1.00 . A A . 17 LYS HB3 1 1 11 3619 1 1 17 LYS HD2 H 11.289 -0.017 2.696 1.00 . A A . 17 LYS HD2 1 1 11 3620 1 1 17 LYS HD3 H 10.233 -0.486 4.029 1.00 . A A . 17 LYS HD3 1 1 11 3621 1 1 17 LYS HE2 H 12.519 -2.191 3.070 1.00 . A A . 17 LYS HE2 1 1 11 3622 1 1 17 LYS HE3 H 12.697 -0.972 4.330 1.00 . A A . 17 LYS HE3 1 1 11 3623 1 1 17 LYS HG2 H 9.713 -2.587 2.799 1.00 . A A . 17 LYS HG2 1 1 11 3624 1 1 17 LYS HG3 H 10.648 -1.970 1.436 1.00 . A A . 17 LYS HG3 1 1 11 3625 1 1 17 LYS HZ1 H 10.932 -2.144 5.578 1.00 . A A . 17 LYS HZ1 1 1 11 3626 1 1 17 LYS HZ2 H 12.321 -3.083 5.346 1.00 . A A . 17 LYS HZ2 1 1 11 3627 1 1 17 LYS HZ3 H 10.944 -3.364 4.407 1.00 . A A . 17 LYS HZ3 1 1 11 3628 1 1 17 LYS N N 6.568 -1.348 2.667 1.00 . A A . 17 LYS N 1 1 11 3629 1 1 17 LYS NZ N 11.517 -2.631 4.867 1.00 . A A . 17 LYS NZ 1 1 11 3630 1 1 17 LYS O O 8.310 1.624 3.545 1.00 . A A . 17 LYS O 1 1 11 3631 1 1 18 PHE C C 4.972 2.938 3.308 1.00 . A A . 18 PHE C 1 1 11 3632 1 1 18 PHE CA C 6.087 2.695 2.305 1.00 . A A . 18 PHE CA 1 1 11 3633 1 1 18 PHE CB C 5.632 3.122 0.908 1.00 . A A . 18 PHE CB 1 1 11 3634 1 1 18 PHE CD1 C 7.469 4.449 -0.166 1.00 . A A . 18 PHE CD1 1 1 11 3635 1 1 18 PHE CD2 C 7.089 2.221 -0.927 1.00 . A A . 18 PHE CD2 1 1 11 3636 1 1 18 PHE CE1 C 8.499 4.588 -1.076 1.00 . A A . 18 PHE CE1 1 1 11 3637 1 1 18 PHE CE2 C 8.118 2.354 -1.838 1.00 . A A . 18 PHE CE2 1 1 11 3638 1 1 18 PHE CG C 6.753 3.265 -0.081 1.00 . A A . 18 PHE CG 1 1 11 3639 1 1 18 PHE CZ C 8.824 3.539 -1.913 1.00 . A A . 18 PHE CZ 1 1 11 3640 1 1 18 PHE H H 5.904 0.642 1.848 1.00 . A A . 18 PHE H 1 1 11 3641 1 1 18 PHE HA H 6.951 3.277 2.591 1.00 . A A . 18 PHE HA 1 1 11 3642 1 1 18 PHE HB2 H 4.944 2.385 0.522 1.00 . A A . 18 PHE HB2 1 1 11 3643 1 1 18 PHE HB3 H 5.127 4.075 0.979 1.00 . A A . 18 PHE HB3 1 1 11 3644 1 1 18 PHE HD1 H 7.216 5.269 0.490 1.00 . A A . 18 PHE HD1 1 1 11 3645 1 1 18 PHE HD2 H 6.538 1.294 -0.869 1.00 . A A . 18 PHE HD2 1 1 11 3646 1 1 18 PHE HE1 H 9.049 5.515 -1.134 1.00 . A A . 18 PHE HE1 1 1 11 3647 1 1 18 PHE HE2 H 8.371 1.531 -2.493 1.00 . A A . 18 PHE HE2 1 1 11 3648 1 1 18 PHE HZ H 9.629 3.645 -2.625 1.00 . A A . 18 PHE HZ 1 1 11 3649 1 1 18 PHE N N 6.464 1.293 2.315 1.00 . A A . 18 PHE N 1 1 11 3650 1 1 18 PHE O O 4.982 3.919 4.047 1.00 . A A . 18 PHE O 1 1 11 3651 1 1 19 CYS C C 3.149 1.412 5.555 1.00 . A A . 19 CYS C 1 1 11 3652 1 1 19 CYS CA C 2.881 2.145 4.242 1.00 . A A . 19 CYS CA 1 1 11 3653 1 1 19 CYS CB C 1.606 1.619 3.580 1.00 . A A . 19 CYS CB 1 1 11 3654 1 1 19 CYS H H 4.089 1.232 2.758 1.00 . A A . 19 CYS H 1 1 11 3655 1 1 19 CYS HA H 2.751 3.195 4.459 1.00 . A A . 19 CYS HA 1 1 11 3656 1 1 19 CYS HB2 H 1.520 0.561 3.758 1.00 . A A . 19 CYS HB2 1 1 11 3657 1 1 19 CYS HB3 H 0.755 2.119 4.017 1.00 . A A . 19 CYS HB3 1 1 11 3658 1 1 19 CYS N N 4.015 2.023 3.338 1.00 . A A . 19 CYS N 1 1 11 3659 1 1 19 CYS O O 2.340 0.591 6.001 1.00 . A A . 19 CYS O 1 1 11 3660 1 1 19 CYS SG S 1.536 1.889 1.779 1.00 . A A . 19 CYS SG 1 1 11 3661 1 1 20 NH2 HN1 H 4.875 2.372 5.761 1.00 . A A . 20 NH2 HN1 1 1 11 3662 1 1 20 NH2 HN2 H 4.482 1.252 7.018 1.00 . A A . 20 NH2 HN2 1 1 11 3663 1 1 20 NH2 N N 4.281 1.709 6.176 1.00 . A A . 20 NH2 N 1 1 12 3664 1 1 1 PHE C C 1.732 6.069 -5.565 1.00 . A A . 1 PHE C 1 1 12 3665 1 1 1 PHE CA C 3.116 5.535 -5.913 1.00 . A A . 1 PHE CA 1 1 12 3666 1 1 1 PHE CB C 4.023 5.550 -4.673 1.00 . A A . 1 PHE CB 1 1 12 3667 1 1 1 PHE CD1 C 3.417 3.377 -3.566 1.00 . A A . 1 PHE CD1 1 1 12 3668 1 1 1 PHE CD2 C 3.050 5.403 -2.362 1.00 . A A . 1 PHE CD2 1 1 12 3669 1 1 1 PHE CE1 C 2.921 2.652 -2.499 1.00 . A A . 1 PHE CE1 1 1 12 3670 1 1 1 PHE CE2 C 2.553 4.682 -1.293 1.00 . A A . 1 PHE CE2 1 1 12 3671 1 1 1 PHE CG C 3.486 4.760 -3.509 1.00 . A A . 1 PHE CG 1 1 12 3672 1 1 1 PHE CZ C 2.488 3.305 -1.362 1.00 . A A . 1 PHE CZ 1 1 12 3673 1 1 1 PHE H1 H 3.124 6.312 -7.843 1.00 . A A . 1 PHE H1 1 1 12 3674 1 1 1 PHE H2 H 4.668 6.019 -7.217 1.00 . A A . 1 PHE H2 1 1 12 3675 1 1 1 PHE H3 H 3.775 7.352 -6.680 1.00 . A A . 1 PHE H3 1 1 12 3676 1 1 1 PHE HA H 3.020 4.521 -6.274 1.00 . A A . 1 PHE HA 1 1 12 3677 1 1 1 PHE HB2 H 4.984 5.135 -4.936 1.00 . A A . 1 PHE HB2 1 1 12 3678 1 1 1 PHE HB3 H 4.157 6.572 -4.348 1.00 . A A . 1 PHE HB3 1 1 12 3679 1 1 1 PHE HD1 H 3.754 2.865 -4.454 1.00 . A A . 1 PHE HD1 1 1 12 3680 1 1 1 PHE HD2 H 3.098 6.481 -2.307 1.00 . A A . 1 PHE HD2 1 1 12 3681 1 1 1 PHE HE1 H 2.871 1.574 -2.555 1.00 . A A . 1 PHE HE1 1 1 12 3682 1 1 1 PHE HE2 H 2.217 5.195 -0.405 1.00 . A A . 1 PHE HE2 1 1 12 3683 1 1 1 PHE HZ H 2.101 2.739 -0.528 1.00 . A A . 1 PHE HZ 1 1 12 3684 1 1 1 PHE N N 3.715 6.360 -6.989 1.00 . A A . 1 PHE N 1 1 12 3685 1 1 1 PHE O O 1.477 7.262 -5.701 1.00 . A A . 1 PHE O 1 1 12 3686 1 1 2 ASN C C -0.757 5.261 -3.300 1.00 . A A . 2 ASN C 1 1 12 3687 1 1 2 ASN CA C -0.513 5.571 -4.770 1.00 . A A . 2 ASN CA 1 1 12 3688 1 1 2 ASN CB C -1.542 4.840 -5.640 1.00 . A A . 2 ASN CB 1 1 12 3689 1 1 2 ASN CG C -2.921 5.471 -5.574 1.00 . A A . 2 ASN CG 1 1 12 3690 1 1 2 ASN H H 1.100 4.240 -5.058 1.00 . A A . 2 ASN H 1 1 12 3691 1 1 2 ASN HA H -0.608 6.636 -4.925 1.00 . A A . 2 ASN HA 1 1 12 3692 1 1 2 ASN HB2 H -1.210 4.856 -6.667 1.00 . A A . 2 ASN HB2 1 1 12 3693 1 1 2 ASN HB3 H -1.619 3.815 -5.307 1.00 . A A . 2 ASN HB3 1 1 12 3694 1 1 2 ASN HD21 H -3.342 4.802 -7.394 1.00 . A A . 2 ASN HD21 1 1 12 3695 1 1 2 ASN HD22 H -4.589 5.713 -6.620 1.00 . A A . 2 ASN HD22 1 1 12 3696 1 1 2 ASN N N 0.841 5.181 -5.140 1.00 . A A . 2 ASN N 1 1 12 3697 1 1 2 ASN ND2 N -3.696 5.312 -6.635 1.00 . A A . 2 ASN ND2 1 1 12 3698 1 1 2 ASN O O -0.745 4.097 -2.894 1.00 . A A . 2 ASN O 1 1 12 3699 1 1 2 ASN OD1 O -3.290 6.094 -4.576 1.00 . A A . 2 ASN OD1 1 1 12 3700 1 1 3 TRP C C -2.452 5.319 -0.783 1.00 . A A . 3 TRP C 1 1 12 3701 1 1 3 TRP CA C -1.219 6.169 -1.077 1.00 . A A . 3 TRP CA 1 1 12 3702 1 1 3 TRP CB C -1.360 7.550 -0.424 1.00 . A A . 3 TRP CB 1 1 12 3703 1 1 3 TRP CD1 C -2.208 9.241 -2.156 1.00 . A A . 3 TRP CD1 1 1 12 3704 1 1 3 TRP CD2 C -3.762 8.582 -0.684 1.00 . A A . 3 TRP CD2 1 1 12 3705 1 1 3 TRP CE2 C -4.348 9.502 -1.574 1.00 . A A . 3 TRP CE2 1 1 12 3706 1 1 3 TRP CE3 C -4.550 8.032 0.332 1.00 . A A . 3 TRP CE3 1 1 12 3707 1 1 3 TRP CG C -2.391 8.427 -1.076 1.00 . A A . 3 TRP CG 1 1 12 3708 1 1 3 TRP CH2 C -6.432 9.327 -0.475 1.00 . A A . 3 TRP CH2 1 1 12 3709 1 1 3 TRP CZ2 C -5.686 9.881 -1.479 1.00 . A A . 3 TRP CZ2 1 1 12 3710 1 1 3 TRP CZ3 C -5.875 8.410 0.425 1.00 . A A . 3 TRP CZ3 1 1 12 3711 1 1 3 TRP H H -1.002 7.202 -2.909 1.00 . A A . 3 TRP H 1 1 12 3712 1 1 3 TRP HA H -0.360 5.675 -0.656 1.00 . A A . 3 TRP HA 1 1 12 3713 1 1 3 TRP HB2 H -1.640 7.423 0.610 1.00 . A A . 3 TRP HB2 1 1 12 3714 1 1 3 TRP HB3 H -0.409 8.061 -0.473 1.00 . A A . 3 TRP HB3 1 1 12 3715 1 1 3 TRP HD1 H -1.272 9.348 -2.685 1.00 . A A . 3 TRP HD1 1 1 12 3716 1 1 3 TRP HE1 H -3.504 10.524 -3.201 1.00 . A A . 3 TRP HE1 1 1 12 3717 1 1 3 TRP HE3 H -4.139 7.323 1.035 1.00 . A A . 3 TRP HE3 1 1 12 3718 1 1 3 TRP HH2 H -7.472 9.594 -0.363 1.00 . A A . 3 TRP HH2 1 1 12 3719 1 1 3 TRP HZ2 H -6.130 10.587 -2.166 1.00 . A A . 3 TRP HZ2 1 1 12 3720 1 1 3 TRP HZ3 H -6.498 7.995 1.204 1.00 . A A . 3 TRP HZ3 1 1 12 3721 1 1 3 TRP N N -0.985 6.307 -2.514 1.00 . A A . 3 TRP N 1 1 12 3722 1 1 3 TRP NE1 N -3.381 9.888 -2.464 1.00 . A A . 3 TRP NE1 1 1 12 3723 1 1 3 TRP O O -2.586 4.754 0.303 1.00 . A A . 3 TRP O 1 1 12 3724 1 1 4 ARG C C -4.243 2.970 -1.361 1.00 . A A . 4 ARG C 1 1 12 3725 1 1 4 ARG CA C -4.558 4.429 -1.607 1.00 . A A . 4 ARG CA 1 1 12 3726 1 1 4 ARG CB C -5.454 4.568 -2.834 1.00 . A A . 4 ARG CB 1 1 12 3727 1 1 4 ARG CD C -7.488 5.415 -1.635 1.00 . A A . 4 ARG CD 1 1 12 3728 1 1 4 ARG CG C -6.465 5.696 -2.725 1.00 . A A . 4 ARG CG 1 1 12 3729 1 1 4 ARG CZ C -9.546 6.441 -0.732 1.00 . A A . 4 ARG CZ 1 1 12 3730 1 1 4 ARG H H -3.168 5.673 -2.613 1.00 . A A . 4 ARG H 1 1 12 3731 1 1 4 ARG HA H -5.072 4.805 -0.749 1.00 . A A . 4 ARG HA 1 1 12 3732 1 1 4 ARG HB2 H -4.832 4.753 -3.698 1.00 . A A . 4 ARG HB2 1 1 12 3733 1 1 4 ARG HB3 H -5.985 3.641 -2.977 1.00 . A A . 4 ARG HB3 1 1 12 3734 1 1 4 ARG HD2 H -8.033 4.519 -1.892 1.00 . A A . 4 ARG HD2 1 1 12 3735 1 1 4 ARG HD3 H -6.965 5.260 -0.702 1.00 . A A . 4 ARG HD3 1 1 12 3736 1 1 4 ARG HE H -8.228 7.359 -1.932 1.00 . A A . 4 ARG HE 1 1 12 3737 1 1 4 ARG HG2 H -5.946 6.613 -2.492 1.00 . A A . 4 ARG HG2 1 1 12 3738 1 1 4 ARG HG3 H -6.979 5.799 -3.669 1.00 . A A . 4 ARG HG3 1 1 12 3739 1 1 4 ARG HH11 H -9.256 4.510 -0.183 1.00 . A A . 4 ARG HH11 1 1 12 3740 1 1 4 ARG HH12 H -10.687 5.250 0.451 1.00 . A A . 4 ARG HH12 1 1 12 3741 1 1 4 ARG HH21 H -10.122 8.351 -1.097 1.00 . A A . 4 ARG HH21 1 1 12 3742 1 1 4 ARG HH22 H -11.180 7.444 -0.070 1.00 . A A . 4 ARG HH22 1 1 12 3743 1 1 4 ARG N N -3.341 5.214 -1.762 1.00 . A A . 4 ARG N 1 1 12 3744 1 1 4 ARG NE N -8.437 6.516 -1.469 1.00 . A A . 4 ARG NE 1 1 12 3745 1 1 4 ARG NH1 N -9.856 5.309 -0.104 1.00 . A A . 4 ARG NH1 1 1 12 3746 1 1 4 ARG NH2 N -10.347 7.497 -0.625 1.00 . A A . 4 ARG NH2 1 1 12 3747 1 1 4 ARG O O -5.029 2.247 -0.754 1.00 . A A . 4 ARG O 1 1 12 3748 1 1 5 CYS C C -2.505 0.855 -0.168 1.00 . A A . 5 CYS C 1 1 12 3749 1 1 5 CYS CA C -2.630 1.189 -1.644 1.00 . A A . 5 CYS CA 1 1 12 3750 1 1 5 CYS CB C -1.281 0.985 -2.321 1.00 . A A . 5 CYS CB 1 1 12 3751 1 1 5 CYS H H -2.511 3.201 -2.291 1.00 . A A . 5 CYS H 1 1 12 3752 1 1 5 CYS HA H -3.358 0.533 -2.097 1.00 . A A . 5 CYS HA 1 1 12 3753 1 1 5 CYS HB2 H -0.693 1.881 -2.194 1.00 . A A . 5 CYS HB2 1 1 12 3754 1 1 5 CYS HB3 H -0.773 0.157 -1.849 1.00 . A A . 5 CYS HB3 1 1 12 3755 1 1 5 CYS N N -3.083 2.558 -1.820 1.00 . A A . 5 CYS N 1 1 12 3756 1 1 5 CYS O O -2.724 -0.279 0.241 1.00 . A A . 5 CYS O 1 1 12 3757 1 1 5 CYS SG S -1.389 0.629 -4.104 1.00 . A A . 5 CYS SG 1 1 12 3758 1 1 6 CYS C C -3.371 1.419 2.741 1.00 . A A . 6 CYS C 1 1 12 3759 1 1 6 CYS CA C -2.026 1.666 2.068 1.00 . A A . 6 CYS CA 1 1 12 3760 1 1 6 CYS CB C -1.323 2.870 2.689 1.00 . A A . 6 CYS CB 1 1 12 3761 1 1 6 CYS H H -2.080 2.767 0.249 1.00 . A A . 6 CYS H 1 1 12 3762 1 1 6 CYS HA H -1.407 0.789 2.209 1.00 . A A . 6 CYS HA 1 1 12 3763 1 1 6 CYS HB2 H -2.035 3.670 2.824 1.00 . A A . 6 CYS HB2 1 1 12 3764 1 1 6 CYS HB3 H -0.918 2.581 3.649 1.00 . A A . 6 CYS HB3 1 1 12 3765 1 1 6 CYS N N -2.192 1.862 0.632 1.00 . A A . 6 CYS N 1 1 12 3766 1 1 6 CYS O O -3.433 0.954 3.879 1.00 . A A . 6 CYS O 1 1 12 3767 1 1 6 CYS SG S 0.053 3.503 1.678 1.00 . A A . 6 CYS SG 1 1 12 3768 1 1 7 LEU C C -6.360 0.238 1.939 1.00 . A A . 7 LEU C 1 1 12 3769 1 1 7 LEU CA C -5.789 1.518 2.532 1.00 . A A . 7 LEU CA 1 1 12 3770 1 1 7 LEU CB C -6.685 2.711 2.187 1.00 . A A . 7 LEU CB 1 1 12 3771 1 1 7 LEU CD1 C -7.080 5.185 2.192 1.00 . A A . 7 LEU CD1 1 1 12 3772 1 1 7 LEU CD2 C -6.144 4.071 4.224 1.00 . A A . 7 LEU CD2 1 1 12 3773 1 1 7 LEU CG C -6.190 4.064 2.703 1.00 . A A . 7 LEU CG 1 1 12 3774 1 1 7 LEU H H -4.325 2.102 1.126 1.00 . A A . 7 LEU H 1 1 12 3775 1 1 7 LEU HA H -5.729 1.412 3.602 1.00 . A A . 7 LEU HA 1 1 12 3776 1 1 7 LEU HB2 H -6.774 2.768 1.112 1.00 . A A . 7 LEU HB2 1 1 12 3777 1 1 7 LEU HB3 H -7.665 2.529 2.603 1.00 . A A . 7 LEU HB3 1 1 12 3778 1 1 7 LEU HD11 H -7.058 5.197 1.112 1.00 . A A . 7 LEU HD11 1 1 12 3779 1 1 7 LEU HD12 H -6.720 6.131 2.569 1.00 . A A . 7 LEU HD12 1 1 12 3780 1 1 7 LEU HD13 H -8.093 5.025 2.530 1.00 . A A . 7 LEU HD13 1 1 12 3781 1 1 7 LEU HD21 H -5.779 5.027 4.569 1.00 . A A . 7 LEU HD21 1 1 12 3782 1 1 7 LEU HD22 H -5.483 3.288 4.568 1.00 . A A . 7 LEU HD22 1 1 12 3783 1 1 7 LEU HD23 H -7.137 3.902 4.615 1.00 . A A . 7 LEU HD23 1 1 12 3784 1 1 7 LEU HG H -5.189 4.238 2.335 1.00 . A A . 7 LEU HG 1 1 12 3785 1 1 7 LEU N N -4.442 1.726 2.024 1.00 . A A . 7 LEU N 1 1 12 3786 1 1 7 LEU O O -7.486 -0.158 2.233 1.00 . A A . 7 LEU O 1 1 12 3787 1 1 8 ILE C C -4.969 -2.746 0.828 1.00 . A A . 8 ILE C 1 1 12 3788 1 1 8 ILE CA C -5.946 -1.641 0.448 1.00 . A A . 8 ILE CA 1 1 12 3789 1 1 8 ILE CB C -5.973 -1.490 -1.091 1.00 . A A . 8 ILE CB 1 1 12 3790 1 1 8 ILE CD1 C -6.766 0.050 -2.962 1.00 . A A . 8 ILE CD1 1 1 12 3791 1 1 8 ILE CG1 C -6.881 -0.327 -1.499 1.00 . A A . 8 ILE CG1 1 1 12 3792 1 1 8 ILE CG2 C -6.439 -2.785 -1.747 1.00 . A A . 8 ILE CG2 1 1 12 3793 1 1 8 ILE H H -4.662 -0.036 0.926 1.00 . A A . 8 ILE H 1 1 12 3794 1 1 8 ILE HA H -6.936 -1.907 0.789 1.00 . A A . 8 ILE HA 1 1 12 3795 1 1 8 ILE HB H -4.968 -1.289 -1.428 1.00 . A A . 8 ILE HB 1 1 12 3796 1 1 8 ILE HD11 H -5.751 0.349 -3.177 1.00 . A A . 8 ILE HD11 1 1 12 3797 1 1 8 ILE HD12 H -7.437 0.868 -3.177 1.00 . A A . 8 ILE HD12 1 1 12 3798 1 1 8 ILE HD13 H -7.028 -0.802 -3.573 1.00 . A A . 8 ILE HD13 1 1 12 3799 1 1 8 ILE HG12 H -7.908 -0.596 -1.307 1.00 . A A . 8 ILE HG12 1 1 12 3800 1 1 8 ILE HG13 H -6.626 0.543 -0.912 1.00 . A A . 8 ILE HG13 1 1 12 3801 1 1 8 ILE HG21 H -6.446 -2.662 -2.820 1.00 . A A . 8 ILE HG21 1 1 12 3802 1 1 8 ILE HG22 H -7.435 -3.025 -1.405 1.00 . A A . 8 ILE HG22 1 1 12 3803 1 1 8 ILE HG23 H -5.764 -3.586 -1.480 1.00 . A A . 8 ILE HG23 1 1 12 3804 1 1 8 ILE N N -5.556 -0.403 1.100 1.00 . A A . 8 ILE N 1 1 12 3805 1 1 8 ILE O O -3.843 -2.786 0.332 1.00 . A A . 8 ILE O 1 1 12 3806 1 1 9 PRO C C -3.843 -5.534 1.076 1.00 . A A . 9 PRO C 1 1 12 3807 1 1 9 PRO CA C -4.565 -4.779 2.193 1.00 . A A . 9 PRO CA 1 1 12 3808 1 1 9 PRO CB C -5.577 -5.691 2.885 1.00 . A A . 9 PRO CB 1 1 12 3809 1 1 9 PRO CD C -6.745 -3.684 2.316 1.00 . A A . 9 PRO CD 1 1 12 3810 1 1 9 PRO CG C -6.652 -4.772 3.351 1.00 . A A . 9 PRO CG 1 1 12 3811 1 1 9 PRO HA H -3.838 -4.439 2.917 1.00 . A A . 9 PRO HA 1 1 12 3812 1 1 9 PRO HB2 H -5.953 -6.418 2.179 1.00 . A A . 9 PRO HB2 1 1 12 3813 1 1 9 PRO HB3 H -5.104 -6.196 3.714 1.00 . A A . 9 PRO HB3 1 1 12 3814 1 1 9 PRO HD2 H -7.495 -3.928 1.578 1.00 . A A . 9 PRO HD2 1 1 12 3815 1 1 9 PRO HD3 H -6.969 -2.737 2.785 1.00 . A A . 9 PRO HD3 1 1 12 3816 1 1 9 PRO HG2 H -7.588 -5.307 3.419 1.00 . A A . 9 PRO HG2 1 1 12 3817 1 1 9 PRO HG3 H -6.386 -4.354 4.311 1.00 . A A . 9 PRO HG3 1 1 12 3818 1 1 9 PRO N N -5.398 -3.664 1.711 1.00 . A A . 9 PRO N 1 1 12 3819 1 1 9 PRO O O -2.747 -6.052 1.279 1.00 . A A . 9 PRO O 1 1 12 3820 1 1 10 ALA C C -2.673 -5.529 -1.811 1.00 . A A . 10 ALA C 1 1 12 3821 1 1 10 ALA CA C -3.879 -6.278 -1.242 1.00 . A A . 10 ALA CA 1 1 12 3822 1 1 10 ALA CB C -4.932 -6.478 -2.320 1.00 . A A . 10 ALA CB 1 1 12 3823 1 1 10 ALA H H -5.327 -5.143 -0.199 1.00 . A A . 10 ALA H 1 1 12 3824 1 1 10 ALA HA H -3.556 -7.252 -0.906 1.00 . A A . 10 ALA HA 1 1 12 3825 1 1 10 ALA HB1 H -5.779 -7.005 -1.904 1.00 . A A . 10 ALA HB1 1 1 12 3826 1 1 10 ALA HB2 H -4.512 -7.057 -3.130 1.00 . A A . 10 ALA HB2 1 1 12 3827 1 1 10 ALA HB3 H -5.253 -5.518 -2.693 1.00 . A A . 10 ALA HB3 1 1 12 3828 1 1 10 ALA N N -4.459 -5.584 -0.099 1.00 . A A . 10 ALA N 1 1 12 3829 1 1 10 ALA O O -1.688 -6.145 -2.212 1.00 . A A . 10 ALA O 1 1 12 3830 1 1 11 CYS C C -0.624 -3.075 -1.283 1.00 . A A . 11 CYS C 1 1 12 3831 1 1 11 CYS CA C -1.642 -3.405 -2.369 1.00 . A A . 11 CYS CA 1 1 12 3832 1 1 11 CYS CB C -2.173 -2.118 -3.010 1.00 . A A . 11 CYS CB 1 1 12 3833 1 1 11 CYS H H -3.521 -3.751 -1.446 1.00 . A A . 11 CYS H 1 1 12 3834 1 1 11 CYS HA H -1.153 -3.996 -3.129 1.00 . A A . 11 CYS HA 1 1 12 3835 1 1 11 CYS HB2 H -3.100 -2.334 -3.521 1.00 . A A . 11 CYS HB2 1 1 12 3836 1 1 11 CYS HB3 H -2.356 -1.387 -2.237 1.00 . A A . 11 CYS HB3 1 1 12 3837 1 1 11 CYS N N -2.735 -4.202 -1.825 1.00 . A A . 11 CYS N 1 1 12 3838 1 1 11 CYS O O 0.580 -3.015 -1.542 1.00 . A A . 11 CYS O 1 1 12 3839 1 1 11 CYS SG S -1.032 -1.369 -4.226 1.00 . A A . 11 CYS SG 1 1 12 3840 1 1 12 ARG C C 0.611 -3.764 1.425 1.00 . A A . 12 ARG C 1 1 12 3841 1 1 12 ARG CA C -0.242 -2.560 1.064 1.00 . A A . 12 ARG CA 1 1 12 3842 1 1 12 ARG CB C -1.069 -2.135 2.275 1.00 . A A . 12 ARG CB 1 1 12 3843 1 1 12 ARG CD C -1.092 -1.074 4.556 1.00 . A A . 12 ARG CD 1 1 12 3844 1 1 12 ARG CG C -0.272 -1.351 3.306 1.00 . A A . 12 ARG CG 1 1 12 3845 1 1 12 ARG CZ C -0.876 0.539 6.417 1.00 . A A . 12 ARG CZ 1 1 12 3846 1 1 12 ARG H H -2.083 -2.929 0.081 1.00 . A A . 12 ARG H 1 1 12 3847 1 1 12 ARG HA H 0.403 -1.745 0.772 1.00 . A A . 12 ARG HA 1 1 12 3848 1 1 12 ARG HB2 H -1.887 -1.526 1.934 1.00 . A A . 12 ARG HB2 1 1 12 3849 1 1 12 ARG HB3 H -1.465 -3.016 2.752 1.00 . A A . 12 ARG HB3 1 1 12 3850 1 1 12 ARG HD2 H -1.965 -0.502 4.278 1.00 . A A . 12 ARG HD2 1 1 12 3851 1 1 12 ARG HD3 H -1.401 -2.016 4.984 1.00 . A A . 12 ARG HD3 1 1 12 3852 1 1 12 ARG HE H 0.639 -0.482 5.595 1.00 . A A . 12 ARG HE 1 1 12 3853 1 1 12 ARG HG2 H 0.602 -1.921 3.581 1.00 . A A . 12 ARG HG2 1 1 12 3854 1 1 12 ARG HG3 H 0.032 -0.411 2.870 1.00 . A A . 12 ARG HG3 1 1 12 3855 1 1 12 ARG HH11 H -2.757 0.367 5.668 1.00 . A A . 12 ARG HH11 1 1 12 3856 1 1 12 ARG HH12 H -2.589 1.451 7.013 1.00 . A A . 12 ARG HH12 1 1 12 3857 1 1 12 ARG HH21 H 0.879 0.970 7.338 1.00 . A A . 12 ARG HH21 1 1 12 3858 1 1 12 ARG HH22 H -0.512 1.796 7.964 1.00 . A A . 12 ARG HH22 1 1 12 3859 1 1 12 ARG N N -1.111 -2.874 -0.064 1.00 . A A . 12 ARG N 1 1 12 3860 1 1 12 ARG NE N -0.332 -0.323 5.557 1.00 . A A . 12 ARG NE 1 1 12 3861 1 1 12 ARG NH1 N -2.177 0.809 6.364 1.00 . A A . 12 ARG NH1 1 1 12 3862 1 1 12 ARG NH2 N -0.111 1.153 7.312 1.00 . A A . 12 ARG NH2 1 1 12 3863 1 1 12 ARG O O 1.670 -3.626 2.029 1.00 . A A . 12 ARG O 1 1 12 3864 1 1 13 ARG C C 2.247 -6.152 0.731 1.00 . A A . 13 ARG C 1 1 12 3865 1 1 13 ARG CA C 0.835 -6.192 1.310 1.00 . A A . 13 ARG CA 1 1 12 3866 1 1 13 ARG CB C 0.062 -7.365 0.703 1.00 . A A . 13 ARG CB 1 1 12 3867 1 1 13 ARG CD C -0.432 -8.640 2.812 1.00 . A A . 13 ARG CD 1 1 12 3868 1 1 13 ARG CG C 0.245 -8.677 1.451 1.00 . A A . 13 ARG CG 1 1 12 3869 1 1 13 ARG CZ C -1.063 -10.223 4.605 1.00 . A A . 13 ARG CZ 1 1 12 3870 1 1 13 ARG H H -0.740 -4.967 0.596 1.00 . A A . 13 ARG H 1 1 12 3871 1 1 13 ARG HA H 0.896 -6.324 2.380 1.00 . A A . 13 ARG HA 1 1 12 3872 1 1 13 ARG HB2 H -0.990 -7.125 0.699 1.00 . A A . 13 ARG HB2 1 1 12 3873 1 1 13 ARG HB3 H 0.393 -7.508 -0.315 1.00 . A A . 13 ARG HB3 1 1 12 3874 1 1 13 ARG HD2 H 0.090 -7.935 3.441 1.00 . A A . 13 ARG HD2 1 1 12 3875 1 1 13 ARG HD3 H -1.454 -8.317 2.682 1.00 . A A . 13 ARG HD3 1 1 12 3876 1 1 13 ARG HE H 0.080 -10.668 3.021 1.00 . A A . 13 ARG HE 1 1 12 3877 1 1 13 ARG HG2 H -0.184 -9.478 0.867 1.00 . A A . 13 ARG HG2 1 1 12 3878 1 1 13 ARG HG3 H 1.302 -8.857 1.589 1.00 . A A . 13 ARG HG3 1 1 12 3879 1 1 13 ARG HH11 H -1.799 -8.350 4.839 1.00 . A A . 13 ARG HH11 1 1 12 3880 1 1 13 ARG HH12 H -2.236 -9.474 6.081 1.00 . A A . 13 ARG HH12 1 1 12 3881 1 1 13 ARG HH21 H -0.494 -12.170 4.657 1.00 . A A . 13 ARG HH21 1 1 12 3882 1 1 13 ARG HH22 H -1.491 -11.654 5.977 1.00 . A A . 13 ARG HH22 1 1 12 3883 1 1 13 ARG N N 0.129 -4.940 1.050 1.00 . A A . 13 ARG N 1 1 12 3884 1 1 13 ARG NE N -0.426 -9.952 3.464 1.00 . A A . 13 ARG NE 1 1 12 3885 1 1 13 ARG NH1 N -1.754 -9.272 5.226 1.00 . A A . 13 ARG NH1 1 1 12 3886 1 1 13 ARG NH2 N -1.011 -11.447 5.121 1.00 . A A . 13 ARG NH2 1 1 12 3887 1 1 13 ARG O O 3.208 -6.570 1.376 1.00 . A A . 13 ARG O 1 1 12 3888 1 1 14 ASN C C 4.305 -4.189 -0.869 1.00 . A A . 14 ASN C 1 1 12 3889 1 1 14 ASN CA C 3.648 -5.536 -1.164 1.00 . A A . 14 ASN CA 1 1 12 3890 1 1 14 ASN CB C 3.458 -5.716 -2.676 1.00 . A A . 14 ASN CB 1 1 12 3891 1 1 14 ASN CG C 4.726 -5.462 -3.473 1.00 . A A . 14 ASN CG 1 1 12 3892 1 1 14 ASN H H 1.554 -5.326 -0.946 1.00 . A A . 14 ASN H 1 1 12 3893 1 1 14 ASN HA H 4.285 -6.323 -0.792 1.00 . A A . 14 ASN HA 1 1 12 3894 1 1 14 ASN HB2 H 3.132 -6.727 -2.870 1.00 . A A . 14 ASN HB2 1 1 12 3895 1 1 14 ASN HB3 H 2.699 -5.027 -3.018 1.00 . A A . 14 ASN HB3 1 1 12 3896 1 1 14 ASN HD21 H 5.283 -7.355 -3.252 1.00 . A A . 14 ASN HD21 1 1 12 3897 1 1 14 ASN HD22 H 6.364 -6.354 -4.150 1.00 . A A . 14 ASN HD22 1 1 12 3898 1 1 14 ASN N N 2.360 -5.639 -0.486 1.00 . A A . 14 ASN N 1 1 12 3899 1 1 14 ASN ND2 N 5.539 -6.494 -3.643 1.00 . A A . 14 ASN ND2 1 1 12 3900 1 1 14 ASN O O 5.520 -4.033 -0.972 1.00 . A A . 14 ASN O 1 1 12 3901 1 1 14 ASN OD1 O 4.970 -4.346 -3.935 1.00 . A A . 14 ASN OD1 1 1 12 3902 1 1 15 HIS C C 4.063 -1.642 1.323 1.00 . A A . 15 HIS C 1 1 12 3903 1 1 15 HIS CA C 4.004 -1.885 -0.181 1.00 . A A . 15 HIS CA 1 1 12 3904 1 1 15 HIS CB C 3.135 -0.824 -0.864 1.00 . A A . 15 HIS CB 1 1 12 3905 1 1 15 HIS CD2 C 2.095 -0.698 -3.238 1.00 . A A . 15 HIS CD2 1 1 12 3906 1 1 15 HIS CE1 C 3.808 -1.435 -4.385 1.00 . A A . 15 HIS CE1 1 1 12 3907 1 1 15 HIS CG C 3.089 -0.958 -2.357 1.00 . A A . 15 HIS CG 1 1 12 3908 1 1 15 HIS H H 2.541 -3.411 -0.349 1.00 . A A . 15 HIS H 1 1 12 3909 1 1 15 HIS HA H 5.006 -1.822 -0.579 1.00 . A A . 15 HIS HA 1 1 12 3910 1 1 15 HIS HB2 H 2.124 -0.904 -0.492 1.00 . A A . 15 HIS HB2 1 1 12 3911 1 1 15 HIS HB3 H 3.524 0.156 -0.627 1.00 . A A . 15 HIS HB3 1 1 12 3912 1 1 15 HIS HD1 H 5.019 -1.711 -2.761 1.00 . A A . 15 HIS HD1 1 1 12 3913 1 1 15 HIS HD2 H 1.110 -0.321 -2.998 1.00 . A A . 15 HIS HD2 1 1 12 3914 1 1 15 HIS HE1 H 4.438 -1.751 -5.203 1.00 . A A . 15 HIS HE1 1 1 12 3915 1 1 15 HIS HE2 H 2.003 -1.117 -5.289 1.00 . A A . 15 HIS HE2 1 1 12 3916 1 1 15 HIS N N 3.497 -3.220 -0.470 1.00 . A A . 15 HIS N 1 1 12 3917 1 1 15 HIS ND1 N 4.149 -1.419 -3.109 1.00 . A A . 15 HIS ND1 1 1 12 3918 1 1 15 HIS NE2 N 2.566 -1.003 -4.493 1.00 . A A . 15 HIS NE2 1 1 12 3919 1 1 15 HIS O O 3.774 -0.545 1.802 1.00 . A A . 15 HIS O 1 1 12 3920 1 1 16 LYS C C 5.690 -1.675 3.942 1.00 . A A . 16 LYS C 1 1 12 3921 1 1 16 LYS CA C 4.564 -2.605 3.510 1.00 . A A . 16 LYS CA 1 1 12 3922 1 1 16 LYS CB C 4.806 -3.999 4.094 1.00 . A A . 16 LYS CB 1 1 12 3923 1 1 16 LYS CD C 3.858 -6.245 4.702 1.00 . A A . 16 LYS CD 1 1 12 3924 1 1 16 LYS CE C 4.663 -6.296 5.993 1.00 . A A . 16 LYS CE 1 1 12 3925 1 1 16 LYS CG C 3.540 -4.813 4.296 1.00 . A A . 16 LYS CG 1 1 12 3926 1 1 16 LYS H H 4.680 -3.519 1.605 1.00 . A A . 16 LYS H 1 1 12 3927 1 1 16 LYS HA H 3.630 -2.222 3.892 1.00 . A A . 16 LYS HA 1 1 12 3928 1 1 16 LYS HB2 H 5.456 -4.547 3.428 1.00 . A A . 16 LYS HB2 1 1 12 3929 1 1 16 LYS HB3 H 5.296 -3.894 5.051 1.00 . A A . 16 LYS HB3 1 1 12 3930 1 1 16 LYS HD2 H 2.933 -6.781 4.847 1.00 . A A . 16 LYS HD2 1 1 12 3931 1 1 16 LYS HD3 H 4.428 -6.714 3.914 1.00 . A A . 16 LYS HD3 1 1 12 3932 1 1 16 LYS HE2 H 5.469 -5.580 5.929 1.00 . A A . 16 LYS HE2 1 1 12 3933 1 1 16 LYS HE3 H 4.015 -6.035 6.817 1.00 . A A . 16 LYS HE3 1 1 12 3934 1 1 16 LYS HG2 H 2.947 -4.353 5.072 1.00 . A A . 16 LYS HG2 1 1 12 3935 1 1 16 LYS HG3 H 2.979 -4.827 3.372 1.00 . A A . 16 LYS HG3 1 1 12 3936 1 1 16 LYS HZ1 H 5.825 -7.936 5.428 1.00 . A A . 16 LYS HZ1 1 1 12 3937 1 1 16 LYS HZ2 H 4.474 -8.344 6.360 1.00 . A A . 16 LYS HZ2 1 1 12 3938 1 1 16 LYS HZ3 H 5.824 -7.639 7.093 1.00 . A A . 16 LYS HZ3 1 1 12 3939 1 1 16 LYS N N 4.459 -2.676 2.056 1.00 . A A . 16 LYS N 1 1 12 3940 1 1 16 LYS NZ N 5.237 -7.648 6.236 1.00 . A A . 16 LYS NZ 1 1 12 3941 1 1 16 LYS O O 5.664 -1.127 5.041 1.00 . A A . 16 LYS O 1 1 12 3942 1 1 17 LYS C C 7.479 0.812 3.161 1.00 . A A . 17 LYS C 1 1 12 3943 1 1 17 LYS CA C 7.816 -0.649 3.388 1.00 . A A . 17 LYS CA 1 1 12 3944 1 1 17 LYS CB C 9.036 -1.044 2.556 1.00 . A A . 17 LYS CB 1 1 12 3945 1 1 17 LYS CD C 10.599 -0.975 4.523 1.00 . A A . 17 LYS CD 1 1 12 3946 1 1 17 LYS CE C 11.582 -1.756 5.381 1.00 . A A . 17 LYS CE 1 1 12 3947 1 1 17 LYS CG C 10.091 -1.802 3.350 1.00 . A A . 17 LYS CG 1 1 12 3948 1 1 17 LYS H H 6.651 -1.972 2.217 1.00 . A A . 17 LYS H 1 1 12 3949 1 1 17 LYS HA H 8.042 -0.785 4.430 1.00 . A A . 17 LYS HA 1 1 12 3950 1 1 17 LYS HB2 H 8.710 -1.667 1.737 1.00 . A A . 17 LYS HB2 1 1 12 3951 1 1 17 LYS HB3 H 9.489 -0.147 2.157 1.00 . A A . 17 LYS HB3 1 1 12 3952 1 1 17 LYS HD2 H 11.093 -0.094 4.141 1.00 . A A . 17 LYS HD2 1 1 12 3953 1 1 17 LYS HD3 H 9.757 -0.681 5.133 1.00 . A A . 17 LYS HD3 1 1 12 3954 1 1 17 LYS HE2 H 11.108 -2.668 5.712 1.00 . A A . 17 LYS HE2 1 1 12 3955 1 1 17 LYS HE3 H 12.450 -1.998 4.784 1.00 . A A . 17 LYS HE3 1 1 12 3956 1 1 17 LYS HG2 H 9.657 -2.716 3.726 1.00 . A A . 17 LYS HG2 1 1 12 3957 1 1 17 LYS HG3 H 10.920 -2.035 2.697 1.00 . A A . 17 LYS HG3 1 1 12 3958 1 1 17 LYS HZ1 H 12.706 -1.519 7.125 1.00 . A A . 17 LYS HZ1 1 1 12 3959 1 1 17 LYS HZ2 H 11.196 -0.757 7.175 1.00 . A A . 17 LYS HZ2 1 1 12 3960 1 1 17 LYS HZ3 H 12.455 -0.080 6.272 1.00 . A A . 17 LYS HZ3 1 1 12 3961 1 1 17 LYS N N 6.682 -1.508 3.077 1.00 . A A . 17 LYS N 1 1 12 3962 1 1 17 LYS NZ N 12.015 -0.974 6.571 1.00 . A A . 17 LYS NZ 1 1 12 3963 1 1 17 LYS O O 8.083 1.696 3.765 1.00 . A A . 17 LYS O 1 1 12 3964 1 1 18 PHE C C 5.079 2.877 3.018 1.00 . A A . 18 PHE C 1 1 12 3965 1 1 18 PHE CA C 6.101 2.415 1.990 1.00 . A A . 18 PHE CA 1 1 12 3966 1 1 18 PHE CB C 5.494 2.497 0.587 1.00 . A A . 18 PHE CB 1 1 12 3967 1 1 18 PHE CD1 C 7.352 3.123 -0.973 1.00 . A A . 18 PHE CD1 1 1 12 3968 1 1 18 PHE CD2 C 6.468 0.913 -1.096 1.00 . A A . 18 PHE CD2 1 1 12 3969 1 1 18 PHE CE1 C 8.241 2.828 -1.989 1.00 . A A . 18 PHE CE1 1 1 12 3970 1 1 18 PHE CE2 C 7.353 0.611 -2.112 1.00 . A A . 18 PHE CE2 1 1 12 3971 1 1 18 PHE CG C 6.458 2.171 -0.515 1.00 . A A . 18 PHE CG 1 1 12 3972 1 1 18 PHE CZ C 8.241 1.570 -2.559 1.00 . A A . 18 PHE CZ 1 1 12 3973 1 1 18 PHE H H 6.090 0.310 1.833 1.00 . A A . 18 PHE H 1 1 12 3974 1 1 18 PHE HA H 6.969 3.055 2.041 1.00 . A A . 18 PHE HA 1 1 12 3975 1 1 18 PHE HB2 H 4.670 1.802 0.520 1.00 . A A . 18 PHE HB2 1 1 12 3976 1 1 18 PHE HB3 H 5.125 3.499 0.423 1.00 . A A . 18 PHE HB3 1 1 12 3977 1 1 18 PHE HD1 H 7.352 4.107 -0.528 1.00 . A A . 18 PHE HD1 1 1 12 3978 1 1 18 PHE HD2 H 5.773 0.163 -0.747 1.00 . A A . 18 PHE HD2 1 1 12 3979 1 1 18 PHE HE1 H 8.932 3.580 -2.337 1.00 . A A . 18 PHE HE1 1 1 12 3980 1 1 18 PHE HE2 H 7.350 -0.374 -2.558 1.00 . A A . 18 PHE HE2 1 1 12 3981 1 1 18 PHE HZ H 8.933 1.338 -3.354 1.00 . A A . 18 PHE HZ 1 1 12 3982 1 1 18 PHE N N 6.523 1.058 2.286 1.00 . A A . 18 PHE N 1 1 12 3983 1 1 18 PHE O O 5.208 3.947 3.609 1.00 . A A . 18 PHE O 1 1 12 3984 1 1 19 CYS C C 3.306 1.808 5.560 1.00 . A A . 19 CYS C 1 1 12 3985 1 1 19 CYS CA C 3.011 2.380 4.177 1.00 . A A . 19 CYS CA 1 1 12 3986 1 1 19 CYS CB C 1.665 1.877 3.654 1.00 . A A . 19 CYS CB 1 1 12 3987 1 1 19 CYS H H 4.052 1.185 2.774 1.00 . A A . 19 CYS H 1 1 12 3988 1 1 19 CYS HA H 2.970 3.457 4.255 1.00 . A A . 19 CYS HA 1 1 12 3989 1 1 19 CYS HB2 H 1.550 0.835 3.898 1.00 . A A . 19 CYS HB2 1 1 12 3990 1 1 19 CYS HB3 H 0.873 2.439 4.128 1.00 . A A . 19 CYS HB3 1 1 12 3991 1 1 19 CYS N N 4.069 2.052 3.235 1.00 . A A . 19 CYS N 1 1 12 3992 1 1 19 CYS O O 2.520 1.022 6.104 1.00 . A A . 19 CYS O 1 1 12 3993 1 1 19 CYS SG S 1.460 2.053 1.851 1.00 . A A . 19 CYS SG 1 1 12 3994 1 1 20 NH2 HN1 H 5.007 2.831 5.645 1.00 . A A . 20 NH2 HN1 1 1 12 3995 1 1 20 NH2 HN2 H 4.646 1.855 7.025 1.00 . A A . 20 NH2 HN2 1 1 12 3996 1 1 20 NH2 N N 4.432 2.205 6.136 1.00 . A A . 20 NH2 N 1 1 13 3997 1 1 1 PHE C C 2.095 6.125 -4.666 1.00 . A A . 1 PHE C 1 1 13 3998 1 1 1 PHE CA C 3.595 5.929 -4.830 1.00 . A A . 1 PHE CA 1 1 13 3999 1 1 1 PHE CB C 4.125 4.930 -3.789 1.00 . A A . 1 PHE CB 1 1 13 4000 1 1 1 PHE CD1 C 4.735 6.222 -1.717 1.00 . A A . 1 PHE CD1 1 1 13 4001 1 1 1 PHE CD2 C 2.810 4.814 -1.647 1.00 . A A . 1 PHE CD2 1 1 13 4002 1 1 1 PHE CE1 C 4.519 6.585 -0.402 1.00 . A A . 1 PHE CE1 1 1 13 4003 1 1 1 PHE CE2 C 2.589 5.176 -0.333 1.00 . A A . 1 PHE CE2 1 1 13 4004 1 1 1 PHE CG C 3.884 5.333 -2.356 1.00 . A A . 1 PHE CG 1 1 13 4005 1 1 1 PHE CZ C 3.444 6.062 0.291 1.00 . A A . 1 PHE CZ 1 1 13 4006 1 1 1 PHE H1 H 5.315 7.108 -4.798 1.00 . A A . 1 PHE H1 1 1 13 4007 1 1 1 PHE H2 H 4.086 7.652 -3.771 1.00 . A A . 1 PHE H2 1 1 13 4008 1 1 1 PHE H3 H 3.955 7.887 -5.438 1.00 . A A . 1 PHE H3 1 1 13 4009 1 1 1 PHE HA H 3.787 5.544 -5.822 1.00 . A A . 1 PHE HA 1 1 13 4010 1 1 1 PHE HB2 H 3.646 3.975 -3.945 1.00 . A A . 1 PHE HB2 1 1 13 4011 1 1 1 PHE HB3 H 5.190 4.815 -3.926 1.00 . A A . 1 PHE HB3 1 1 13 4012 1 1 1 PHE HD1 H 5.574 6.632 -2.258 1.00 . A A . 1 PHE HD1 1 1 13 4013 1 1 1 PHE HD2 H 2.140 4.121 -2.134 1.00 . A A . 1 PHE HD2 1 1 13 4014 1 1 1 PHE HE1 H 5.189 7.279 0.084 1.00 . A A . 1 PHE HE1 1 1 13 4015 1 1 1 PHE HE2 H 1.749 4.766 0.207 1.00 . A A . 1 PHE HE2 1 1 13 4016 1 1 1 PHE HZ H 3.273 6.347 1.319 1.00 . A A . 1 PHE HZ 1 1 13 4017 1 1 1 PHE N N 4.288 7.233 -4.700 1.00 . A A . 1 PHE N 1 1 13 4018 1 1 1 PHE O O 1.642 7.239 -4.411 1.00 . A A . 1 PHE O 1 1 13 4019 1 1 2 ASN C C -0.514 4.884 -3.226 1.00 . A A . 2 ASN C 1 1 13 4020 1 1 2 ASN CA C -0.116 5.117 -4.677 1.00 . A A . 2 ASN CA 1 1 13 4021 1 1 2 ASN CB C -0.791 4.081 -5.580 1.00 . A A . 2 ASN CB 1 1 13 4022 1 1 2 ASN CG C -2.257 4.386 -5.829 1.00 . A A . 2 ASN CG 1 1 13 4023 1 1 2 ASN H H 1.752 4.186 -5.005 1.00 . A A . 2 ASN H 1 1 13 4024 1 1 2 ASN HA H -0.433 6.107 -4.972 1.00 . A A . 2 ASN HA 1 1 13 4025 1 1 2 ASN HB2 H -0.282 4.059 -6.533 1.00 . A A . 2 ASN HB2 1 1 13 4026 1 1 2 ASN HB3 H -0.718 3.108 -5.117 1.00 . A A . 2 ASN HB3 1 1 13 4027 1 1 2 ASN HD21 H -2.200 3.393 -7.547 1.00 . A A . 2 ASN HD21 1 1 13 4028 1 1 2 ASN HD22 H -3.721 4.095 -7.135 1.00 . A A . 2 ASN HD22 1 1 13 4029 1 1 2 ASN N N 1.333 5.048 -4.812 1.00 . A A . 2 ASN N 1 1 13 4030 1 1 2 ASN ND2 N -2.778 3.911 -6.949 1.00 . A A . 2 ASN ND2 1 1 13 4031 1 1 2 ASN O O -0.574 3.743 -2.766 1.00 . A A . 2 ASN O 1 1 13 4032 1 1 2 ASN OD1 O -2.916 5.042 -5.022 1.00 . A A . 2 ASN OD1 1 1 13 4033 1 1 3 TRP C C -2.443 5.108 -0.899 1.00 . A A . 3 TRP C 1 1 13 4034 1 1 3 TRP CA C -1.166 5.915 -1.106 1.00 . A A . 3 TRP CA 1 1 13 4035 1 1 3 TRP CB C -1.333 7.329 -0.537 1.00 . A A . 3 TRP CB 1 1 13 4036 1 1 3 TRP CD1 C -1.837 8.996 -2.421 1.00 . A A . 3 TRP CD1 1 1 13 4037 1 1 3 TRP CD2 C -3.626 8.428 -1.199 1.00 . A A . 3 TRP CD2 1 1 13 4038 1 1 3 TRP CE2 C -4.032 9.339 -2.193 1.00 . A A . 3 TRP CE2 1 1 13 4039 1 1 3 TRP CE3 C -4.583 7.933 -0.309 1.00 . A A . 3 TRP CE3 1 1 13 4040 1 1 3 TRP CG C -2.217 8.218 -1.365 1.00 . A A . 3 TRP CG 1 1 13 4041 1 1 3 TRP CH2 C -6.267 9.262 -1.435 1.00 . A A . 3 TRP CH2 1 1 13 4042 1 1 3 TRP CZ2 C -5.351 9.763 -2.321 1.00 . A A . 3 TRP CZ2 1 1 13 4043 1 1 3 TRP CZ3 C -5.893 8.356 -0.436 1.00 . A A . 3 TRP CZ3 1 1 13 4044 1 1 3 TRP H H -0.727 6.849 -2.952 1.00 . A A . 3 TRP H 1 1 13 4045 1 1 3 TRP HA H -0.366 5.423 -0.578 1.00 . A A . 3 TRP HA 1 1 13 4046 1 1 3 TRP HB2 H -1.764 7.263 0.450 1.00 . A A . 3 TRP HB2 1 1 13 4047 1 1 3 TRP HB3 H -0.361 7.797 -0.467 1.00 . A A . 3 TRP HB3 1 1 13 4048 1 1 3 TRP HD1 H -0.827 9.060 -2.798 1.00 . A A . 3 TRP HD1 1 1 13 4049 1 1 3 TRP HE1 H -2.905 10.287 -3.688 1.00 . A A . 3 TRP HE1 1 1 13 4050 1 1 3 TRP HE3 H -4.314 7.234 0.468 1.00 . A A . 3 TRP HE3 1 1 13 4051 1 1 3 TRP HH2 H -7.302 9.565 -1.498 1.00 . A A . 3 TRP HH2 1 1 13 4052 1 1 3 TRP HZ2 H -5.656 10.461 -3.087 1.00 . A A . 3 TRP HZ2 1 1 13 4053 1 1 3 TRP HZ3 H -6.646 7.984 0.243 1.00 . A A . 3 TRP HZ3 1 1 13 4054 1 1 3 TRP N N -0.785 5.974 -2.516 1.00 . A A . 3 TRP N 1 1 13 4055 1 1 3 TRP NE1 N -2.922 9.669 -2.927 1.00 . A A . 3 TRP NE1 1 1 13 4056 1 1 3 TRP O O -2.684 4.570 0.182 1.00 . A A . 3 TRP O 1 1 13 4057 1 1 4 ARG C C -4.231 2.791 -1.596 1.00 . A A . 4 ARG C 1 1 13 4058 1 1 4 ARG CA C -4.497 4.255 -1.869 1.00 . A A . 4 ARG CA 1 1 13 4059 1 1 4 ARG CB C -5.307 4.404 -3.152 1.00 . A A . 4 ARG CB 1 1 13 4060 1 1 4 ARG CD C -7.235 5.513 -4.315 1.00 . A A . 4 ARG CD 1 1 13 4061 1 1 4 ARG CG C -6.278 5.572 -3.135 1.00 . A A . 4 ARG CG 1 1 13 4062 1 1 4 ARG CZ C -8.875 3.936 -5.288 1.00 . A A . 4 ARG CZ 1 1 13 4063 1 1 4 ARG H H -2.993 5.428 -2.791 1.00 . A A . 4 ARG H 1 1 13 4064 1 1 4 ARG HA H -5.055 4.650 -1.047 1.00 . A A . 4 ARG HA 1 1 13 4065 1 1 4 ARG HB2 H -4.624 4.545 -3.978 1.00 . A A . 4 ARG HB2 1 1 13 4066 1 1 4 ARG HB3 H -5.865 3.496 -3.313 1.00 . A A . 4 ARG HB3 1 1 13 4067 1 1 4 ARG HD2 H -7.890 6.371 -4.274 1.00 . A A . 4 ARG HD2 1 1 13 4068 1 1 4 ARG HD3 H -6.662 5.543 -5.229 1.00 . A A . 4 ARG HD3 1 1 13 4069 1 1 4 ARG HE H -7.971 3.713 -3.514 1.00 . A A . 4 ARG HE 1 1 13 4070 1 1 4 ARG HG2 H -6.848 5.541 -2.219 1.00 . A A . 4 ARG HG2 1 1 13 4071 1 1 4 ARG HG3 H -5.718 6.495 -3.183 1.00 . A A . 4 ARG HG3 1 1 13 4072 1 1 4 ARG HH11 H -8.482 5.557 -6.440 1.00 . A A . 4 ARG HH11 1 1 13 4073 1 1 4 ARG HH12 H -9.624 4.439 -7.106 1.00 . A A . 4 ARG HH12 1 1 13 4074 1 1 4 ARG HH21 H -9.480 2.223 -4.382 1.00 . A A . 4 ARG HH21 1 1 13 4075 1 1 4 ARG HH22 H -10.193 2.532 -5.931 1.00 . A A . 4 ARG HH22 1 1 13 4076 1 1 4 ARG N N -3.249 5.002 -1.947 1.00 . A A . 4 ARG N 1 1 13 4077 1 1 4 ARG NE N -8.049 4.293 -4.302 1.00 . A A . 4 ARG NE 1 1 13 4078 1 1 4 ARG NH1 N -9.004 4.705 -6.365 1.00 . A A . 4 ARG NH1 1 1 13 4079 1 1 4 ARG NH2 N -9.572 2.806 -5.193 1.00 . A A . 4 ARG NH2 1 1 13 4080 1 1 4 ARG O O -5.062 2.092 -1.020 1.00 . A A . 4 ARG O 1 1 13 4081 1 1 5 CYS C C -2.568 0.675 -0.311 1.00 . A A . 5 CYS C 1 1 13 4082 1 1 5 CYS CA C -2.658 0.968 -1.795 1.00 . A A . 5 CYS CA 1 1 13 4083 1 1 5 CYS CB C -1.305 0.705 -2.443 1.00 . A A . 5 CYS CB 1 1 13 4084 1 1 5 CYS H H -2.458 2.967 -2.459 1.00 . A A . 5 CYS H 1 1 13 4085 1 1 5 CYS HA H -3.400 0.323 -2.241 1.00 . A A . 5 CYS HA 1 1 13 4086 1 1 5 CYS HB2 H -0.697 1.593 -2.346 1.00 . A A . 5 CYS HB2 1 1 13 4087 1 1 5 CYS HB3 H -0.821 -0.114 -1.929 1.00 . A A . 5 CYS HB3 1 1 13 4088 1 1 5 CYS N N -3.065 2.345 -2.005 1.00 . A A . 5 CYS N 1 1 13 4089 1 1 5 CYS O O -2.842 -0.435 0.132 1.00 . A A . 5 CYS O 1 1 13 4090 1 1 5 CYS SG S -1.397 0.277 -4.210 1.00 . A A . 5 CYS SG 1 1 13 4091 1 1 6 CYS C C -3.464 1.373 2.549 1.00 . A A . 6 CYS C 1 1 13 4092 1 1 6 CYS CA C -2.095 1.539 1.901 1.00 . A A . 6 CYS CA 1 1 13 4093 1 1 6 CYS CB C -1.355 2.736 2.490 1.00 . A A . 6 CYS CB 1 1 13 4094 1 1 6 CYS H H -2.093 2.585 0.052 1.00 . A A . 6 CYS H 1 1 13 4095 1 1 6 CYS HA H -1.518 0.640 2.083 1.00 . A A . 6 CYS HA 1 1 13 4096 1 1 6 CYS HB2 H -2.057 3.534 2.676 1.00 . A A . 6 CYS HB2 1 1 13 4097 1 1 6 CYS HB3 H -0.894 2.438 3.420 1.00 . A A . 6 CYS HB3 1 1 13 4098 1 1 6 CYS N N -2.233 1.694 0.460 1.00 . A A . 6 CYS N 1 1 13 4099 1 1 6 CYS O O -3.574 0.945 3.699 1.00 . A A . 6 CYS O 1 1 13 4100 1 1 6 CYS SG S -0.042 3.384 1.405 1.00 . A A . 6 CYS SG 1 1 13 4101 1 1 7 LEU C C -6.432 0.222 1.837 1.00 . A A . 7 LEU C 1 1 13 4102 1 1 7 LEU CA C -5.870 1.564 2.277 1.00 . A A . 7 LEU CA 1 1 13 4103 1 1 7 LEU CB C -6.744 2.703 1.747 1.00 . A A . 7 LEU CB 1 1 13 4104 1 1 7 LEU CD1 C -7.068 5.148 1.299 1.00 . A A . 7 LEU CD1 1 1 13 4105 1 1 7 LEU CD2 C -6.202 4.393 3.520 1.00 . A A . 7 LEU CD2 1 1 13 4106 1 1 7 LEU CG C -6.220 4.113 2.024 1.00 . A A . 7 LEU CG 1 1 13 4107 1 1 7 LEU H H -4.348 2.043 0.890 1.00 . A A . 7 LEU H 1 1 13 4108 1 1 7 LEU HA H -5.848 1.596 3.351 1.00 . A A . 7 LEU HA 1 1 13 4109 1 1 7 LEU HB2 H -6.844 2.583 0.678 1.00 . A A . 7 LEU HB2 1 1 13 4110 1 1 7 LEU HB3 H -7.723 2.614 2.193 1.00 . A A . 7 LEU HB3 1 1 13 4111 1 1 7 LEU HD11 H -8.088 5.083 1.646 1.00 . A A . 7 LEU HD11 1 1 13 4112 1 1 7 LEU HD12 H -7.036 4.957 0.235 1.00 . A A . 7 LEU HD12 1 1 13 4113 1 1 7 LEU HD13 H -6.680 6.135 1.499 1.00 . A A . 7 LEU HD13 1 1 13 4114 1 1 7 LEU HD21 H -7.208 4.325 3.910 1.00 . A A . 7 LEU HD21 1 1 13 4115 1 1 7 LEU HD22 H -5.815 5.385 3.697 1.00 . A A . 7 LEU HD22 1 1 13 4116 1 1 7 LEU HD23 H -5.574 3.668 4.014 1.00 . A A . 7 LEU HD23 1 1 13 4117 1 1 7 LEU HG H -5.207 4.194 1.655 1.00 . A A . 7 LEU HG 1 1 13 4118 1 1 7 LEU N N -4.504 1.699 1.797 1.00 . A A . 7 LEU N 1 1 13 4119 1 1 7 LEU O O -7.496 -0.204 2.278 1.00 . A A . 7 LEU O 1 1 13 4120 1 1 8 ILE C C -5.077 -2.805 0.895 1.00 . A A . 8 ILE C 1 1 13 4121 1 1 8 ILE CA C -6.074 -1.744 0.449 1.00 . A A . 8 ILE CA 1 1 13 4122 1 1 8 ILE CB C -6.142 -1.732 -1.096 1.00 . A A . 8 ILE CB 1 1 13 4123 1 1 8 ILE CD1 C -6.926 -0.325 -3.073 1.00 . A A . 8 ILE CD1 1 1 13 4124 1 1 8 ILE CG1 C -7.028 -0.581 -1.584 1.00 . A A . 8 ILE CG1 1 1 13 4125 1 1 8 ILE CG2 C -6.666 -3.064 -1.615 1.00 . A A . 8 ILE CG2 1 1 13 4126 1 1 8 ILE H H -4.819 -0.063 0.701 1.00 . A A . 8 ILE H 1 1 13 4127 1 1 8 ILE HA H -7.053 -1.988 0.837 1.00 . A A . 8 ILE HA 1 1 13 4128 1 1 8 ILE HB H -5.140 -1.593 -1.477 1.00 . A A . 8 ILE HB 1 1 13 4129 1 1 8 ILE HD11 H -7.212 -1.216 -3.613 1.00 . A A . 8 ILE HD11 1 1 13 4130 1 1 8 ILE HD12 H -5.910 -0.063 -3.325 1.00 . A A . 8 ILE HD12 1 1 13 4131 1 1 8 ILE HD13 H -7.584 0.486 -3.345 1.00 . A A . 8 ILE HD13 1 1 13 4132 1 1 8 ILE HG12 H -8.059 -0.809 -1.358 1.00 . A A . 8 ILE HG12 1 1 13 4133 1 1 8 ILE HG13 H -6.743 0.326 -1.071 1.00 . A A . 8 ILE HG13 1 1 13 4134 1 1 8 ILE HG21 H -6.709 -3.039 -2.694 1.00 . A A . 8 ILE HG21 1 1 13 4135 1 1 8 ILE HG22 H -7.655 -3.242 -1.220 1.00 . A A . 8 ILE HG22 1 1 13 4136 1 1 8 ILE HG23 H -6.005 -3.859 -1.299 1.00 . A A . 8 ILE HG23 1 1 13 4137 1 1 8 ILE N N -5.681 -0.448 0.976 1.00 . A A . 8 ILE N 1 1 13 4138 1 1 8 ILE O O -3.956 -2.858 0.395 1.00 . A A . 8 ILE O 1 1 13 4139 1 1 9 PRO C C -3.873 -5.526 1.315 1.00 . A A . 9 PRO C 1 1 13 4140 1 1 9 PRO CA C -4.627 -4.736 2.387 1.00 . A A . 9 PRO CA 1 1 13 4141 1 1 9 PRO CB C -5.623 -5.639 3.112 1.00 . A A . 9 PRO CB 1 1 13 4142 1 1 9 PRO CD C -6.824 -3.675 2.459 1.00 . A A . 9 PRO CD 1 1 13 4143 1 1 9 PRO CG C -6.717 -4.722 3.535 1.00 . A A . 9 PRO CG 1 1 13 4144 1 1 9 PRO HA H -3.917 -4.342 3.099 1.00 . A A . 9 PRO HA 1 1 13 4145 1 1 9 PRO HB2 H -5.981 -6.401 2.435 1.00 . A A . 9 PRO HB2 1 1 13 4146 1 1 9 PRO HB3 H -5.143 -6.099 3.963 1.00 . A A . 9 PRO HB3 1 1 13 4147 1 1 9 PRO HD2 H -7.578 -3.952 1.737 1.00 . A A . 9 PRO HD2 1 1 13 4148 1 1 9 PRO HD3 H -7.052 -2.712 2.891 1.00 . A A . 9 PRO HD3 1 1 13 4149 1 1 9 PRO HG2 H -7.643 -5.272 3.616 1.00 . A A . 9 PRO HG2 1 1 13 4150 1 1 9 PRO HG3 H -6.468 -4.264 4.480 1.00 . A A . 9 PRO HG3 1 1 13 4151 1 1 9 PRO N N -5.482 -3.671 1.841 1.00 . A A . 9 PRO N 1 1 13 4152 1 1 9 PRO O O -2.738 -5.946 1.532 1.00 . A A . 9 PRO O 1 1 13 4153 1 1 10 ALA C C -2.681 -5.707 -1.522 1.00 . A A . 10 ALA C 1 1 13 4154 1 1 10 ALA CA C -3.889 -6.444 -0.941 1.00 . A A . 10 ALA CA 1 1 13 4155 1 1 10 ALA CB C -4.917 -6.710 -2.031 1.00 . A A . 10 ALA CB 1 1 13 4156 1 1 10 ALA H H -5.396 -5.329 0.039 1.00 . A A . 10 ALA H 1 1 13 4157 1 1 10 ALA HA H -3.560 -7.398 -0.554 1.00 . A A . 10 ALA HA 1 1 13 4158 1 1 10 ALA HB1 H -4.472 -7.318 -2.804 1.00 . A A . 10 ALA HB1 1 1 13 4159 1 1 10 ALA HB2 H -5.244 -5.772 -2.454 1.00 . A A . 10 ALA HB2 1 1 13 4160 1 1 10 ALA HB3 H -5.764 -7.229 -1.608 1.00 . A A . 10 ALA HB3 1 1 13 4161 1 1 10 ALA N N -4.499 -5.704 0.158 1.00 . A A . 10 ALA N 1 1 13 4162 1 1 10 ALA O O -1.670 -6.324 -1.851 1.00 . A A . 10 ALA O 1 1 13 4163 1 1 11 CYS C C -0.711 -3.170 -1.083 1.00 . A A . 11 CYS C 1 1 13 4164 1 1 11 CYS CA C -1.684 -3.594 -2.180 1.00 . A A . 11 CYS CA 1 1 13 4165 1 1 11 CYS CB C -2.232 -2.367 -2.918 1.00 . A A . 11 CYS CB 1 1 13 4166 1 1 11 CYS H H -3.583 -3.934 -1.294 1.00 . A A . 11 CYS H 1 1 13 4167 1 1 11 CYS HA H -1.156 -4.218 -2.885 1.00 . A A . 11 CYS HA 1 1 13 4168 1 1 11 CYS HB2 H -3.176 -2.623 -3.377 1.00 . A A . 11 CYS HB2 1 1 13 4169 1 1 11 CYS HB3 H -2.388 -1.568 -2.209 1.00 . A A . 11 CYS HB3 1 1 13 4170 1 1 11 CYS N N -2.774 -4.386 -1.620 1.00 . A A . 11 CYS N 1 1 13 4171 1 1 11 CYS O O 0.491 -3.042 -1.320 1.00 . A A . 11 CYS O 1 1 13 4172 1 1 11 CYS SG S -1.130 -1.738 -4.234 1.00 . A A . 11 CYS SG 1 1 13 4173 1 1 12 ARG C C 0.551 -3.687 1.626 1.00 . A A . 12 ARG C 1 1 13 4174 1 1 12 ARG CA C -0.419 -2.572 1.264 1.00 . A A . 12 ARG CA 1 1 13 4175 1 1 12 ARG CB C -1.309 -2.254 2.465 1.00 . A A . 12 ARG CB 1 1 13 4176 1 1 12 ARG CD C -1.297 -1.885 4.954 1.00 . A A . 12 ARG CD 1 1 13 4177 1 1 12 ARG CG C -0.562 -1.645 3.643 1.00 . A A . 12 ARG CG 1 1 13 4178 1 1 12 ARG CZ C -3.656 -1.670 5.670 1.00 . A A . 12 ARG CZ 1 1 13 4179 1 1 12 ARG H H -2.206 -3.074 0.242 1.00 . A A . 12 ARG H 1 1 13 4180 1 1 12 ARG HA H 0.140 -1.691 0.991 1.00 . A A . 12 ARG HA 1 1 13 4181 1 1 12 ARG HB2 H -2.072 -1.565 2.151 1.00 . A A . 12 ARG HB2 1 1 13 4182 1 1 12 ARG HB3 H -1.780 -3.163 2.799 1.00 . A A . 12 ARG HB3 1 1 13 4183 1 1 12 ARG HD2 H -1.436 -2.948 5.085 1.00 . A A . 12 ARG HD2 1 1 13 4184 1 1 12 ARG HD3 H -0.696 -1.499 5.765 1.00 . A A . 12 ARG HD3 1 1 13 4185 1 1 12 ARG HE H -2.705 -0.404 4.447 1.00 . A A . 12 ARG HE 1 1 13 4186 1 1 12 ARG HG2 H 0.419 -2.093 3.705 1.00 . A A . 12 ARG HG2 1 1 13 4187 1 1 12 ARG HG3 H -0.466 -0.581 3.484 1.00 . A A . 12 ARG HG3 1 1 13 4188 1 1 12 ARG HH11 H -2.700 -3.280 6.443 1.00 . A A . 12 ARG HH11 1 1 13 4189 1 1 12 ARG HH12 H -4.353 -3.102 6.926 1.00 . A A . 12 ARG HH12 1 1 13 4190 1 1 12 ARG HH21 H -4.869 -0.160 5.069 1.00 . A A . 12 ARG HH21 1 1 13 4191 1 1 12 ARG HH22 H -5.599 -1.314 6.140 1.00 . A A . 12 ARG HH22 1 1 13 4192 1 1 12 ARG N N -1.236 -2.967 0.121 1.00 . A A . 12 ARG N 1 1 13 4193 1 1 12 ARG NE N -2.605 -1.230 4.980 1.00 . A A . 12 ARG NE 1 1 13 4194 1 1 12 ARG NH1 N -3.564 -2.774 6.405 1.00 . A A . 12 ARG NH1 1 1 13 4195 1 1 12 ARG NH2 N -4.802 -0.996 5.624 1.00 . A A . 12 ARG NH2 1 1 13 4196 1 1 12 ARG O O 1.656 -3.437 2.091 1.00 . A A . 12 ARG O 1 1 13 4197 1 1 13 ARG C C 2.210 -6.088 0.856 1.00 . A A . 13 ARG C 1 1 13 4198 1 1 13 ARG CA C 0.929 -6.094 1.690 1.00 . A A . 13 ARG CA 1 1 13 4199 1 1 13 ARG CB C 0.122 -7.366 1.407 1.00 . A A . 13 ARG CB 1 1 13 4200 1 1 13 ARG CD C 0.055 -9.875 1.312 1.00 . A A . 13 ARG CD 1 1 13 4201 1 1 13 ARG CG C 0.851 -8.656 1.752 1.00 . A A . 13 ARG CG 1 1 13 4202 1 1 13 ARG CZ C 0.913 -12.112 0.699 1.00 . A A . 13 ARG CZ 1 1 13 4203 1 1 13 ARG H H -0.794 -5.036 1.051 1.00 . A A . 13 ARG H 1 1 13 4204 1 1 13 ARG HA H 1.194 -6.066 2.733 1.00 . A A . 13 ARG HA 1 1 13 4205 1 1 13 ARG HB2 H -0.790 -7.333 1.984 1.00 . A A . 13 ARG HB2 1 1 13 4206 1 1 13 ARG HB3 H -0.130 -7.391 0.357 1.00 . A A . 13 ARG HB3 1 1 13 4207 1 1 13 ARG HD2 H -0.888 -9.881 1.839 1.00 . A A . 13 ARG HD2 1 1 13 4208 1 1 13 ARG HD3 H -0.129 -9.804 0.249 1.00 . A A . 13 ARG HD3 1 1 13 4209 1 1 13 ARG HE H 1.136 -11.239 2.489 1.00 . A A . 13 ARG HE 1 1 13 4210 1 1 13 ARG HG2 H 1.808 -8.662 1.250 1.00 . A A . 13 ARG HG2 1 1 13 4211 1 1 13 ARG HG3 H 1.002 -8.700 2.820 1.00 . A A . 13 ARG HG3 1 1 13 4212 1 1 13 ARG HH11 H -0.087 -11.157 -0.785 1.00 . A A . 13 ARG HH11 1 1 13 4213 1 1 13 ARG HH12 H 0.521 -12.725 -1.196 1.00 . A A . 13 ARG HH12 1 1 13 4214 1 1 13 ARG HH21 H 1.944 -13.323 1.959 1.00 . A A . 13 ARG HH21 1 1 13 4215 1 1 13 ARG HH22 H 1.681 -13.962 0.370 1.00 . A A . 13 ARG HH22 1 1 13 4216 1 1 13 ARG N N 0.114 -4.917 1.403 1.00 . A A . 13 ARG N 1 1 13 4217 1 1 13 ARG NE N 0.761 -11.128 1.589 1.00 . A A . 13 ARG NE 1 1 13 4218 1 1 13 ARG NH1 N 0.408 -11.989 -0.526 1.00 . A A . 13 ARG NH1 1 1 13 4219 1 1 13 ARG NH2 N 1.565 -13.221 1.037 1.00 . A A . 13 ARG NH2 1 1 13 4220 1 1 13 ARG O O 3.261 -6.550 1.305 1.00 . A A . 13 ARG O 1 1 13 4221 1 1 14 ASN C C 4.007 -4.170 -1.078 1.00 . A A . 14 ASN C 1 1 13 4222 1 1 14 ASN CA C 3.253 -5.486 -1.257 1.00 . A A . 14 ASN CA 1 1 13 4223 1 1 14 ASN CB C 2.776 -5.632 -2.709 1.00 . A A . 14 ASN CB 1 1 13 4224 1 1 14 ASN CG C 3.849 -5.286 -3.729 1.00 . A A . 14 ASN CG 1 1 13 4225 1 1 14 ASN H H 1.247 -5.203 -0.647 1.00 . A A . 14 ASN H 1 1 13 4226 1 1 14 ASN HA H 3.916 -6.304 -1.020 1.00 . A A . 14 ASN HA 1 1 13 4227 1 1 14 ASN HB2 H 2.469 -6.654 -2.876 1.00 . A A . 14 ASN HB2 1 1 13 4228 1 1 14 ASN HB3 H 1.931 -4.979 -2.868 1.00 . A A . 14 ASN HB3 1 1 13 4229 1 1 14 ASN HD21 H 4.533 -7.149 -3.692 1.00 . A A . 14 ASN HD21 1 1 13 4230 1 1 14 ASN HD22 H 5.364 -6.064 -4.746 1.00 . A A . 14 ASN HD22 1 1 13 4231 1 1 14 ASN N N 2.112 -5.557 -0.353 1.00 . A A . 14 ASN N 1 1 13 4232 1 1 14 ASN ND2 N 4.663 -6.265 -4.092 1.00 . A A . 14 ASN ND2 1 1 13 4233 1 1 14 ASN O O 5.216 -4.097 -1.294 1.00 . A A . 14 ASN O 1 1 13 4234 1 1 14 ASN OD1 O 3.937 -4.147 -4.190 1.00 . A A . 14 ASN OD1 1 1 13 4235 1 1 15 HIS C C 4.012 -1.469 1.010 1.00 . A A . 15 HIS C 1 1 13 4236 1 1 15 HIS CA C 3.906 -1.825 -0.464 1.00 . A A . 15 HIS CA 1 1 13 4237 1 1 15 HIS CB C 3.108 -0.755 -1.214 1.00 . A A . 15 HIS CB 1 1 13 4238 1 1 15 HIS CD2 C 2.110 -1.267 -3.550 1.00 . A A . 15 HIS CD2 1 1 13 4239 1 1 15 HIS CE1 C 3.933 -1.037 -4.740 1.00 . A A . 15 HIS CE1 1 1 13 4240 1 1 15 HIS CG C 3.109 -0.941 -2.700 1.00 . A A . 15 HIS CG 1 1 13 4241 1 1 15 HIS H H 2.349 -3.269 -0.420 1.00 . A A . 15 HIS H 1 1 13 4242 1 1 15 HIS HA H 4.903 -1.868 -0.878 1.00 . A A . 15 HIS HA 1 1 13 4243 1 1 15 HIS HB2 H 2.082 -0.779 -0.877 1.00 . A A . 15 HIS HB2 1 1 13 4244 1 1 15 HIS HB3 H 3.530 0.216 -0.999 1.00 . A A . 15 HIS HB3 1 1 13 4245 1 1 15 HIS HD1 H 5.137 -0.584 -3.150 1.00 . A A . 15 HIS HD1 1 1 13 4246 1 1 15 HIS HD2 H 1.078 -1.452 -3.285 1.00 . A A . 15 HIS HD2 1 1 13 4247 1 1 15 HIS HE1 H 4.620 -1.002 -5.572 1.00 . A A . 15 HIS HE1 1 1 13 4248 1 1 15 HIS HE2 H 2.214 -1.744 -5.588 1.00 . A A . 15 HIS HE2 1 1 13 4249 1 1 15 HIS N N 3.299 -3.140 -0.645 1.00 . A A . 15 HIS N 1 1 13 4250 1 1 15 HIS ND1 N 4.241 -0.804 -3.477 1.00 . A A . 15 HIS ND1 1 1 13 4251 1 1 15 HIS NE2 N 2.647 -1.322 -4.813 1.00 . A A . 15 HIS NE2 1 1 13 4252 1 1 15 HIS O O 3.866 -0.310 1.396 1.00 . A A . 15 HIS O 1 1 13 4253 1 1 16 LYS C C 5.659 -1.473 3.612 1.00 . A A . 16 LYS C 1 1 13 4254 1 1 16 LYS CA C 4.427 -2.302 3.267 1.00 . A A . 16 LYS CA 1 1 13 4255 1 1 16 LYS CB C 4.510 -3.668 3.950 1.00 . A A . 16 LYS CB 1 1 13 4256 1 1 16 LYS CD C 5.562 -5.952 3.998 1.00 . A A . 16 LYS CD 1 1 13 4257 1 1 16 LYS CE C 6.573 -6.877 3.342 1.00 . A A . 16 LYS CE 1 1 13 4258 1 1 16 LYS CG C 5.550 -4.589 3.330 1.00 . A A . 16 LYS CG 1 1 13 4259 1 1 16 LYS H H 4.405 -3.372 1.443 1.00 . A A . 16 LYS H 1 1 13 4260 1 1 16 LYS HA H 3.548 -1.785 3.622 1.00 . A A . 16 LYS HA 1 1 13 4261 1 1 16 LYS HB2 H 4.760 -3.525 4.991 1.00 . A A . 16 LYS HB2 1 1 13 4262 1 1 16 LYS HB3 H 3.546 -4.152 3.882 1.00 . A A . 16 LYS HB3 1 1 13 4263 1 1 16 LYS HD2 H 5.821 -5.831 5.039 1.00 . A A . 16 LYS HD2 1 1 13 4264 1 1 16 LYS HD3 H 4.579 -6.392 3.918 1.00 . A A . 16 LYS HD3 1 1 13 4265 1 1 16 LYS HE2 H 6.302 -7.010 2.305 1.00 . A A . 16 LYS HE2 1 1 13 4266 1 1 16 LYS HE3 H 7.551 -6.422 3.402 1.00 . A A . 16 LYS HE3 1 1 13 4267 1 1 16 LYS HG2 H 5.323 -4.717 2.282 1.00 . A A . 16 LYS HG2 1 1 13 4268 1 1 16 LYS HG3 H 6.524 -4.137 3.436 1.00 . A A . 16 LYS HG3 1 1 13 4269 1 1 16 LYS HZ1 H 7.296 -8.828 3.514 1.00 . A A . 16 LYS HZ1 1 1 13 4270 1 1 16 LYS HZ2 H 5.678 -8.652 3.976 1.00 . A A . 16 LYS HZ2 1 1 13 4271 1 1 16 LYS HZ3 H 6.912 -8.106 4.995 1.00 . A A . 16 LYS HZ3 1 1 13 4272 1 1 16 LYS N N 4.295 -2.476 1.823 1.00 . A A . 16 LYS N 1 1 13 4273 1 1 16 LYS NZ N 6.618 -8.209 4.003 1.00 . A A . 16 LYS NZ 1 1 13 4274 1 1 16 LYS O O 5.799 -0.981 4.728 1.00 . A A . 16 LYS O 1 1 13 4275 1 1 17 LYS C C 7.519 0.919 2.613 1.00 . A A . 17 LYS C 1 1 13 4276 1 1 17 LYS CA C 7.771 -0.560 2.853 1.00 . A A . 17 LYS CA 1 1 13 4277 1 1 17 LYS CB C 8.880 -1.057 1.928 1.00 . A A . 17 LYS CB 1 1 13 4278 1 1 17 LYS CD C 10.653 -0.705 3.673 1.00 . A A . 17 LYS CD 1 1 13 4279 1 1 17 LYS CE C 11.724 -1.365 4.525 1.00 . A A . 17 LYS CE 1 1 13 4280 1 1 17 LYS CG C 10.054 -1.677 2.669 1.00 . A A . 17 LYS CG 1 1 13 4281 1 1 17 LYS H H 6.396 -1.752 1.781 1.00 . A A . 17 LYS H 1 1 13 4282 1 1 17 LYS HA H 8.077 -0.696 3.877 1.00 . A A . 17 LYS HA 1 1 13 4283 1 1 17 LYS HB2 H 8.467 -1.797 1.260 1.00 . A A . 17 LYS HB2 1 1 13 4284 1 1 17 LYS HB3 H 9.246 -0.224 1.348 1.00 . A A . 17 LYS HB3 1 1 13 4285 1 1 17 LYS HD2 H 11.094 0.123 3.138 1.00 . A A . 17 LYS HD2 1 1 13 4286 1 1 17 LYS HD3 H 9.867 -0.340 4.318 1.00 . A A . 17 LYS HD3 1 1 13 4287 1 1 17 LYS HE2 H 11.304 -2.242 4.994 1.00 . A A . 17 LYS HE2 1 1 13 4288 1 1 17 LYS HE3 H 12.545 -1.657 3.886 1.00 . A A . 17 LYS HE3 1 1 13 4289 1 1 17 LYS HG2 H 9.712 -2.557 3.194 1.00 . A A . 17 LYS HG2 1 1 13 4290 1 1 17 LYS HG3 H 10.813 -1.955 1.952 1.00 . A A . 17 LYS HG3 1 1 13 4291 1 1 17 LYS HZ1 H 11.456 -0.163 6.211 1.00 . A A . 17 LYS HZ1 1 1 13 4292 1 1 17 LYS HZ2 H 12.643 0.405 5.147 1.00 . A A . 17 LYS HZ2 1 1 13 4293 1 1 17 LYS HZ3 H 12.965 -0.922 6.146 1.00 . A A . 17 LYS HZ3 1 1 13 4294 1 1 17 LYS N N 6.557 -1.330 2.648 1.00 . A A . 17 LYS N 1 1 13 4295 1 1 17 LYS NZ N 12.233 -0.447 5.581 1.00 . A A . 17 LYS NZ 1 1 13 4296 1 1 17 LYS O O 8.249 1.772 3.113 1.00 . A A . 17 LYS O 1 1 13 4297 1 1 18 PHE C C 5.114 3.090 2.546 1.00 . A A . 18 PHE C 1 1 13 4298 1 1 18 PHE CA C 6.126 2.580 1.532 1.00 . A A . 18 PHE CA 1 1 13 4299 1 1 18 PHE CB C 5.541 2.679 0.120 1.00 . A A . 18 PHE CB 1 1 13 4300 1 1 18 PHE CD1 C 7.397 3.235 -1.475 1.00 . A A . 18 PHE CD1 1 1 13 4301 1 1 18 PHE CD2 C 6.518 1.018 -1.487 1.00 . A A . 18 PHE CD2 1 1 13 4302 1 1 18 PHE CE1 C 8.282 2.894 -2.479 1.00 . A A . 18 PHE CE1 1 1 13 4303 1 1 18 PHE CE2 C 7.402 0.670 -2.491 1.00 . A A . 18 PHE CE2 1 1 13 4304 1 1 18 PHE CG C 6.506 2.303 -0.968 1.00 . A A . 18 PHE CG 1 1 13 4305 1 1 18 PHE CZ C 8.285 1.609 -2.988 1.00 . A A . 18 PHE CZ 1 1 13 4306 1 1 18 PHE H H 5.954 0.475 1.472 1.00 . A A . 18 PHE H 1 1 13 4307 1 1 18 PHE HA H 7.020 3.184 1.590 1.00 . A A . 18 PHE HA 1 1 13 4308 1 1 18 PHE HB2 H 4.687 2.022 0.046 1.00 . A A . 18 PHE HB2 1 1 13 4309 1 1 18 PHE HB3 H 5.221 3.696 -0.055 1.00 . A A . 18 PHE HB3 1 1 13 4310 1 1 18 PHE HD1 H 7.396 4.240 -1.077 1.00 . A A . 18 PHE HD1 1 1 13 4311 1 1 18 PHE HD2 H 5.829 0.283 -1.099 1.00 . A A . 18 PHE HD2 1 1 13 4312 1 1 18 PHE HE1 H 8.971 3.629 -2.867 1.00 . A A . 18 PHE HE1 1 1 13 4313 1 1 18 PHE HE2 H 7.402 -0.335 -2.886 1.00 . A A . 18 PHE HE2 1 1 13 4314 1 1 18 PHE HZ H 8.975 1.339 -3.772 1.00 . A A . 18 PHE HZ 1 1 13 4315 1 1 18 PHE N N 6.489 1.206 1.839 1.00 . A A . 18 PHE N 1 1 13 4316 1 1 18 PHE O O 5.220 4.211 3.041 1.00 . A A . 18 PHE O 1 1 13 4317 1 1 19 CYS C C 3.479 2.189 5.216 1.00 . A A . 19 CYS C 1 1 13 4318 1 1 19 CYS CA C 3.096 2.621 3.805 1.00 . A A . 19 CYS CA 1 1 13 4319 1 1 19 CYS CB C 1.759 1.997 3.398 1.00 . A A . 19 CYS CB 1 1 13 4320 1 1 19 CYS H H 4.120 1.363 2.448 1.00 . A A . 19 CYS H 1 1 13 4321 1 1 19 CYS HA H 3.000 3.697 3.788 1.00 . A A . 19 CYS HA 1 1 13 4322 1 1 19 CYS HB2 H 1.727 0.970 3.722 1.00 . A A . 19 CYS HB2 1 1 13 4323 1 1 19 CYS HB3 H 0.958 2.543 3.874 1.00 . A A . 19 CYS HB3 1 1 13 4324 1 1 19 CYS N N 4.135 2.255 2.855 1.00 . A A . 19 CYS N 1 1 13 4325 1 1 19 CYS O O 2.827 1.332 5.814 1.00 . A A . 19 CYS O 1 1 13 4326 1 1 19 CYS SG S 1.449 2.024 1.601 1.00 . A A . 19 CYS SG 1 1 13 4327 1 1 20 NH2 HN1 H 5.007 3.456 5.211 1.00 . A A . 20 NH2 HN1 1 1 13 4328 1 1 20 NH2 HN2 H 4.809 2.522 6.651 1.00 . A A . 20 NH2 HN2 1 1 13 4329 1 1 20 NH2 N N 4.538 2.782 5.748 1.00 . A A . 20 NH2 N 1 1 14 4330 1 1 1 PHE C C 1.539 6.455 -5.433 1.00 . A A . 1 PHE C 1 1 14 4331 1 1 1 PHE CA C 3.013 6.468 -5.809 1.00 . A A . 1 PHE CA 1 1 14 4332 1 1 1 PHE CB C 3.882 6.564 -4.548 1.00 . A A . 1 PHE CB 1 1 14 4333 1 1 1 PHE CD1 C 3.934 4.186 -3.734 1.00 . A A . 1 PHE CD1 1 1 14 4334 1 1 1 PHE CD2 C 2.954 5.843 -2.328 1.00 . A A . 1 PHE CD2 1 1 14 4335 1 1 1 PHE CE1 C 3.659 3.217 -2.788 1.00 . A A . 1 PHE CE1 1 1 14 4336 1 1 1 PHE CE2 C 2.676 4.878 -1.378 1.00 . A A . 1 PHE CE2 1 1 14 4337 1 1 1 PHE CG C 3.585 5.509 -3.516 1.00 . A A . 1 PHE CG 1 1 14 4338 1 1 1 PHE CZ C 3.029 3.563 -1.609 1.00 . A A . 1 PHE CZ 1 1 14 4339 1 1 1 PHE H1 H 2.749 7.517 -7.587 1.00 . A A . 1 PHE H1 1 1 14 4340 1 1 1 PHE H2 H 4.307 7.647 -6.941 1.00 . A A . 1 PHE H2 1 1 14 4341 1 1 1 PHE H3 H 3.025 8.502 -6.242 1.00 . A A . 1 PHE H3 1 1 14 4342 1 1 1 PHE HA H 3.247 5.554 -6.336 1.00 . A A . 1 PHE HA 1 1 14 4343 1 1 1 PHE HB2 H 4.921 6.466 -4.829 1.00 . A A . 1 PHE HB2 1 1 14 4344 1 1 1 PHE HB3 H 3.731 7.529 -4.089 1.00 . A A . 1 PHE HB3 1 1 14 4345 1 1 1 PHE HD1 H 4.427 3.913 -4.656 1.00 . A A . 1 PHE HD1 1 1 14 4346 1 1 1 PHE HD2 H 2.676 6.871 -2.146 1.00 . A A . 1 PHE HD2 1 1 14 4347 1 1 1 PHE HE1 H 3.935 2.189 -2.971 1.00 . A A . 1 PHE HE1 1 1 14 4348 1 1 1 PHE HE2 H 2.184 5.153 -0.457 1.00 . A A . 1 PHE HE2 1 1 14 4349 1 1 1 PHE HZ H 2.813 2.808 -0.868 1.00 . A A . 1 PHE HZ 1 1 14 4350 1 1 1 PHE N N 3.295 7.612 -6.708 1.00 . A A . 1 PHE N 1 1 14 4351 1 1 1 PHE O O 0.953 7.506 -5.187 1.00 . A A . 1 PHE O 1 1 14 4352 1 1 2 ASN C C -0.610 4.847 -3.568 1.00 . A A . 2 ASN C 1 1 14 4353 1 1 2 ASN CA C -0.465 5.135 -5.057 1.00 . A A . 2 ASN CA 1 1 14 4354 1 1 2 ASN CB C -1.123 4.018 -5.873 1.00 . A A . 2 ASN CB 1 1 14 4355 1 1 2 ASN CG C -2.608 3.887 -5.581 1.00 . A A . 2 ASN CG 1 1 14 4356 1 1 2 ASN H H 1.460 4.468 -5.620 1.00 . A A . 2 ASN H 1 1 14 4357 1 1 2 ASN HA H -0.954 6.071 -5.280 1.00 . A A . 2 ASN HA 1 1 14 4358 1 1 2 ASN HB2 H -1.000 4.228 -6.925 1.00 . A A . 2 ASN HB2 1 1 14 4359 1 1 2 ASN HB3 H -0.645 3.079 -5.637 1.00 . A A . 2 ASN HB3 1 1 14 4360 1 1 2 ASN HD21 H -2.571 1.968 -6.091 1.00 . A A . 2 ASN HD21 1 1 14 4361 1 1 2 ASN HD22 H -4.108 2.589 -5.604 1.00 . A A . 2 ASN HD22 1 1 14 4362 1 1 2 ASN N N 0.943 5.271 -5.408 1.00 . A A . 2 ASN N 1 1 14 4363 1 1 2 ASN ND2 N -3.149 2.694 -5.775 1.00 . A A . 2 ASN ND2 1 1 14 4364 1 1 2 ASN O O -0.605 3.689 -3.145 1.00 . A A . 2 ASN O 1 1 14 4365 1 1 2 ASN OD1 O -3.261 4.850 -5.179 1.00 . A A . 2 ASN OD1 1 1 14 4366 1 1 3 TRP C C -2.141 5.008 -0.970 1.00 . A A . 3 TRP C 1 1 14 4367 1 1 3 TRP CA C -0.882 5.787 -1.333 1.00 . A A . 3 TRP CA 1 1 14 4368 1 1 3 TRP CB C -0.903 7.174 -0.676 1.00 . A A . 3 TRP CB 1 1 14 4369 1 1 3 TRP CD1 C -1.890 8.861 -2.340 1.00 . A A . 3 TRP CD1 1 1 14 4370 1 1 3 TRP CD2 C -3.258 8.335 -0.648 1.00 . A A . 3 TRP CD2 1 1 14 4371 1 1 3 TRP CE2 C -3.912 9.260 -1.483 1.00 . A A . 3 TRP CE2 1 1 14 4372 1 1 3 TRP CE3 C -3.928 7.861 0.485 1.00 . A A . 3 TRP CE3 1 1 14 4373 1 1 3 TRP CG C -1.965 8.088 -1.216 1.00 . A A . 3 TRP CG 1 1 14 4374 1 1 3 TRP CH2 C -5.831 9.240 -0.106 1.00 . A A . 3 TRP CH2 1 1 14 4375 1 1 3 TRP CZ2 C -5.200 9.720 -1.222 1.00 . A A . 3 TRP CZ2 1 1 14 4376 1 1 3 TRP CZ3 C -5.206 8.319 0.743 1.00 . A A . 3 TRP CZ3 1 1 14 4377 1 1 3 TRP H H -0.740 6.802 -3.185 1.00 . A A . 3 TRP H 1 1 14 4378 1 1 3 TRP HA H -0.027 5.242 -0.968 1.00 . A A . 3 TRP HA 1 1 14 4379 1 1 3 TRP HB2 H -1.074 7.058 0.383 1.00 . A A . 3 TRP HB2 1 1 14 4380 1 1 3 TRP HB3 H 0.055 7.649 -0.829 1.00 . A A . 3 TRP HB3 1 1 14 4381 1 1 3 TRP HD1 H -1.031 8.898 -2.995 1.00 . A A . 3 TRP HD1 1 1 14 4382 1 1 3 TRP HE1 H -3.245 10.185 -3.246 1.00 . A A . 3 TRP HE1 1 1 14 4383 1 1 3 TRP HE3 H -3.463 7.150 1.151 1.00 . A A . 3 TRP HE3 1 1 14 4384 1 1 3 TRP HH2 H -6.830 9.570 0.135 1.00 . A A . 3 TRP HH2 1 1 14 4385 1 1 3 TRP HZ2 H -5.696 10.430 -1.867 1.00 . A A . 3 TRP HZ2 1 1 14 4386 1 1 3 TRP HZ3 H -5.737 7.964 1.615 1.00 . A A . 3 TRP HZ3 1 1 14 4387 1 1 3 TRP N N -0.740 5.909 -2.782 1.00 . A A . 3 TRP N 1 1 14 4388 1 1 3 TRP NE1 N -3.057 9.563 -2.510 1.00 . A A . 3 TRP NE1 1 1 14 4389 1 1 3 TRP O O -2.226 4.402 0.099 1.00 . A A . 3 TRP O 1 1 14 4390 1 1 4 ARG C C -4.137 2.811 -1.508 1.00 . A A . 4 ARG C 1 1 14 4391 1 1 4 ARG CA C -4.359 4.298 -1.671 1.00 . A A . 4 ARG CA 1 1 14 4392 1 1 4 ARG CB C -5.331 4.562 -2.813 1.00 . A A . 4 ARG CB 1 1 14 4393 1 1 4 ARG CD C -7.170 5.496 -1.381 1.00 . A A . 4 ARG CD 1 1 14 4394 1 1 4 ARG CG C -6.251 5.748 -2.569 1.00 . A A . 4 ARG CG 1 1 14 4395 1 1 4 ARG CZ C -8.923 6.678 -0.103 1.00 . A A . 4 ARG CZ 1 1 14 4396 1 1 4 ARG H H -2.957 5.479 -2.727 1.00 . A A . 4 ARG H 1 1 14 4397 1 1 4 ARG HA H -4.778 4.669 -0.758 1.00 . A A . 4 ARG HA 1 1 14 4398 1 1 4 ARG HB2 H -4.765 4.754 -3.713 1.00 . A A . 4 ARG HB2 1 1 14 4399 1 1 4 ARG HB3 H -5.934 3.682 -2.962 1.00 . A A . 4 ARG HB3 1 1 14 4400 1 1 4 ARG HD2 H -7.811 4.658 -1.612 1.00 . A A . 4 ARG HD2 1 1 14 4401 1 1 4 ARG HD3 H -6.565 5.257 -0.520 1.00 . A A . 4 ARG HD3 1 1 14 4402 1 1 4 ARG HE H -7.864 7.467 -1.611 1.00 . A A . 4 ARG HE 1 1 14 4403 1 1 4 ARG HG2 H -5.650 6.622 -2.367 1.00 . A A . 4 ARG HG2 1 1 14 4404 1 1 4 ARG HG3 H -6.852 5.914 -3.450 1.00 . A A . 4 ARG HG3 1 1 14 4405 1 1 4 ARG HH11 H -8.608 4.760 0.475 1.00 . A A . 4 ARG HH11 1 1 14 4406 1 1 4 ARG HH12 H -9.828 5.608 1.365 1.00 . A A . 4 ARG HH12 1 1 14 4407 1 1 4 ARG HH21 H -9.476 8.602 -0.437 1.00 . A A . 4 ARG HH21 1 1 14 4408 1 1 4 ARG HH22 H -10.323 7.801 0.844 1.00 . A A . 4 ARG HH22 1 1 14 4409 1 1 4 ARG N N -3.103 5.002 -1.884 1.00 . A A . 4 ARG N 1 1 14 4410 1 1 4 ARG NE N -8.003 6.658 -1.070 1.00 . A A . 4 ARG NE 1 1 14 4411 1 1 4 ARG NH1 N -9.138 5.595 0.639 1.00 . A A . 4 ARG NH1 1 1 14 4412 1 1 4 ARG NH2 N -9.631 7.782 0.119 1.00 . A A . 4 ARG NH2 1 1 14 4413 1 1 4 ARG O O -4.955 2.113 -0.914 1.00 . A A . 4 ARG O 1 1 14 4414 1 1 5 CYS C C -2.534 0.548 -0.462 1.00 . A A . 5 CYS C 1 1 14 4415 1 1 5 CYS CA C -2.668 0.935 -1.922 1.00 . A A . 5 CYS CA 1 1 14 4416 1 1 5 CYS CB C -1.348 0.658 -2.630 1.00 . A A . 5 CYS CB 1 1 14 4417 1 1 5 CYS H H -2.440 2.955 -2.519 1.00 . A A . 5 CYS H 1 1 14 4418 1 1 5 CYS HA H -3.449 0.345 -2.378 1.00 . A A . 5 CYS HA 1 1 14 4419 1 1 5 CYS HB2 H -0.743 1.552 -2.597 1.00 . A A . 5 CYS HB2 1 1 14 4420 1 1 5 CYS HB3 H -0.832 -0.136 -2.110 1.00 . A A . 5 CYS HB3 1 1 14 4421 1 1 5 CYS N N -3.030 2.338 -2.036 1.00 . A A . 5 CYS N 1 1 14 4422 1 1 5 CYS O O -2.882 -0.560 -0.067 1.00 . A A . 5 CYS O 1 1 14 4423 1 1 5 CYS SG S -1.521 0.160 -4.372 1.00 . A A . 5 CYS SG 1 1 14 4424 1 1 6 CYS C C -3.208 1.198 2.498 1.00 . A A . 6 CYS C 1 1 14 4425 1 1 6 CYS CA C -1.872 1.245 1.764 1.00 . A A . 6 CYS CA 1 1 14 4426 1 1 6 CYS CB C -0.948 2.309 2.350 1.00 . A A . 6 CYS CB 1 1 14 4427 1 1 6 CYS H H -1.877 2.388 -0.026 1.00 . A A . 6 CYS H 1 1 14 4428 1 1 6 CYS HA H -1.396 0.277 1.864 1.00 . A A . 6 CYS HA 1 1 14 4429 1 1 6 CYS HB2 H -1.463 3.258 2.369 1.00 . A A . 6 CYS HB2 1 1 14 4430 1 1 6 CYS HB3 H -0.674 2.028 3.356 1.00 . A A . 6 CYS HB3 1 1 14 4431 1 1 6 CYS N N -2.072 1.490 0.343 1.00 . A A . 6 CYS N 1 1 14 4432 1 1 6 CYS O O -3.280 0.812 3.665 1.00 . A A . 6 CYS O 1 1 14 4433 1 1 6 CYS SG S 0.590 2.523 1.394 1.00 . A A . 6 CYS SG 1 1 14 4434 1 1 7 LEU C C -6.290 0.256 1.929 1.00 . A A . 7 LEU C 1 1 14 4435 1 1 7 LEU CA C -5.606 1.541 2.369 1.00 . A A . 7 LEU CA 1 1 14 4436 1 1 7 LEU CB C -6.430 2.760 1.931 1.00 . A A . 7 LEU CB 1 1 14 4437 1 1 7 LEU CD1 C -6.210 3.783 4.219 1.00 . A A . 7 LEU CD1 1 1 14 4438 1 1 7 LEU CD2 C -4.859 4.688 2.317 1.00 . A A . 7 LEU CD2 1 1 14 4439 1 1 7 LEU CG C -6.180 4.052 2.721 1.00 . A A . 7 LEU CG 1 1 14 4440 1 1 7 LEU H H -4.147 1.898 0.883 1.00 . A A . 7 LEU H 1 1 14 4441 1 1 7 LEU HA H -5.513 1.535 3.441 1.00 . A A . 7 LEU HA 1 1 14 4442 1 1 7 LEU HB2 H -6.215 2.956 0.890 1.00 . A A . 7 LEU HB2 1 1 14 4443 1 1 7 LEU HB3 H -7.476 2.509 2.020 1.00 . A A . 7 LEU HB3 1 1 14 4444 1 1 7 LEU HD11 H -6.029 4.703 4.753 1.00 . A A . 7 LEU HD11 1 1 14 4445 1 1 7 LEU HD12 H -5.445 3.063 4.470 1.00 . A A . 7 LEU HD12 1 1 14 4446 1 1 7 LEU HD13 H -7.178 3.391 4.494 1.00 . A A . 7 LEU HD13 1 1 14 4447 1 1 7 LEU HD21 H -4.707 5.596 2.883 1.00 . A A . 7 LEU HD21 1 1 14 4448 1 1 7 LEU HD22 H -4.879 4.922 1.262 1.00 . A A . 7 LEU HD22 1 1 14 4449 1 1 7 LEU HD23 H -4.051 4.000 2.517 1.00 . A A . 7 LEU HD23 1 1 14 4450 1 1 7 LEU HG H -6.970 4.755 2.497 1.00 . A A . 7 LEU HG 1 1 14 4451 1 1 7 LEU N N -4.267 1.580 1.803 1.00 . A A . 7 LEU N 1 1 14 4452 1 1 7 LEU O O -7.369 -0.093 2.402 1.00 . A A . 7 LEU O 1 1 14 4453 1 1 8 ILE C C -5.237 -2.856 0.959 1.00 . A A . 8 ILE C 1 1 14 4454 1 1 8 ILE CA C -6.123 -1.706 0.494 1.00 . A A . 8 ILE CA 1 1 14 4455 1 1 8 ILE CB C -6.160 -1.687 -1.050 1.00 . A A . 8 ILE CB 1 1 14 4456 1 1 8 ILE CD1 C -6.799 -0.229 -3.043 1.00 . A A . 8 ILE CD1 1 1 14 4457 1 1 8 ILE CG1 C -6.939 -0.468 -1.554 1.00 . A A . 8 ILE CG1 1 1 14 4458 1 1 8 ILE CG2 C -6.778 -2.973 -1.585 1.00 . A A . 8 ILE CG2 1 1 14 4459 1 1 8 ILE H H -4.745 -0.124 0.729 1.00 . A A . 8 ILE H 1 1 14 4460 1 1 8 ILE HA H -7.127 -1.856 0.863 1.00 . A A . 8 ILE HA 1 1 14 4461 1 1 8 ILE HB H -5.144 -1.630 -1.411 1.00 . A A . 8 ILE HB 1 1 14 4462 1 1 8 ILE HD11 H -7.385 0.632 -3.325 1.00 . A A . 8 ILE HD11 1 1 14 4463 1 1 8 ILE HD12 H -7.152 -1.096 -3.580 1.00 . A A . 8 ILE HD12 1 1 14 4464 1 1 8 ILE HD13 H -5.761 -0.055 -3.283 1.00 . A A . 8 ILE HD13 1 1 14 4465 1 1 8 ILE HG12 H -7.987 -0.605 -1.337 1.00 . A A . 8 ILE HG12 1 1 14 4466 1 1 8 ILE HG13 H -6.582 0.414 -1.040 1.00 . A A . 8 ILE HG13 1 1 14 4467 1 1 8 ILE HG21 H -7.784 -3.074 -1.205 1.00 . A A . 8 ILE HG21 1 1 14 4468 1 1 8 ILE HG22 H -6.186 -3.818 -1.265 1.00 . A A . 8 ILE HG22 1 1 14 4469 1 1 8 ILE HG23 H -6.803 -2.938 -2.664 1.00 . A A . 8 ILE HG23 1 1 14 4470 1 1 8 ILE N N -5.621 -0.452 1.030 1.00 . A A . 8 ILE N 1 1 14 4471 1 1 8 ILE O O -4.081 -2.959 0.548 1.00 . A A . 8 ILE O 1 1 14 4472 1 1 9 PRO C C -4.316 -5.731 1.304 1.00 . A A . 9 PRO C 1 1 14 4473 1 1 9 PRO CA C -5.034 -4.890 2.362 1.00 . A A . 9 PRO CA 1 1 14 4474 1 1 9 PRO CB C -6.127 -5.718 3.041 1.00 . A A . 9 PRO CB 1 1 14 4475 1 1 9 PRO CD C -7.164 -3.696 2.308 1.00 . A A . 9 PRO CD 1 1 14 4476 1 1 9 PRO CG C -7.181 -4.728 3.400 1.00 . A A . 9 PRO CG 1 1 14 4477 1 1 9 PRO HA H -4.318 -4.570 3.104 1.00 . A A . 9 PRO HA 1 1 14 4478 1 1 9 PRO HB2 H -6.499 -6.462 2.353 1.00 . A A . 9 PRO HB2 1 1 14 4479 1 1 9 PRO HB3 H -5.724 -6.200 3.919 1.00 . A A . 9 PRO HB3 1 1 14 4480 1 1 9 PRO HD2 H -7.862 -3.961 1.528 1.00 . A A . 9 PRO HD2 1 1 14 4481 1 1 9 PRO HD3 H -7.396 -2.720 2.709 1.00 . A A . 9 PRO HD3 1 1 14 4482 1 1 9 PRO HG2 H -8.144 -5.217 3.441 1.00 . A A . 9 PRO HG2 1 1 14 4483 1 1 9 PRO HG3 H -6.948 -4.273 4.351 1.00 . A A . 9 PRO HG3 1 1 14 4484 1 1 9 PRO N N -5.775 -3.742 1.810 1.00 . A A . 9 PRO N 1 1 14 4485 1 1 9 PRO O O -3.345 -6.420 1.611 1.00 . A A . 9 PRO O 1 1 14 4486 1 1 10 ALA C C -2.962 -5.729 -1.608 1.00 . A A . 10 ALA C 1 1 14 4487 1 1 10 ALA CA C -4.190 -6.429 -1.021 1.00 . A A . 10 ALA CA 1 1 14 4488 1 1 10 ALA CB C -5.221 -6.685 -2.110 1.00 . A A . 10 ALA CB 1 1 14 4489 1 1 10 ALA H H -5.558 -5.091 -0.120 1.00 . A A . 10 ALA H 1 1 14 4490 1 1 10 ALA HA H -3.884 -7.386 -0.623 1.00 . A A . 10 ALA HA 1 1 14 4491 1 1 10 ALA HB1 H -4.788 -7.312 -2.875 1.00 . A A . 10 ALA HB1 1 1 14 4492 1 1 10 ALA HB2 H -5.526 -5.745 -2.545 1.00 . A A . 10 ALA HB2 1 1 14 4493 1 1 10 ALA HB3 H -6.081 -7.179 -1.682 1.00 . A A . 10 ALA HB3 1 1 14 4494 1 1 10 ALA N N -4.788 -5.666 0.067 1.00 . A A . 10 ALA N 1 1 14 4495 1 1 10 ALA O O -1.999 -6.386 -1.998 1.00 . A A . 10 ALA O 1 1 14 4496 1 1 11 CYS C C -0.883 -3.214 -1.134 1.00 . A A . 11 CYS C 1 1 14 4497 1 1 11 CYS CA C -1.862 -3.651 -2.220 1.00 . A A . 11 CYS CA 1 1 14 4498 1 1 11 CYS CB C -2.375 -2.432 -2.999 1.00 . A A . 11 CYS CB 1 1 14 4499 1 1 11 CYS H H -3.742 -3.915 -1.261 1.00 . A A . 11 CYS H 1 1 14 4500 1 1 11 CYS HA H -1.346 -4.309 -2.903 1.00 . A A . 11 CYS HA 1 1 14 4501 1 1 11 CYS HB2 H -3.317 -2.681 -3.464 1.00 . A A . 11 CYS HB2 1 1 14 4502 1 1 11 CYS HB3 H -2.526 -1.613 -2.311 1.00 . A A . 11 CYS HB3 1 1 14 4503 1 1 11 CYS N N -2.979 -4.401 -1.646 1.00 . A A . 11 CYS N 1 1 14 4504 1 1 11 CYS O O 0.304 -2.999 -1.399 1.00 . A A . 11 CYS O 1 1 14 4505 1 1 11 CYS SG S -1.245 -1.853 -4.314 1.00 . A A . 11 CYS SG 1 1 14 4506 1 1 12 ARG C C 0.521 -3.725 1.498 1.00 . A A . 12 ARG C 1 1 14 4507 1 1 12 ARG CA C -0.553 -2.689 1.221 1.00 . A A . 12 ARG CA 1 1 14 4508 1 1 12 ARG CB C -1.413 -2.495 2.465 1.00 . A A . 12 ARG CB 1 1 14 4509 1 1 12 ARG CD C -1.600 -1.431 4.742 1.00 . A A . 12 ARG CD 1 1 14 4510 1 1 12 ARG CG C -0.659 -1.888 3.640 1.00 . A A . 12 ARG CG 1 1 14 4511 1 1 12 ARG CZ C -3.768 -2.424 5.392 1.00 . A A . 12 ARG CZ 1 1 14 4512 1 1 12 ARG H H -2.337 -3.265 0.236 1.00 . A A . 12 ARG H 1 1 14 4513 1 1 12 ARG HA H -0.080 -1.751 0.970 1.00 . A A . 12 ARG HA 1 1 14 4514 1 1 12 ARG HB2 H -2.237 -1.855 2.215 1.00 . A A . 12 ARG HB2 1 1 14 4515 1 1 12 ARG HB3 H -1.799 -3.453 2.772 1.00 . A A . 12 ARG HB3 1 1 14 4516 1 1 12 ARG HD2 H -1.011 -1.038 5.558 1.00 . A A . 12 ARG HD2 1 1 14 4517 1 1 12 ARG HD3 H -2.235 -0.649 4.351 1.00 . A A . 12 ARG HD3 1 1 14 4518 1 1 12 ARG HE H -1.992 -3.348 5.509 1.00 . A A . 12 ARG HE 1 1 14 4519 1 1 12 ARG HG2 H 0.015 -2.629 4.043 1.00 . A A . 12 ARG HG2 1 1 14 4520 1 1 12 ARG HG3 H -0.091 -1.039 3.288 1.00 . A A . 12 ARG HG3 1 1 14 4521 1 1 12 ARG HH11 H -3.888 -0.537 4.642 1.00 . A A . 12 ARG HH11 1 1 14 4522 1 1 12 ARG HH12 H -5.397 -1.240 5.136 1.00 . A A . 12 ARG HH12 1 1 14 4523 1 1 12 ARG HH21 H -3.983 -4.285 6.169 1.00 . A A . 12 ARG HH21 1 1 14 4524 1 1 12 ARG HH22 H -5.448 -3.376 6.010 1.00 . A A . 12 ARG HH22 1 1 14 4525 1 1 12 ARG N N -1.380 -3.093 0.090 1.00 . A A . 12 ARG N 1 1 14 4526 1 1 12 ARG NE N -2.443 -2.515 5.247 1.00 . A A . 12 ARG NE 1 1 14 4527 1 1 12 ARG NH1 N -4.403 -1.314 5.028 1.00 . A A . 12 ARG NH1 1 1 14 4528 1 1 12 ARG NH2 N -4.455 -3.444 5.895 1.00 . A A . 12 ARG NH2 1 1 14 4529 1 1 12 ARG O O 1.595 -3.400 1.981 1.00 . A A . 12 ARG O 1 1 14 4530 1 1 13 ARG C C 2.450 -5.854 0.622 1.00 . A A . 13 ARG C 1 1 14 4531 1 1 13 ARG CA C 1.148 -6.076 1.389 1.00 . A A . 13 ARG CA 1 1 14 4532 1 1 13 ARG CB C 0.521 -7.398 0.942 1.00 . A A . 13 ARG CB 1 1 14 4533 1 1 13 ARG CD C -1.226 -9.160 1.293 1.00 . A A . 13 ARG CD 1 1 14 4534 1 1 13 ARG CG C -0.569 -7.913 1.865 1.00 . A A . 13 ARG CG 1 1 14 4535 1 1 13 ARG CZ C -2.958 -10.807 1.919 1.00 . A A . 13 ARG CZ 1 1 14 4536 1 1 13 ARG H H -0.678 -5.154 0.818 1.00 . A A . 13 ARG H 1 1 14 4537 1 1 13 ARG HA H 1.371 -6.130 2.443 1.00 . A A . 13 ARG HA 1 1 14 4538 1 1 13 ARG HB2 H 0.093 -7.264 -0.040 1.00 . A A . 13 ARG HB2 1 1 14 4539 1 1 13 ARG HB3 H 1.297 -8.147 0.886 1.00 . A A . 13 ARG HB3 1 1 14 4540 1 1 13 ARG HD2 H -1.673 -8.910 0.342 1.00 . A A . 13 ARG HD2 1 1 14 4541 1 1 13 ARG HD3 H -0.467 -9.913 1.144 1.00 . A A . 13 ARG HD3 1 1 14 4542 1 1 13 ARG HE H -2.444 -9.202 3.005 1.00 . A A . 13 ARG HE 1 1 14 4543 1 1 13 ARG HG2 H -0.134 -8.153 2.824 1.00 . A A . 13 ARG HG2 1 1 14 4544 1 1 13 ARG HG3 H -1.318 -7.144 1.988 1.00 . A A . 13 ARG HG3 1 1 14 4545 1 1 13 ARG HH11 H -2.038 -11.175 0.150 1.00 . A A . 13 ARG HH11 1 1 14 4546 1 1 13 ARG HH12 H -3.252 -12.324 0.604 1.00 . A A . 13 ARG HH12 1 1 14 4547 1 1 13 ARG HH21 H -4.055 -10.720 3.623 1.00 . A A . 13 ARG HH21 1 1 14 4548 1 1 13 ARG HH22 H -4.404 -12.063 2.588 1.00 . A A . 13 ARG HH22 1 1 14 4549 1 1 13 ARG N N 0.211 -4.971 1.186 1.00 . A A . 13 ARG N 1 1 14 4550 1 1 13 ARG NE N -2.262 -9.697 2.177 1.00 . A A . 13 ARG NE 1 1 14 4551 1 1 13 ARG NH1 N -2.732 -11.491 0.801 1.00 . A A . 13 ARG NH1 1 1 14 4552 1 1 13 ARG NH2 N -3.879 -11.231 2.779 1.00 . A A . 13 ARG NH2 1 1 14 4553 1 1 13 ARG O O 3.529 -6.199 1.097 1.00 . A A . 13 ARG O 1 1 14 4554 1 1 14 ASN C C 4.139 -3.654 -1.084 1.00 . A A . 14 ASN C 1 1 14 4555 1 1 14 ASN CA C 3.501 -5.005 -1.401 1.00 . A A . 14 ASN CA 1 1 14 4556 1 1 14 ASN CB C 3.081 -5.063 -2.877 1.00 . A A . 14 ASN CB 1 1 14 4557 1 1 14 ASN CG C 4.162 -4.585 -3.831 1.00 . A A . 14 ASN CG 1 1 14 4558 1 1 14 ASN H H 1.454 -4.974 -0.865 1.00 . A A . 14 ASN H 1 1 14 4559 1 1 14 ASN HA H 4.224 -5.784 -1.212 1.00 . A A . 14 ASN HA 1 1 14 4560 1 1 14 ASN HB2 H 2.834 -6.083 -3.131 1.00 . A A . 14 ASN HB2 1 1 14 4561 1 1 14 ASN HB3 H 2.206 -4.444 -3.015 1.00 . A A . 14 ASN HB3 1 1 14 4562 1 1 14 ASN HD21 H 4.913 -6.418 -3.951 1.00 . A A . 14 ASN HD21 1 1 14 4563 1 1 14 ASN HD22 H 5.723 -5.211 -4.884 1.00 . A A . 14 ASN HD22 1 1 14 4564 1 1 14 ASN N N 2.340 -5.255 -0.555 1.00 . A A . 14 ASN N 1 1 14 4565 1 1 14 ASN ND2 N 5.020 -5.496 -4.264 1.00 . A A . 14 ASN ND2 1 1 14 4566 1 1 14 ASN O O 5.334 -3.450 -1.297 1.00 . A A . 14 ASN O 1 1 14 4567 1 1 14 ASN OD1 O 4.218 -3.406 -4.185 1.00 . A A . 14 ASN OD1 1 1 14 4568 1 1 15 HIS C C 3.923 -1.178 1.276 1.00 . A A . 15 HIS C 1 1 14 4569 1 1 15 HIS CA C 3.855 -1.407 -0.227 1.00 . A A . 15 HIS CA 1 1 14 4570 1 1 15 HIS CB C 2.985 -0.338 -0.893 1.00 . A A . 15 HIS CB 1 1 14 4571 1 1 15 HIS CD2 C 1.945 -0.920 -3.197 1.00 . A A . 15 HIS CD2 1 1 14 4572 1 1 15 HIS CE1 C 3.626 -0.333 -4.471 1.00 . A A . 15 HIS CE1 1 1 14 4573 1 1 15 HIS CG C 2.927 -0.461 -2.386 1.00 . A A . 15 HIS CG 1 1 14 4574 1 1 15 HIS H H 2.422 -2.972 -0.323 1.00 . A A . 15 HIS H 1 1 14 4575 1 1 15 HIS HA H 4.855 -1.338 -0.626 1.00 . A A . 15 HIS HA 1 1 14 4576 1 1 15 HIS HB2 H 1.977 -0.415 -0.514 1.00 . A A . 15 HIS HB2 1 1 14 4577 1 1 15 HIS HB3 H 3.381 0.638 -0.654 1.00 . A A . 15 HIS HB3 1 1 14 4578 1 1 15 HIS HD1 H 4.832 0.259 -2.929 1.00 . A A . 15 HIS HD1 1 1 14 4579 1 1 15 HIS HD2 H 0.979 -1.290 -2.885 1.00 . A A . 15 HIS HD2 1 1 14 4580 1 1 15 HIS HE1 H 4.245 -0.148 -5.336 1.00 . A A . 15 HIS HE1 1 1 14 4581 1 1 15 HIS HE2 H 1.996 -1.280 -5.260 1.00 . A A . 15 HIS HE2 1 1 14 4582 1 1 15 HIS N N 3.352 -2.740 -0.538 1.00 . A A . 15 HIS N 1 1 14 4583 1 1 15 HIS ND1 N 3.968 -0.102 -3.216 1.00 . A A . 15 HIS ND1 1 1 14 4584 1 1 15 HIS NE2 N 2.404 -0.831 -4.488 1.00 . A A . 15 HIS NE2 1 1 14 4585 1 1 15 HIS O O 3.881 -0.039 1.749 1.00 . A A . 15 HIS O 1 1 14 4586 1 1 16 LYS C C 5.497 -1.660 3.909 1.00 . A A . 16 LYS C 1 1 14 4587 1 1 16 LYS CA C 4.141 -2.193 3.475 1.00 . A A . 16 LYS CA 1 1 14 4588 1 1 16 LYS CB C 3.902 -3.570 4.100 1.00 . A A . 16 LYS CB 1 1 14 4589 1 1 16 LYS CD C 3.794 -4.538 6.426 1.00 . A A . 16 LYS CD 1 1 14 4590 1 1 16 LYS CE C 5.237 -4.230 6.806 1.00 . A A . 16 LYS CE 1 1 14 4591 1 1 16 LYS CG C 3.231 -3.502 5.465 1.00 . A A . 16 LYS CG 1 1 14 4592 1 1 16 LYS H H 4.104 -3.140 1.580 1.00 . A A . 16 LYS H 1 1 14 4593 1 1 16 LYS HA H 3.374 -1.514 3.814 1.00 . A A . 16 LYS HA 1 1 14 4594 1 1 16 LYS HB2 H 3.273 -4.150 3.440 1.00 . A A . 16 LYS HB2 1 1 14 4595 1 1 16 LYS HB3 H 4.851 -4.071 4.214 1.00 . A A . 16 LYS HB3 1 1 14 4596 1 1 16 LYS HD2 H 3.193 -4.547 7.322 1.00 . A A . 16 LYS HD2 1 1 14 4597 1 1 16 LYS HD3 H 3.756 -5.509 5.954 1.00 . A A . 16 LYS HD3 1 1 14 4598 1 1 16 LYS HE2 H 5.552 -4.931 7.564 1.00 . A A . 16 LYS HE2 1 1 14 4599 1 1 16 LYS HE3 H 5.859 -4.346 5.930 1.00 . A A . 16 LYS HE3 1 1 14 4600 1 1 16 LYS HG2 H 3.386 -2.518 5.882 1.00 . A A . 16 LYS HG2 1 1 14 4601 1 1 16 LYS HG3 H 2.172 -3.678 5.341 1.00 . A A . 16 LYS HG3 1 1 14 4602 1 1 16 LYS HZ1 H 4.643 -2.631 8.016 1.00 . A A . 16 LYS HZ1 1 1 14 4603 1 1 16 LYS HZ2 H 5.346 -2.154 6.550 1.00 . A A . 16 LYS HZ2 1 1 14 4604 1 1 16 LYS HZ3 H 6.316 -2.745 7.807 1.00 . A A . 16 LYS HZ3 1 1 14 4605 1 1 16 LYS N N 4.064 -2.265 2.021 1.00 . A A . 16 LYS N 1 1 14 4606 1 1 16 LYS NZ N 5.396 -2.845 7.334 1.00 . A A . 16 LYS NZ 1 1 14 4607 1 1 16 LYS O O 5.719 -1.382 5.090 1.00 . A A . 16 LYS O 1 1 14 4608 1 1 17 LYS C C 7.687 0.477 3.359 1.00 . A A . 17 LYS C 1 1 14 4609 1 1 17 LYS CA C 7.736 -1.033 3.229 1.00 . A A . 17 LYS CA 1 1 14 4610 1 1 17 LYS CB C 8.708 -1.443 2.122 1.00 . A A . 17 LYS CB 1 1 14 4611 1 1 17 LYS CD C 9.911 -3.306 0.933 1.00 . A A . 17 LYS CD 1 1 14 4612 1 1 17 LYS CE C 10.213 -4.796 0.918 1.00 . A A . 17 LYS CE 1 1 14 4613 1 1 17 LYS CG C 9.016 -2.933 2.104 1.00 . A A . 17 LYS CG 1 1 14 4614 1 1 17 LYS H H 6.173 -1.811 2.042 1.00 . A A . 17 LYS H 1 1 14 4615 1 1 17 LYS HA H 8.062 -1.449 4.166 1.00 . A A . 17 LYS HA 1 1 14 4616 1 1 17 LYS HB2 H 8.282 -1.174 1.167 1.00 . A A . 17 LYS HB2 1 1 14 4617 1 1 17 LYS HB3 H 9.634 -0.906 2.256 1.00 . A A . 17 LYS HB3 1 1 14 4618 1 1 17 LYS HD2 H 9.412 -3.040 0.012 1.00 . A A . 17 LYS HD2 1 1 14 4619 1 1 17 LYS HD3 H 10.839 -2.760 1.013 1.00 . A A . 17 LYS HD3 1 1 14 4620 1 1 17 LYS HE2 H 10.727 -5.055 1.832 1.00 . A A . 17 LYS HE2 1 1 14 4621 1 1 17 LYS HE3 H 9.280 -5.339 0.865 1.00 . A A . 17 LYS HE3 1 1 14 4622 1 1 17 LYS HG2 H 9.515 -3.199 3.024 1.00 . A A . 17 LYS HG2 1 1 14 4623 1 1 17 LYS HG3 H 8.088 -3.480 2.026 1.00 . A A . 17 LYS HG3 1 1 14 4624 1 1 17 LYS HZ1 H 10.565 -4.986 -1.132 1.00 . A A . 17 LYS HZ1 1 1 14 4625 1 1 17 LYS HZ2 H 11.289 -6.196 -0.197 1.00 . A A . 17 LYS HZ2 1 1 14 4626 1 1 17 LYS HZ3 H 11.953 -4.640 -0.228 1.00 . A A . 17 LYS HZ3 1 1 14 4627 1 1 17 LYS N N 6.407 -1.546 2.955 1.00 . A A . 17 LYS N 1 1 14 4628 1 1 17 LYS NZ N 11.064 -5.181 -0.241 1.00 . A A . 17 LYS NZ 1 1 14 4629 1 1 17 LYS O O 8.288 1.055 4.259 1.00 . A A . 17 LYS O 1 1 14 4630 1 1 18 PHE C C 5.798 2.928 3.543 1.00 . A A . 18 PHE C 1 1 14 4631 1 1 18 PHE CA C 6.795 2.543 2.463 1.00 . A A . 18 PHE CA 1 1 14 4632 1 1 18 PHE CB C 6.306 3.031 1.097 1.00 . A A . 18 PHE CB 1 1 14 4633 1 1 18 PHE CD1 C 7.607 5.111 0.568 1.00 . A A . 18 PHE CD1 1 1 14 4634 1 1 18 PHE CD2 C 5.288 5.326 1.081 1.00 . A A . 18 PHE CD2 1 1 14 4635 1 1 18 PHE CE1 C 7.699 6.478 0.395 1.00 . A A . 18 PHE CE1 1 1 14 4636 1 1 18 PHE CE2 C 5.374 6.695 0.910 1.00 . A A . 18 PHE CE2 1 1 14 4637 1 1 18 PHE CG C 6.402 4.520 0.912 1.00 . A A . 18 PHE CG 1 1 14 4638 1 1 18 PHE CZ C 6.581 7.272 0.566 1.00 . A A . 18 PHE CZ 1 1 14 4639 1 1 18 PHE H H 6.510 0.578 1.759 1.00 . A A . 18 PHE H 1 1 14 4640 1 1 18 PHE HA H 7.753 2.989 2.684 1.00 . A A . 18 PHE HA 1 1 14 4641 1 1 18 PHE HB2 H 6.894 2.561 0.325 1.00 . A A . 18 PHE HB2 1 1 14 4642 1 1 18 PHE HB3 H 5.270 2.747 0.974 1.00 . A A . 18 PHE HB3 1 1 14 4643 1 1 18 PHE HD1 H 8.481 4.492 0.434 1.00 . A A . 18 PHE HD1 1 1 14 4644 1 1 18 PHE HD2 H 4.344 4.876 1.350 1.00 . A A . 18 PHE HD2 1 1 14 4645 1 1 18 PHE HE1 H 8.644 6.927 0.127 1.00 . A A . 18 PHE HE1 1 1 14 4646 1 1 18 PHE HE2 H 4.499 7.313 1.043 1.00 . A A . 18 PHE HE2 1 1 14 4647 1 1 18 PHE HZ H 6.650 8.341 0.431 1.00 . A A . 18 PHE HZ 1 1 14 4648 1 1 18 PHE N N 6.955 1.101 2.452 1.00 . A A . 18 PHE N 1 1 14 4649 1 1 18 PHE O O 6.036 3.833 4.340 1.00 . A A . 18 PHE O 1 1 14 4650 1 1 19 CYS C C 3.833 1.601 5.776 1.00 . A A . 19 CYS C 1 1 14 4651 1 1 19 CYS CA C 3.639 2.480 4.546 1.00 . A A . 19 CYS CA 1 1 14 4652 1 1 19 CYS CB C 2.252 2.275 3.932 1.00 . A A . 19 CYS CB 1 1 14 4653 1 1 19 CYS H H 4.563 1.488 2.919 1.00 . A A . 19 CYS H 1 1 14 4654 1 1 19 CYS HA H 3.733 3.513 4.850 1.00 . A A . 19 CYS HA 1 1 14 4655 1 1 19 CYS HB2 H 2.204 1.300 3.471 1.00 . A A . 19 CYS HB2 1 1 14 4656 1 1 19 CYS HB3 H 1.507 2.335 4.713 1.00 . A A . 19 CYS HB3 1 1 14 4657 1 1 19 CYS N N 4.679 2.220 3.566 1.00 . A A . 19 CYS N 1 1 14 4658 1 1 19 CYS O O 3.247 0.520 5.884 1.00 . A A . 19 CYS O 1 1 14 4659 1 1 19 CYS SG S 1.826 3.513 2.661 1.00 . A A . 19 CYS SG 1 1 14 4660 1 1 20 NH2 HN1 H 5.094 2.927 6.542 1.00 . A A . 20 NH2 HN1 1 1 14 4661 1 1 20 NH2 HN2 H 4.818 1.515 7.497 1.00 . A A . 20 NH2 HN2 1 1 14 4662 1 1 20 NH2 N N 4.666 2.059 6.699 1.00 . A A . 20 NH2 N 1 1 15 4663 1 1 1 PHE C C 1.781 6.283 -5.368 1.00 . A A . 1 PHE C 1 1 15 4664 1 1 1 PHE CA C 3.168 5.811 -5.779 1.00 . A A . 1 PHE CA 1 1 15 4665 1 1 1 PHE CB C 4.056 5.616 -4.540 1.00 . A A . 1 PHE CB 1 1 15 4666 1 1 1 PHE CD1 C 3.289 3.366 -3.722 1.00 . A A . 1 PHE CD1 1 1 15 4667 1 1 1 PHE CD2 C 3.058 5.240 -2.266 1.00 . A A . 1 PHE CD2 1 1 15 4668 1 1 1 PHE CE1 C 2.735 2.546 -2.759 1.00 . A A . 1 PHE CE1 1 1 15 4669 1 1 1 PHE CE2 C 2.505 4.424 -1.297 1.00 . A A . 1 PHE CE2 1 1 15 4670 1 1 1 PHE CG C 3.456 4.722 -3.488 1.00 . A A . 1 PHE CG 1 1 15 4671 1 1 1 PHE CZ C 2.343 3.075 -1.545 1.00 . A A . 1 PHE CZ 1 1 15 4672 1 1 1 PHE H1 H 4.769 6.545 -6.894 1.00 . A A . 1 PHE H1 1 1 15 4673 1 1 1 PHE H2 H 3.759 7.747 -6.256 1.00 . A A . 1 PHE H2 1 1 15 4674 1 1 1 PHE H3 H 3.253 6.836 -7.587 1.00 . A A . 1 PHE H3 1 1 15 4675 1 1 1 PHE HA H 3.077 4.871 -6.305 1.00 . A A . 1 PHE HA 1 1 15 4676 1 1 1 PHE HB2 H 4.995 5.181 -4.846 1.00 . A A . 1 PHE HB2 1 1 15 4677 1 1 1 PHE HB3 H 4.244 6.580 -4.089 1.00 . A A . 1 PHE HB3 1 1 15 4678 1 1 1 PHE HD1 H 3.596 2.951 -4.672 1.00 . A A . 1 PHE HD1 1 1 15 4679 1 1 1 PHE HD2 H 3.184 6.295 -2.071 1.00 . A A . 1 PHE HD2 1 1 15 4680 1 1 1 PHE HE1 H 2.611 1.491 -2.954 1.00 . A A . 1 PHE HE1 1 1 15 4681 1 1 1 PHE HE2 H 2.198 4.840 -0.349 1.00 . A A . 1 PHE HE2 1 1 15 4682 1 1 1 PHE HZ H 1.910 2.434 -0.791 1.00 . A A . 1 PHE HZ 1 1 15 4683 1 1 1 PHE N N 3.782 6.802 -6.693 1.00 . A A . 1 PHE N 1 1 15 4684 1 1 1 PHE O O 1.545 7.482 -5.257 1.00 . A A . 1 PHE O 1 1 15 4685 1 1 2 ASN C C -0.703 5.290 -3.302 1.00 . A A . 2 ASN C 1 1 15 4686 1 1 2 ASN CA C -0.489 5.677 -4.759 1.00 . A A . 2 ASN CA 1 1 15 4687 1 1 2 ASN CB C -1.511 4.963 -5.649 1.00 . A A . 2 ASN CB 1 1 15 4688 1 1 2 ASN CG C -2.887 5.605 -5.584 1.00 . A A . 2 ASN CG 1 1 15 4689 1 1 2 ASN H H 1.112 4.401 -5.276 1.00 . A A . 2 ASN H 1 1 15 4690 1 1 2 ASN HA H -0.615 6.745 -4.860 1.00 . A A . 2 ASN HA 1 1 15 4691 1 1 2 ASN HB2 H -1.170 4.991 -6.672 1.00 . A A . 2 ASN HB2 1 1 15 4692 1 1 2 ASN HB3 H -1.600 3.935 -5.330 1.00 . A A . 2 ASN HB3 1 1 15 4693 1 1 2 ASN HD21 H -3.274 5.018 -7.441 1.00 . A A . 2 ASN HD21 1 1 15 4694 1 1 2 ASN HD22 H -4.526 5.913 -6.657 1.00 . A A . 2 ASN HD22 1 1 15 4695 1 1 2 ASN N N 0.868 5.343 -5.164 1.00 . A A . 2 ASN N 1 1 15 4696 1 1 2 ASN ND2 N -3.639 5.499 -6.668 1.00 . A A . 2 ASN ND2 1 1 15 4697 1 1 2 ASN O O -0.724 4.105 -2.963 1.00 . A A . 2 ASN O 1 1 15 4698 1 1 2 ASN OD1 O -3.270 6.187 -4.571 1.00 . A A . 2 ASN OD1 1 1 15 4699 1 1 3 TRP C C -2.329 5.270 -0.740 1.00 . A A . 3 TRP C 1 1 15 4700 1 1 3 TRP CA C -1.066 6.082 -1.019 1.00 . A A . 3 TRP CA 1 1 15 4701 1 1 3 TRP CB C -1.128 7.426 -0.284 1.00 . A A . 3 TRP CB 1 1 15 4702 1 1 3 TRP CD1 C -2.455 9.025 -1.792 1.00 . A A . 3 TRP CD1 1 1 15 4703 1 1 3 TRP CD2 C -3.504 8.468 0.106 1.00 . A A . 3 TRP CD2 1 1 15 4704 1 1 3 TRP CE2 C -4.332 9.340 -0.624 1.00 . A A . 3 TRP CE2 1 1 15 4705 1 1 3 TRP CE3 C -3.953 7.984 1.338 1.00 . A A . 3 TRP CE3 1 1 15 4706 1 1 3 TRP CG C -2.308 8.275 -0.660 1.00 . A A . 3 TRP CG 1 1 15 4707 1 1 3 TRP CH2 C -5.998 9.250 1.047 1.00 . A A . 3 TRP CH2 1 1 15 4708 1 1 3 TRP CZ2 C -5.584 9.739 -0.162 1.00 . A A . 3 TRP CZ2 1 1 15 4709 1 1 3 TRP CZ3 C -5.196 8.381 1.796 1.00 . A A . 3 TRP CZ3 1 1 15 4710 1 1 3 TRP H H -0.859 7.213 -2.794 1.00 . A A . 3 TRP H 1 1 15 4711 1 1 3 TRP HA H -0.218 5.527 -0.655 1.00 . A A . 3 TRP HA 1 1 15 4712 1 1 3 TRP HB2 H -1.178 7.242 0.778 1.00 . A A . 3 TRP HB2 1 1 15 4713 1 1 3 TRP HB3 H -0.231 7.987 -0.503 1.00 . A A . 3 TRP HB3 1 1 15 4714 1 1 3 TRP HD1 H -1.717 9.092 -2.577 1.00 . A A . 3 TRP HD1 1 1 15 4715 1 1 3 TRP HE1 H -4.006 10.261 -2.481 1.00 . A A . 3 TRP HE1 1 1 15 4716 1 1 3 TRP HE3 H -3.349 7.313 1.929 1.00 . A A . 3 TRP HE3 1 1 15 4717 1 1 3 TRP HH2 H -6.962 9.534 1.443 1.00 . A A . 3 TRP HH2 1 1 15 4718 1 1 3 TRP HZ2 H -6.215 10.408 -0.727 1.00 . A A . 3 TRP HZ2 1 1 15 4719 1 1 3 TRP HZ3 H -5.560 8.017 2.745 1.00 . A A . 3 TRP HZ3 1 1 15 4720 1 1 3 TRP N N -0.869 6.296 -2.451 1.00 . A A . 3 TRP N 1 1 15 4721 1 1 3 TRP NE1 N -3.670 9.665 -1.779 1.00 . A A . 3 TRP NE1 1 1 15 4722 1 1 3 TRP O O -2.479 4.683 0.333 1.00 . A A . 3 TRP O 1 1 15 4723 1 1 4 ARG C C -4.197 2.994 -1.377 1.00 . A A . 4 ARG C 1 1 15 4724 1 1 4 ARG CA C -4.466 4.472 -1.573 1.00 . A A . 4 ARG CA 1 1 15 4725 1 1 4 ARG CB C -5.367 4.673 -2.785 1.00 . A A . 4 ARG CB 1 1 15 4726 1 1 4 ARG CD C -7.606 5.604 -3.430 1.00 . A A . 4 ARG CD 1 1 15 4727 1 1 4 ARG CG C -6.326 5.842 -2.645 1.00 . A A . 4 ARG CG 1 1 15 4728 1 1 4 ARG CZ C -8.850 3.481 -3.697 1.00 . A A . 4 ARG CZ 1 1 15 4729 1 1 4 ARG H H -3.044 5.697 -2.555 1.00 . A A . 4 ARG H 1 1 15 4730 1 1 4 ARG HA H -4.962 4.839 -0.698 1.00 . A A . 4 ARG HA 1 1 15 4731 1 1 4 ARG HB2 H -4.746 4.849 -3.652 1.00 . A A . 4 ARG HB2 1 1 15 4732 1 1 4 ARG HB3 H -5.938 3.774 -2.940 1.00 . A A . 4 ARG HB3 1 1 15 4733 1 1 4 ARG HD2 H -8.229 6.482 -3.355 1.00 . A A . 4 ARG HD2 1 1 15 4734 1 1 4 ARG HD3 H -7.350 5.431 -4.466 1.00 . A A . 4 ARG HD3 1 1 15 4735 1 1 4 ARG HE H -8.484 4.394 -1.952 1.00 . A A . 4 ARG HE 1 1 15 4736 1 1 4 ARG HG2 H -6.575 5.970 -1.601 1.00 . A A . 4 ARG HG2 1 1 15 4737 1 1 4 ARG HG3 H -5.847 6.736 -3.017 1.00 . A A . 4 ARG HG3 1 1 15 4738 1 1 4 ARG HH11 H -8.187 4.288 -5.435 1.00 . A A . 4 ARG HH11 1 1 15 4739 1 1 4 ARG HH12 H -9.057 2.801 -5.598 1.00 . A A . 4 ARG HH12 1 1 15 4740 1 1 4 ARG HH21 H -9.643 2.426 -2.156 1.00 . A A . 4 ARG HH21 1 1 15 4741 1 1 4 ARG HH22 H -9.891 1.739 -3.727 1.00 . A A . 4 ARG HH22 1 1 15 4742 1 1 4 ARG N N -3.226 5.220 -1.717 1.00 . A A . 4 ARG N 1 1 15 4743 1 1 4 ARG NE N -8.351 4.448 -2.924 1.00 . A A . 4 ARG NE 1 1 15 4744 1 1 4 ARG NH1 N -8.685 3.526 -5.016 1.00 . A A . 4 ARG NH1 1 1 15 4745 1 1 4 ARG NH2 N -9.514 2.467 -3.150 1.00 . A A . 4 ARG NH2 1 1 15 4746 1 1 4 ARG O O -5.016 2.271 -0.815 1.00 . A A . 4 ARG O 1 1 15 4747 1 1 5 CYS C C -2.527 0.793 -0.250 1.00 . A A . 5 CYS C 1 1 15 4748 1 1 5 CYS CA C -2.630 1.175 -1.714 1.00 . A A . 5 CYS CA 1 1 15 4749 1 1 5 CYS CB C -1.277 0.957 -2.376 1.00 . A A . 5 CYS CB 1 1 15 4750 1 1 5 CYS H H -2.457 3.203 -2.299 1.00 . A A . 5 CYS H 1 1 15 4751 1 1 5 CYS HA H -3.367 0.550 -2.194 1.00 . A A . 5 CYS HA 1 1 15 4752 1 1 5 CYS HB2 H -0.709 1.873 -2.306 1.00 . A A . 5 CYS HB2 1 1 15 4753 1 1 5 CYS HB3 H -0.750 0.174 -1.850 1.00 . A A . 5 CYS HB3 1 1 15 4754 1 1 5 CYS N N -3.046 2.563 -1.847 1.00 . A A . 5 CYS N 1 1 15 4755 1 1 5 CYS O O -2.775 -0.349 0.124 1.00 . A A . 5 CYS O 1 1 15 4756 1 1 5 CYS SG S -1.372 0.482 -4.131 1.00 . A A . 5 CYS SG 1 1 15 4757 1 1 6 CYS C C -3.395 1.296 2.660 1.00 . A A . 6 CYS C 1 1 15 4758 1 1 6 CYS CA C -2.038 1.530 2.008 1.00 . A A . 6 CYS CA 1 1 15 4759 1 1 6 CYS CB C -1.316 2.704 2.664 1.00 . A A . 6 CYS CB 1 1 15 4760 1 1 6 CYS H H -2.042 2.677 0.220 1.00 . A A . 6 CYS H 1 1 15 4761 1 1 6 CYS HA H -1.440 0.637 2.132 1.00 . A A . 6 CYS HA 1 1 15 4762 1 1 6 CYS HB2 H -2.017 3.505 2.839 1.00 . A A . 6 CYS HB2 1 1 15 4763 1 1 6 CYS HB3 H -0.898 2.377 3.606 1.00 . A A . 6 CYS HB3 1 1 15 4764 1 1 6 CYS N N -2.186 1.766 0.579 1.00 . A A . 6 CYS N 1 1 15 4765 1 1 6 CYS O O -3.480 0.779 3.772 1.00 . A A . 6 CYS O 1 1 15 4766 1 1 6 CYS SG S 0.051 3.363 1.655 1.00 . A A . 6 CYS SG 1 1 15 4767 1 1 7 LEU C C -6.384 0.199 1.862 1.00 . A A . 7 LEU C 1 1 15 4768 1 1 7 LEU CA C -5.810 1.486 2.436 1.00 . A A . 7 LEU CA 1 1 15 4769 1 1 7 LEU CB C -6.692 2.673 2.036 1.00 . A A . 7 LEU CB 1 1 15 4770 1 1 7 LEU CD1 C -6.985 5.144 1.759 1.00 . A A . 7 LEU CD1 1 1 15 4771 1 1 7 LEU CD2 C -6.056 4.235 3.895 1.00 . A A . 7 LEU CD2 1 1 15 4772 1 1 7 LEU CG C -6.132 4.053 2.386 1.00 . A A . 7 LEU CG 1 1 15 4773 1 1 7 LEU H H -4.313 2.082 1.069 1.00 . A A . 7 LEU H 1 1 15 4774 1 1 7 LEU HA H -5.775 1.409 3.510 1.00 . A A . 7 LEU HA 1 1 15 4775 1 1 7 LEU HB2 H -6.847 2.632 0.967 1.00 . A A . 7 LEU HB2 1 1 15 4776 1 1 7 LEU HB3 H -7.648 2.563 2.524 1.00 . A A . 7 LEU HB3 1 1 15 4777 1 1 7 LEU HD11 H -6.578 6.111 2.016 1.00 . A A . 7 LEU HD11 1 1 15 4778 1 1 7 LEU HD12 H -7.996 5.068 2.133 1.00 . A A . 7 LEU HD12 1 1 15 4779 1 1 7 LEU HD13 H -6.988 5.027 0.686 1.00 . A A . 7 LEU HD13 1 1 15 4780 1 1 7 LEU HD21 H -5.638 5.205 4.119 1.00 . A A . 7 LEU HD21 1 1 15 4781 1 1 7 LEU HD22 H -5.429 3.465 4.319 1.00 . A A . 7 LEU HD22 1 1 15 4782 1 1 7 LEU HD23 H -7.048 4.164 4.316 1.00 . A A . 7 LEU HD23 1 1 15 4783 1 1 7 LEU HG H -5.131 4.141 1.986 1.00 . A A . 7 LEU HG 1 1 15 4784 1 1 7 LEU N N -4.451 1.670 1.950 1.00 . A A . 7 LEU N 1 1 15 4785 1 1 7 LEU O O -7.509 -0.194 2.166 1.00 . A A . 7 LEU O 1 1 15 4786 1 1 8 ILE C C -5.017 -2.803 0.779 1.00 . A A . 8 ILE C 1 1 15 4787 1 1 8 ILE CA C -5.987 -1.696 0.390 1.00 . A A . 8 ILE CA 1 1 15 4788 1 1 8 ILE CB C -6.019 -1.562 -1.150 1.00 . A A . 8 ILE CB 1 1 15 4789 1 1 8 ILE CD1 C -6.764 -0.008 -3.031 1.00 . A A . 8 ILE CD1 1 1 15 4790 1 1 8 ILE CG1 C -6.892 -0.374 -1.568 1.00 . A A . 8 ILE CG1 1 1 15 4791 1 1 8 ILE CG2 C -6.533 -2.849 -1.784 1.00 . A A . 8 ILE CG2 1 1 15 4792 1 1 8 ILE H H -4.696 -0.087 0.842 1.00 . A A . 8 ILE H 1 1 15 4793 1 1 8 ILE HA H -6.979 -1.952 0.736 1.00 . A A . 8 ILE HA 1 1 15 4794 1 1 8 ILE HB H -5.009 -1.397 -1.495 1.00 . A A . 8 ILE HB 1 1 15 4795 1 1 8 ILE HD11 H -7.045 -0.856 -3.640 1.00 . A A . 8 ILE HD11 1 1 15 4796 1 1 8 ILE HD12 H -5.741 0.264 -3.246 1.00 . A A . 8 ILE HD12 1 1 15 4797 1 1 8 ILE HD13 H -7.413 0.826 -3.252 1.00 . A A . 8 ILE HD13 1 1 15 4798 1 1 8 ILE HG12 H -7.927 -0.613 -1.378 1.00 . A A . 8 ILE HG12 1 1 15 4799 1 1 8 ILE HG13 H -6.613 0.491 -0.983 1.00 . A A . 8 ILE HG13 1 1 15 4800 1 1 8 ILE HG21 H -5.883 -3.668 -1.512 1.00 . A A . 8 ILE HG21 1 1 15 4801 1 1 8 ILE HG22 H -6.544 -2.741 -2.859 1.00 . A A . 8 ILE HG22 1 1 15 4802 1 1 8 ILE HG23 H -7.534 -3.049 -1.432 1.00 . A A . 8 ILE HG23 1 1 15 4803 1 1 8 ILE N N -5.590 -0.451 1.025 1.00 . A A . 8 ILE N 1 1 15 4804 1 1 8 ILE O O -3.888 -2.844 0.290 1.00 . A A . 8 ILE O 1 1 15 4805 1 1 9 PRO C C -3.897 -5.582 1.037 1.00 . A A . 9 PRO C 1 1 15 4806 1 1 9 PRO CA C -4.631 -4.835 2.149 1.00 . A A . 9 PRO CA 1 1 15 4807 1 1 9 PRO CB C -5.655 -5.750 2.818 1.00 . A A . 9 PRO CB 1 1 15 4808 1 1 9 PRO CD C -6.804 -3.730 2.262 1.00 . A A . 9 PRO CD 1 1 15 4809 1 1 9 PRO CG C -6.723 -4.828 3.290 1.00 . A A . 9 PRO CG 1 1 15 4810 1 1 9 PRO HA H -3.914 -4.501 2.886 1.00 . A A . 9 PRO HA 1 1 15 4811 1 1 9 PRO HB2 H -6.033 -6.460 2.097 1.00 . A A . 9 PRO HB2 1 1 15 4812 1 1 9 PRO HB3 H -5.193 -6.273 3.642 1.00 . A A . 9 PRO HB3 1 1 15 4813 1 1 9 PRO HD2 H -7.553 -3.964 1.521 1.00 . A A . 9 PRO HD2 1 1 15 4814 1 1 9 PRO HD3 H -7.023 -2.785 2.737 1.00 . A A . 9 PRO HD3 1 1 15 4815 1 1 9 PRO HG2 H -7.664 -5.355 3.351 1.00 . A A . 9 PRO HG2 1 1 15 4816 1 1 9 PRO HG3 H -6.456 -4.419 4.253 1.00 . A A . 9 PRO HG3 1 1 15 4817 1 1 9 PRO N N -5.455 -3.718 1.661 1.00 . A A . 9 PRO N 1 1 15 4818 1 1 9 PRO O O -2.777 -6.047 1.228 1.00 . A A . 9 PRO O 1 1 15 4819 1 1 10 ALA C C -2.692 -5.654 -1.787 1.00 . A A . 10 ALA C 1 1 15 4820 1 1 10 ALA CA C -3.941 -6.370 -1.266 1.00 . A A . 10 ALA CA 1 1 15 4821 1 1 10 ALA CB C -4.970 -6.510 -2.378 1.00 . A A . 10 ALA CB 1 1 15 4822 1 1 10 ALA H H -5.414 -5.271 -0.219 1.00 . A A . 10 ALA H 1 1 15 4823 1 1 10 ALA HA H -3.663 -7.362 -0.943 1.00 . A A . 10 ALA HA 1 1 15 4824 1 1 10 ALA HB1 H -5.249 -5.531 -2.736 1.00 . A A . 10 ALA HB1 1 1 15 4825 1 1 10 ALA HB2 H -5.844 -7.017 -1.996 1.00 . A A . 10 ALA HB2 1 1 15 4826 1 1 10 ALA HB3 H -4.547 -7.084 -3.189 1.00 . A A . 10 ALA HB3 1 1 15 4827 1 1 10 ALA N N -4.528 -5.677 -0.127 1.00 . A A . 10 ALA N 1 1 15 4828 1 1 10 ALA O O -1.713 -6.301 -2.167 1.00 . A A . 10 ALA O 1 1 15 4829 1 1 11 CYS C C -0.609 -3.231 -1.144 1.00 . A A . 11 CYS C 1 1 15 4830 1 1 11 CYS CA C -1.596 -3.533 -2.270 1.00 . A A . 11 CYS CA 1 1 15 4831 1 1 11 CYS CB C -2.091 -2.225 -2.904 1.00 . A A . 11 CYS CB 1 1 15 4832 1 1 11 CYS H H -3.509 -3.864 -1.417 1.00 . A A . 11 CYS H 1 1 15 4833 1 1 11 CYS HA H -1.090 -4.117 -3.024 1.00 . A A . 11 CYS HA 1 1 15 4834 1 1 11 CYS HB2 H -3.026 -2.412 -3.411 1.00 . A A . 11 CYS HB2 1 1 15 4835 1 1 11 CYS HB3 H -2.250 -1.494 -2.126 1.00 . A A . 11 CYS HB3 1 1 15 4836 1 1 11 CYS N N -2.720 -4.324 -1.778 1.00 . A A . 11 CYS N 1 1 15 4837 1 1 11 CYS O O 0.607 -3.275 -1.343 1.00 . A A . 11 CYS O 1 1 15 4838 1 1 11 CYS SG S -0.934 -1.503 -4.120 1.00 . A A . 11 CYS SG 1 1 15 4839 1 1 12 ARG C C 0.548 -3.842 1.579 1.00 . A A . 12 ARG C 1 1 15 4840 1 1 12 ARG CA C -0.304 -2.635 1.206 1.00 . A A . 12 ARG CA 1 1 15 4841 1 1 12 ARG CB C -1.181 -2.222 2.391 1.00 . A A . 12 ARG CB 1 1 15 4842 1 1 12 ARG CD C 0.064 -2.194 4.579 1.00 . A A . 12 ARG CD 1 1 15 4843 1 1 12 ARG CG C -0.461 -1.362 3.420 1.00 . A A . 12 ARG CG 1 1 15 4844 1 1 12 ARG CZ C 0.860 -1.500 6.814 1.00 . A A . 12 ARG CZ 1 1 15 4845 1 1 12 ARG H H -2.116 -2.919 0.141 1.00 . A A . 12 ARG H 1 1 15 4846 1 1 12 ARG HA H 0.347 -1.814 0.945 1.00 . A A . 12 ARG HA 1 1 15 4847 1 1 12 ARG HB2 H -2.027 -1.669 2.018 1.00 . A A . 12 ARG HB2 1 1 15 4848 1 1 12 ARG HB3 H -1.537 -3.111 2.886 1.00 . A A . 12 ARG HB3 1 1 15 4849 1 1 12 ARG HD2 H -0.776 -2.584 5.134 1.00 . A A . 12 ARG HD2 1 1 15 4850 1 1 12 ARG HD3 H 0.644 -3.014 4.182 1.00 . A A . 12 ARG HD3 1 1 15 4851 1 1 12 ARG HE H 1.547 -0.787 5.074 1.00 . A A . 12 ARG HE 1 1 15 4852 1 1 12 ARG HG2 H 0.371 -0.868 2.941 1.00 . A A . 12 ARG HG2 1 1 15 4853 1 1 12 ARG HG3 H -1.150 -0.623 3.801 1.00 . A A . 12 ARG HG3 1 1 15 4854 1 1 12 ARG HH11 H -0.621 -2.884 6.842 1.00 . A A . 12 ARG HH11 1 1 15 4855 1 1 12 ARG HH12 H -0.039 -2.396 8.398 1.00 . A A . 12 ARG HH12 1 1 15 4856 1 1 12 ARG HH21 H 2.325 -0.123 7.115 1.00 . A A . 12 ARG HH21 1 1 15 4857 1 1 12 ARG HH22 H 1.647 -0.821 8.555 1.00 . A A . 12 ARG HH22 1 1 15 4858 1 1 12 ARG N N -1.136 -2.940 0.044 1.00 . A A . 12 ARG N 1 1 15 4859 1 1 12 ARG NE N 0.907 -1.410 5.484 1.00 . A A . 12 ARG NE 1 1 15 4860 1 1 12 ARG NH1 N -0.003 -2.327 7.399 1.00 . A A . 12 ARG NH1 1 1 15 4861 1 1 12 ARG NH2 N 1.674 -0.758 7.557 1.00 . A A . 12 ARG NH2 1 1 15 4862 1 1 12 ARG O O 1.609 -3.706 2.178 1.00 . A A . 12 ARG O 1 1 15 4863 1 1 13 ARG C C 2.140 -6.275 0.825 1.00 . A A . 13 ARG C 1 1 15 4864 1 1 13 ARG CA C 0.759 -6.271 1.476 1.00 . A A . 13 ARG CA 1 1 15 4865 1 1 13 ARG CB C -0.077 -7.437 0.942 1.00 . A A . 13 ARG CB 1 1 15 4866 1 1 13 ARG CD C -0.125 -9.811 0.140 1.00 . A A . 13 ARG CD 1 1 15 4867 1 1 13 ARG CG C 0.620 -8.786 0.981 1.00 . A A . 13 ARG CG 1 1 15 4868 1 1 13 ARG CZ C -0.280 -9.987 -2.323 1.00 . A A . 13 ARG CZ 1 1 15 4869 1 1 13 ARG H H -0.812 -5.045 0.766 1.00 . A A . 13 ARG H 1 1 15 4870 1 1 13 ARG HA H 0.873 -6.374 2.541 1.00 . A A . 13 ARG HA 1 1 15 4871 1 1 13 ARG HB2 H -0.980 -7.511 1.527 1.00 . A A . 13 ARG HB2 1 1 15 4872 1 1 13 ARG HB3 H -0.345 -7.228 -0.083 1.00 . A A . 13 ARG HB3 1 1 15 4873 1 1 13 ARG HD2 H 0.491 -10.692 0.038 1.00 . A A . 13 ARG HD2 1 1 15 4874 1 1 13 ARG HD3 H -1.045 -10.071 0.644 1.00 . A A . 13 ARG HD3 1 1 15 4875 1 1 13 ARG HE H -0.802 -8.379 -1.249 1.00 . A A . 13 ARG HE 1 1 15 4876 1 1 13 ARG HG2 H 1.623 -8.676 0.595 1.00 . A A . 13 ARG HG2 1 1 15 4877 1 1 13 ARG HG3 H 0.660 -9.132 2.004 1.00 . A A . 13 ARG HG3 1 1 15 4878 1 1 13 ARG HH11 H 0.450 -11.642 -1.407 1.00 . A A . 13 ARG HH11 1 1 15 4879 1 1 13 ARG HH12 H 0.327 -11.747 -3.131 1.00 . A A . 13 ARG HH12 1 1 15 4880 1 1 13 ARG HH21 H -0.965 -8.501 -3.522 1.00 . A A . 13 ARG HH21 1 1 15 4881 1 1 13 ARG HH22 H -0.484 -9.951 -4.340 1.00 . A A . 13 ARG HH22 1 1 15 4882 1 1 13 ARG N N 0.060 -5.018 1.215 1.00 . A A . 13 ARG N 1 1 15 4883 1 1 13 ARG NE N -0.443 -9.295 -1.195 1.00 . A A . 13 ARG NE 1 1 15 4884 1 1 13 ARG NH1 N 0.206 -11.225 -2.284 1.00 . A A . 13 ARG NH1 1 1 15 4885 1 1 13 ARG NH2 N -0.602 -9.437 -3.489 1.00 . A A . 13 ARG NH2 1 1 15 4886 1 1 13 ARG O O 3.099 -6.817 1.376 1.00 . A A . 13 ARG O 1 1 15 4887 1 1 14 ASN C C 4.179 -4.256 -0.824 1.00 . A A . 14 ASN C 1 1 15 4888 1 1 14 ASN CA C 3.478 -5.587 -1.087 1.00 . A A . 14 ASN CA 1 1 15 4889 1 1 14 ASN CB C 3.197 -5.761 -2.588 1.00 . A A . 14 ASN CB 1 1 15 4890 1 1 14 ASN CG C 4.310 -5.233 -3.478 1.00 . A A . 14 ASN CG 1 1 15 4891 1 1 14 ASN H H 1.422 -5.246 -0.719 1.00 . A A . 14 ASN H 1 1 15 4892 1 1 14 ASN HA H 4.114 -6.391 -0.751 1.00 . A A . 14 ASN HA 1 1 15 4893 1 1 14 ASN HB2 H 3.066 -6.811 -2.800 1.00 . A A . 14 ASN HB2 1 1 15 4894 1 1 14 ASN HB3 H 2.285 -5.235 -2.836 1.00 . A A . 14 ASN HB3 1 1 15 4895 1 1 14 ASN HD21 H 5.231 -6.992 -3.425 1.00 . A A . 14 ASN HD21 1 1 15 4896 1 1 14 ASN HD22 H 6.006 -5.764 -4.359 1.00 . A A . 14 ASN HD22 1 1 15 4897 1 1 14 ASN N N 2.225 -5.663 -0.344 1.00 . A A . 14 ASN N 1 1 15 4898 1 1 14 ASN ND2 N 5.279 -6.082 -3.784 1.00 . A A . 14 ASN ND2 1 1 15 4899 1 1 14 ASN O O 5.399 -4.140 -0.946 1.00 . A A . 14 ASN O 1 1 15 4900 1 1 14 ASN OD1 O 4.292 -4.073 -3.893 1.00 . A A . 14 ASN OD1 1 1 15 4901 1 1 15 HIS C C 4.025 -1.634 1.324 1.00 . A A . 15 HIS C 1 1 15 4902 1 1 15 HIS CA C 3.953 -1.934 -0.169 1.00 . A A . 15 HIS CA 1 1 15 4903 1 1 15 HIS CB C 3.122 -0.869 -0.892 1.00 . A A . 15 HIS CB 1 1 15 4904 1 1 15 HIS CD2 C 2.316 -1.425 -3.296 1.00 . A A . 15 HIS CD2 1 1 15 4905 1 1 15 HIS CE1 C 4.091 -0.765 -4.395 1.00 . A A . 15 HIS CE1 1 1 15 4906 1 1 15 HIS CG C 3.204 -0.961 -2.387 1.00 . A A . 15 HIS CG 1 1 15 4907 1 1 15 HIS H H 2.450 -3.427 -0.265 1.00 . A A . 15 HIS H 1 1 15 4908 1 1 15 HIS HA H 4.956 -1.916 -0.568 1.00 . A A . 15 HIS HA 1 1 15 4909 1 1 15 HIS HB2 H 2.085 -0.978 -0.611 1.00 . A A . 15 HIS HB2 1 1 15 4910 1 1 15 HIS HB3 H 3.468 0.111 -0.598 1.00 . A A . 15 HIS HB3 1 1 15 4911 1 1 15 HIS HD1 H 5.126 -0.169 -2.735 1.00 . A A . 15 HIS HD1 1 1 15 4912 1 1 15 HIS HD2 H 1.337 -1.828 -3.085 1.00 . A A . 15 HIS HD2 1 1 15 4913 1 1 15 HIS HE1 H 4.781 -0.541 -5.196 1.00 . A A . 15 HIS HE1 1 1 15 4914 1 1 15 HIS HE2 H 2.564 -1.723 -5.355 1.00 . A A . 15 HIS HE2 1 1 15 4915 1 1 15 HIS N N 3.406 -3.261 -0.419 1.00 . A A . 15 HIS N 1 1 15 4916 1 1 15 HIS ND1 N 4.307 -0.554 -3.109 1.00 . A A . 15 HIS ND1 1 1 15 4917 1 1 15 HIS NE2 N 2.891 -1.293 -4.536 1.00 . A A . 15 HIS NE2 1 1 15 4918 1 1 15 HIS O O 3.727 -0.522 1.760 1.00 . A A . 15 HIS O 1 1 15 4919 1 1 16 LYS C C 5.629 -1.458 3.897 1.00 . A A . 16 LYS C 1 1 15 4920 1 1 16 LYS CA C 4.561 -2.486 3.546 1.00 . A A . 16 LYS CA 1 1 15 4921 1 1 16 LYS CB C 4.920 -3.824 4.193 1.00 . A A . 16 LYS CB 1 1 15 4922 1 1 16 LYS CD C 4.293 -6.204 4.666 1.00 . A A . 16 LYS CD 1 1 15 4923 1 1 16 LYS CE C 3.217 -7.270 4.545 1.00 . A A . 16 LYS CE 1 1 15 4924 1 1 16 LYS CG C 3.823 -4.869 4.113 1.00 . A A . 16 LYS CG 1 1 15 4925 1 1 16 LYS H H 4.646 -3.495 1.684 1.00 . A A . 16 LYS H 1 1 15 4926 1 1 16 LYS HA H 3.610 -2.150 3.932 1.00 . A A . 16 LYS HA 1 1 15 4927 1 1 16 LYS HB2 H 5.799 -4.220 3.704 1.00 . A A . 16 LYS HB2 1 1 15 4928 1 1 16 LYS HB3 H 5.148 -3.654 5.235 1.00 . A A . 16 LYS HB3 1 1 15 4929 1 1 16 LYS HD2 H 5.164 -6.523 4.115 1.00 . A A . 16 LYS HD2 1 1 15 4930 1 1 16 LYS HD3 H 4.549 -6.079 5.709 1.00 . A A . 16 LYS HD3 1 1 15 4931 1 1 16 LYS HE2 H 2.383 -6.994 5.172 1.00 . A A . 16 LYS HE2 1 1 15 4932 1 1 16 LYS HE3 H 2.892 -7.320 3.517 1.00 . A A . 16 LYS HE3 1 1 15 4933 1 1 16 LYS HG2 H 2.972 -4.531 4.687 1.00 . A A . 16 LYS HG2 1 1 15 4934 1 1 16 LYS HG3 H 3.535 -4.998 3.079 1.00 . A A . 16 LYS HG3 1 1 15 4935 1 1 16 LYS HZ1 H 4.474 -8.922 4.326 1.00 . A A . 16 LYS HZ1 1 1 15 4936 1 1 16 LYS HZ2 H 2.940 -9.303 4.930 1.00 . A A . 16 LYS HZ2 1 1 15 4937 1 1 16 LYS HZ3 H 4.085 -8.567 5.933 1.00 . A A . 16 LYS HZ3 1 1 15 4938 1 1 16 LYS N N 4.435 -2.632 2.097 1.00 . A A . 16 LYS N 1 1 15 4939 1 1 16 LYS NZ N 3.714 -8.608 4.963 1.00 . A A . 16 LYS NZ 1 1 15 4940 1 1 16 LYS O O 5.480 -0.696 4.848 1.00 . A A . 16 LYS O 1 1 15 4941 1 1 17 LYS C C 7.397 0.909 3.076 1.00 . A A . 17 LYS C 1 1 15 4942 1 1 17 LYS CA C 7.812 -0.530 3.333 1.00 . A A . 17 LYS CA 1 1 15 4943 1 1 17 LYS CB C 8.992 -0.899 2.432 1.00 . A A . 17 LYS CB 1 1 15 4944 1 1 17 LYS CD C 10.916 -2.463 1.966 1.00 . A A . 17 LYS CD 1 1 15 4945 1 1 17 LYS CE C 10.480 -2.882 0.569 1.00 . A A . 17 LYS CE 1 1 15 4946 1 1 17 LYS CG C 9.723 -2.161 2.865 1.00 . A A . 17 LYS CG 1 1 15 4947 1 1 17 LYS H H 6.748 -2.083 2.371 1.00 . A A . 17 LYS H 1 1 15 4948 1 1 17 LYS HA H 8.112 -0.621 4.362 1.00 . A A . 17 LYS HA 1 1 15 4949 1 1 17 LYS HB2 H 8.627 -1.049 1.426 1.00 . A A . 17 LYS HB2 1 1 15 4950 1 1 17 LYS HB3 H 9.695 -0.081 2.430 1.00 . A A . 17 LYS HB3 1 1 15 4951 1 1 17 LYS HD2 H 11.528 -1.578 1.889 1.00 . A A . 17 LYS HD2 1 1 15 4952 1 1 17 LYS HD3 H 11.492 -3.263 2.409 1.00 . A A . 17 LYS HD3 1 1 15 4953 1 1 17 LYS HE2 H 9.822 -3.734 0.652 1.00 . A A . 17 LYS HE2 1 1 15 4954 1 1 17 LYS HE3 H 9.949 -2.060 0.112 1.00 . A A . 17 LYS HE3 1 1 15 4955 1 1 17 LYS HG2 H 10.075 -2.033 3.878 1.00 . A A . 17 LYS HG2 1 1 15 4956 1 1 17 LYS HG3 H 9.035 -2.993 2.825 1.00 . A A . 17 LYS HG3 1 1 15 4957 1 1 17 LYS HZ1 H 12.169 -4.035 0.140 1.00 . A A . 17 LYS HZ1 1 1 15 4958 1 1 17 LYS HZ2 H 12.278 -2.434 -0.397 1.00 . A A . 17 LYS HZ2 1 1 15 4959 1 1 17 LYS HZ3 H 11.310 -3.544 -1.230 1.00 . A A . 17 LYS HZ3 1 1 15 4960 1 1 17 LYS N N 6.702 -1.451 3.113 1.00 . A A . 17 LYS N 1 1 15 4961 1 1 17 LYS NZ N 11.641 -3.250 -0.290 1.00 . A A . 17 LYS NZ 1 1 15 4962 1 1 17 LYS O O 7.804 1.819 3.792 1.00 . A A . 17 LYS O 1 1 15 4963 1 1 18 PHE C C 5.153 2.942 2.740 1.00 . A A . 18 PHE C 1 1 15 4964 1 1 18 PHE CA C 6.123 2.431 1.685 1.00 . A A . 18 PHE CA 1 1 15 4965 1 1 18 PHE CB C 5.434 2.405 0.318 1.00 . A A . 18 PHE CB 1 1 15 4966 1 1 18 PHE CD1 C 6.881 3.470 -1.430 1.00 . A A . 18 PHE CD1 1 1 15 4967 1 1 18 PHE CD2 C 6.779 1.090 -1.344 1.00 . A A . 18 PHE CD2 1 1 15 4968 1 1 18 PHE CE1 C 7.753 3.398 -2.499 1.00 . A A . 18 PHE CE1 1 1 15 4969 1 1 18 PHE CE2 C 7.651 1.011 -2.413 1.00 . A A . 18 PHE CE2 1 1 15 4970 1 1 18 PHE CG C 6.384 2.319 -0.841 1.00 . A A . 18 PHE CG 1 1 15 4971 1 1 18 PHE CZ C 8.139 2.166 -2.991 1.00 . A A . 18 PHE CZ 1 1 15 4972 1 1 18 PHE H H 6.323 0.338 1.506 1.00 . A A . 18 PHE H 1 1 15 4973 1 1 18 PHE HA H 6.975 3.093 1.640 1.00 . A A . 18 PHE HA 1 1 15 4974 1 1 18 PHE HB2 H 4.779 1.548 0.272 1.00 . A A . 18 PHE HB2 1 1 15 4975 1 1 18 PHE HB3 H 4.848 3.305 0.202 1.00 . A A . 18 PHE HB3 1 1 15 4976 1 1 18 PHE HD1 H 6.581 4.433 -1.046 1.00 . A A . 18 PHE HD1 1 1 15 4977 1 1 18 PHE HD2 H 6.398 0.185 -0.892 1.00 . A A . 18 PHE HD2 1 1 15 4978 1 1 18 PHE HE1 H 8.133 4.302 -2.949 1.00 . A A . 18 PHE HE1 1 1 15 4979 1 1 18 PHE HE2 H 7.951 0.045 -2.796 1.00 . A A . 18 PHE HE2 1 1 15 4980 1 1 18 PHE HZ H 8.821 2.107 -3.826 1.00 . A A . 18 PHE HZ 1 1 15 4981 1 1 18 PHE N N 6.600 1.104 2.039 1.00 . A A . 18 PHE N 1 1 15 4982 1 1 18 PHE O O 5.292 4.053 3.248 1.00 . A A . 18 PHE O 1 1 15 4983 1 1 19 CYS C C 3.571 2.005 5.441 1.00 . A A . 19 CYS C 1 1 15 4984 1 1 19 CYS CA C 3.169 2.490 4.053 1.00 . A A . 19 CYS CA 1 1 15 4985 1 1 19 CYS CB C 1.802 1.933 3.656 1.00 . A A . 19 CYS CB 1 1 15 4986 1 1 19 CYS H H 4.132 1.230 2.654 1.00 . A A . 19 CYS H 1 1 15 4987 1 1 19 CYS HA H 3.113 3.569 4.070 1.00 . A A . 19 CYS HA 1 1 15 4988 1 1 19 CYS HB2 H 1.718 0.912 3.992 1.00 . A A . 19 CYS HB2 1 1 15 4989 1 1 19 CYS HB3 H 1.031 2.525 4.127 1.00 . A A . 19 CYS HB3 1 1 15 4990 1 1 19 CYS N N 4.169 2.120 3.066 1.00 . A A . 19 CYS N 1 1 15 4991 1 1 19 CYS O O 2.928 1.121 6.015 1.00 . A A . 19 CYS O 1 1 15 4992 1 1 19 CYS SG S 1.495 1.955 1.859 1.00 . A A . 19 CYS SG 1 1 15 4993 1 1 20 NH2 HN1 H 5.098 3.275 5.462 1.00 . A A . 20 NH2 HN1 1 1 15 4994 1 1 20 NH2 HN2 H 4.925 2.284 6.866 1.00 . A A . 20 NH2 HN2 1 1 15 4995 1 1 20 NH2 N N 4.638 2.579 5.979 1.00 . A A . 20 NH2 N 1 1 16 4996 1 1 1 PHE C C 1.557 6.848 -4.977 1.00 . A A . 1 PHE C 1 1 16 4997 1 1 1 PHE CA C 3.040 7.154 -5.149 1.00 . A A . 1 PHE CA 1 1 16 4998 1 1 1 PHE CB C 3.705 7.358 -3.780 1.00 . A A . 1 PHE CB 1 1 16 4999 1 1 1 PHE CD1 C 3.887 4.956 -3.065 1.00 . A A . 1 PHE CD1 1 1 16 5000 1 1 1 PHE CD2 C 2.762 6.488 -1.625 1.00 . A A . 1 PHE CD2 1 1 16 5001 1 1 1 PHE CE1 C 3.645 3.933 -2.170 1.00 . A A . 1 PHE CE1 1 1 16 5002 1 1 1 PHE CE2 C 2.517 5.468 -0.726 1.00 . A A . 1 PHE CE2 1 1 16 5003 1 1 1 PHE CG C 3.448 6.244 -2.803 1.00 . A A . 1 PHE CG 1 1 16 5004 1 1 1 PHE CZ C 2.960 4.190 -0.999 1.00 . A A . 1 PHE CZ 1 1 16 5005 1 1 1 PHE H1 H 2.693 9.163 -5.555 1.00 . A A . 1 PHE H1 1 1 16 5006 1 1 1 PHE H2 H 2.837 8.200 -6.935 1.00 . A A . 1 PHE H2 1 1 16 5007 1 1 1 PHE H3 H 4.216 8.618 -6.051 1.00 . A A . 1 PHE H3 1 1 16 5008 1 1 1 PHE HA H 3.512 6.325 -5.655 1.00 . A A . 1 PHE HA 1 1 16 5009 1 1 1 PHE HB2 H 4.773 7.435 -3.917 1.00 . A A . 1 PHE HB2 1 1 16 5010 1 1 1 PHE HB3 H 3.337 8.274 -3.344 1.00 . A A . 1 PHE HB3 1 1 16 5011 1 1 1 PHE HD1 H 4.423 4.755 -3.980 1.00 . A A . 1 PHE HD1 1 1 16 5012 1 1 1 PHE HD2 H 2.415 7.488 -1.411 1.00 . A A . 1 PHE HD2 1 1 16 5013 1 1 1 PHE HE1 H 3.993 2.933 -2.385 1.00 . A A . 1 PHE HE1 1 1 16 5014 1 1 1 PHE HE2 H 1.982 5.671 0.190 1.00 . A A . 1 PHE HE2 1 1 16 5015 1 1 1 PHE HZ H 2.769 3.391 -0.297 1.00 . A A . 1 PHE HZ 1 1 16 5016 1 1 1 PHE N N 3.211 8.367 -5.981 1.00 . A A . 1 PHE N 1 1 16 5017 1 1 1 PHE O O 0.749 7.761 -4.833 1.00 . A A . 1 PHE O 1 1 16 5018 1 1 2 ASN C C -0.494 4.906 -3.377 1.00 . A A . 2 ASN C 1 1 16 5019 1 1 2 ASN CA C -0.184 5.156 -4.848 1.00 . A A . 2 ASN CA 1 1 16 5020 1 1 2 ASN CB C -0.467 3.892 -5.669 1.00 . A A . 2 ASN CB 1 1 16 5021 1 1 2 ASN CG C -1.954 3.618 -5.829 1.00 . A A . 2 ASN CG 1 1 16 5022 1 1 2 ASN H H 1.895 4.883 -5.121 1.00 . A A . 2 ASN H 1 1 16 5023 1 1 2 ASN HA H -0.812 5.957 -5.206 1.00 . A A . 2 ASN HA 1 1 16 5024 1 1 2 ASN HB2 H -0.036 4.006 -6.652 1.00 . A A . 2 ASN HB2 1 1 16 5025 1 1 2 ASN HB3 H -0.014 3.043 -5.179 1.00 . A A . 2 ASN HB3 1 1 16 5026 1 1 2 ASN HD21 H -1.614 2.560 -7.476 1.00 . A A . 2 ASN HD21 1 1 16 5027 1 1 2 ASN HD22 H -3.267 2.687 -6.993 1.00 . A A . 2 ASN HD22 1 1 16 5028 1 1 2 ASN N N 1.206 5.569 -5.005 1.00 . A A . 2 ASN N 1 1 16 5029 1 1 2 ASN ND2 N -2.314 2.883 -6.872 1.00 . A A . 2 ASN ND2 1 1 16 5030 1 1 2 ASN O O -0.493 3.764 -2.914 1.00 . A A . 2 ASN O 1 1 16 5031 1 1 2 ASN OD1 O -2.772 4.058 -5.023 1.00 . A A . 2 ASN OD1 1 1 16 5032 1 1 3 TRP C C -2.342 5.096 -0.984 1.00 . A A . 3 TRP C 1 1 16 5033 1 1 3 TRP CA C -1.071 5.902 -1.224 1.00 . A A . 3 TRP CA 1 1 16 5034 1 1 3 TRP CB C -1.210 7.307 -0.618 1.00 . A A . 3 TRP CB 1 1 16 5035 1 1 3 TRP CD1 C -1.857 8.993 -2.438 1.00 . A A . 3 TRP CD1 1 1 16 5036 1 1 3 TRP CD2 C -3.546 8.413 -1.086 1.00 . A A . 3 TRP CD2 1 1 16 5037 1 1 3 TRP CE2 C -4.026 9.333 -2.037 1.00 . A A . 3 TRP CE2 1 1 16 5038 1 1 3 TRP CE3 C -4.432 7.910 -0.129 1.00 . A A . 3 TRP CE3 1 1 16 5039 1 1 3 TRP CG C -2.154 8.205 -1.364 1.00 . A A . 3 TRP CG 1 1 16 5040 1 1 3 TRP CH2 C -6.195 9.252 -1.109 1.00 . A A . 3 TRP CH2 1 1 16 5041 1 1 3 TRP CZ2 C -5.351 9.760 -2.057 1.00 . A A . 3 TRP CZ2 1 1 16 5042 1 1 3 TRP CZ3 C -5.747 8.335 -0.150 1.00 . A A . 3 TRP CZ3 1 1 16 5043 1 1 3 TRP H H -0.754 6.865 -3.083 1.00 . A A . 3 TRP H 1 1 16 5044 1 1 3 TRP HA H -0.250 5.396 -0.745 1.00 . A A . 3 TRP HA 1 1 16 5045 1 1 3 TRP HB2 H -1.570 7.218 0.397 1.00 . A A . 3 TRP HB2 1 1 16 5046 1 1 3 TRP HB3 H -0.238 7.781 -0.606 1.00 . A A . 3 TRP HB3 1 1 16 5047 1 1 3 TRP HD1 H -0.880 9.059 -2.891 1.00 . A A . 3 TRP HD1 1 1 16 5048 1 1 3 TRP HE1 H -3.020 10.296 -3.605 1.00 . A A . 3 TRP HE1 1 1 16 5049 1 1 3 TRP HE3 H -4.105 7.201 0.618 1.00 . A A . 3 TRP HE3 1 1 16 5050 1 1 3 TRP HH2 H -7.231 9.558 -1.087 1.00 . A A . 3 TRP HH2 1 1 16 5051 1 1 3 TRP HZ2 H -5.713 10.467 -2.790 1.00 . A A . 3 TRP HZ2 1 1 16 5052 1 1 3 TRP HZ3 H -6.446 7.959 0.583 1.00 . A A . 3 TRP HZ3 1 1 16 5053 1 1 3 TRP N N -0.763 5.986 -2.650 1.00 . A A . 3 TRP N 1 1 16 5054 1 1 3 TRP NE1 N -2.978 9.670 -2.852 1.00 . A A . 3 TRP NE1 1 1 16 5055 1 1 3 TRP O O -2.556 4.553 0.100 1.00 . A A . 3 TRP O 1 1 16 5056 1 1 4 ARG C C -4.146 2.791 -1.663 1.00 . A A . 4 ARG C 1 1 16 5057 1 1 4 ARG CA C -4.418 4.255 -1.921 1.00 . A A . 4 ARG CA 1 1 16 5058 1 1 4 ARG CB C -5.248 4.423 -3.190 1.00 . A A . 4 ARG CB 1 1 16 5059 1 1 4 ARG CD C -7.342 5.335 -2.151 1.00 . A A . 4 ARG CD 1 1 16 5060 1 1 4 ARG CG C -6.216 5.592 -3.140 1.00 . A A . 4 ARG CG 1 1 16 5061 1 1 4 ARG CZ C -9.447 6.412 -1.432 1.00 . A A . 4 ARG CZ 1 1 16 5062 1 1 4 ARG H H -2.930 5.428 -2.860 1.00 . A A . 4 ARG H 1 1 16 5063 1 1 4 ARG HA H -4.959 4.645 -1.086 1.00 . A A . 4 ARG HA 1 1 16 5064 1 1 4 ARG HB2 H -4.580 4.575 -4.025 1.00 . A A . 4 ARG HB2 1 1 16 5065 1 1 4 ARG HB3 H -5.812 3.519 -3.355 1.00 . A A . 4 ARG HB3 1 1 16 5066 1 1 4 ARG HD2 H -7.878 4.449 -2.460 1.00 . A A . 4 ARG HD2 1 1 16 5067 1 1 4 ARG HD3 H -6.914 5.174 -1.173 1.00 . A A . 4 ARG HD3 1 1 16 5068 1 1 4 ARG HE H -8.023 7.284 -2.540 1.00 . A A . 4 ARG HE 1 1 16 5069 1 1 4 ARG HG2 H -5.681 6.479 -2.837 1.00 . A A . 4 ARG HG2 1 1 16 5070 1 1 4 ARG HG3 H -6.639 5.741 -4.123 1.00 . A A . 4 ARG HG3 1 1 16 5071 1 1 4 ARG HH11 H -9.226 4.492 -0.818 1.00 . A A . 4 ARG HH11 1 1 16 5072 1 1 4 ARG HH12 H -10.694 5.264 -0.317 1.00 . A A . 4 ARG HH12 1 1 16 5073 1 1 4 ARG HH21 H -9.964 8.322 -1.885 1.00 . A A . 4 ARG HH21 1 1 16 5074 1 1 4 ARG HH22 H -11.115 7.452 -0.928 1.00 . A A . 4 ARG HH22 1 1 16 5075 1 1 4 ARG N N -3.171 4.999 -2.014 1.00 . A A . 4 ARG N 1 1 16 5076 1 1 4 ARG NE N -8.281 6.456 -2.080 1.00 . A A . 4 ARG NE 1 1 16 5077 1 1 4 ARG NH1 N -9.820 5.301 -0.805 1.00 . A A . 4 ARG NH1 1 1 16 5078 1 1 4 ARG NH2 N -10.239 7.481 -1.413 1.00 . A A . 4 ARG NH2 1 1 16 5079 1 1 4 ARG O O -4.960 2.092 -1.061 1.00 . A A . 4 ARG O 1 1 16 5080 1 1 5 CYS C C -2.472 0.669 -0.425 1.00 . A A . 5 CYS C 1 1 16 5081 1 1 5 CYS CA C -2.580 0.967 -1.908 1.00 . A A . 5 CYS CA 1 1 16 5082 1 1 5 CYS CB C -1.232 0.710 -2.567 1.00 . A A . 5 CYS CB 1 1 16 5083 1 1 5 CYS H H -2.399 2.965 -2.583 1.00 . A A . 5 CYS H 1 1 16 5084 1 1 5 CYS HA H -3.324 0.322 -2.349 1.00 . A A . 5 CYS HA 1 1 16 5085 1 1 5 CYS HB2 H -0.660 1.625 -2.551 1.00 . A A . 5 CYS HB2 1 1 16 5086 1 1 5 CYS HB3 H -0.704 -0.047 -2.004 1.00 . A A . 5 CYS HB3 1 1 16 5087 1 1 5 CYS N N -2.992 2.345 -2.107 1.00 . A A . 5 CYS N 1 1 16 5088 1 1 5 CYS O O -2.763 -0.436 0.021 1.00 . A A . 5 CYS O 1 1 16 5089 1 1 5 CYS SG S -1.341 0.143 -4.294 1.00 . A A . 5 CYS SG 1 1 16 5090 1 1 6 CYS C C -3.293 1.376 2.465 1.00 . A A . 6 CYS C 1 1 16 5091 1 1 6 CYS CA C -1.939 1.527 1.781 1.00 . A A . 6 CYS CA 1 1 16 5092 1 1 6 CYS CB C -1.169 2.713 2.356 1.00 . A A . 6 CYS CB 1 1 16 5093 1 1 6 CYS H H -1.962 2.573 -0.071 1.00 . A A . 6 CYS H 1 1 16 5094 1 1 6 CYS HA H -1.368 0.624 1.947 1.00 . A A . 6 CYS HA 1 1 16 5095 1 1 6 CYS HB2 H -1.846 3.539 2.509 1.00 . A A . 6 CYS HB2 1 1 16 5096 1 1 6 CYS HB3 H -0.737 2.421 3.304 1.00 . A A . 6 CYS HB3 1 1 16 5097 1 1 6 CYS N N -2.104 1.684 0.342 1.00 . A A . 6 CYS N 1 1 16 5098 1 1 6 CYS O O -3.378 0.963 3.622 1.00 . A A . 6 CYS O 1 1 16 5099 1 1 6 CYS SG S 0.189 3.288 1.284 1.00 . A A . 6 CYS SG 1 1 16 5100 1 1 7 LEU C C -6.306 0.256 1.805 1.00 . A A . 7 LEU C 1 1 16 5101 1 1 7 LEU CA C -5.702 1.577 2.256 1.00 . A A . 7 LEU CA 1 1 16 5102 1 1 7 LEU CB C -6.566 2.748 1.782 1.00 . A A . 7 LEU CB 1 1 16 5103 1 1 7 LEU CD1 C -6.962 5.216 1.616 1.00 . A A . 7 LEU CD1 1 1 16 5104 1 1 7 LEU CD2 C -5.982 4.254 3.702 1.00 . A A . 7 LEU CD2 1 1 16 5105 1 1 7 LEU CG C -6.061 4.135 2.187 1.00 . A A . 7 LEU CG 1 1 16 5106 1 1 7 LEU H H -4.216 2.026 0.821 1.00 . A A . 7 LEU H 1 1 16 5107 1 1 7 LEU HA H -5.645 1.585 3.329 1.00 . A A . 7 LEU HA 1 1 16 5108 1 1 7 LEU HB2 H -6.622 2.711 0.703 1.00 . A A . 7 LEU HB2 1 1 16 5109 1 1 7 LEU HB3 H -7.560 2.620 2.181 1.00 . A A . 7 LEU HB3 1 1 16 5110 1 1 7 LEU HD11 H -6.579 6.187 1.895 1.00 . A A . 7 LEU HD11 1 1 16 5111 1 1 7 LEU HD12 H -7.961 5.097 2.008 1.00 . A A . 7 LEU HD12 1 1 16 5112 1 1 7 LEU HD13 H -6.985 5.134 0.540 1.00 . A A . 7 LEU HD13 1 1 16 5113 1 1 7 LEU HD21 H -5.319 3.495 4.089 1.00 . A A . 7 LEU HD21 1 1 16 5114 1 1 7 LEU HD22 H -6.967 4.123 4.125 1.00 . A A . 7 LEU HD22 1 1 16 5115 1 1 7 LEU HD23 H -5.604 5.231 3.967 1.00 . A A . 7 LEU HD23 1 1 16 5116 1 1 7 LEU HG H -5.068 4.280 1.786 1.00 . A A . 7 LEU HG 1 1 16 5117 1 1 7 LEU N N -4.349 1.697 1.736 1.00 . A A . 7 LEU N 1 1 16 5118 1 1 7 LEU O O -7.379 -0.143 2.252 1.00 . A A . 7 LEU O 1 1 16 5119 1 1 8 ILE C C -5.087 -2.808 0.877 1.00 . A A . 8 ILE C 1 1 16 5120 1 1 8 ILE CA C -6.021 -1.705 0.398 1.00 . A A . 8 ILE CA 1 1 16 5121 1 1 8 ILE CB C -6.046 -1.694 -1.146 1.00 . A A . 8 ILE CB 1 1 16 5122 1 1 8 ILE CD1 C -6.750 -0.279 -3.145 1.00 . A A . 8 ILE CD1 1 1 16 5123 1 1 8 ILE CG1 C -6.893 -0.526 -1.659 1.00 . A A . 8 ILE CG1 1 1 16 5124 1 1 8 ILE CG2 C -6.587 -3.016 -1.679 1.00 . A A . 8 ILE CG2 1 1 16 5125 1 1 8 ILE H H -4.716 -0.063 0.651 1.00 . A A . 8 ILE H 1 1 16 5126 1 1 8 ILE HA H -7.019 -1.901 0.761 1.00 . A A . 8 ILE HA 1 1 16 5127 1 1 8 ILE HB H -5.033 -1.577 -1.501 1.00 . A A . 8 ILE HB 1 1 16 5128 1 1 8 ILE HD11 H -7.063 -1.160 -3.686 1.00 . A A . 8 ILE HD11 1 1 16 5129 1 1 8 ILE HD12 H -5.718 -0.062 -3.377 1.00 . A A . 8 ILE HD12 1 1 16 5130 1 1 8 ILE HD13 H -7.369 0.559 -3.432 1.00 . A A . 8 ILE HD13 1 1 16 5131 1 1 8 ILE HG12 H -7.934 -0.729 -1.457 1.00 . A A . 8 ILE HG12 1 1 16 5132 1 1 8 ILE HG13 H -6.601 0.377 -1.141 1.00 . A A . 8 ILE HG13 1 1 16 5133 1 1 8 ILE HG21 H -5.958 -3.826 -1.340 1.00 . A A . 8 ILE HG21 1 1 16 5134 1 1 8 ILE HG22 H -6.595 -2.992 -2.759 1.00 . A A . 8 ILE HG22 1 1 16 5135 1 1 8 ILE HG23 H -7.593 -3.165 -1.316 1.00 . A A . 8 ILE HG23 1 1 16 5136 1 1 8 ILE N N -5.583 -0.426 0.932 1.00 . A A . 8 ILE N 1 1 16 5137 1 1 8 ILE O O -3.933 -2.873 0.460 1.00 . A A . 8 ILE O 1 1 16 5138 1 1 9 PRO C C -4.052 -5.623 1.259 1.00 . A A . 9 PRO C 1 1 16 5139 1 1 9 PRO CA C -4.792 -4.803 2.317 1.00 . A A . 9 PRO CA 1 1 16 5140 1 1 9 PRO CB C -5.843 -5.661 3.022 1.00 . A A . 9 PRO CB 1 1 16 5141 1 1 9 PRO CD C -6.969 -3.700 2.261 1.00 . A A . 9 PRO CD 1 1 16 5142 1 1 9 PRO CG C -6.928 -4.707 3.377 1.00 . A A . 9 PRO CG 1 1 16 5143 1 1 9 PRO HA H -4.080 -4.440 3.043 1.00 . A A . 9 PRO HA 1 1 16 5144 1 1 9 PRO HB2 H -6.195 -6.430 2.349 1.00 . A A . 9 PRO HB2 1 1 16 5145 1 1 9 PRO HB3 H -5.412 -6.113 3.902 1.00 . A A . 9 PRO HB3 1 1 16 5146 1 1 9 PRO HD2 H -7.660 -4.017 1.493 1.00 . A A . 9 PRO HD2 1 1 16 5147 1 1 9 PRO HD3 H -7.242 -2.727 2.639 1.00 . A A . 9 PRO HD3 1 1 16 5148 1 1 9 PRO HG2 H -7.870 -5.230 3.446 1.00 . A A . 9 PRO HG2 1 1 16 5149 1 1 9 PRO HG3 H -6.698 -4.219 4.312 1.00 . A A . 9 PRO HG3 1 1 16 5150 1 1 9 PRO N N -5.583 -3.698 1.752 1.00 . A A . 9 PRO N 1 1 16 5151 1 1 9 PRO O O -2.977 -6.156 1.521 1.00 . A A . 9 PRO O 1 1 16 5152 1 1 10 ALA C C -2.783 -5.773 -1.588 1.00 . A A . 10 ALA C 1 1 16 5153 1 1 10 ALA CA C -4.026 -6.464 -1.023 1.00 . A A . 10 ALA CA 1 1 16 5154 1 1 10 ALA CB C -5.047 -6.694 -2.128 1.00 . A A . 10 ALA CB 1 1 16 5155 1 1 10 ALA H H -5.475 -5.241 -0.086 1.00 . A A . 10 ALA H 1 1 16 5156 1 1 10 ALA HA H -3.737 -7.428 -0.632 1.00 . A A . 10 ALA HA 1 1 16 5157 1 1 10 ALA HB1 H -5.918 -7.182 -1.716 1.00 . A A . 10 ALA HB1 1 1 16 5158 1 1 10 ALA HB2 H -4.612 -7.320 -2.894 1.00 . A A . 10 ALA HB2 1 1 16 5159 1 1 10 ALA HB3 H -5.334 -5.746 -2.557 1.00 . A A . 10 ALA HB3 1 1 16 5160 1 1 10 ALA N N -4.625 -5.703 0.065 1.00 . A A . 10 ALA N 1 1 16 5161 1 1 10 ALA O O -1.830 -6.441 -1.994 1.00 . A A . 10 ALA O 1 1 16 5162 1 1 11 CYS C C -0.692 -3.285 -1.027 1.00 . A A . 11 CYS C 1 1 16 5163 1 1 11 CYS CA C -1.656 -3.692 -2.138 1.00 . A A . 11 CYS CA 1 1 16 5164 1 1 11 CYS CB C -2.146 -2.455 -2.902 1.00 . A A . 11 CYS CB 1 1 16 5165 1 1 11 CYS H H -3.552 -3.960 -1.222 1.00 . A A . 11 CYS H 1 1 16 5166 1 1 11 CYS HA H -1.133 -4.340 -2.825 1.00 . A A . 11 CYS HA 1 1 16 5167 1 1 11 CYS HB2 H -3.074 -2.692 -3.399 1.00 . A A . 11 CYS HB2 1 1 16 5168 1 1 11 CYS HB3 H -2.313 -1.651 -2.200 1.00 . A A . 11 CYS HB3 1 1 16 5169 1 1 11 CYS N N -2.785 -4.445 -1.599 1.00 . A A . 11 CYS N 1 1 16 5170 1 1 11 CYS O O 0.525 -3.282 -1.221 1.00 . A A . 11 CYS O 1 1 16 5171 1 1 11 CYS SG S -0.977 -1.853 -4.170 1.00 . A A . 11 CYS SG 1 1 16 5172 1 1 12 ARG C C 0.509 -3.676 1.693 1.00 . A A . 12 ARG C 1 1 16 5173 1 1 12 ARG CA C -0.431 -2.553 1.289 1.00 . A A . 12 ARG CA 1 1 16 5174 1 1 12 ARG CB C -1.334 -2.189 2.465 1.00 . A A . 12 ARG CB 1 1 16 5175 1 1 12 ARG CD C -1.542 -1.186 4.763 1.00 . A A . 12 ARG CD 1 1 16 5176 1 1 12 ARG CG C -0.588 -1.608 3.656 1.00 . A A . 12 ARG CG 1 1 16 5177 1 1 12 ARG CZ C -3.675 -2.277 5.387 1.00 . A A . 12 ARG CZ 1 1 16 5178 1 1 12 ARG H H -2.219 -2.974 0.231 1.00 . A A . 12 ARG H 1 1 16 5179 1 1 12 ARG HA H 0.152 -1.690 1.006 1.00 . A A . 12 ARG HA 1 1 16 5180 1 1 12 ARG HB2 H -2.058 -1.468 2.130 1.00 . A A . 12 ARG HB2 1 1 16 5181 1 1 12 ARG HB3 H -1.852 -3.076 2.792 1.00 . A A . 12 ARG HB3 1 1 16 5182 1 1 12 ARG HD2 H -0.967 -0.777 5.579 1.00 . A A . 12 ARG HD2 1 1 16 5183 1 1 12 ARG HD3 H -2.206 -0.427 4.375 1.00 . A A . 12 ARG HD3 1 1 16 5184 1 1 12 ARG HE H -1.859 -3.117 5.534 1.00 . A A . 12 ARG HE 1 1 16 5185 1 1 12 ARG HG2 H 0.088 -2.355 4.043 1.00 . A A . 12 ARG HG2 1 1 16 5186 1 1 12 ARG HG3 H -0.025 -0.745 3.330 1.00 . A A . 12 ARG HG3 1 1 16 5187 1 1 12 ARG HH11 H -3.879 -0.400 4.629 1.00 . A A . 12 ARG HH11 1 1 16 5188 1 1 12 ARG HH12 H -5.358 -1.177 5.105 1.00 . A A . 12 ARG HH12 1 1 16 5189 1 1 12 ARG HH21 H -3.810 -4.148 6.162 1.00 . A A . 12 ARG HH21 1 1 16 5190 1 1 12 ARG HH22 H -5.315 -3.312 5.981 1.00 . A A . 12 ARG HH22 1 1 16 5191 1 1 12 ARG N N -1.239 -2.956 0.140 1.00 . A A . 12 ARG N 1 1 16 5192 1 1 12 ARG NE N -2.345 -2.307 5.263 1.00 . A A . 12 ARG NE 1 1 16 5193 1 1 12 ARG NH1 N -4.361 -1.201 5.011 1.00 . A A . 12 ARG NH1 1 1 16 5194 1 1 12 ARG NH2 N -4.318 -3.331 5.881 1.00 . A A . 12 ARG NH2 1 1 16 5195 1 1 12 ARG O O 1.624 -3.438 2.138 1.00 . A A . 12 ARG O 1 1 16 5196 1 1 13 ARG C C 2.121 -6.127 1.068 1.00 . A A . 13 ARG C 1 1 16 5197 1 1 13 ARG CA C 0.807 -6.093 1.850 1.00 . A A . 13 ARG CA 1 1 16 5198 1 1 13 ARG CB C -0.027 -7.335 1.533 1.00 . A A . 13 ARG CB 1 1 16 5199 1 1 13 ARG CD C -0.105 -9.811 1.155 1.00 . A A . 13 ARG CD 1 1 16 5200 1 1 13 ARG CG C 0.718 -8.651 1.692 1.00 . A A . 13 ARG CG 1 1 16 5201 1 1 13 ARG CZ C -1.790 -10.024 -0.645 1.00 . A A . 13 ARG CZ 1 1 16 5202 1 1 13 ARG H H -0.881 -5.002 1.187 1.00 . A A . 13 ARG H 1 1 16 5203 1 1 13 ARG HA H 1.027 -6.074 2.905 1.00 . A A . 13 ARG HA 1 1 16 5204 1 1 13 ARG HB2 H -0.881 -7.352 2.191 1.00 . A A . 13 ARG HB2 1 1 16 5205 1 1 13 ARG HB3 H -0.374 -7.267 0.512 1.00 . A A . 13 ARG HB3 1 1 16 5206 1 1 13 ARG HD2 H 0.524 -10.688 1.098 1.00 . A A . 13 ARG HD2 1 1 16 5207 1 1 13 ARG HD3 H -0.925 -9.999 1.833 1.00 . A A . 13 ARG HD3 1 1 16 5208 1 1 13 ARG HE H -0.123 -8.916 -0.747 1.00 . A A . 13 ARG HE 1 1 16 5209 1 1 13 ARG HG2 H 1.648 -8.597 1.146 1.00 . A A . 13 ARG HG2 1 1 16 5210 1 1 13 ARG HG3 H 0.920 -8.818 2.740 1.00 . A A . 13 ARG HG3 1 1 16 5211 1 1 13 ARG HH11 H -2.203 -11.111 1.019 1.00 . A A . 13 ARG HH11 1 1 16 5212 1 1 13 ARG HH12 H -3.375 -11.231 -0.250 1.00 . A A . 13 ARG HH12 1 1 16 5213 1 1 13 ARG HH21 H -1.675 -9.052 -2.424 1.00 . A A . 13 ARG HH21 1 1 16 5214 1 1 13 ARG HH22 H -3.071 -10.059 -2.219 1.00 . A A . 13 ARG HH22 1 1 16 5215 1 1 13 ARG N N 0.033 -4.899 1.527 1.00 . A A . 13 ARG N 1 1 16 5216 1 1 13 ARG NE N -0.644 -9.524 -0.177 1.00 . A A . 13 ARG NE 1 1 16 5217 1 1 13 ARG NH1 N -2.515 -10.855 0.101 1.00 . A A . 13 ARG NH1 1 1 16 5218 1 1 13 ARG NH2 N -2.214 -9.684 -1.859 1.00 . A A . 13 ARG NH2 1 1 16 5219 1 1 13 ARG O O 3.149 -6.572 1.578 1.00 . A A . 13 ARG O 1 1 16 5220 1 1 14 ASN C C 4.035 -4.313 -0.830 1.00 . A A . 14 ASN C 1 1 16 5221 1 1 14 ASN CA C 3.254 -5.613 -1.021 1.00 . A A . 14 ASN CA 1 1 16 5222 1 1 14 ASN CB C 2.831 -5.780 -2.489 1.00 . A A . 14 ASN CB 1 1 16 5223 1 1 14 ASN CG C 3.889 -5.322 -3.481 1.00 . A A . 14 ASN CG 1 1 16 5224 1 1 14 ASN H H 1.230 -5.279 -0.498 1.00 . A A . 14 ASN H 1 1 16 5225 1 1 14 ASN HA H 3.887 -6.443 -0.742 1.00 . A A . 14 ASN HA 1 1 16 5226 1 1 14 ASN HB2 H 2.621 -6.822 -2.678 1.00 . A A . 14 ASN HB2 1 1 16 5227 1 1 14 ASN HB3 H 1.933 -5.204 -2.662 1.00 . A A . 14 ASN HB3 1 1 16 5228 1 1 14 ASN HD21 H 4.761 -7.106 -3.429 1.00 . A A . 14 ASN HD21 1 1 16 5229 1 1 14 ASN HD22 H 5.501 -5.937 -4.461 1.00 . A A . 14 ASN HD22 1 1 16 5230 1 1 14 ASN N N 2.077 -5.639 -0.161 1.00 . A A . 14 ASN N 1 1 16 5231 1 1 14 ASN ND2 N 4.809 -6.212 -3.825 1.00 . A A . 14 ASN ND2 1 1 16 5232 1 1 14 ASN O O 5.246 -4.261 -1.035 1.00 . A A . 14 ASN O 1 1 16 5233 1 1 14 ASN OD1 O 3.875 -4.178 -3.937 1.00 . A A . 14 ASN OD1 1 1 16 5234 1 1 15 HIS C C 4.099 -1.649 1.283 1.00 . A A . 15 HIS C 1 1 16 5235 1 1 15 HIS CA C 3.972 -1.972 -0.200 1.00 . A A . 15 HIS CA 1 1 16 5236 1 1 15 HIS CB C 3.179 -0.871 -0.913 1.00 . A A . 15 HIS CB 1 1 16 5237 1 1 15 HIS CD2 C 2.209 -1.522 -3.228 1.00 . A A . 15 HIS CD2 1 1 16 5238 1 1 15 HIS CE1 C 3.888 -0.880 -4.477 1.00 . A A . 15 HIS CE1 1 1 16 5239 1 1 15 HIS CG C 3.155 -1.015 -2.404 1.00 . A A . 15 HIS CG 1 1 16 5240 1 1 15 HIS H H 2.387 -3.381 -0.197 1.00 . A A . 15 HIS H 1 1 16 5241 1 1 15 HIS HA H 4.962 -2.019 -0.629 1.00 . A A . 15 HIS HA 1 1 16 5242 1 1 15 HIS HB2 H 2.157 -0.892 -0.563 1.00 . A A . 15 HIS HB2 1 1 16 5243 1 1 15 HIS HB3 H 3.616 0.088 -0.677 1.00 . A A . 15 HIS HB3 1 1 16 5244 1 1 15 HIS HD1 H 5.036 -0.215 -2.920 1.00 . A A . 15 HIS HD1 1 1 16 5245 1 1 15 HIS HD2 H 1.252 -1.926 -2.931 1.00 . A A . 15 HIS HD2 1 1 16 5246 1 1 15 HIS HE1 H 4.514 -0.679 -5.333 1.00 . A A . 15 HIS HE1 1 1 16 5247 1 1 15 HIS HE2 H 2.312 -1.899 -5.284 1.00 . A A . 15 HIS HE2 1 1 16 5248 1 1 15 HIS N N 3.342 -3.270 -0.401 1.00 . A A . 15 HIS N 1 1 16 5249 1 1 15 HIS ND1 N 4.195 -0.621 -3.219 1.00 . A A . 15 HIS ND1 1 1 16 5250 1 1 15 HIS NE2 N 2.688 -1.428 -4.511 1.00 . A A . 15 HIS NE2 1 1 16 5251 1 1 15 HIS O O 3.950 -0.499 1.690 1.00 . A A . 15 HIS O 1 1 16 5252 1 1 16 LYS C C 5.739 -1.631 3.870 1.00 . A A . 16 LYS C 1 1 16 5253 1 1 16 LYS CA C 4.542 -2.509 3.525 1.00 . A A . 16 LYS CA 1 1 16 5254 1 1 16 LYS CB C 4.705 -3.872 4.199 1.00 . A A . 16 LYS CB 1 1 16 5255 1 1 16 LYS CD C 3.628 -5.993 5.014 1.00 . A A . 16 LYS CD 1 1 16 5256 1 1 16 LYS CE C 4.352 -5.935 6.350 1.00 . A A . 16 LYS CE 1 1 16 5257 1 1 16 LYS CG C 3.394 -4.603 4.441 1.00 . A A . 16 LYS CG 1 1 16 5258 1 1 16 LYS H H 4.511 -3.561 1.686 1.00 . A A . 16 LYS H 1 1 16 5259 1 1 16 LYS HA H 3.645 -2.039 3.899 1.00 . A A . 16 LYS HA 1 1 16 5260 1 1 16 LYS HB2 H 5.328 -4.496 3.576 1.00 . A A . 16 LYS HB2 1 1 16 5261 1 1 16 LYS HB3 H 5.192 -3.731 5.153 1.00 . A A . 16 LYS HB3 1 1 16 5262 1 1 16 LYS HD2 H 2.674 -6.478 5.154 1.00 . A A . 16 LYS HD2 1 1 16 5263 1 1 16 LYS HD3 H 4.224 -6.562 4.315 1.00 . A A . 16 LYS HD3 1 1 16 5264 1 1 16 LYS HE2 H 5.253 -5.351 6.231 1.00 . A A . 16 LYS HE2 1 1 16 5265 1 1 16 LYS HE3 H 3.708 -5.457 7.075 1.00 . A A . 16 LYS HE3 1 1 16 5266 1 1 16 LYS HG2 H 2.799 -4.032 5.138 1.00 . A A . 16 LYS HG2 1 1 16 5267 1 1 16 LYS HG3 H 2.866 -4.693 3.502 1.00 . A A . 16 LYS HG3 1 1 16 5268 1 1 16 LYS HZ1 H 5.203 -7.220 7.759 1.00 . A A . 16 LYS HZ1 1 1 16 5269 1 1 16 LYS HZ2 H 5.345 -7.761 6.163 1.00 . A A . 16 LYS HZ2 1 1 16 5270 1 1 16 LYS HZ3 H 3.860 -7.869 6.962 1.00 . A A . 16 LYS HZ3 1 1 16 5271 1 1 16 LYS N N 4.396 -2.670 2.079 1.00 . A A . 16 LYS N 1 1 16 5272 1 1 16 LYS NZ N 4.715 -7.291 6.843 1.00 . A A . 16 LYS NZ 1 1 16 5273 1 1 16 LYS O O 5.806 -1.056 4.952 1.00 . A A . 16 LYS O 1 1 16 5274 1 1 17 LYS C C 7.591 0.730 2.931 1.00 . A A . 17 LYS C 1 1 16 5275 1 1 17 LYS CA C 7.881 -0.740 3.159 1.00 . A A . 17 LYS CA 1 1 16 5276 1 1 17 LYS CB C 8.989 -1.191 2.214 1.00 . A A . 17 LYS CB 1 1 16 5277 1 1 17 LYS CD C 11.458 -1.373 1.769 1.00 . A A . 17 LYS CD 1 1 16 5278 1 1 17 LYS CE C 12.828 -0.852 2.175 1.00 . A A . 17 LYS CE 1 1 16 5279 1 1 17 LYS CG C 10.386 -0.951 2.762 1.00 . A A . 17 LYS CG 1 1 16 5280 1 1 17 LYS H H 6.577 -2.030 2.107 1.00 . A A . 17 LYS H 1 1 16 5281 1 1 17 LYS HA H 8.199 -0.880 4.176 1.00 . A A . 17 LYS HA 1 1 16 5282 1 1 17 LYS HB2 H 8.867 -2.240 2.018 1.00 . A A . 17 LYS HB2 1 1 16 5283 1 1 17 LYS HB3 H 8.893 -0.648 1.286 1.00 . A A . 17 LYS HB3 1 1 16 5284 1 1 17 LYS HD2 H 11.491 -2.452 1.726 1.00 . A A . 17 LYS HD2 1 1 16 5285 1 1 17 LYS HD3 H 11.207 -0.980 0.795 1.00 . A A . 17 LYS HD3 1 1 16 5286 1 1 17 LYS HE2 H 13.559 -1.209 1.465 1.00 . A A . 17 LYS HE2 1 1 16 5287 1 1 17 LYS HE3 H 12.808 0.227 2.158 1.00 . A A . 17 LYS HE3 1 1 16 5288 1 1 17 LYS HG2 H 10.503 0.100 2.975 1.00 . A A . 17 LYS HG2 1 1 16 5289 1 1 17 LYS HG3 H 10.507 -1.521 3.671 1.00 . A A . 17 LYS HG3 1 1 16 5290 1 1 17 LYS HZ1 H 14.178 -0.975 3.765 1.00 . A A . 17 LYS HZ1 1 1 16 5291 1 1 17 LYS HZ2 H 13.203 -2.346 3.588 1.00 . A A . 17 LYS HZ2 1 1 16 5292 1 1 17 LYS HZ3 H 12.557 -0.927 4.246 1.00 . A A . 17 LYS HZ3 1 1 16 5293 1 1 17 LYS N N 6.685 -1.542 2.948 1.00 . A A . 17 LYS N 1 1 16 5294 1 1 17 LYS NZ N 13.219 -1.308 3.540 1.00 . A A . 17 LYS NZ 1 1 16 5295 1 1 17 LYS O O 8.167 1.599 3.579 1.00 . A A . 17 LYS O 1 1 16 5296 1 1 18 PHE C C 5.285 2.871 2.624 1.00 . A A . 18 PHE C 1 1 16 5297 1 1 18 PHE CA C 6.334 2.352 1.653 1.00 . A A . 18 PHE CA 1 1 16 5298 1 1 18 PHE CB C 5.802 2.420 0.221 1.00 . A A . 18 PHE CB 1 1 16 5299 1 1 18 PHE CD1 C 7.771 2.850 -1.273 1.00 . A A . 18 PHE CD1 1 1 16 5300 1 1 18 PHE CD2 C 6.755 0.693 -1.330 1.00 . A A . 18 PHE CD2 1 1 16 5301 1 1 18 PHE CE1 C 8.687 2.448 -2.225 1.00 . A A . 18 PHE CE1 1 1 16 5302 1 1 18 PHE CE2 C 7.668 0.285 -2.283 1.00 . A A . 18 PHE CE2 1 1 16 5303 1 1 18 PHE CG C 6.796 1.980 -0.815 1.00 . A A . 18 PHE CG 1 1 16 5304 1 1 18 PHE CZ C 8.636 1.163 -2.732 1.00 . A A . 18 PHE CZ 1 1 16 5305 1 1 18 PHE H H 6.303 0.243 1.507 1.00 . A A . 18 PHE H 1 1 16 5306 1 1 18 PHE HA H 7.216 2.969 1.730 1.00 . A A . 18 PHE HA 1 1 16 5307 1 1 18 PHE HB2 H 4.933 1.785 0.136 1.00 . A A . 18 PHE HB2 1 1 16 5308 1 1 18 PHE HB3 H 5.520 3.439 -0.002 1.00 . A A . 18 PHE HB3 1 1 16 5309 1 1 18 PHE HD1 H 7.812 3.854 -0.877 1.00 . A A . 18 PHE HD1 1 1 16 5310 1 1 18 PHE HD2 H 6.000 0.007 -0.980 1.00 . A A . 18 PHE HD2 1 1 16 5311 1 1 18 PHE HE1 H 9.443 3.136 -2.574 1.00 . A A . 18 PHE HE1 1 1 16 5312 1 1 18 PHE HE2 H 7.626 -0.720 -2.677 1.00 . A A . 18 PHE HE2 1 1 16 5313 1 1 18 PHE HZ H 9.350 0.846 -3.476 1.00 . A A . 18 PHE HZ 1 1 16 5314 1 1 18 PHE N N 6.711 0.989 1.988 1.00 . A A . 18 PHE N 1 1 16 5315 1 1 18 PHE O O 5.383 3.990 3.123 1.00 . A A . 18 PHE O 1 1 16 5316 1 1 19 CYS C C 3.533 1.999 5.230 1.00 . A A . 19 CYS C 1 1 16 5317 1 1 19 CYS CA C 3.214 2.435 3.804 1.00 . A A . 19 CYS CA 1 1 16 5318 1 1 19 CYS CB C 1.877 1.845 3.345 1.00 . A A . 19 CYS CB 1 1 16 5319 1 1 19 CYS H H 4.281 1.148 2.504 1.00 . A A . 19 CYS H 1 1 16 5320 1 1 19 CYS HA H 3.143 3.514 3.783 1.00 . A A . 19 CYS HA 1 1 16 5321 1 1 19 CYS HB2 H 1.808 0.819 3.667 1.00 . A A . 19 CYS HB2 1 1 16 5322 1 1 19 CYS HB3 H 1.074 2.410 3.796 1.00 . A A . 19 CYS HB3 1 1 16 5323 1 1 19 CYS N N 4.285 2.049 2.897 1.00 . A A . 19 CYS N 1 1 16 5324 1 1 19 CYS O O 2.807 1.202 5.826 1.00 . A A . 19 CYS O 1 1 16 5325 1 1 19 CYS SG S 1.629 1.881 1.539 1.00 . A A . 19 CYS SG 1 1 16 5326 1 1 20 NH2 HN1 H 5.154 3.147 5.239 1.00 . A A . 20 NH2 HN1 1 1 16 5327 1 1 20 NH2 HN2 H 4.857 2.250 6.687 1.00 . A A . 20 NH2 HN2 1 1 16 5328 1 1 20 NH2 N N 4.624 2.518 5.775 1.00 . A A . 20 NH2 N 1 1 17 5329 1 1 1 PHE C C 2.120 6.188 -4.944 1.00 . A A . 1 PHE C 1 1 17 5330 1 1 1 PHE CA C 3.633 6.032 -4.860 1.00 . A A . 1 PHE CA 1 1 17 5331 1 1 1 PHE CB C 4.194 6.879 -3.710 1.00 . A A . 1 PHE CB 1 1 17 5332 1 1 1 PHE CD1 C 3.708 5.413 -1.727 1.00 . A A . 1 PHE CD1 1 1 17 5333 1 1 1 PHE CD2 C 2.758 7.600 -1.780 1.00 . A A . 1 PHE CD2 1 1 17 5334 1 1 1 PHE CE1 C 3.108 5.179 -0.505 1.00 . A A . 1 PHE CE1 1 1 17 5335 1 1 1 PHE CE2 C 2.156 7.371 -0.558 1.00 . A A . 1 PHE CE2 1 1 17 5336 1 1 1 PHE CG C 3.540 6.624 -2.378 1.00 . A A . 1 PHE CG 1 1 17 5337 1 1 1 PHE CZ C 2.331 6.159 0.081 1.00 . A A . 1 PHE CZ 1 1 17 5338 1 1 1 PHE H1 H 3.929 5.823 -6.909 1.00 . A A . 1 PHE H1 1 1 17 5339 1 1 1 PHE H2 H 5.286 6.391 -6.075 1.00 . A A . 1 PHE H2 1 1 17 5340 1 1 1 PHE H3 H 3.977 7.423 -6.366 1.00 . A A . 1 PHE H3 1 1 17 5341 1 1 1 PHE HA H 3.868 4.991 -4.687 1.00 . A A . 1 PHE HA 1 1 17 5342 1 1 1 PHE HB2 H 5.249 6.672 -3.604 1.00 . A A . 1 PHE HB2 1 1 17 5343 1 1 1 PHE HB3 H 4.063 7.924 -3.950 1.00 . A A . 1 PHE HB3 1 1 17 5344 1 1 1 PHE HD1 H 4.317 4.646 -2.183 1.00 . A A . 1 PHE HD1 1 1 17 5345 1 1 1 PHE HD2 H 2.619 8.547 -2.279 1.00 . A A . 1 PHE HD2 1 1 17 5346 1 1 1 PHE HE1 H 3.246 4.230 -0.007 1.00 . A A . 1 PHE HE1 1 1 17 5347 1 1 1 PHE HE2 H 1.548 8.138 -0.102 1.00 . A A . 1 PHE HE2 1 1 17 5348 1 1 1 PHE HZ H 1.860 5.978 1.036 1.00 . A A . 1 PHE HZ 1 1 17 5349 1 1 1 PHE N N 4.251 6.444 -6.141 1.00 . A A . 1 PHE N 1 1 17 5350 1 1 1 PHE O O 1.629 7.107 -5.591 1.00 . A A . 1 PHE O 1 1 17 5351 1 1 2 ASN C C -0.582 5.063 -2.902 1.00 . A A . 2 ASN C 1 1 17 5352 1 1 2 ASN CA C -0.064 5.325 -4.307 1.00 . A A . 2 ASN CA 1 1 17 5353 1 1 2 ASN CB C -0.645 4.296 -5.283 1.00 . A A . 2 ASN CB 1 1 17 5354 1 1 2 ASN CG C -2.112 4.549 -5.586 1.00 . A A . 2 ASN CG 1 1 17 5355 1 1 2 ASN H H 1.843 4.564 -3.812 1.00 . A A . 2 ASN H 1 1 17 5356 1 1 2 ASN HA H -0.366 6.316 -4.613 1.00 . A A . 2 ASN HA 1 1 17 5357 1 1 2 ASN HB2 H -0.093 4.337 -6.211 1.00 . A A . 2 ASN HB2 1 1 17 5358 1 1 2 ASN HB3 H -0.549 3.310 -4.855 1.00 . A A . 2 ASN HB3 1 1 17 5359 1 1 2 ASN HD21 H -1.949 3.603 -7.324 1.00 . A A . 2 ASN HD21 1 1 17 5360 1 1 2 ASN HD22 H -3.513 4.235 -6.954 1.00 . A A . 2 ASN HD22 1 1 17 5361 1 1 2 ASN N N 1.393 5.279 -4.308 1.00 . A A . 2 ASN N 1 1 17 5362 1 1 2 ASN ND2 N -2.570 4.082 -6.736 1.00 . A A . 2 ASN ND2 1 1 17 5363 1 1 2 ASN O O -0.657 3.914 -2.464 1.00 . A A . 2 ASN O 1 1 17 5364 1 1 2 ASN OD1 O -2.829 5.157 -4.790 1.00 . A A . 2 ASN OD1 1 1 17 5365 1 1 3 TRP C C -2.699 5.185 -0.745 1.00 . A A . 3 TRP C 1 1 17 5366 1 1 3 TRP CA C -1.444 6.047 -0.839 1.00 . A A . 3 TRP CA 1 1 17 5367 1 1 3 TRP CB C -1.717 7.449 -0.279 1.00 . A A . 3 TRP CB 1 1 17 5368 1 1 3 TRP CD1 C -2.257 9.003 -2.250 1.00 . A A . 3 TRP CD1 1 1 17 5369 1 1 3 TRP CD2 C -4.022 8.500 -0.967 1.00 . A A . 3 TRP CD2 1 1 17 5370 1 1 3 TRP CE2 C -4.449 9.350 -2.006 1.00 . A A . 3 TRP CE2 1 1 17 5371 1 1 3 TRP CE3 C -4.962 8.053 -0.034 1.00 . A A . 3 TRP CE3 1 1 17 5372 1 1 3 TRP CG C -2.616 8.286 -1.145 1.00 . A A . 3 TRP CG 1 1 17 5373 1 1 3 TRP CH2 C -6.670 9.310 -1.207 1.00 . A A . 3 TRP CH2 1 1 17 5374 1 1 3 TRP CZ2 C -5.773 9.761 -2.135 1.00 . A A . 3 TRP CZ2 1 1 17 5375 1 1 3 TRP CZ3 C -6.275 8.464 -0.164 1.00 . A A . 3 TRP CZ3 1 1 17 5376 1 1 3 TRP H H -0.883 7.016 -2.632 1.00 . A A . 3 TRP H 1 1 17 5377 1 1 3 TRP HA H -0.674 5.585 -0.248 1.00 . A A . 3 TRP HA 1 1 17 5378 1 1 3 TRP HB2 H -2.185 7.355 0.689 1.00 . A A . 3 TRP HB2 1 1 17 5379 1 1 3 TRP HB3 H -0.779 7.972 -0.170 1.00 . A A . 3 TRP HB3 1 1 17 5380 1 1 3 TRP HD1 H -1.253 9.047 -2.647 1.00 . A A . 3 TRP HD1 1 1 17 5381 1 1 3 TRP HE1 H -3.351 10.212 -3.573 1.00 . A A . 3 TRP HE1 1 1 17 5382 1 1 3 TRP HE3 H -4.676 7.400 0.777 1.00 . A A . 3 TRP HE3 1 1 17 5383 1 1 3 TRP HH2 H -7.708 9.604 -1.269 1.00 . A A . 3 TRP HH2 1 1 17 5384 1 1 3 TRP HZ2 H -6.094 10.412 -2.934 1.00 . A A . 3 TRP HZ2 1 1 17 5385 1 1 3 TRP HZ3 H -7.015 8.129 0.550 1.00 . A A . 3 TRP HZ3 1 1 17 5386 1 1 3 TRP N N -0.946 6.135 -2.209 1.00 . A A . 3 TRP N 1 1 17 5387 1 1 3 TRP NE1 N -3.353 9.639 -2.777 1.00 . A A . 3 TRP NE1 1 1 17 5388 1 1 3 TRP O O -2.987 4.607 0.302 1.00 . A A . 3 TRP O 1 1 17 5389 1 1 4 ARG C C -4.335 2.822 -1.610 1.00 . A A . 4 ARG C 1 1 17 5390 1 1 4 ARG CA C -4.644 4.279 -1.872 1.00 . A A . 4 ARG CA 1 1 17 5391 1 1 4 ARG CB C -5.373 4.432 -3.205 1.00 . A A . 4 ARG CB 1 1 17 5392 1 1 4 ARG CD C -7.520 5.368 -2.290 1.00 . A A . 4 ARG CD 1 1 17 5393 1 1 4 ARG CG C -6.353 5.594 -3.239 1.00 . A A . 4 ARG CG 1 1 17 5394 1 1 4 ARG CZ C -9.622 6.497 -1.642 1.00 . A A . 4 ARG CZ 1 1 17 5395 1 1 4 ARG H H -3.127 5.528 -2.663 1.00 . A A . 4 ARG H 1 1 17 5396 1 1 4 ARG HA H -5.268 4.630 -1.081 1.00 . A A . 4 ARG HA 1 1 17 5397 1 1 4 ARG HB2 H -4.640 4.585 -3.984 1.00 . A A . 4 ARG HB2 1 1 17 5398 1 1 4 ARG HB3 H -5.915 3.522 -3.410 1.00 . A A . 4 ARG HB3 1 1 17 5399 1 1 4 ARG HD2 H -8.038 4.467 -2.586 1.00 . A A . 4 ARG HD2 1 1 17 5400 1 1 4 ARG HD3 H -7.134 5.248 -1.289 1.00 . A A . 4 ARG HD3 1 1 17 5401 1 1 4 ARG HE H -8.217 7.272 -2.841 1.00 . A A . 4 ARG HE 1 1 17 5402 1 1 4 ARG HG2 H -5.836 6.497 -2.947 1.00 . A A . 4 ARG HG2 1 1 17 5403 1 1 4 ARG HG3 H -6.732 5.703 -4.244 1.00 . A A . 4 ARG HG3 1 1 17 5404 1 1 4 ARG HH11 H -9.390 4.638 -0.863 1.00 . A A . 4 ARG HH11 1 1 17 5405 1 1 4 ARG HH12 H -10.853 5.450 -0.415 1.00 . A A . 4 ARG HH12 1 1 17 5406 1 1 4 ARG HH21 H -10.151 8.356 -2.257 1.00 . A A . 4 ARG HH21 1 1 17 5407 1 1 4 ARG HH22 H -11.287 7.573 -1.212 1.00 . A A . 4 ARG HH22 1 1 17 5408 1 1 4 ARG N N -3.425 5.074 -1.848 1.00 . A A . 4 ARG N 1 1 17 5409 1 1 4 ARG NE N -8.464 6.486 -2.305 1.00 . A A . 4 ARG NE 1 1 17 5410 1 1 4 ARG NH1 N -9.985 5.444 -0.916 1.00 . A A . 4 ARG NH1 1 1 17 5411 1 1 4 ARG NH2 N -10.418 7.560 -1.709 1.00 . A A . 4 ARG NH2 1 1 17 5412 1 1 4 ARG O O -5.134 2.097 -1.021 1.00 . A A . 4 ARG O 1 1 17 5413 1 1 5 CYS C C -2.564 0.768 -0.343 1.00 . A A . 5 CYS C 1 1 17 5414 1 1 5 CYS CA C -2.708 1.049 -1.823 1.00 . A A . 5 CYS CA 1 1 17 5415 1 1 5 CYS CB C -1.369 0.822 -2.508 1.00 . A A . 5 CYS CB 1 1 17 5416 1 1 5 CYS H H -2.561 3.061 -2.461 1.00 . A A . 5 CYS H 1 1 17 5417 1 1 5 CYS HA H -3.445 0.383 -2.245 1.00 . A A . 5 CYS HA 1 1 17 5418 1 1 5 CYS HB2 H -0.795 1.735 -2.449 1.00 . A A . 5 CYS HB2 1 1 17 5419 1 1 5 CYS HB3 H -0.838 0.036 -1.993 1.00 . A A . 5 CYS HB3 1 1 17 5420 1 1 5 CYS N N -3.155 2.415 -2.022 1.00 . A A . 5 CYS N 1 1 17 5421 1 1 5 CYS O O -2.772 -0.352 0.113 1.00 . A A . 5 CYS O 1 1 17 5422 1 1 5 CYS SG S -1.496 0.350 -4.263 1.00 . A A . 5 CYS SG 1 1 17 5423 1 1 6 CYS C C -3.410 1.470 2.539 1.00 . A A . 6 CYS C 1 1 17 5424 1 1 6 CYS CA C -2.069 1.669 1.847 1.00 . A A . 6 CYS CA 1 1 17 5425 1 1 6 CYS CB C -1.344 2.890 2.407 1.00 . A A . 6 CYS CB 1 1 17 5426 1 1 6 CYS H H -2.178 2.702 -0.006 1.00 . A A . 6 CYS H 1 1 17 5427 1 1 6 CYS HA H -1.460 0.791 2.017 1.00 . A A . 6 CYS HA 1 1 17 5428 1 1 6 CYS HB2 H -2.059 3.682 2.577 1.00 . A A . 6 CYS HB2 1 1 17 5429 1 1 6 CYS HB3 H -0.879 2.619 3.344 1.00 . A A . 6 CYS HB3 1 1 17 5430 1 1 6 CYS N N -2.255 1.807 0.412 1.00 . A A . 6 CYS N 1 1 17 5431 1 1 6 CYS O O -3.473 1.056 3.697 1.00 . A A . 6 CYS O 1 1 17 5432 1 1 6 CYS SG S -0.041 3.535 1.308 1.00 . A A . 6 CYS SG 1 1 17 5433 1 1 7 LEU C C -6.395 0.262 1.856 1.00 . A A . 7 LEU C 1 1 17 5434 1 1 7 LEU CA C -5.827 1.590 2.335 1.00 . A A . 7 LEU CA 1 1 17 5435 1 1 7 LEU CB C -6.726 2.746 1.885 1.00 . A A . 7 LEU CB 1 1 17 5436 1 1 7 LEU CD1 C -7.110 5.208 1.626 1.00 . A A . 7 LEU CD1 1 1 17 5437 1 1 7 LEU CD2 C -6.134 4.318 3.748 1.00 . A A . 7 LEU CD2 1 1 17 5438 1 1 7 LEU CG C -6.214 4.144 2.238 1.00 . A A . 7 LEU CG 1 1 17 5439 1 1 7 LEU H H -4.362 2.089 0.895 1.00 . A A . 7 LEU H 1 1 17 5440 1 1 7 LEU HA H -5.767 1.578 3.410 1.00 . A A . 7 LEU HA 1 1 17 5441 1 1 7 LEU HB2 H -6.841 2.688 0.813 1.00 . A A . 7 LEU HB2 1 1 17 5442 1 1 7 LEU HB3 H -7.696 2.616 2.341 1.00 . A A . 7 LEU HB3 1 1 17 5443 1 1 7 LEU HD11 H -8.114 5.100 2.012 1.00 . A A . 7 LEU HD11 1 1 17 5444 1 1 7 LEU HD12 H -7.123 5.094 0.553 1.00 . A A . 7 LEU HD12 1 1 17 5445 1 1 7 LEU HD13 H -6.732 6.188 1.880 1.00 . A A . 7 LEU HD13 1 1 17 5446 1 1 7 LEU HD21 H -5.463 3.579 4.161 1.00 . A A . 7 LEU HD21 1 1 17 5447 1 1 7 LEU HD22 H -7.118 4.191 4.178 1.00 . A A . 7 LEU HD22 1 1 17 5448 1 1 7 LEU HD23 H -5.767 5.307 3.978 1.00 . A A . 7 LEU HD23 1 1 17 5449 1 1 7 LEU HG H -5.221 4.271 1.833 1.00 . A A . 7 LEU HG 1 1 17 5450 1 1 7 LEU N N -4.481 1.757 1.813 1.00 . A A . 7 LEU N 1 1 17 5451 1 1 7 LEU O O -7.497 -0.134 2.227 1.00 . A A . 7 LEU O 1 1 17 5452 1 1 8 ILE C C -4.995 -2.771 0.890 1.00 . A A . 8 ILE C 1 1 17 5453 1 1 8 ILE CA C -6.009 -1.708 0.481 1.00 . A A . 8 ILE CA 1 1 17 5454 1 1 8 ILE CB C -6.112 -1.663 -1.063 1.00 . A A . 8 ILE CB 1 1 17 5455 1 1 8 ILE CD1 C -8.523 -0.809 -1.047 1.00 . A A . 8 ILE CD1 1 1 17 5456 1 1 8 ILE CG1 C -7.099 -0.576 -1.509 1.00 . A A . 8 ILE CG1 1 1 17 5457 1 1 8 ILE CG2 C -6.528 -3.019 -1.617 1.00 . A A . 8 ILE CG2 1 1 17 5458 1 1 8 ILE H H -4.734 -0.054 0.794 1.00 . A A . 8 ILE H 1 1 17 5459 1 1 8 ILE HA H -6.977 -1.964 0.884 1.00 . A A . 8 ILE HA 1 1 17 5460 1 1 8 ILE HB H -5.133 -1.430 -1.456 1.00 . A A . 8 ILE HB 1 1 17 5461 1 1 8 ILE HD11 H -8.551 -0.841 0.033 1.00 . A A . 8 ILE HD11 1 1 17 5462 1 1 8 ILE HD12 H -8.882 -1.747 -1.444 1.00 . A A . 8 ILE HD12 1 1 17 5463 1 1 8 ILE HD13 H -9.152 -0.005 -1.399 1.00 . A A . 8 ILE HD13 1 1 17 5464 1 1 8 ILE HG12 H -6.776 0.376 -1.113 1.00 . A A . 8 ILE HG12 1 1 17 5465 1 1 8 ILE HG13 H -7.103 -0.526 -2.589 1.00 . A A . 8 ILE HG13 1 1 17 5466 1 1 8 ILE HG21 H -5.800 -3.764 -1.331 1.00 . A A . 8 ILE HG21 1 1 17 5467 1 1 8 ILE HG22 H -6.586 -2.966 -2.693 1.00 . A A . 8 ILE HG22 1 1 17 5468 1 1 8 ILE HG23 H -7.495 -3.290 -1.218 1.00 . A A . 8 ILE HG23 1 1 17 5469 1 1 8 ILE N N -5.615 -0.422 1.030 1.00 . A A . 8 ILE N 1 1 17 5470 1 1 8 ILE O O -3.886 -2.811 0.358 1.00 . A A . 8 ILE O 1 1 17 5471 1 1 9 PRO C C -3.802 -5.519 1.237 1.00 . A A . 9 PRO C 1 1 17 5472 1 1 9 PRO CA C -4.487 -4.717 2.342 1.00 . A A . 9 PRO CA 1 1 17 5473 1 1 9 PRO CB C -5.426 -5.622 3.156 1.00 . A A . 9 PRO CB 1 1 17 5474 1 1 9 PRO CD C -6.685 -3.701 2.480 1.00 . A A . 9 PRO CD 1 1 17 5475 1 1 9 PRO CG C -6.811 -5.145 2.862 1.00 . A A . 9 PRO CG 1 1 17 5476 1 1 9 PRO HA H -3.731 -4.309 2.996 1.00 . A A . 9 PRO HA 1 1 17 5477 1 1 9 PRO HB2 H -5.291 -6.648 2.848 1.00 . A A . 9 PRO HB2 1 1 17 5478 1 1 9 PRO HB3 H -5.194 -5.527 4.206 1.00 . A A . 9 PRO HB3 1 1 17 5479 1 1 9 PRO HD2 H -7.469 -3.424 1.791 1.00 . A A . 9 PRO HD2 1 1 17 5480 1 1 9 PRO HD3 H -6.708 -3.071 3.356 1.00 . A A . 9 PRO HD3 1 1 17 5481 1 1 9 PRO HG2 H -7.229 -5.714 2.045 1.00 . A A . 9 PRO HG2 1 1 17 5482 1 1 9 PRO HG3 H -7.428 -5.247 3.743 1.00 . A A . 9 PRO HG3 1 1 17 5483 1 1 9 PRO N N -5.369 -3.655 1.832 1.00 . A A . 9 PRO N 1 1 17 5484 1 1 9 PRO O O -2.676 -5.980 1.407 1.00 . A A . 9 PRO O 1 1 17 5485 1 1 10 ALA C C -2.743 -5.691 -1.654 1.00 . A A . 10 ALA C 1 1 17 5486 1 1 10 ALA CA C -3.937 -6.410 -1.025 1.00 . A A . 10 ALA CA 1 1 17 5487 1 1 10 ALA CB C -5.020 -6.644 -2.067 1.00 . A A . 10 ALA CB 1 1 17 5488 1 1 10 ALA H H -5.366 -5.259 0.027 1.00 . A A . 10 ALA H 1 1 17 5489 1 1 10 ALA HA H -3.611 -7.372 -0.660 1.00 . A A . 10 ALA HA 1 1 17 5490 1 1 10 ALA HB1 H -5.855 -7.154 -1.609 1.00 . A A . 10 ALA HB1 1 1 17 5491 1 1 10 ALA HB2 H -4.624 -7.250 -2.868 1.00 . A A . 10 ALA HB2 1 1 17 5492 1 1 10 ALA HB3 H -5.351 -5.695 -2.463 1.00 . A A . 10 ALA HB3 1 1 17 5493 1 1 10 ALA N N -4.478 -5.664 0.104 1.00 . A A . 10 ALA N 1 1 17 5494 1 1 10 ALA O O -1.771 -6.326 -2.057 1.00 . A A . 10 ALA O 1 1 17 5495 1 1 11 CYS C C -0.690 -3.216 -1.253 1.00 . A A . 11 CYS C 1 1 17 5496 1 1 11 CYS CA C -1.718 -3.597 -2.311 1.00 . A A . 11 CYS CA 1 1 17 5497 1 1 11 CYS CB C -2.251 -2.338 -3.008 1.00 . A A . 11 CYS CB 1 1 17 5498 1 1 11 CYS H H -3.578 -3.899 -1.339 1.00 . A A . 11 CYS H 1 1 17 5499 1 1 11 CYS HA H -1.236 -4.225 -3.047 1.00 . A A . 11 CYS HA 1 1 17 5500 1 1 11 CYS HB2 H -3.179 -2.574 -3.506 1.00 . A A . 11 CYS HB2 1 1 17 5501 1 1 11 CYS HB3 H -2.429 -1.572 -2.267 1.00 . A A . 11 CYS HB3 1 1 17 5502 1 1 11 CYS N N -2.803 -4.367 -1.716 1.00 . A A . 11 CYS N 1 1 17 5503 1 1 11 CYS O O 0.510 -3.168 -1.528 1.00 . A A . 11 CYS O 1 1 17 5504 1 1 11 CYS SG S -1.110 -1.646 -4.259 1.00 . A A . 11 CYS SG 1 1 17 5505 1 1 12 ARG C C 0.600 -3.746 1.473 1.00 . A A . 12 ARG C 1 1 17 5506 1 1 12 ARG CA C -0.282 -2.580 1.061 1.00 . A A . 12 ARG CA 1 1 17 5507 1 1 12 ARG CB C -1.084 -2.097 2.265 1.00 . A A . 12 ARG CB 1 1 17 5508 1 1 12 ARG CD C -1.049 -0.854 4.459 1.00 . A A . 12 ARG CD 1 1 17 5509 1 1 12 ARG CG C -0.274 -1.217 3.204 1.00 . A A . 12 ARG CG 1 1 17 5510 1 1 12 ARG CZ C -0.766 0.948 6.133 1.00 . A A . 12 ARG CZ 1 1 17 5511 1 1 12 ARG H H -2.133 -3.014 0.124 1.00 . A A . 12 ARG H 1 1 17 5512 1 1 12 ARG HA H 0.349 -1.776 0.714 1.00 . A A . 12 ARG HA 1 1 17 5513 1 1 12 ARG HB2 H -1.934 -1.539 1.912 1.00 . A A . 12 ARG HB2 1 1 17 5514 1 1 12 ARG HB3 H -1.433 -2.953 2.820 1.00 . A A . 12 ARG HB3 1 1 17 5515 1 1 12 ARG HD2 H -1.943 -0.317 4.173 1.00 . A A . 12 ARG HD2 1 1 17 5516 1 1 12 ARG HD3 H -1.324 -1.763 4.973 1.00 . A A . 12 ARG HD3 1 1 17 5517 1 1 12 ARG HE H 0.710 -0.188 5.397 1.00 . A A . 12 ARG HE 1 1 17 5518 1 1 12 ARG HG2 H 0.622 -1.746 3.491 1.00 . A A . 12 ARG HG2 1 1 17 5519 1 1 12 ARG HG3 H -0.005 -0.308 2.684 1.00 . A A . 12 ARG HG3 1 1 17 5520 1 1 12 ARG HH11 H -2.672 0.718 5.466 1.00 . A A . 12 ARG HH11 1 1 17 5521 1 1 12 ARG HH12 H -2.449 1.945 6.671 1.00 . A A . 12 ARG HH12 1 1 17 5522 1 1 12 ARG HH21 H 1.021 1.453 6.951 1.00 . A A . 12 ARG HH21 1 1 17 5523 1 1 12 ARG HH22 H -0.341 2.368 7.516 1.00 . A A . 12 ARG HH22 1 1 17 5524 1 1 12 ARG N N -1.163 -2.959 -0.037 1.00 . A A . 12 ARG N 1 1 17 5525 1 1 12 ARG NE N -0.257 -0.016 5.362 1.00 . A A . 12 ARG NE 1 1 17 5526 1 1 12 ARG NH1 N -2.065 1.227 6.088 1.00 . A A . 12 ARG NH1 1 1 17 5527 1 1 12 ARG NH2 N 0.034 1.647 6.930 1.00 . A A . 12 ARG NH2 1 1 17 5528 1 1 12 ARG O O 1.681 -3.549 2.015 1.00 . A A . 12 ARG O 1 1 17 5529 1 1 13 ARG C C 2.256 -6.137 0.884 1.00 . A A . 13 ARG C 1 1 17 5530 1 1 13 ARG CA C 0.884 -6.160 1.556 1.00 . A A . 13 ARG CA 1 1 17 5531 1 1 13 ARG CB C 0.115 -7.416 1.135 1.00 . A A . 13 ARG CB 1 1 17 5532 1 1 13 ARG CD C 1.004 -8.857 2.997 1.00 . A A . 13 ARG CD 1 1 17 5533 1 1 13 ARG CG C 0.823 -8.713 1.492 1.00 . A A . 13 ARG CG 1 1 17 5534 1 1 13 ARG CZ C 1.985 -10.557 4.502 1.00 . A A . 13 ARG CZ 1 1 17 5535 1 1 13 ARG H H -0.764 -5.044 0.818 1.00 . A A . 13 ARG H 1 1 17 5536 1 1 13 ARG HA H 1.023 -6.175 2.627 1.00 . A A . 13 ARG HA 1 1 17 5537 1 1 13 ARG HB2 H -0.849 -7.413 1.620 1.00 . A A . 13 ARG HB2 1 1 17 5538 1 1 13 ARG HB3 H -0.030 -7.392 0.065 1.00 . A A . 13 ARG HB3 1 1 17 5539 1 1 13 ARG HD2 H 1.355 -7.917 3.395 1.00 . A A . 13 ARG HD2 1 1 17 5540 1 1 13 ARG HD3 H 0.050 -9.100 3.439 1.00 . A A . 13 ARG HD3 1 1 17 5541 1 1 13 ARG HE H 2.638 -10.133 2.654 1.00 . A A . 13 ARG HE 1 1 17 5542 1 1 13 ARG HG2 H 0.237 -9.544 1.130 1.00 . A A . 13 ARG HG2 1 1 17 5543 1 1 13 ARG HG3 H 1.795 -8.723 1.020 1.00 . A A . 13 ARG HG3 1 1 17 5544 1 1 13 ARG HH11 H 0.393 -9.567 5.275 1.00 . A A . 13 ARG HH11 1 1 17 5545 1 1 13 ARG HH12 H 1.099 -10.757 6.317 1.00 . A A . 13 ARG HH12 1 1 17 5546 1 1 13 ARG HH21 H 3.583 -11.712 4.022 1.00 . A A . 13 ARG HH21 1 1 17 5547 1 1 13 ARG HH22 H 2.921 -11.983 5.601 1.00 . A A . 13 ARG HH22 1 1 17 5548 1 1 13 ARG N N 0.126 -4.957 1.221 1.00 . A A . 13 ARG N 1 1 17 5549 1 1 13 ARG NE N 1.966 -9.907 3.335 1.00 . A A . 13 ARG NE 1 1 17 5550 1 1 13 ARG NH1 N 1.086 -10.271 5.440 1.00 . A A . 13 ARG NH1 1 1 17 5551 1 1 13 ARG NH2 N 2.903 -11.492 4.727 1.00 . A A . 13 ARG NH2 1 1 17 5552 1 1 13 ARG O O 3.268 -6.444 1.509 1.00 . A A . 13 ARG O 1 1 17 5553 1 1 14 ASN C C 4.069 -4.255 -1.150 1.00 . A A . 14 ASN C 1 1 17 5554 1 1 14 ASN CA C 3.527 -5.684 -1.143 1.00 . A A . 14 ASN CA 1 1 17 5555 1 1 14 ASN CB C 3.299 -6.180 -2.577 1.00 . A A . 14 ASN CB 1 1 17 5556 1 1 14 ASN CG C 4.595 -6.507 -3.299 1.00 . A A . 14 ASN CG 1 1 17 5557 1 1 14 ASN H H 1.440 -5.502 -0.826 1.00 . A A . 14 ASN H 1 1 17 5558 1 1 14 ASN HA H 4.245 -6.328 -0.657 1.00 . A A . 14 ASN HA 1 1 17 5559 1 1 14 ASN HB2 H 2.692 -7.071 -2.549 1.00 . A A . 14 ASN HB2 1 1 17 5560 1 1 14 ASN HB3 H 2.780 -5.414 -3.135 1.00 . A A . 14 ASN HB3 1 1 17 5561 1 1 14 ASN HD21 H 3.728 -6.198 -5.059 1.00 . A A . 14 ASN HD21 1 1 17 5562 1 1 14 ASN HD22 H 5.392 -6.659 -5.110 1.00 . A A . 14 ASN HD22 1 1 17 5563 1 1 14 ASN N N 2.281 -5.749 -0.385 1.00 . A A . 14 ASN N 1 1 17 5564 1 1 14 ASN ND2 N 4.568 -6.445 -4.622 1.00 . A A . 14 ASN ND2 1 1 17 5565 1 1 14 ASN O O 5.015 -3.926 -1.867 1.00 . A A . 14 ASN O 1 1 17 5566 1 1 14 ASN OD1 O 5.606 -6.820 -2.678 1.00 . A A . 14 ASN OD1 1 1 17 5567 1 1 15 HIS C C 3.992 -1.607 1.209 1.00 . A A . 15 HIS C 1 1 17 5568 1 1 15 HIS CA C 3.862 -2.001 -0.255 1.00 . A A . 15 HIS CA 1 1 17 5569 1 1 15 HIS CB C 2.855 -1.074 -0.951 1.00 . A A . 15 HIS CB 1 1 17 5570 1 1 15 HIS CD2 C 2.029 -0.585 -3.360 1.00 . A A . 15 HIS CD2 1 1 17 5571 1 1 15 HIS CE1 C 3.473 -1.806 -4.464 1.00 . A A . 15 HIS CE1 1 1 17 5572 1 1 15 HIS CG C 2.845 -1.166 -2.450 1.00 . A A . 15 HIS CG 1 1 17 5573 1 1 15 HIS H H 2.700 -3.713 0.198 1.00 . A A . 15 HIS H 1 1 17 5574 1 1 15 HIS HA H 4.826 -1.902 -0.732 1.00 . A A . 15 HIS HA 1 1 17 5575 1 1 15 HIS HB2 H 1.862 -1.314 -0.602 1.00 . A A . 15 HIS HB2 1 1 17 5576 1 1 15 HIS HB3 H 3.081 -0.051 -0.684 1.00 . A A . 15 HIS HB3 1 1 17 5577 1 1 15 HIS HD1 H 4.455 -2.491 -2.800 1.00 . A A . 15 HIS HD1 1 1 17 5578 1 1 15 HIS HD2 H 1.203 0.081 -3.146 1.00 . A A . 15 HIS HD2 1 1 17 5579 1 1 15 HIS HE1 H 4.013 -2.287 -5.267 1.00 . A A . 15 HIS HE1 1 1 17 5580 1 1 15 HIS HE2 H 1.902 -0.917 -5.425 1.00 . A A . 15 HIS HE2 1 1 17 5581 1 1 15 HIS N N 3.451 -3.396 -0.353 1.00 . A A . 15 HIS N 1 1 17 5582 1 1 15 HIS ND1 N 3.739 -1.926 -3.177 1.00 . A A . 15 HIS ND1 1 1 17 5583 1 1 15 HIS NE2 N 2.437 -0.999 -4.605 1.00 . A A . 15 HIS NE2 1 1 17 5584 1 1 15 HIS O O 3.843 -0.438 1.569 1.00 . A A . 15 HIS O 1 1 17 5585 1 1 16 LYS C C 5.671 -1.554 3.800 1.00 . A A . 16 LYS C 1 1 17 5586 1 1 16 LYS CA C 4.431 -2.382 3.481 1.00 . A A . 16 LYS CA 1 1 17 5587 1 1 16 LYS CB C 4.500 -3.725 4.214 1.00 . A A . 16 LYS CB 1 1 17 5588 1 1 16 LYS CD C 4.905 -4.574 6.553 1.00 . A A . 16 LYS CD 1 1 17 5589 1 1 16 LYS CE C 6.363 -4.138 6.636 1.00 . A A . 16 LYS CE 1 1 17 5590 1 1 16 LYS CG C 4.086 -3.640 5.676 1.00 . A A . 16 LYS CG 1 1 17 5591 1 1 16 LYS H H 4.412 -3.499 1.682 1.00 . A A . 16 LYS H 1 1 17 5592 1 1 16 LYS HA H 3.559 -1.844 3.821 1.00 . A A . 16 LYS HA 1 1 17 5593 1 1 16 LYS HB2 H 3.848 -4.428 3.717 1.00 . A A . 16 LYS HB2 1 1 17 5594 1 1 16 LYS HB3 H 5.514 -4.095 4.171 1.00 . A A . 16 LYS HB3 1 1 17 5595 1 1 16 LYS HD2 H 4.486 -4.577 7.548 1.00 . A A . 16 LYS HD2 1 1 17 5596 1 1 16 LYS HD3 H 4.861 -5.571 6.138 1.00 . A A . 16 LYS HD3 1 1 17 5597 1 1 16 LYS HE2 H 6.885 -4.798 7.312 1.00 . A A . 16 LYS HE2 1 1 17 5598 1 1 16 LYS HE3 H 6.803 -4.212 5.652 1.00 . A A . 16 LYS HE3 1 1 17 5599 1 1 16 LYS HG2 H 4.227 -2.626 6.020 1.00 . A A . 16 LYS HG2 1 1 17 5600 1 1 16 LYS HG3 H 3.042 -3.906 5.759 1.00 . A A . 16 LYS HG3 1 1 17 5601 1 1 16 LYS HZ1 H 5.927 -2.595 7.978 1.00 . A A . 16 LYS HZ1 1 1 17 5602 1 1 16 LYS HZ2 H 6.189 -2.064 6.391 1.00 . A A . 16 LYS HZ2 1 1 17 5603 1 1 16 LYS HZ3 H 7.497 -2.535 7.358 1.00 . A A . 16 LYS HZ3 1 1 17 5604 1 1 16 LYS N N 4.293 -2.595 2.044 1.00 . A A . 16 LYS N 1 1 17 5605 1 1 16 LYS NZ N 6.504 -2.736 7.127 1.00 . A A . 16 LYS NZ 1 1 17 5606 1 1 16 LYS O O 5.894 -1.166 4.949 1.00 . A A . 16 LYS O 1 1 17 5607 1 1 17 LYS C C 7.382 0.950 2.774 1.00 . A A . 17 LYS C 1 1 17 5608 1 1 17 LYS CA C 7.694 -0.524 2.954 1.00 . A A . 17 LYS CA 1 1 17 5609 1 1 17 LYS CB C 8.763 -0.959 1.949 1.00 . A A . 17 LYS CB 1 1 17 5610 1 1 17 LYS CD C 10.436 -2.688 1.226 1.00 . A A . 17 LYS CD 1 1 17 5611 1 1 17 LYS CE C 11.108 -4.009 1.568 1.00 . A A . 17 LYS CE 1 1 17 5612 1 1 17 LYS CG C 9.401 -2.301 2.271 1.00 . A A . 17 LYS CG 1 1 17 5613 1 1 17 LYS H H 6.268 -1.673 1.905 1.00 . A A . 17 LYS H 1 1 17 5614 1 1 17 LYS HA H 8.057 -0.682 3.953 1.00 . A A . 17 LYS HA 1 1 17 5615 1 1 17 LYS HB2 H 8.311 -1.027 0.971 1.00 . A A . 17 LYS HB2 1 1 17 5616 1 1 17 LYS HB3 H 9.539 -0.210 1.924 1.00 . A A . 17 LYS HB3 1 1 17 5617 1 1 17 LYS HD2 H 9.947 -2.784 0.268 1.00 . A A . 17 LYS HD2 1 1 17 5618 1 1 17 LYS HD3 H 11.188 -1.915 1.174 1.00 . A A . 17 LYS HD3 1 1 17 5619 1 1 17 LYS HE2 H 11.605 -3.908 2.522 1.00 . A A . 17 LYS HE2 1 1 17 5620 1 1 17 LYS HE3 H 10.351 -4.776 1.637 1.00 . A A . 17 LYS HE3 1 1 17 5621 1 1 17 LYS HG2 H 9.885 -2.237 3.234 1.00 . A A . 17 LYS HG2 1 1 17 5622 1 1 17 LYS HG3 H 8.631 -3.057 2.301 1.00 . A A . 17 LYS HG3 1 1 17 5623 1 1 17 LYS HZ1 H 11.647 -4.519 -0.384 1.00 . A A . 17 LYS HZ1 1 1 17 5624 1 1 17 LYS HZ2 H 12.553 -5.311 0.806 1.00 . A A . 17 LYS HZ2 1 1 17 5625 1 1 17 LYS HZ3 H 12.849 -3.681 0.461 1.00 . A A . 17 LYS HZ3 1 1 17 5626 1 1 17 LYS N N 6.487 -1.314 2.788 1.00 . A A . 17 LYS N 1 1 17 5627 1 1 17 LYS NZ N 12.109 -4.408 0.541 1.00 . A A . 17 LYS NZ 1 1 17 5628 1 1 17 LYS O O 7.877 1.796 3.510 1.00 . A A . 17 LYS O 1 1 17 5629 1 1 18 PHE C C 5.130 3.098 2.509 1.00 . A A . 18 PHE C 1 1 17 5630 1 1 18 PHE CA C 6.152 2.604 1.495 1.00 . A A . 18 PHE CA 1 1 17 5631 1 1 18 PHE CB C 5.560 2.687 0.086 1.00 . A A . 18 PHE CB 1 1 17 5632 1 1 18 PHE CD1 C 7.547 2.881 -1.434 1.00 . A A . 18 PHE CD1 1 1 17 5633 1 1 18 PHE CD2 C 6.226 0.897 -1.543 1.00 . A A . 18 PHE CD2 1 1 17 5634 1 1 18 PHE CE1 C 8.379 2.383 -2.420 1.00 . A A . 18 PHE CE1 1 1 17 5635 1 1 18 PHE CE2 C 7.053 0.395 -2.528 1.00 . A A . 18 PHE CE2 1 1 17 5636 1 1 18 PHE CG C 6.463 2.144 -0.986 1.00 . A A . 18 PHE CG 1 1 17 5637 1 1 18 PHE CZ C 8.132 1.140 -2.967 1.00 . A A . 18 PHE CZ 1 1 17 5638 1 1 18 PHE H H 6.183 0.512 1.251 1.00 . A A . 18 PHE H 1 1 17 5639 1 1 18 PHE HA H 7.032 3.227 1.547 1.00 . A A . 18 PHE HA 1 1 17 5640 1 1 18 PHE HB2 H 4.639 2.123 0.058 1.00 . A A . 18 PHE HB2 1 1 17 5641 1 1 18 PHE HB3 H 5.350 3.719 -0.146 1.00 . A A . 18 PHE HB3 1 1 17 5642 1 1 18 PHE HD1 H 7.741 3.853 -1.007 1.00 . A A . 18 PHE HD1 1 1 17 5643 1 1 18 PHE HD2 H 5.384 0.316 -1.200 1.00 . A A . 18 PHE HD2 1 1 17 5644 1 1 18 PHE HE1 H 9.220 2.966 -2.761 1.00 . A A . 18 PHE HE1 1 1 17 5645 1 1 18 PHE HE2 H 6.858 -0.578 -2.954 1.00 . A A . 18 PHE HE2 1 1 17 5646 1 1 18 PHE HZ H 8.781 0.749 -3.738 1.00 . A A . 18 PHE HZ 1 1 17 5647 1 1 18 PHE N N 6.546 1.238 1.791 1.00 . A A . 18 PHE N 1 1 17 5648 1 1 18 PHE O O 5.247 4.197 3.045 1.00 . A A . 18 PHE O 1 1 17 5649 1 1 19 CYS C C 3.423 2.159 5.127 1.00 . A A . 19 CYS C 1 1 17 5650 1 1 19 CYS CA C 3.082 2.634 3.717 1.00 . A A . 19 CYS CA 1 1 17 5651 1 1 19 CYS CB C 1.735 2.062 3.267 1.00 . A A . 19 CYS CB 1 1 17 5652 1 1 19 CYS H H 4.114 1.388 2.347 1.00 . A A . 19 CYS H 1 1 17 5653 1 1 19 CYS HA H 3.013 3.712 3.727 1.00 . A A . 19 CYS HA 1 1 17 5654 1 1 19 CYS HB2 H 1.674 1.023 3.551 1.00 . A A . 19 CYS HB2 1 1 17 5655 1 1 19 CYS HB3 H 0.942 2.607 3.756 1.00 . A A . 19 CYS HB3 1 1 17 5656 1 1 19 CYS N N 4.131 2.271 2.777 1.00 . A A . 19 CYS N 1 1 17 5657 1 1 19 CYS O O 2.715 1.328 5.707 1.00 . A A . 19 CYS O 1 1 17 5658 1 1 19 CYS SG S 1.446 2.163 1.470 1.00 . A A . 19 CYS SG 1 1 17 5659 1 1 20 NH2 HN1 H 5.015 3.346 5.157 1.00 . A A . 20 NH2 HN1 1 1 17 5660 1 1 20 NH2 HN2 H 4.745 2.412 6.586 1.00 . A A . 20 NH2 HN2 1 1 17 5661 1 1 20 NH2 N N 4.503 2.690 5.681 1.00 . A A . 20 NH2 N 1 1 18 5662 1 1 1 PHE C C 1.537 6.597 -5.329 1.00 . A A . 1 PHE C 1 1 18 5663 1 1 1 PHE CA C 3.015 6.749 -5.658 1.00 . A A . 1 PHE CA 1 1 18 5664 1 1 1 PHE CB C 3.843 6.804 -4.368 1.00 . A A . 1 PHE CB 1 1 18 5665 1 1 1 PHE CD1 C 4.272 4.392 -3.810 1.00 . A A . 1 PHE CD1 1 1 18 5666 1 1 1 PHE CD2 C 2.924 5.675 -2.319 1.00 . A A . 1 PHE CD2 1 1 18 5667 1 1 1 PHE CE1 C 4.118 3.285 -2.999 1.00 . A A . 1 PHE CE1 1 1 18 5668 1 1 1 PHE CE2 C 2.767 4.571 -1.505 1.00 . A A . 1 PHE CE2 1 1 18 5669 1 1 1 PHE CG C 3.676 5.599 -3.481 1.00 . A A . 1 PHE CG 1 1 18 5670 1 1 1 PHE CZ C 3.365 3.374 -1.845 1.00 . A A . 1 PHE CZ 1 1 18 5671 1 1 1 PHE H1 H 4.246 8.124 -6.628 1.00 . A A . 1 PHE H1 1 1 18 5672 1 1 1 PHE H2 H 2.859 8.805 -5.935 1.00 . A A . 1 PHE H2 1 1 18 5673 1 1 1 PHE H3 H 2.737 7.910 -7.363 1.00 . A A . 1 PHE H3 1 1 18 5674 1 1 1 PHE HA H 3.331 5.902 -6.250 1.00 . A A . 1 PHE HA 1 1 18 5675 1 1 1 PHE HB2 H 4.888 6.882 -4.623 1.00 . A A . 1 PHE HB2 1 1 18 5676 1 1 1 PHE HB3 H 3.551 7.676 -3.800 1.00 . A A . 1 PHE HB3 1 1 18 5677 1 1 1 PHE HD1 H 4.861 4.321 -4.713 1.00 . A A . 1 PHE HD1 1 1 18 5678 1 1 1 PHE HD2 H 2.455 6.611 -2.053 1.00 . A A . 1 PHE HD2 1 1 18 5679 1 1 1 PHE HE1 H 4.588 2.349 -3.266 1.00 . A A . 1 PHE HE1 1 1 18 5680 1 1 1 PHE HE2 H 2.179 4.644 -0.602 1.00 . A A . 1 PHE HE2 1 1 18 5681 1 1 1 PHE HZ H 3.244 2.509 -1.210 1.00 . A A . 1 PHE HZ 1 1 18 5682 1 1 1 PHE N N 3.231 7.982 -6.453 1.00 . A A . 1 PHE N 1 1 18 5683 1 1 1 PHE O O 0.864 7.581 -5.031 1.00 . A A . 1 PHE O 1 1 18 5684 1 1 2 ASN C C -0.535 4.754 -3.627 1.00 . A A . 2 ASN C 1 1 18 5685 1 1 2 ASN CA C -0.371 5.112 -5.097 1.00 . A A . 2 ASN CA 1 1 18 5686 1 1 2 ASN CB C -0.919 3.980 -5.971 1.00 . A A . 2 ASN CB 1 1 18 5687 1 1 2 ASN CG C -2.431 3.849 -5.869 1.00 . A A . 2 ASN CG 1 1 18 5688 1 1 2 ASN H H 1.613 4.625 -5.649 1.00 . A A . 2 ASN H 1 1 18 5689 1 1 2 ASN HA H -0.927 6.015 -5.300 1.00 . A A . 2 ASN HA 1 1 18 5690 1 1 2 ASN HB2 H -0.661 4.169 -7.002 1.00 . A A . 2 ASN HB2 1 1 18 5691 1 1 2 ASN HB3 H -0.475 3.046 -5.658 1.00 . A A . 2 ASN HB3 1 1 18 5692 1 1 2 ASN HD21 H -2.309 1.883 -6.134 1.00 . A A . 2 ASN HD21 1 1 18 5693 1 1 2 ASN HD22 H -3.903 2.519 -5.932 1.00 . A A . 2 ASN HD22 1 1 18 5694 1 1 2 ASN N N 1.032 5.372 -5.398 1.00 . A A . 2 ASN N 1 1 18 5695 1 1 2 ASN ND2 N -2.931 2.629 -5.989 1.00 . A A . 2 ASN ND2 1 1 18 5696 1 1 2 ASN O O -0.605 3.577 -3.267 1.00 . A A . 2 ASN O 1 1 18 5697 1 1 2 ASN OD1 O -3.143 4.840 -5.680 1.00 . A A . 2 ASN OD1 1 1 18 5698 1 1 3 TRP C C -2.051 4.868 -1.020 1.00 . A A . 3 TRP C 1 1 18 5699 1 1 3 TRP CA C -0.750 5.594 -1.341 1.00 . A A . 3 TRP CA 1 1 18 5700 1 1 3 TRP CB C -0.703 6.946 -0.619 1.00 . A A . 3 TRP CB 1 1 18 5701 1 1 3 TRP CD1 C -1.194 8.895 -2.213 1.00 . A A . 3 TRP CD1 1 1 18 5702 1 1 3 TRP CD2 C -2.941 8.280 -0.953 1.00 . A A . 3 TRP CD2 1 1 18 5703 1 1 3 TRP CE2 C -3.337 9.348 -1.781 1.00 . A A . 3 TRP CE2 1 1 18 5704 1 1 3 TRP CE3 C -3.877 7.728 -0.073 1.00 . A A . 3 TRP CE3 1 1 18 5705 1 1 3 TRP CG C -1.566 8.001 -1.249 1.00 . A A . 3 TRP CG 1 1 18 5706 1 1 3 TRP CH2 C -5.520 9.314 -0.880 1.00 . A A . 3 TRP CH2 1 1 18 5707 1 1 3 TRP CZ2 C -4.626 9.873 -1.752 1.00 . A A . 3 TRP CZ2 1 1 18 5708 1 1 3 TRP CZ3 C -5.155 8.252 -0.045 1.00 . A A . 3 TRP CZ3 1 1 18 5709 1 1 3 TRP H H -0.532 6.691 -3.139 1.00 . A A . 3 TRP H 1 1 18 5710 1 1 3 TRP HA H 0.075 4.987 -1.000 1.00 . A A . 3 TRP HA 1 1 18 5711 1 1 3 TRP HB2 H -1.035 6.812 0.400 1.00 . A A . 3 TRP HB2 1 1 18 5712 1 1 3 TRP HB3 H 0.316 7.307 -0.613 1.00 . A A . 3 TRP HB3 1 1 18 5713 1 1 3 TRP HD1 H -0.208 8.944 -2.650 1.00 . A A . 3 TRP HD1 1 1 18 5714 1 1 3 TRP HE1 H -2.238 10.423 -3.208 1.00 . A A . 3 TRP HE1 1 1 18 5715 1 1 3 TRP HE3 H -3.613 6.907 0.579 1.00 . A A . 3 TRP HE3 1 1 18 5716 1 1 3 TRP HH2 H -6.531 9.692 -0.825 1.00 . A A . 3 TRP HH2 1 1 18 5717 1 1 3 TRP HZ2 H -4.924 10.693 -2.389 1.00 . A A . 3 TRP HZ2 1 1 18 5718 1 1 3 TRP HZ3 H -5.890 7.838 0.630 1.00 . A A . 3 TRP HZ3 1 1 18 5719 1 1 3 TRP N N -0.596 5.779 -2.784 1.00 . A A . 3 TRP N 1 1 18 5720 1 1 3 TRP NE1 N -2.254 9.704 -2.541 1.00 . A A . 3 TRP NE1 1 1 18 5721 1 1 3 TRP O O -2.202 4.281 0.050 1.00 . A A . 3 TRP O 1 1 18 5722 1 1 4 ARG C C -4.102 2.752 -1.603 1.00 . A A . 4 ARG C 1 1 18 5723 1 1 4 ARG CA C -4.269 4.241 -1.814 1.00 . A A . 4 ARG CA 1 1 18 5724 1 1 4 ARG CB C -5.143 4.495 -3.035 1.00 . A A . 4 ARG CB 1 1 18 5725 1 1 4 ARG CD C -6.615 6.091 -4.294 1.00 . A A . 4 ARG CD 1 1 18 5726 1 1 4 ARG CG C -5.925 5.795 -2.972 1.00 . A A . 4 ARG CG 1 1 18 5727 1 1 4 ARG CZ C -5.910 6.650 -6.597 1.00 . A A . 4 ARG CZ 1 1 18 5728 1 1 4 ARG H H -2.782 5.371 -2.802 1.00 . A A . 4 ARG H 1 1 18 5729 1 1 4 ARG HA H -4.736 4.652 -0.945 1.00 . A A . 4 ARG HA 1 1 18 5730 1 1 4 ARG HB2 H -4.512 4.523 -3.912 1.00 . A A . 4 ARG HB2 1 1 18 5731 1 1 4 ARG HB3 H -5.839 3.679 -3.134 1.00 . A A . 4 ARG HB3 1 1 18 5732 1 1 4 ARG HD2 H -7.375 5.343 -4.464 1.00 . A A . 4 ARG HD2 1 1 18 5733 1 1 4 ARG HD3 H -7.077 7.065 -4.234 1.00 . A A . 4 ARG HD3 1 1 18 5734 1 1 4 ARG HE H -4.817 5.609 -5.282 1.00 . A A . 4 ARG HE 1 1 18 5735 1 1 4 ARG HG2 H -6.672 5.719 -2.197 1.00 . A A . 4 ARG HG2 1 1 18 5736 1 1 4 ARG HG3 H -5.245 6.602 -2.743 1.00 . A A . 4 ARG HG3 1 1 18 5737 1 1 4 ARG HH11 H -7.749 7.343 -6.095 1.00 . A A . 4 ARG HH11 1 1 18 5738 1 1 4 ARG HH12 H -7.232 7.720 -7.704 1.00 . A A . 4 ARG HH12 1 1 18 5739 1 1 4 ARG HH21 H -4.131 6.094 -7.394 1.00 . A A . 4 ARG HH21 1 1 18 5740 1 1 4 ARG HH22 H -5.161 7.008 -8.448 1.00 . A A . 4 ARG HH22 1 1 18 5741 1 1 4 ARG N N -2.976 4.894 -1.971 1.00 . A A . 4 ARG N 1 1 18 5742 1 1 4 ARG NE N -5.676 6.077 -5.417 1.00 . A A . 4 ARG NE 1 1 18 5743 1 1 4 ARG NH1 N -7.056 7.290 -6.817 1.00 . A A . 4 ARG NH1 1 1 18 5744 1 1 4 ARG NH2 N -4.995 6.579 -7.558 1.00 . A A . 4 ARG NH2 1 1 18 5745 1 1 4 ARG O O -4.943 2.098 -0.991 1.00 . A A . 4 ARG O 1 1 18 5746 1 1 5 CYS C C -2.573 0.456 -0.510 1.00 . A A . 5 CYS C 1 1 18 5747 1 1 5 CYS CA C -2.691 0.823 -1.977 1.00 . A A . 5 CYS CA 1 1 18 5748 1 1 5 CYS CB C -1.374 0.507 -2.671 1.00 . A A . 5 CYS CB 1 1 18 5749 1 1 5 CYS H H -2.404 2.821 -2.611 1.00 . A A . 5 CYS H 1 1 18 5750 1 1 5 CYS HA H -3.483 0.243 -2.428 1.00 . A A . 5 CYS HA 1 1 18 5751 1 1 5 CYS HB2 H -0.748 1.386 -2.641 1.00 . A A . 5 CYS HB2 1 1 18 5752 1 1 5 CYS HB3 H -0.881 -0.296 -2.141 1.00 . A A . 5 CYS HB3 1 1 18 5753 1 1 5 CYS N N -3.012 2.232 -2.119 1.00 . A A . 5 CYS N 1 1 18 5754 1 1 5 CYS O O -2.949 -0.636 -0.097 1.00 . A A . 5 CYS O 1 1 18 5755 1 1 5 CYS SG S -1.544 0.000 -4.410 1.00 . A A . 5 CYS SG 1 1 18 5756 1 1 6 CYS C C -3.229 1.166 2.442 1.00 . A A . 6 CYS C 1 1 18 5757 1 1 6 CYS CA C -1.896 1.176 1.705 1.00 . A A . 6 CYS CA 1 1 18 5758 1 1 6 CYS CB C -0.954 2.235 2.272 1.00 . A A . 6 CYS CB 1 1 18 5759 1 1 6 CYS H H -1.887 2.290 -0.103 1.00 . A A . 6 CYS H 1 1 18 5760 1 1 6 CYS HA H -1.436 0.201 1.821 1.00 . A A . 6 CYS HA 1 1 18 5761 1 1 6 CYS HB2 H -1.444 3.198 2.248 1.00 . A A . 6 CYS HB2 1 1 18 5762 1 1 6 CYS HB3 H -0.709 1.983 3.294 1.00 . A A . 6 CYS HB3 1 1 18 5763 1 1 6 CYS N N -2.092 1.401 0.280 1.00 . A A . 6 CYS N 1 1 18 5764 1 1 6 CYS O O -3.307 0.772 3.604 1.00 . A A . 6 CYS O 1 1 18 5765 1 1 6 CYS SG S 0.607 2.376 1.341 1.00 . A A . 6 CYS SG 1 1 18 5766 1 1 7 LEU C C -6.312 0.294 1.949 1.00 . A A . 7 LEU C 1 1 18 5767 1 1 7 LEU CA C -5.612 1.586 2.335 1.00 . A A . 7 LEU CA 1 1 18 5768 1 1 7 LEU CB C -6.427 2.799 1.862 1.00 . A A . 7 LEU CB 1 1 18 5769 1 1 7 LEU CD1 C -6.168 3.893 4.112 1.00 . A A . 7 LEU CD1 1 1 18 5770 1 1 7 LEU CD2 C -4.839 4.729 2.163 1.00 . A A . 7 LEU CD2 1 1 18 5771 1 1 7 LEU CG C -6.157 4.113 2.607 1.00 . A A . 7 LEU CG 1 1 18 5772 1 1 7 LEU H H -4.158 1.912 0.838 1.00 . A A . 7 LEU H 1 1 18 5773 1 1 7 LEU HA H -5.508 1.617 3.405 1.00 . A A . 7 LEU HA 1 1 18 5774 1 1 7 LEU HB2 H -6.216 2.956 0.815 1.00 . A A . 7 LEU HB2 1 1 18 5775 1 1 7 LEU HB3 H -7.475 2.562 1.967 1.00 . A A . 7 LEU HB3 1 1 18 5776 1 1 7 LEU HD11 H -5.972 4.828 4.614 1.00 . A A . 7 LEU HD11 1 1 18 5777 1 1 7 LEU HD12 H -5.405 3.175 4.375 1.00 . A A . 7 LEU HD12 1 1 18 5778 1 1 7 LEU HD13 H -7.134 3.518 4.414 1.00 . A A . 7 LEU HD13 1 1 18 5779 1 1 7 LEU HD21 H -4.671 5.649 2.702 1.00 . A A . 7 LEU HD21 1 1 18 5780 1 1 7 LEU HD22 H -4.875 4.933 1.103 1.00 . A A . 7 LEU HD22 1 1 18 5781 1 1 7 LEU HD23 H -4.032 4.039 2.370 1.00 . A A . 7 LEU HD23 1 1 18 5782 1 1 7 LEU HG H -6.946 4.814 2.372 1.00 . A A . 7 LEU HG 1 1 18 5783 1 1 7 LEU N N -4.280 1.588 1.757 1.00 . A A . 7 LEU N 1 1 18 5784 1 1 7 LEU O O -7.366 -0.050 2.478 1.00 . A A . 7 LEU O 1 1 18 5785 1 1 8 ILE C C -5.324 -2.841 1.037 1.00 . A A . 8 ILE C 1 1 18 5786 1 1 8 ILE CA C -6.204 -1.695 0.550 1.00 . A A . 8 ILE CA 1 1 18 5787 1 1 8 ILE CB C -6.275 -1.719 -0.995 1.00 . A A . 8 ILE CB 1 1 18 5788 1 1 8 ILE CD1 C -8.499 -0.457 -1.056 1.00 . A A . 8 ILE CD1 1 1 18 5789 1 1 8 ILE CG1 C -7.057 -0.508 -1.520 1.00 . A A . 8 ILE CG1 1 1 18 5790 1 1 8 ILE CG2 C -6.907 -3.014 -1.487 1.00 . A A . 8 ILE CG2 1 1 18 5791 1 1 8 ILE H H -4.815 -0.112 0.698 1.00 . A A . 8 ILE H 1 1 18 5792 1 1 8 ILE HA H -7.203 -1.821 0.944 1.00 . A A . 8 ILE HA 1 1 18 5793 1 1 8 ILE HB H -5.265 -1.675 -1.377 1.00 . A A . 8 ILE HB 1 1 18 5794 1 1 8 ILE HD11 H -8.529 -0.406 0.022 1.00 . A A . 8 ILE HD11 1 1 18 5795 1 1 8 ILE HD12 H -9.015 -1.346 -1.388 1.00 . A A . 8 ILE HD12 1 1 18 5796 1 1 8 ILE HD13 H -8.981 0.415 -1.472 1.00 . A A . 8 ILE HD13 1 1 18 5797 1 1 8 ILE HG12 H -6.572 0.397 -1.185 1.00 . A A . 8 ILE HG12 1 1 18 5798 1 1 8 ILE HG13 H -7.056 -0.530 -2.601 1.00 . A A . 8 ILE HG13 1 1 18 5799 1 1 8 ILE HG21 H -6.253 -3.842 -1.261 1.00 . A A . 8 ILE HG21 1 1 18 5800 1 1 8 ILE HG22 H -7.060 -2.958 -2.555 1.00 . A A . 8 ILE HG22 1 1 18 5801 1 1 8 ILE HG23 H -7.856 -3.161 -0.994 1.00 . A A . 8 ILE HG23 1 1 18 5802 1 1 8 ILE N N -5.679 -0.433 1.039 1.00 . A A . 8 ILE N 1 1 18 5803 1 1 8 ILE O O -4.174 -2.972 0.614 1.00 . A A . 8 ILE O 1 1 18 5804 1 1 9 PRO C C -4.497 -5.767 1.458 1.00 . A A . 9 PRO C 1 1 18 5805 1 1 9 PRO CA C -5.131 -4.841 2.501 1.00 . A A . 9 PRO CA 1 1 18 5806 1 1 9 PRO CB C -6.210 -5.592 3.285 1.00 . A A . 9 PRO CB 1 1 18 5807 1 1 9 PRO CD C -7.242 -3.613 2.440 1.00 . A A . 9 PRO CD 1 1 18 5808 1 1 9 PRO CG C -7.234 -4.559 3.606 1.00 . A A . 9 PRO CG 1 1 18 5809 1 1 9 PRO HA H -4.365 -4.506 3.184 1.00 . A A . 9 PRO HA 1 1 18 5810 1 1 9 PRO HB2 H -6.622 -6.380 2.672 1.00 . A A . 9 PRO HB2 1 1 18 5811 1 1 9 PRO HB3 H -5.780 -6.013 4.181 1.00 . A A . 9 PRO HB3 1 1 18 5812 1 1 9 PRO HD2 H -7.955 -3.938 1.695 1.00 . A A . 9 PRO HD2 1 1 18 5813 1 1 9 PRO HD3 H -7.469 -2.610 2.769 1.00 . A A . 9 PRO HD3 1 1 18 5814 1 1 9 PRO HG2 H -8.201 -5.025 3.720 1.00 . A A . 9 PRO HG2 1 1 18 5815 1 1 9 PRO HG3 H -6.958 -4.038 4.510 1.00 . A A . 9 PRO HG3 1 1 18 5816 1 1 9 PRO N N -5.863 -3.698 1.922 1.00 . A A . 9 PRO N 1 1 18 5817 1 1 9 PRO O O -3.680 -6.622 1.796 1.00 . A A . 9 PRO O 1 1 18 5818 1 1 10 ALA C C -3.101 -5.784 -1.502 1.00 . A A . 10 ALA C 1 1 18 5819 1 1 10 ALA CA C -4.343 -6.421 -0.877 1.00 . A A . 10 ALA CA 1 1 18 5820 1 1 10 ALA CB C -5.406 -6.657 -1.939 1.00 . A A . 10 ALA CB 1 1 18 5821 1 1 10 ALA H H -5.547 -4.917 -0.006 1.00 . A A . 10 ALA H 1 1 18 5822 1 1 10 ALA HA H -4.071 -7.380 -0.460 1.00 . A A . 10 ALA HA 1 1 18 5823 1 1 10 ALA HB1 H -6.276 -7.107 -1.485 1.00 . A A . 10 ALA HB1 1 1 18 5824 1 1 10 ALA HB2 H -5.015 -7.315 -2.700 1.00 . A A . 10 ALA HB2 1 1 18 5825 1 1 10 ALA HB3 H -5.682 -5.713 -2.386 1.00 . A A . 10 ALA HB3 1 1 18 5826 1 1 10 ALA N N -4.882 -5.604 0.201 1.00 . A A . 10 ALA N 1 1 18 5827 1 1 10 ALA O O -2.164 -6.484 -1.878 1.00 . A A . 10 ALA O 1 1 18 5828 1 1 11 CYS C C -0.945 -3.294 -1.136 1.00 . A A . 11 CYS C 1 1 18 5829 1 1 11 CYS CA C -1.949 -3.754 -2.192 1.00 . A A . 11 CYS CA 1 1 18 5830 1 1 11 CYS CB C -2.447 -2.555 -3.010 1.00 . A A . 11 CYS CB 1 1 18 5831 1 1 11 CYS H H -3.817 -3.936 -1.193 1.00 . A A . 11 CYS H 1 1 18 5832 1 1 11 CYS HA H -1.455 -4.447 -2.856 1.00 . A A . 11 CYS HA 1 1 18 5833 1 1 11 CYS HB2 H -3.387 -2.812 -3.475 1.00 . A A . 11 CYS HB2 1 1 18 5834 1 1 11 CYS HB3 H -2.600 -1.717 -2.346 1.00 . A A . 11 CYS HB3 1 1 18 5835 1 1 11 CYS N N -3.076 -4.455 -1.578 1.00 . A A . 11 CYS N 1 1 18 5836 1 1 11 CYS O O 0.233 -3.077 -1.432 1.00 . A A . 11 CYS O 1 1 18 5837 1 1 11 CYS SG S -1.303 -2.016 -4.330 1.00 . A A . 11 CYS SG 1 1 18 5838 1 1 12 ARG C C 0.544 -3.739 1.451 1.00 . A A . 12 ARG C 1 1 18 5839 1 1 12 ARG CA C -0.569 -2.731 1.207 1.00 . A A . 12 ARG CA 1 1 18 5840 1 1 12 ARG CB C -1.405 -2.578 2.475 1.00 . A A . 12 ARG CB 1 1 18 5841 1 1 12 ARG CD C -1.392 -2.104 4.946 1.00 . A A . 12 ARG CD 1 1 18 5842 1 1 12 ARG CG C -0.669 -1.901 3.622 1.00 . A A . 12 ARG CG 1 1 18 5843 1 1 12 ARG CZ C -3.738 -1.821 5.683 1.00 . A A . 12 ARG CZ 1 1 18 5844 1 1 12 ARG H H -2.369 -3.331 0.266 1.00 . A A . 12 ARG H 1 1 18 5845 1 1 12 ARG HA H -0.133 -1.776 0.952 1.00 . A A . 12 ARG HA 1 1 18 5846 1 1 12 ARG HB2 H -2.280 -1.999 2.239 1.00 . A A . 12 ARG HB2 1 1 18 5847 1 1 12 ARG HB3 H -1.715 -3.554 2.803 1.00 . A A . 12 ARG HB3 1 1 18 5848 1 1 12 ARG HD2 H -1.555 -3.161 5.094 1.00 . A A . 12 ARG HD2 1 1 18 5849 1 1 12 ARG HD3 H -0.771 -1.721 5.742 1.00 . A A . 12 ARG HD3 1 1 18 5850 1 1 12 ARG HE H -2.765 -0.594 4.434 1.00 . A A . 12 ARG HE 1 1 18 5851 1 1 12 ARG HG2 H 0.323 -2.319 3.698 1.00 . A A . 12 ARG HG2 1 1 18 5852 1 1 12 ARG HG3 H -0.601 -0.843 3.418 1.00 . A A . 12 ARG HG3 1 1 18 5853 1 1 12 ARG HH11 H -2.814 -3.442 6.473 1.00 . A A . 12 ARG HH11 1 1 18 5854 1 1 12 ARG HH12 H -4.457 -3.216 6.967 1.00 . A A . 12 ARG HH12 1 1 18 5855 1 1 12 ARG HH21 H -4.919 -0.290 5.071 1.00 . A A . 12 ARG HH21 1 1 18 5856 1 1 12 ARG HH22 H -5.667 -1.412 6.163 1.00 . A A . 12 ARG HH22 1 1 18 5857 1 1 12 ARG N N -1.417 -3.157 0.098 1.00 . A A . 12 ARG N 1 1 18 5858 1 1 12 ARG NE N -2.682 -1.418 4.977 1.00 . A A . 12 ARG NE 1 1 18 5859 1 1 12 ARG NH1 N -3.665 -2.916 6.434 1.00 . A A . 12 ARG NH1 1 1 18 5860 1 1 12 ARG NH2 N -4.866 -1.120 5.636 1.00 . A A . 12 ARG NH2 1 1 18 5861 1 1 12 ARG O O 1.612 -3.391 1.932 1.00 . A A . 12 ARG O 1 1 18 5862 1 1 13 ARG C C 2.539 -5.795 0.533 1.00 . A A . 13 ARG C 1 1 18 5863 1 1 13 ARG CA C 1.235 -6.074 1.280 1.00 . A A . 13 ARG CA 1 1 18 5864 1 1 13 ARG CB C 0.648 -7.394 0.773 1.00 . A A . 13 ARG CB 1 1 18 5865 1 1 13 ARG CD C -1.317 -8.946 0.662 1.00 . A A . 13 ARG CD 1 1 18 5866 1 1 13 ARG CG C -0.724 -7.718 1.334 1.00 . A A . 13 ARG CG 1 1 18 5867 1 1 13 ARG CZ C -3.486 -10.120 0.533 1.00 . A A . 13 ARG CZ 1 1 18 5868 1 1 13 ARG H H -0.614 -5.182 0.736 1.00 . A A . 13 ARG H 1 1 18 5869 1 1 13 ARG HA H 1.448 -6.167 2.334 1.00 . A A . 13 ARG HA 1 1 18 5870 1 1 13 ARG HB2 H 0.569 -7.347 -0.303 1.00 . A A . 13 ARG HB2 1 1 18 5871 1 1 13 ARG HB3 H 1.319 -8.196 1.038 1.00 . A A . 13 ARG HB3 1 1 18 5872 1 1 13 ARG HD2 H -1.206 -8.844 -0.407 1.00 . A A . 13 ARG HD2 1 1 18 5873 1 1 13 ARG HD3 H -0.777 -9.819 0.997 1.00 . A A . 13 ARG HD3 1 1 18 5874 1 1 13 ARG HE H -3.146 -8.428 1.558 1.00 . A A . 13 ARG HE 1 1 18 5875 1 1 13 ARG HG2 H -0.635 -7.905 2.393 1.00 . A A . 13 ARG HG2 1 1 18 5876 1 1 13 ARG HG3 H -1.379 -6.875 1.168 1.00 . A A . 13 ARG HG3 1 1 18 5877 1 1 13 ARG HH11 H -1.993 -10.987 -0.530 1.00 . A A . 13 ARG HH11 1 1 18 5878 1 1 13 ARG HH12 H -3.519 -11.802 -0.601 1.00 . A A . 13 ARG HH12 1 1 18 5879 1 1 13 ARG HH21 H -5.170 -9.499 1.476 1.00 . A A . 13 ARG HH21 1 1 18 5880 1 1 13 ARG HH22 H -5.336 -10.951 0.546 1.00 . A A . 13 ARG HH22 1 1 18 5881 1 1 13 ARG N N 0.270 -4.986 1.108 1.00 . A A . 13 ARG N 1 1 18 5882 1 1 13 ARG NE N -2.734 -9.113 0.978 1.00 . A A . 13 ARG NE 1 1 18 5883 1 1 13 ARG NH1 N -2.958 -11.045 -0.264 1.00 . A A . 13 ARG NH1 1 1 18 5884 1 1 13 ARG NH2 N -4.767 -10.197 0.879 1.00 . A A . 13 ARG NH2 1 1 18 5885 1 1 13 ARG O O 3.623 -6.092 1.028 1.00 . A A . 13 ARG O 1 1 18 5886 1 1 14 ASN C C 4.177 -3.541 -1.160 1.00 . A A . 14 ASN C 1 1 18 5887 1 1 14 ASN CA C 3.587 -4.914 -1.480 1.00 . A A . 14 ASN CA 1 1 18 5888 1 1 14 ASN CB C 3.190 -4.996 -2.962 1.00 . A A . 14 ASN CB 1 1 18 5889 1 1 14 ASN CG C 4.259 -4.469 -3.906 1.00 . A A . 14 ASN CG 1 1 18 5890 1 1 14 ASN H H 1.533 -4.956 -0.972 1.00 . A A . 14 ASN H 1 1 18 5891 1 1 14 ASN HA H 4.334 -5.667 -1.278 1.00 . A A . 14 ASN HA 1 1 18 5892 1 1 14 ASN HB2 H 2.996 -6.027 -3.216 1.00 . A A . 14 ASN HB2 1 1 18 5893 1 1 14 ASN HB3 H 2.288 -4.420 -3.114 1.00 . A A . 14 ASN HB3 1 1 18 5894 1 1 14 ASN HD21 H 5.155 -6.240 -3.936 1.00 . A A . 14 ASN HD21 1 1 18 5895 1 1 14 ASN HD22 H 5.898 -5.004 -4.887 1.00 . A A . 14 ASN HD22 1 1 18 5896 1 1 14 ASN N N 2.423 -5.205 -0.649 1.00 . A A . 14 ASN N 1 1 18 5897 1 1 14 ASN ND2 N 5.197 -5.324 -4.281 1.00 . A A . 14 ASN ND2 1 1 18 5898 1 1 14 ASN O O 5.339 -3.267 -1.450 1.00 . A A . 14 ASN O 1 1 18 5899 1 1 14 ASN OD1 O 4.233 -3.302 -4.300 1.00 . A A . 14 ASN OD1 1 1 18 5900 1 1 15 HIS C C 3.927 -1.145 1.299 1.00 . A A . 15 HIS C 1 1 18 5901 1 1 15 HIS CA C 3.854 -1.343 -0.207 1.00 . A A . 15 HIS CA 1 1 18 5902 1 1 15 HIS CB C 2.946 -0.291 -0.847 1.00 . A A . 15 HIS CB 1 1 18 5903 1 1 15 HIS CD2 C 1.873 -0.850 -3.142 1.00 . A A . 15 HIS CD2 1 1 18 5904 1 1 15 HIS CE1 C 3.545 -0.275 -4.430 1.00 . A A . 15 HIS CE1 1 1 18 5905 1 1 15 HIS CG C 2.867 -0.404 -2.340 1.00 . A A . 15 HIS CG 1 1 18 5906 1 1 15 HIS H H 2.484 -2.963 -0.273 1.00 . A A . 15 HIS H 1 1 18 5907 1 1 15 HIS HA H 4.848 -1.238 -0.613 1.00 . A A . 15 HIS HA 1 1 18 5908 1 1 15 HIS HB2 H 1.946 -0.399 -0.452 1.00 . A A . 15 HIS HB2 1 1 18 5909 1 1 15 HIS HB3 H 3.319 0.694 -0.605 1.00 . A A . 15 HIS HB3 1 1 18 5910 1 1 15 HIS HD1 H 4.774 0.299 -2.899 1.00 . A A . 15 HIS HD1 1 1 18 5911 1 1 15 HIS HD2 H 0.905 -1.210 -2.821 1.00 . A A . 15 HIS HD2 1 1 18 5912 1 1 15 HIS HE1 H 4.156 -0.092 -5.302 1.00 . A A . 15 HIS HE1 1 1 18 5913 1 1 15 HIS HE2 H 1.902 -1.212 -5.204 1.00 . A A . 15 HIS HE2 1 1 18 5914 1 1 15 HIS N N 3.388 -2.684 -0.534 1.00 . A A . 15 HIS N 1 1 18 5915 1 1 15 HIS ND1 N 3.902 -0.051 -3.179 1.00 . A A . 15 HIS ND1 1 1 18 5916 1 1 15 HIS NE2 N 2.318 -0.761 -4.437 1.00 . A A . 15 HIS NE2 1 1 18 5917 1 1 15 HIS O O 3.838 -0.023 1.798 1.00 . A A . 15 HIS O 1 1 18 5918 1 1 16 LYS C C 5.543 -1.634 3.917 1.00 . A A . 16 LYS C 1 1 18 5919 1 1 16 LYS CA C 4.209 -2.217 3.468 1.00 . A A . 16 LYS CA 1 1 18 5920 1 1 16 LYS CB C 4.037 -3.631 4.032 1.00 . A A . 16 LYS CB 1 1 18 5921 1 1 16 LYS CD C 3.825 -5.091 6.064 1.00 . A A . 16 LYS CD 1 1 18 5922 1 1 16 LYS CE C 3.715 -5.121 7.579 1.00 . A A . 16 LYS CE 1 1 18 5923 1 1 16 LYS CG C 3.803 -3.668 5.534 1.00 . A A . 16 LYS CG 1 1 18 5924 1 1 16 LYS H H 4.202 -3.102 1.548 1.00 . A A . 16 LYS H 1 1 18 5925 1 1 16 LYS HA H 3.410 -1.590 3.838 1.00 . A A . 16 LYS HA 1 1 18 5926 1 1 16 LYS HB2 H 3.192 -4.098 3.547 1.00 . A A . 16 LYS HB2 1 1 18 5927 1 1 16 LYS HB3 H 4.926 -4.202 3.814 1.00 . A A . 16 LYS HB3 1 1 18 5928 1 1 16 LYS HD2 H 2.994 -5.636 5.642 1.00 . A A . 16 LYS HD2 1 1 18 5929 1 1 16 LYS HD3 H 4.752 -5.560 5.770 1.00 . A A . 16 LYS HD3 1 1 18 5930 1 1 16 LYS HE2 H 4.505 -4.514 7.998 1.00 . A A . 16 LYS HE2 1 1 18 5931 1 1 16 LYS HE3 H 2.757 -4.711 7.866 1.00 . A A . 16 LYS HE3 1 1 18 5932 1 1 16 LYS HG2 H 4.579 -3.100 6.024 1.00 . A A . 16 LYS HG2 1 1 18 5933 1 1 16 LYS HG3 H 2.841 -3.228 5.749 1.00 . A A . 16 LYS HG3 1 1 18 5934 1 1 16 LYS HZ1 H 4.740 -6.921 7.834 1.00 . A A . 16 LYS HZ1 1 1 18 5935 1 1 16 LYS HZ2 H 3.061 -7.097 7.748 1.00 . A A . 16 LYS HZ2 1 1 18 5936 1 1 16 LYS HZ3 H 3.776 -6.491 9.155 1.00 . A A . 16 LYS HZ3 1 1 18 5937 1 1 16 LYS N N 4.123 -2.244 2.012 1.00 . A A . 16 LYS N 1 1 18 5938 1 1 16 LYS NZ N 3.831 -6.505 8.116 1.00 . A A . 16 LYS NZ 1 1 18 5939 1 1 16 LYS O O 5.708 -1.240 5.070 1.00 . A A . 16 LYS O 1 1 18 5940 1 1 17 LYS C C 7.792 0.466 3.270 1.00 . A A . 17 LYS C 1 1 18 5941 1 1 17 LYS CA C 7.812 -1.050 3.306 1.00 . A A . 17 LYS CA 1 1 18 5942 1 1 17 LYS CB C 8.860 -1.590 2.334 1.00 . A A . 17 LYS CB 1 1 18 5943 1 1 17 LYS CD C 10.492 -2.154 4.156 1.00 . A A . 17 LYS CD 1 1 18 5944 1 1 17 LYS CE C 11.271 -3.260 4.848 1.00 . A A . 17 LYS CE 1 1 18 5945 1 1 17 LYS CG C 9.744 -2.671 2.936 1.00 . A A . 17 LYS CG 1 1 18 5946 1 1 17 LYS H H 6.314 -1.929 2.101 1.00 . A A . 17 LYS H 1 1 18 5947 1 1 17 LYS HA H 8.062 -1.361 4.304 1.00 . A A . 17 LYS HA 1 1 18 5948 1 1 17 LYS HB2 H 8.354 -2.003 1.473 1.00 . A A . 17 LYS HB2 1 1 18 5949 1 1 17 LYS HB3 H 9.490 -0.774 2.013 1.00 . A A . 17 LYS HB3 1 1 18 5950 1 1 17 LYS HD2 H 11.181 -1.384 3.844 1.00 . A A . 17 LYS HD2 1 1 18 5951 1 1 17 LYS HD3 H 9.778 -1.739 4.853 1.00 . A A . 17 LYS HD3 1 1 18 5952 1 1 17 LYS HE2 H 10.590 -4.062 5.096 1.00 . A A . 17 LYS HE2 1 1 18 5953 1 1 17 LYS HE3 H 12.028 -3.627 4.171 1.00 . A A . 17 LYS HE3 1 1 18 5954 1 1 17 LYS HG2 H 9.126 -3.505 3.231 1.00 . A A . 17 LYS HG2 1 1 18 5955 1 1 17 LYS HG3 H 10.460 -2.992 2.194 1.00 . A A . 17 LYS HG3 1 1 18 5956 1 1 17 LYS HZ1 H 12.433 -3.558 6.558 1.00 . A A . 17 LYS HZ1 1 1 18 5957 1 1 17 LYS HZ2 H 11.211 -2.404 6.752 1.00 . A A . 17 LYS HZ2 1 1 18 5958 1 1 17 LYS HZ3 H 12.604 -2.021 5.872 1.00 . A A . 17 LYS HZ3 1 1 18 5959 1 1 17 LYS N N 6.498 -1.590 2.999 1.00 . A A . 17 LYS N 1 1 18 5960 1 1 17 LYS NZ N 11.926 -2.778 6.094 1.00 . A A . 17 LYS NZ 1 1 18 5961 1 1 17 LYS O O 8.602 1.121 3.921 1.00 . A A . 17 LYS O 1 1 18 5962 1 1 18 PHE C C 5.755 2.932 3.455 1.00 . A A . 18 PHE C 1 1 18 5963 1 1 18 PHE CA C 6.727 2.449 2.391 1.00 . A A . 18 PHE CA 1 1 18 5964 1 1 18 PHE CB C 6.220 2.832 0.998 1.00 . A A . 18 PHE CB 1 1 18 5965 1 1 18 PHE CD1 C 7.538 4.797 0.159 1.00 . A A . 18 PHE CD1 1 1 18 5966 1 1 18 PHE CD2 C 5.306 5.170 0.912 1.00 . A A . 18 PHE CD2 1 1 18 5967 1 1 18 PHE CE1 C 7.667 6.142 -0.132 1.00 . A A . 18 PHE CE1 1 1 18 5968 1 1 18 PHE CE2 C 5.430 6.516 0.623 1.00 . A A . 18 PHE CE2 1 1 18 5969 1 1 18 PHE CG C 6.357 4.296 0.684 1.00 . A A . 18 PHE CG 1 1 18 5970 1 1 18 PHE CZ C 6.612 7.002 0.101 1.00 . A A . 18 PHE CZ 1 1 18 5971 1 1 18 PHE H H 6.265 0.429 1.999 1.00 . A A . 18 PHE H 1 1 18 5972 1 1 18 PHE HA H 7.694 2.899 2.560 1.00 . A A . 18 PHE HA 1 1 18 5973 1 1 18 PHE HB2 H 6.777 2.280 0.256 1.00 . A A . 18 PHE HB2 1 1 18 5974 1 1 18 PHE HB3 H 5.174 2.571 0.921 1.00 . A A . 18 PHE HB3 1 1 18 5975 1 1 18 PHE HD1 H 8.362 4.125 -0.023 1.00 . A A . 18 PHE HD1 1 1 18 5976 1 1 18 PHE HD2 H 4.381 4.791 1.321 1.00 . A A . 18 PHE HD2 1 1 18 5977 1 1 18 PHE HE1 H 8.592 6.519 -0.540 1.00 . A A . 18 PHE HE1 1 1 18 5978 1 1 18 PHE HE2 H 4.603 7.186 0.807 1.00 . A A . 18 PHE HE2 1 1 18 5979 1 1 18 PHE HZ H 6.711 8.053 -0.126 1.00 . A A . 18 PHE HZ 1 1 18 5980 1 1 18 PHE N N 6.870 1.010 2.500 1.00 . A A . 18 PHE N 1 1 18 5981 1 1 18 PHE O O 6.021 3.893 4.176 1.00 . A A . 18 PHE O 1 1 18 5982 1 1 19 CYS C C 3.786 1.795 5.804 1.00 . A A . 19 CYS C 1 1 18 5983 1 1 19 CYS CA C 3.602 2.592 4.517 1.00 . A A . 19 CYS CA 1 1 18 5984 1 1 19 CYS CB C 2.211 2.360 3.925 1.00 . A A . 19 CYS CB 1 1 18 5985 1 1 19 CYS H H 4.497 1.466 2.967 1.00 . A A . 19 CYS H 1 1 18 5986 1 1 19 CYS HA H 3.711 3.642 4.746 1.00 . A A . 19 CYS HA 1 1 18 5987 1 1 19 CYS HB2 H 2.147 1.347 3.555 1.00 . A A . 19 CYS HB2 1 1 18 5988 1 1 19 CYS HB3 H 1.469 2.504 4.698 1.00 . A A . 19 CYS HB3 1 1 18 5989 1 1 19 CYS N N 4.628 2.247 3.547 1.00 . A A . 19 CYS N 1 1 18 5990 1 1 19 CYS O O 2.982 0.919 6.126 1.00 . A A . 19 CYS O 1 1 18 5991 1 1 19 CYS SG S 1.804 3.483 2.546 1.00 . A A . 19 CYS SG 1 1 18 5992 1 1 20 NH2 HN1 H 5.446 2.804 6.213 1.00 . A A . 20 NH2 HN1 1 1 18 5993 1 1 20 NH2 HN2 H 4.997 1.594 7.362 1.00 . A A . 20 NH2 HN2 1 1 18 5994 1 1 20 NH2 N N 4.849 2.094 6.535 1.00 . A A . 20 NH2 N 1 1 19 5995 1 1 1 PHE C C 1.668 6.394 -5.248 1.00 . A A . 1 PHE C 1 1 19 5996 1 1 1 PHE CA C 3.157 6.320 -5.565 1.00 . A A . 1 PHE CA 1 1 19 5997 1 1 1 PHE CB C 3.972 6.218 -4.268 1.00 . A A . 1 PHE CB 1 1 19 5998 1 1 1 PHE CD1 C 3.854 3.760 -3.765 1.00 . A A . 1 PHE CD1 1 1 19 5999 1 1 1 PHE CD2 C 2.919 5.286 -2.187 1.00 . A A . 1 PHE CD2 1 1 19 6000 1 1 1 PHE CE1 C 3.485 2.698 -2.960 1.00 . A A . 1 PHE CE1 1 1 19 6001 1 1 1 PHE CE2 C 2.548 4.228 -1.379 1.00 . A A . 1 PHE CE2 1 1 19 6002 1 1 1 PHE CG C 3.575 5.064 -3.388 1.00 . A A . 1 PHE CG 1 1 19 6003 1 1 1 PHE CZ C 2.831 2.933 -1.766 1.00 . A A . 1 PHE CZ 1 1 19 6004 1 1 1 PHE H1 H 3.351 8.379 -5.784 1.00 . A A . 1 PHE H1 1 1 19 6005 1 1 1 PHE H2 H 3.052 7.561 -7.232 1.00 . A A . 1 PHE H2 1 1 19 6006 1 1 1 PHE H3 H 4.587 7.491 -6.525 1.00 . A A . 1 PHE H3 1 1 19 6007 1 1 1 PHE HA H 3.343 5.448 -6.174 1.00 . A A . 1 PHE HA 1 1 19 6008 1 1 1 PHE HB2 H 5.016 6.099 -4.517 1.00 . A A . 1 PHE HB2 1 1 19 6009 1 1 1 PHE HB3 H 3.846 7.128 -3.701 1.00 . A A . 1 PHE HB3 1 1 19 6010 1 1 1 PHE HD1 H 4.366 3.576 -4.697 1.00 . A A . 1 PHE HD1 1 1 19 6011 1 1 1 PHE HD2 H 2.697 6.297 -1.883 1.00 . A A . 1 PHE HD2 1 1 19 6012 1 1 1 PHE HE1 H 3.708 1.687 -3.264 1.00 . A A . 1 PHE HE1 1 1 19 6013 1 1 1 PHE HE2 H 2.037 4.414 -0.445 1.00 . A A . 1 PHE HE2 1 1 19 6014 1 1 1 PHE HZ H 2.542 2.104 -1.137 1.00 . A A . 1 PHE HZ 1 1 19 6015 1 1 1 PHE N N 3.567 7.521 -6.330 1.00 . A A . 1 PHE N 1 1 19 6016 1 1 1 PHE O O 1.143 7.474 -4.992 1.00 . A A . 1 PHE O 1 1 19 6017 1 1 2 ASN C C -0.656 4.969 -3.505 1.00 . A A . 2 ASN C 1 1 19 6018 1 1 2 ASN CA C -0.434 5.199 -4.994 1.00 . A A . 2 ASN CA 1 1 19 6019 1 1 2 ASN CB C -1.108 4.089 -5.806 1.00 . A A . 2 ASN CB 1 1 19 6020 1 1 2 ASN CG C -2.603 4.007 -5.550 1.00 . A A . 2 ASN CG 1 1 19 6021 1 1 2 ASN H H 1.466 4.422 -5.501 1.00 . A A . 2 ASN H 1 1 19 6022 1 1 2 ASN HA H -0.864 6.151 -5.269 1.00 . A A . 2 ASN HA 1 1 19 6023 1 1 2 ASN HB2 H -0.952 4.276 -6.858 1.00 . A A . 2 ASN HB2 1 1 19 6024 1 1 2 ASN HB3 H -0.664 3.140 -5.543 1.00 . A A . 2 ASN HB3 1 1 19 6025 1 1 2 ASN HD21 H -2.595 2.063 -5.963 1.00 . A A . 2 ASN HD21 1 1 19 6026 1 1 2 ASN HD22 H -4.129 2.740 -5.550 1.00 . A A . 2 ASN HD22 1 1 19 6027 1 1 2 ASN N N 0.994 5.252 -5.285 1.00 . A A . 2 ASN N 1 1 19 6028 1 1 2 ASN ND2 N -3.167 2.818 -5.700 1.00 . A A . 2 ASN ND2 1 1 19 6029 1 1 2 ASN O O -0.666 3.829 -3.037 1.00 . A A . 2 ASN O 1 1 19 6030 1 1 2 ASN OD1 O -3.245 5.002 -5.217 1.00 . A A . 2 ASN OD1 1 1 19 6031 1 1 3 TRP C C -2.312 5.219 -0.982 1.00 . A A . 3 TRP C 1 1 19 6032 1 1 3 TRP CA C -1.049 6.001 -1.325 1.00 . A A . 3 TRP CA 1 1 19 6033 1 1 3 TRP CB C -1.127 7.416 -0.736 1.00 . A A . 3 TRP CB 1 1 19 6034 1 1 3 TRP CD1 C -1.883 9.082 -2.534 1.00 . A A . 3 TRP CD1 1 1 19 6035 1 1 3 TRP CD2 C -3.484 8.523 -1.071 1.00 . A A . 3 TRP CD2 1 1 19 6036 1 1 3 TRP CE2 C -4.023 9.433 -2.000 1.00 . A A . 3 TRP CE2 1 1 19 6037 1 1 3 TRP CE3 C -4.308 8.033 -0.054 1.00 . A A . 3 TRP CE3 1 1 19 6038 1 1 3 TRP CG C -2.114 8.307 -1.433 1.00 . A A . 3 TRP CG 1 1 19 6039 1 1 3 TRP CH2 C -6.130 9.366 -0.936 1.00 . A A . 3 TRP CH2 1 1 19 6040 1 1 3 TRP CZ2 C -5.347 9.861 -1.942 1.00 . A A . 3 TRP CZ2 1 1 19 6041 1 1 3 TRP CZ3 C -5.621 8.460 0.004 1.00 . A A . 3 TRP CZ3 1 1 19 6042 1 1 3 TRP H H -0.823 6.937 -3.210 1.00 . A A . 3 TRP H 1 1 19 6043 1 1 3 TRP HA H -0.203 5.492 -0.893 1.00 . A A . 3 TRP HA 1 1 19 6044 1 1 3 TRP HB2 H -1.416 7.349 0.302 1.00 . A A . 3 TRP HB2 1 1 19 6045 1 1 3 TRP HB3 H -0.153 7.879 -0.804 1.00 . A A . 3 TRP HB3 1 1 19 6046 1 1 3 TRP HD1 H -0.936 9.141 -3.049 1.00 . A A . 3 TRP HD1 1 1 19 6047 1 1 3 TRP HE1 H -3.115 10.373 -3.642 1.00 . A A . 3 TRP HE1 1 1 19 6048 1 1 3 TRP HE3 H -3.936 7.334 0.680 1.00 . A A . 3 TRP HE3 1 1 19 6049 1 1 3 TRP HH2 H -7.161 9.673 -0.852 1.00 . A A . 3 TRP HH2 1 1 19 6050 1 1 3 TRP HZ2 H -5.753 10.559 -2.659 1.00 . A A . 3 TRP HZ2 1 1 19 6051 1 1 3 TRP HZ3 H -6.273 8.093 0.784 1.00 . A A . 3 TRP HZ3 1 1 19 6052 1 1 3 TRP N N -0.835 6.061 -2.770 1.00 . A A . 3 TRP N 1 1 19 6053 1 1 3 TRP NE1 N -3.028 9.756 -2.885 1.00 . A A . 3 TRP NE1 1 1 19 6054 1 1 3 TRP O O -2.444 4.679 0.117 1.00 . A A . 3 TRP O 1 1 19 6055 1 1 4 ARG C C -4.223 2.945 -1.494 1.00 . A A . 4 ARG C 1 1 19 6056 1 1 4 ARG CA C -4.476 4.418 -1.745 1.00 . A A . 4 ARG CA 1 1 19 6057 1 1 4 ARG CB C -5.393 4.589 -2.951 1.00 . A A . 4 ARG CB 1 1 19 6058 1 1 4 ARG CD C -7.319 5.818 -3.997 1.00 . A A . 4 ARG CD 1 1 19 6059 1 1 4 ARG CG C -6.326 5.784 -2.846 1.00 . A A . 4 ARG CG 1 1 19 6060 1 1 4 ARG CZ C -9.093 4.379 -4.946 1.00 . A A . 4 ARG CZ 1 1 19 6061 1 1 4 ARG H H -3.049 5.569 -2.801 1.00 . A A . 4 ARG H 1 1 19 6062 1 1 4 ARG HA H -4.950 4.829 -0.877 1.00 . A A . 4 ARG HA 1 1 19 6063 1 1 4 ARG HB2 H -4.782 4.715 -3.834 1.00 . A A . 4 ARG HB2 1 1 19 6064 1 1 4 ARG HB3 H -5.985 3.697 -3.061 1.00 . A A . 4 ARG HB3 1 1 19 6065 1 1 4 ARG HD2 H -7.890 6.732 -3.935 1.00 . A A . 4 ARG HD2 1 1 19 6066 1 1 4 ARG HD3 H -6.770 5.799 -4.928 1.00 . A A . 4 ARG HD3 1 1 19 6067 1 1 4 ARG HE H -8.220 4.112 -3.162 1.00 . A A . 4 ARG HE 1 1 19 6068 1 1 4 ARG HG2 H -6.871 5.722 -1.916 1.00 . A A . 4 ARG HG2 1 1 19 6069 1 1 4 ARG HG3 H -5.739 6.690 -2.861 1.00 . A A . 4 ARG HG3 1 1 19 6070 1 1 4 ARG HH11 H -8.534 5.924 -6.138 1.00 . A A . 4 ARG HH11 1 1 19 6071 1 1 4 ARG HH12 H -9.779 4.907 -6.783 1.00 . A A . 4 ARG HH12 1 1 19 6072 1 1 4 ARG HH21 H -9.867 2.757 -4.006 1.00 . A A . 4 ARG HH21 1 1 19 6073 1 1 4 ARG HH22 H -10.540 3.098 -5.566 1.00 . A A . 4 ARG HH22 1 1 19 6074 1 1 4 ARG N N -3.225 5.137 -1.941 1.00 . A A . 4 ARG N 1 1 19 6075 1 1 4 ARG NE N -8.241 4.680 -3.964 1.00 . A A . 4 ARG NE 1 1 19 6076 1 1 4 ARG NH1 N -9.140 5.130 -6.045 1.00 . A A . 4 ARG NH1 1 1 19 6077 1 1 4 ARG NH2 N -9.898 3.326 -4.830 1.00 . A A . 4 ARG NH2 1 1 19 6078 1 1 4 ARG O O -5.035 2.257 -0.881 1.00 . A A . 4 ARG O 1 1 19 6079 1 1 5 CYS C C -2.544 0.775 -0.314 1.00 . A A . 5 CYS C 1 1 19 6080 1 1 5 CYS CA C -2.688 1.093 -1.791 1.00 . A A . 5 CYS CA 1 1 19 6081 1 1 5 CYS CB C -1.359 0.830 -2.486 1.00 . A A . 5 CYS CB 1 1 19 6082 1 1 5 CYS H H -2.504 3.093 -2.462 1.00 . A A . 5 CYS H 1 1 19 6083 1 1 5 CYS HA H -3.448 0.458 -2.221 1.00 . A A . 5 CYS HA 1 1 19 6084 1 1 5 CYS HB2 H -0.753 1.722 -2.420 1.00 . A A . 5 CYS HB2 1 1 19 6085 1 1 5 CYS HB3 H -0.852 0.021 -1.982 1.00 . A A . 5 CYS HB3 1 1 19 6086 1 1 5 CYS N N -3.089 2.479 -1.972 1.00 . A A . 5 CYS N 1 1 19 6087 1 1 5 CYS O O -2.794 -0.346 0.118 1.00 . A A . 5 CYS O 1 1 19 6088 1 1 5 CYS SG S -1.509 0.384 -4.246 1.00 . A A . 5 CYS SG 1 1 19 6089 1 1 6 CYS C C -3.318 1.425 2.600 1.00 . A A . 6 CYS C 1 1 19 6090 1 1 6 CYS CA C -1.979 1.610 1.893 1.00 . A A . 6 CYS CA 1 1 19 6091 1 1 6 CYS CB C -1.222 2.801 2.475 1.00 . A A . 6 CYS CB 1 1 19 6092 1 1 6 CYS H H -2.029 2.674 0.056 1.00 . A A . 6 CYS H 1 1 19 6093 1 1 6 CYS HA H -1.389 0.716 2.039 1.00 . A A . 6 CYS HA 1 1 19 6094 1 1 6 CYS HB2 H -1.895 3.638 2.579 1.00 . A A . 6 CYS HB2 1 1 19 6095 1 1 6 CYS HB3 H -0.833 2.528 3.447 1.00 . A A . 6 CYS HB3 1 1 19 6096 1 1 6 CYS N N -2.170 1.783 0.460 1.00 . A A . 6 CYS N 1 1 19 6097 1 1 6 CYS O O -3.371 0.998 3.755 1.00 . A A . 6 CYS O 1 1 19 6098 1 1 6 CYS SG S 0.187 3.337 1.450 1.00 . A A . 6 CYS SG 1 1 19 6099 1 1 7 LEU C C -6.337 0.274 1.950 1.00 . A A . 7 LEU C 1 1 19 6100 1 1 7 LEU CA C -5.736 1.586 2.436 1.00 . A A . 7 LEU CA 1 1 19 6101 1 1 7 LEU CB C -6.621 2.760 2.009 1.00 . A A . 7 LEU CB 1 1 19 6102 1 1 7 LEU CD1 C -6.927 5.228 1.697 1.00 . A A . 7 LEU CD1 1 1 19 6103 1 1 7 LEU CD2 C -5.983 4.352 3.841 1.00 . A A . 7 LEU CD2 1 1 19 6104 1 1 7 LEU CG C -6.066 4.150 2.335 1.00 . A A . 7 LEU CG 1 1 19 6105 1 1 7 LEU H H -4.285 2.079 0.982 1.00 . A A . 7 LEU H 1 1 19 6106 1 1 7 LEU HA H -5.663 1.562 3.511 1.00 . A A . 7 LEU HA 1 1 19 6107 1 1 7 LEU HB2 H -6.773 2.698 0.941 1.00 . A A . 7 LEU HB2 1 1 19 6108 1 1 7 LEU HB3 H -7.578 2.657 2.498 1.00 . A A . 7 LEU HB3 1 1 19 6109 1 1 7 LEU HD11 H -6.519 6.201 1.932 1.00 . A A . 7 LEU HD11 1 1 19 6110 1 1 7 LEU HD12 H -7.935 5.158 2.081 1.00 . A A . 7 LEU HD12 1 1 19 6111 1 1 7 LEU HD13 H -6.940 5.092 0.625 1.00 . A A . 7 LEU HD13 1 1 19 6112 1 1 7 LEU HD21 H -5.345 3.594 4.272 1.00 . A A . 7 LEU HD21 1 1 19 6113 1 1 7 LEU HD22 H -6.972 4.275 4.270 1.00 . A A . 7 LEU HD22 1 1 19 6114 1 1 7 LEU HD23 H -5.575 5.329 4.052 1.00 . A A . 7 LEU HD23 1 1 19 6115 1 1 7 LEU HG H -5.069 4.235 1.929 1.00 . A A . 7 LEU HG 1 1 19 6116 1 1 7 LEU N N -4.394 1.737 1.896 1.00 . A A . 7 LEU N 1 1 19 6117 1 1 7 LEU O O -7.462 -0.082 2.295 1.00 . A A . 7 LEU O 1 1 19 6118 1 1 8 ILE C C -5.030 -2.822 1.022 1.00 . A A . 8 ILE C 1 1 19 6119 1 1 8 ILE CA C -5.991 -1.716 0.595 1.00 . A A . 8 ILE CA 1 1 19 6120 1 1 8 ILE CB C -6.058 -1.668 -0.950 1.00 . A A . 8 ILE CB 1 1 19 6121 1 1 8 ILE CD1 C -6.773 -0.188 -2.901 1.00 . A A . 8 ILE CD1 1 1 19 6122 1 1 8 ILE CG1 C -6.879 -0.461 -1.415 1.00 . A A . 8 ILE CG1 1 1 19 6123 1 1 8 ILE CG2 C -6.653 -2.959 -1.498 1.00 . A A . 8 ILE CG2 1 1 19 6124 1 1 8 ILE H H -4.663 -0.109 0.935 1.00 . A A . 8 ILE H 1 1 19 6125 1 1 8 ILE HA H -6.978 -1.936 0.977 1.00 . A A . 8 ILE HA 1 1 19 6126 1 1 8 ILE HB H -5.051 -1.577 -1.328 1.00 . A A . 8 ILE HB 1 1 19 6127 1 1 8 ILE HD11 H -7.114 -1.052 -3.451 1.00 . A A . 8 ILE HD11 1 1 19 6128 1 1 8 ILE HD12 H -5.745 0.019 -3.157 1.00 . A A . 8 ILE HD12 1 1 19 6129 1 1 8 ILE HD13 H -7.386 0.665 -3.154 1.00 . A A . 8 ILE HD13 1 1 19 6130 1 1 8 ILE HG12 H -7.920 -0.632 -1.184 1.00 . A A . 8 ILE HG12 1 1 19 6131 1 1 8 ILE HG13 H -6.539 0.419 -0.890 1.00 . A A . 8 ILE HG13 1 1 19 6132 1 1 8 ILE HG21 H -6.003 -3.786 -1.257 1.00 . A A . 8 ILE HG21 1 1 19 6133 1 1 8 ILE HG22 H -6.755 -2.881 -2.570 1.00 . A A . 8 ILE HG22 1 1 19 6134 1 1 8 ILE HG23 H -7.625 -3.124 -1.056 1.00 . A A . 8 ILE HG23 1 1 19 6135 1 1 8 ILE N N -5.561 -0.443 1.149 1.00 . A A . 8 ILE N 1 1 19 6136 1 1 8 ILE O O -3.887 -2.869 0.562 1.00 . A A . 8 ILE O 1 1 19 6137 1 1 9 PRO C C -4.064 -5.724 1.311 1.00 . A A . 9 PRO C 1 1 19 6138 1 1 9 PRO CA C -4.675 -4.851 2.411 1.00 . A A . 9 PRO CA 1 1 19 6139 1 1 9 PRO CB C -5.673 -5.666 3.238 1.00 . A A . 9 PRO CB 1 1 19 6140 1 1 9 PRO CD C -6.850 -3.742 2.464 1.00 . A A . 9 PRO CD 1 1 19 6141 1 1 9 PRO CG C -6.733 -4.695 3.619 1.00 . A A . 9 PRO CG 1 1 19 6142 1 1 9 PRO HA H -3.886 -4.492 3.056 1.00 . A A . 9 PRO HA 1 1 19 6143 1 1 9 PRO HB2 H -6.072 -6.470 2.636 1.00 . A A . 9 PRO HB2 1 1 19 6144 1 1 9 PRO HB3 H -5.179 -6.072 4.108 1.00 . A A . 9 PRO HB3 1 1 19 6145 1 1 9 PRO HD2 H -7.568 -4.107 1.744 1.00 . A A . 9 PRO HD2 1 1 19 6146 1 1 9 PRO HD3 H -7.128 -2.758 2.811 1.00 . A A . 9 PRO HD3 1 1 19 6147 1 1 9 PRO HG2 H -7.668 -5.212 3.776 1.00 . A A . 9 PRO HG2 1 1 19 6148 1 1 9 PRO HG3 H -6.442 -4.164 4.515 1.00 . A A . 9 PRO HG3 1 1 19 6149 1 1 9 PRO N N -5.489 -3.734 1.895 1.00 . A A . 9 PRO N 1 1 19 6150 1 1 9 PRO O O -3.174 -6.537 1.571 1.00 . A A . 9 PRO O 1 1 19 6151 1 1 10 ALA C C -2.845 -5.627 -1.682 1.00 . A A . 10 ALA C 1 1 19 6152 1 1 10 ALA CA C -4.045 -6.325 -1.041 1.00 . A A . 10 ALA CA 1 1 19 6153 1 1 10 ALA CB C -5.145 -6.538 -2.071 1.00 . A A . 10 ALA CB 1 1 19 6154 1 1 10 ALA H H -5.270 -4.914 -0.054 1.00 . A A . 10 ALA H 1 1 19 6155 1 1 10 ALA HA H -3.732 -7.293 -0.677 1.00 . A A . 10 ALA HA 1 1 19 6156 1 1 10 ALA HB1 H -5.460 -5.583 -2.464 1.00 . A A . 10 ALA HB1 1 1 19 6157 1 1 10 ALA HB2 H -5.985 -7.030 -1.603 1.00 . A A . 10 ALA HB2 1 1 19 6158 1 1 10 ALA HB3 H -4.771 -7.152 -2.876 1.00 . A A . 10 ALA HB3 1 1 19 6159 1 1 10 ALA N N -4.550 -5.563 0.089 1.00 . A A . 10 ALA N 1 1 19 6160 1 1 10 ALA O O -1.918 -6.282 -2.150 1.00 . A A . 10 ALA O 1 1 19 6161 1 1 11 CYS C C -0.722 -3.148 -1.234 1.00 . A A . 11 CYS C 1 1 19 6162 1 1 11 CYS CA C -1.762 -3.536 -2.279 1.00 . A A . 11 CYS CA 1 1 19 6163 1 1 11 CYS CB C -2.296 -2.284 -2.986 1.00 . A A . 11 CYS CB 1 1 19 6164 1 1 11 CYS H H -3.587 -3.819 -1.233 1.00 . A A . 11 CYS H 1 1 19 6165 1 1 11 CYS HA H -1.288 -4.174 -3.011 1.00 . A A . 11 CYS HA 1 1 19 6166 1 1 11 CYS HB2 H -3.235 -2.519 -3.462 1.00 . A A . 11 CYS HB2 1 1 19 6167 1 1 11 CYS HB3 H -2.454 -1.506 -2.253 1.00 . A A . 11 CYS HB3 1 1 19 6168 1 1 11 CYS N N -2.849 -4.297 -1.672 1.00 . A A . 11 CYS N 1 1 19 6169 1 1 11 CYS O O 0.474 -3.083 -1.527 1.00 . A A . 11 CYS O 1 1 19 6170 1 1 11 CYS SG S -1.174 -1.621 -4.266 1.00 . A A . 11 CYS SG 1 1 19 6171 1 1 12 ARG C C 0.629 -3.687 1.437 1.00 . A A . 12 ARG C 1 1 19 6172 1 1 12 ARG CA C -0.284 -2.528 1.082 1.00 . A A . 12 ARG CA 1 1 19 6173 1 1 12 ARG CB C -1.079 -2.115 2.317 1.00 . A A . 12 ARG CB 1 1 19 6174 1 1 12 ARG CD C -1.057 -0.955 4.554 1.00 . A A . 12 ARG CD 1 1 19 6175 1 1 12 ARG CG C -0.280 -1.254 3.283 1.00 . A A . 12 ARG CG 1 1 19 6176 1 1 12 ARG CZ C -0.805 0.782 6.297 1.00 . A A . 12 ARG CZ 1 1 19 6177 1 1 12 ARG H H -2.146 -2.962 0.166 1.00 . A A . 12 ARG H 1 1 19 6178 1 1 12 ARG HA H 0.317 -1.694 0.752 1.00 . A A . 12 ARG HA 1 1 19 6179 1 1 12 ARG HB2 H -1.949 -1.566 1.999 1.00 . A A . 12 ARG HB2 1 1 19 6180 1 1 12 ARG HB3 H -1.397 -3.004 2.839 1.00 . A A . 12 ARG HB3 1 1 19 6181 1 1 12 ARG HD2 H -1.961 -0.425 4.293 1.00 . A A . 12 ARG HD2 1 1 19 6182 1 1 12 ARG HD3 H -1.313 -1.888 5.035 1.00 . A A . 12 ARG HD3 1 1 19 6183 1 1 12 ARG HE H 0.693 -0.285 5.509 1.00 . A A . 12 ARG HE 1 1 19 6184 1 1 12 ARG HG2 H 0.628 -1.776 3.546 1.00 . A A . 12 ARG HG2 1 1 19 6185 1 1 12 ARG HG3 H -0.032 -0.322 2.796 1.00 . A A . 12 ARG HG3 1 1 19 6186 1 1 12 ARG HH11 H -2.707 0.536 5.631 1.00 . A A . 12 ARG HH11 1 1 19 6187 1 1 12 ARG HH12 H -2.506 1.720 6.881 1.00 . A A . 12 ARG HH12 1 1 19 6188 1 1 12 ARG HH21 H 0.976 1.297 7.123 1.00 . A A . 12 ARG HH21 1 1 19 6189 1 1 12 ARG HH22 H -0.403 2.159 7.732 1.00 . A A . 12 ARG HH22 1 1 19 6190 1 1 12 ARG N N -1.179 -2.902 -0.009 1.00 . A A . 12 ARG N 1 1 19 6191 1 1 12 ARG NE N -0.279 -0.137 5.487 1.00 . A A . 12 ARG NE 1 1 19 6192 1 1 12 ARG NH1 N -2.109 1.035 6.269 1.00 . A A . 12 ARG NH1 1 1 19 6193 1 1 12 ARG NH2 N -0.016 1.469 7.117 1.00 . A A . 12 ARG NH2 1 1 19 6194 1 1 12 ARG O O 1.699 -3.498 2.005 1.00 . A A . 12 ARG O 1 1 19 6195 1 1 13 ARG C C 2.322 -6.026 0.699 1.00 . A A . 13 ARG C 1 1 19 6196 1 1 13 ARG CA C 0.946 -6.098 1.359 1.00 . A A . 13 ARG CA 1 1 19 6197 1 1 13 ARG CB C 0.178 -7.311 0.838 1.00 . A A . 13 ARG CB 1 1 19 6198 1 1 13 ARG CD C -0.222 -9.783 0.944 1.00 . A A . 13 ARG CD 1 1 19 6199 1 1 13 ARG CG C 0.671 -8.637 1.391 1.00 . A A . 13 ARG CG 1 1 19 6200 1 1 13 ARG CZ C -2.640 -10.057 0.503 1.00 . A A . 13 ARG CZ 1 1 19 6201 1 1 13 ARG H H -0.689 -4.952 0.664 1.00 . A A . 13 ARG H 1 1 19 6202 1 1 13 ARG HA H 1.074 -6.191 2.427 1.00 . A A . 13 ARG HA 1 1 19 6203 1 1 13 ARG HB2 H -0.862 -7.203 1.104 1.00 . A A . 13 ARG HB2 1 1 19 6204 1 1 13 ARG HB3 H 0.263 -7.341 -0.238 1.00 . A A . 13 ARG HB3 1 1 19 6205 1 1 13 ARG HD2 H -0.067 -9.954 -0.110 1.00 . A A . 13 ARG HD2 1 1 19 6206 1 1 13 ARG HD3 H 0.047 -10.671 1.497 1.00 . A A . 13 ARG HD3 1 1 19 6207 1 1 13 ARG HE H -1.849 -8.821 1.867 1.00 . A A . 13 ARG HE 1 1 19 6208 1 1 13 ARG HG2 H 1.675 -8.816 1.035 1.00 . A A . 13 ARG HG2 1 1 19 6209 1 1 13 ARG HG3 H 0.671 -8.590 2.471 1.00 . A A . 13 ARG HG3 1 1 19 6210 1 1 13 ARG HH11 H -1.439 -11.217 -0.647 1.00 . A A . 13 ARG HH11 1 1 19 6211 1 1 13 ARG HH12 H -3.136 -11.390 -0.944 1.00 . A A . 13 ARG HH12 1 1 19 6212 1 1 13 ARG HH21 H -4.090 -9.034 1.482 1.00 . A A . 13 ARG HH21 1 1 19 6213 1 1 13 ARG HH22 H -4.653 -10.144 0.276 1.00 . A A . 13 ARG HH22 1 1 19 6214 1 1 13 ARG N N 0.185 -4.884 1.097 1.00 . A A . 13 ARG N 1 1 19 6215 1 1 13 ARG NE N -1.639 -9.489 1.175 1.00 . A A . 13 ARG NE 1 1 19 6216 1 1 13 ARG NH1 N -2.386 -10.962 -0.439 1.00 . A A . 13 ARG NH1 1 1 19 6217 1 1 13 ARG NH2 N -3.895 -9.718 0.775 1.00 . A A . 13 ARG NH2 1 1 19 6218 1 1 13 ARG O O 3.338 -6.320 1.324 1.00 . A A . 13 ARG O 1 1 19 6219 1 1 14 ASN C C 4.152 -4.072 -1.195 1.00 . A A . 14 ASN C 1 1 19 6220 1 1 14 ASN CA C 3.592 -5.488 -1.310 1.00 . A A . 14 ASN CA 1 1 19 6221 1 1 14 ASN CB C 3.354 -5.854 -2.781 1.00 . A A . 14 ASN CB 1 1 19 6222 1 1 14 ASN CG C 4.644 -6.130 -3.535 1.00 . A A . 14 ASN CG 1 1 19 6223 1 1 14 ASN H H 1.501 -5.356 -0.993 1.00 . A A . 14 ASN H 1 1 19 6224 1 1 14 ASN HA H 4.301 -6.180 -0.883 1.00 . A A . 14 ASN HA 1 1 19 6225 1 1 14 ASN HB2 H 2.737 -6.738 -2.828 1.00 . A A . 14 ASN HB2 1 1 19 6226 1 1 14 ASN HB3 H 2.842 -5.038 -3.269 1.00 . A A . 14 ASN HB3 1 1 19 6227 1 1 14 ASN HD21 H 3.785 -5.622 -5.252 1.00 . A A . 14 ASN HD21 1 1 19 6228 1 1 14 ASN HD22 H 5.440 -6.107 -5.351 1.00 . A A . 14 ASN HD22 1 1 19 6229 1 1 14 ASN N N 2.344 -5.601 -0.559 1.00 . A A . 14 ASN N 1 1 19 6230 1 1 14 ASN ND2 N 4.619 -5.931 -4.844 1.00 . A A . 14 ASN ND2 1 1 19 6231 1 1 14 ASN O O 5.098 -3.690 -1.885 1.00 . A A . 14 ASN O 1 1 19 6232 1 1 14 ASN OD1 O 5.646 -6.529 -2.950 1.00 . A A . 14 ASN OD1 1 1 19 6233 1 1 15 HIS C C 4.110 -1.649 1.390 1.00 . A A . 15 HIS C 1 1 19 6234 1 1 15 HIS CA C 3.975 -1.904 -0.103 1.00 . A A . 15 HIS CA 1 1 19 6235 1 1 15 HIS CB C 2.978 -0.911 -0.715 1.00 . A A . 15 HIS CB 1 1 19 6236 1 1 15 HIS CD2 C 1.907 -0.530 -3.048 1.00 . A A . 15 HIS CD2 1 1 19 6237 1 1 15 HIS CE1 C 3.457 -1.456 -4.283 1.00 . A A . 15 HIS CE1 1 1 19 6238 1 1 15 HIS CG C 2.875 -0.974 -2.213 1.00 . A A . 15 HIS CG 1 1 19 6239 1 1 15 HIS H H 2.797 -3.637 0.203 1.00 . A A . 15 HIS H 1 1 19 6240 1 1 15 HIS HA H 4.940 -1.775 -0.571 1.00 . A A . 15 HIS HA 1 1 19 6241 1 1 15 HIS HB2 H 1.997 -1.108 -0.311 1.00 . A A . 15 HIS HB2 1 1 19 6242 1 1 15 HIS HB3 H 3.275 0.092 -0.444 1.00 . A A . 15 HIS HB3 1 1 19 6243 1 1 15 HIS HD1 H 4.657 -1.995 -2.711 1.00 . A A . 15 HIS HD1 1 1 19 6244 1 1 15 HIS HD2 H 0.998 -0.021 -2.760 1.00 . A A . 15 HIS HD2 1 1 19 6245 1 1 15 HIS HE1 H 4.010 -1.823 -5.134 1.00 . A A . 15 HIS HE1 1 1 19 6246 1 1 15 HIS HE2 H 1.697 -0.829 -5.110 1.00 . A A . 15 HIS HE2 1 1 19 6247 1 1 15 HIS N N 3.548 -3.281 -0.322 1.00 . A A . 15 HIS N 1 1 19 6248 1 1 15 HIS ND1 N 3.832 -1.551 -3.022 1.00 . A A . 15 HIS ND1 1 1 19 6249 1 1 15 HIS NE2 N 2.292 -0.842 -4.328 1.00 . A A . 15 HIS NE2 1 1 19 6250 1 1 15 HIS O O 3.954 -0.523 1.860 1.00 . A A . 15 HIS O 1 1 19 6251 1 1 16 LYS C C 5.692 -1.739 4.001 1.00 . A A . 16 LYS C 1 1 19 6252 1 1 16 LYS CA C 4.553 -2.655 3.574 1.00 . A A . 16 LYS CA 1 1 19 6253 1 1 16 LYS CB C 4.783 -4.061 4.131 1.00 . A A . 16 LYS CB 1 1 19 6254 1 1 16 LYS CD C 3.072 -4.264 5.959 1.00 . A A . 16 LYS CD 1 1 19 6255 1 1 16 LYS CE C 4.071 -4.663 7.038 1.00 . A A . 16 LYS CE 1 1 19 6256 1 1 16 LYS CG C 3.510 -4.754 4.589 1.00 . A A . 16 LYS CG 1 1 19 6257 1 1 16 LYS H H 4.531 -3.577 1.672 1.00 . A A . 16 LYS H 1 1 19 6258 1 1 16 LYS HA H 3.630 -2.267 3.979 1.00 . A A . 16 LYS HA 1 1 19 6259 1 1 16 LYS HB2 H 5.240 -4.668 3.363 1.00 . A A . 16 LYS HB2 1 1 19 6260 1 1 16 LYS HB3 H 5.455 -3.996 4.974 1.00 . A A . 16 LYS HB3 1 1 19 6261 1 1 16 LYS HD2 H 2.992 -3.187 5.938 1.00 . A A . 16 LYS HD2 1 1 19 6262 1 1 16 LYS HD3 H 2.110 -4.694 6.196 1.00 . A A . 16 LYS HD3 1 1 19 6263 1 1 16 LYS HE2 H 4.060 -5.738 7.140 1.00 . A A . 16 LYS HE2 1 1 19 6264 1 1 16 LYS HE3 H 5.056 -4.341 6.734 1.00 . A A . 16 LYS HE3 1 1 19 6265 1 1 16 LYS HG2 H 2.724 -4.551 3.876 1.00 . A A . 16 LYS HG2 1 1 19 6266 1 1 16 LYS HG3 H 3.688 -5.820 4.636 1.00 . A A . 16 LYS HG3 1 1 19 6267 1 1 16 LYS HZ1 H 3.779 -3.013 8.285 1.00 . A A . 16 LYS HZ1 1 1 19 6268 1 1 16 LYS HZ2 H 4.433 -4.359 9.072 1.00 . A A . 16 LYS HZ2 1 1 19 6269 1 1 16 LYS HZ3 H 2.794 -4.335 8.659 1.00 . A A . 16 LYS HZ3 1 1 19 6270 1 1 16 LYS N N 4.410 -2.713 2.123 1.00 . A A . 16 LYS N 1 1 19 6271 1 1 16 LYS NZ N 3.746 -4.050 8.355 1.00 . A A . 16 LYS NZ 1 1 19 6272 1 1 16 LYS O O 5.700 -1.237 5.124 1.00 . A A . 16 LYS O 1 1 19 6273 1 1 17 LYS C C 7.428 0.783 3.218 1.00 . A A . 17 LYS C 1 1 19 6274 1 1 17 LYS CA C 7.789 -0.680 3.408 1.00 . A A . 17 LYS CA 1 1 19 6275 1 1 17 LYS CB C 8.974 -1.043 2.516 1.00 . A A . 17 LYS CB 1 1 19 6276 1 1 17 LYS CD C 10.905 -2.585 2.061 1.00 . A A . 17 LYS CD 1 1 19 6277 1 1 17 LYS CE C 11.702 -3.782 2.556 1.00 . A A . 17 LYS CE 1 1 19 6278 1 1 17 LYS CG C 9.740 -2.270 2.985 1.00 . A A . 17 LYS CG 1 1 19 6279 1 1 17 LYS H H 6.593 -1.974 2.240 1.00 . A A . 17 LYS H 1 1 19 6280 1 1 17 LYS HA H 8.058 -0.837 4.437 1.00 . A A . 17 LYS HA 1 1 19 6281 1 1 17 LYS HB2 H 8.611 -1.234 1.516 1.00 . A A . 17 LYS HB2 1 1 19 6282 1 1 17 LYS HB3 H 9.655 -0.206 2.486 1.00 . A A . 17 LYS HB3 1 1 19 6283 1 1 17 LYS HD2 H 10.520 -2.805 1.076 1.00 . A A . 17 LYS HD2 1 1 19 6284 1 1 17 LYS HD3 H 11.556 -1.724 2.012 1.00 . A A . 17 LYS HD3 1 1 19 6285 1 1 17 LYS HE2 H 12.095 -3.555 3.537 1.00 . A A . 17 LYS HE2 1 1 19 6286 1 1 17 LYS HE3 H 11.044 -4.635 2.620 1.00 . A A . 17 LYS HE3 1 1 19 6287 1 1 17 LYS HG2 H 10.121 -2.085 3.978 1.00 . A A . 17 LYS HG2 1 1 19 6288 1 1 17 LYS HG3 H 9.068 -3.115 3.006 1.00 . A A . 17 LYS HG3 1 1 19 6289 1 1 17 LYS HZ1 H 13.495 -3.306 1.592 1.00 . A A . 17 LYS HZ1 1 1 19 6290 1 1 17 LYS HZ2 H 12.479 -4.316 0.692 1.00 . A A . 17 LYS HZ2 1 1 19 6291 1 1 17 LYS HZ3 H 13.349 -4.941 1.999 1.00 . A A . 17 LYS HZ3 1 1 19 6292 1 1 17 LYS N N 6.651 -1.537 3.112 1.00 . A A . 17 LYS N 1 1 19 6293 1 1 17 LYS NZ N 12.835 -4.109 1.647 1.00 . A A . 17 LYS NZ 1 1 19 6294 1 1 17 LYS O O 7.879 1.646 3.967 1.00 . A A . 17 LYS O 1 1 19 6295 1 1 18 PHE C C 5.151 2.865 2.933 1.00 . A A . 18 PHE C 1 1 19 6296 1 1 18 PHE CA C 6.192 2.408 1.921 1.00 . A A . 18 PHE CA 1 1 19 6297 1 1 18 PHE CB C 5.613 2.496 0.508 1.00 . A A . 18 PHE CB 1 1 19 6298 1 1 18 PHE CD1 C 7.509 3.020 -1.050 1.00 . A A . 18 PHE CD1 1 1 19 6299 1 1 18 PHE CD2 C 6.565 0.830 -1.112 1.00 . A A . 18 PHE CD2 1 1 19 6300 1 1 18 PHE CE1 C 8.402 2.667 -2.044 1.00 . A A . 18 PHE CE1 1 1 19 6301 1 1 18 PHE CE2 C 7.453 0.472 -2.107 1.00 . A A . 18 PHE CE2 1 1 19 6302 1 1 18 PHE CG C 6.582 2.107 -0.573 1.00 . A A . 18 PHE CG 1 1 19 6303 1 1 18 PHE CZ C 8.373 1.391 -2.574 1.00 . A A . 18 PHE CZ 1 1 19 6304 1 1 18 PHE H H 6.289 0.318 1.660 1.00 . A A . 18 PHE H 1 1 19 6305 1 1 18 PHE HA H 7.056 3.052 1.991 1.00 . A A . 18 PHE HA 1 1 19 6306 1 1 18 PHE HB2 H 4.758 1.840 0.435 1.00 . A A . 18 PHE HB2 1 1 19 6307 1 1 18 PHE HB3 H 5.295 3.511 0.319 1.00 . A A . 18 PHE HB3 1 1 19 6308 1 1 18 PHE HD1 H 7.532 4.017 -0.636 1.00 . A A . 18 PHE HD1 1 1 19 6309 1 1 18 PHE HD2 H 5.846 0.111 -0.748 1.00 . A A . 18 PHE HD2 1 1 19 6310 1 1 18 PHE HE1 H 9.121 3.387 -2.407 1.00 . A A . 18 PHE HE1 1 1 19 6311 1 1 18 PHE HE2 H 7.429 -0.526 -2.520 1.00 . A A . 18 PHE HE2 1 1 19 6312 1 1 18 PHE HZ H 9.070 1.113 -3.352 1.00 . A A . 18 PHE HZ 1 1 19 6313 1 1 18 PHE N N 6.616 1.051 2.213 1.00 . A A . 18 PHE N 1 1 19 6314 1 1 18 PHE O O 5.255 3.948 3.505 1.00 . A A . 18 PHE O 1 1 19 6315 1 1 19 CYS C C 3.385 1.808 5.475 1.00 . A A . 19 CYS C 1 1 19 6316 1 1 19 CYS CA C 3.084 2.359 4.084 1.00 . A A . 19 CYS CA 1 1 19 6317 1 1 19 CYS CB C 1.744 1.834 3.567 1.00 . A A . 19 CYS CB 1 1 19 6318 1 1 19 CYS H H 4.145 1.153 2.703 1.00 . A A . 19 CYS H 1 1 19 6319 1 1 19 CYS HA H 3.032 3.435 4.149 1.00 . A A . 19 CYS HA 1 1 19 6320 1 1 19 CYS HB2 H 1.614 0.810 3.880 1.00 . A A . 19 CYS HB2 1 1 19 6321 1 1 19 CYS HB3 H 0.948 2.433 3.988 1.00 . A A . 19 CYS HB3 1 1 19 6322 1 1 19 CYS N N 4.149 2.029 3.153 1.00 . A A . 19 CYS N 1 1 19 6323 1 1 19 CYS O O 2.597 1.038 6.041 1.00 . A A . 19 CYS O 1 1 19 6324 1 1 19 CYS SG S 1.573 1.887 1.753 1.00 . A A . 19 CYS SG 1 1 19 6325 1 1 20 NH2 HN1 H 5.097 2.813 5.522 1.00 . A A . 20 NH2 HN1 1 1 19 6326 1 1 20 NH2 HN2 H 4.744 1.862 6.921 1.00 . A A . 20 NH2 HN2 1 1 19 6327 1 1 20 NH2 N N 4.522 2.199 6.031 1.00 . A A . 20 NH2 N 1 1 20 6328 1 1 1 PHE C C 1.596 6.515 -5.213 1.00 . A A . 1 PHE C 1 1 20 6329 1 1 1 PHE CA C 3.083 6.460 -5.534 1.00 . A A . 1 PHE CA 1 1 20 6330 1 1 1 PHE CB C 3.899 6.293 -4.243 1.00 . A A . 1 PHE CB 1 1 20 6331 1 1 1 PHE CD1 C 3.829 3.817 -3.820 1.00 . A A . 1 PHE CD1 1 1 20 6332 1 1 1 PHE CD2 C 2.789 5.266 -2.236 1.00 . A A . 1 PHE CD2 1 1 20 6333 1 1 1 PHE CE1 C 3.459 2.722 -3.063 1.00 . A A . 1 PHE CE1 1 1 20 6334 1 1 1 PHE CE2 C 2.415 4.174 -1.477 1.00 . A A . 1 PHE CE2 1 1 20 6335 1 1 1 PHE CG C 3.499 5.101 -3.416 1.00 . A A . 1 PHE CG 1 1 20 6336 1 1 1 PHE CZ C 2.751 2.900 -1.890 1.00 . A A . 1 PHE CZ 1 1 20 6337 1 1 1 PHE H1 H 3.274 8.527 -5.647 1.00 . A A . 1 PHE H1 1 1 20 6338 1 1 1 PHE H2 H 2.979 7.783 -7.136 1.00 . A A . 1 PHE H2 1 1 20 6339 1 1 1 PHE H3 H 4.513 7.681 -6.431 1.00 . A A . 1 PHE H3 1 1 20 6340 1 1 1 PHE HA H 3.270 5.618 -6.186 1.00 . A A . 1 PHE HA 1 1 20 6341 1 1 1 PHE HB2 H 4.942 6.183 -4.499 1.00 . A A . 1 PHE HB2 1 1 20 6342 1 1 1 PHE HB3 H 3.775 7.177 -3.635 1.00 . A A . 1 PHE HB3 1 1 20 6343 1 1 1 PHE HD1 H 4.383 3.675 -4.737 1.00 . A A . 1 PHE HD1 1 1 20 6344 1 1 1 PHE HD2 H 2.525 6.262 -1.911 1.00 . A A . 1 PHE HD2 1 1 20 6345 1 1 1 PHE HE1 H 3.723 1.726 -3.389 1.00 . A A . 1 PHE HE1 1 1 20 6346 1 1 1 PHE HE2 H 1.862 4.316 -0.559 1.00 . A A . 1 PHE HE2 1 1 20 6347 1 1 1 PHE HZ H 2.460 2.045 -1.299 1.00 . A A . 1 PHE HZ 1 1 20 6348 1 1 1 PHE N N 3.493 7.698 -6.236 1.00 . A A . 1 PHE N 1 1 20 6349 1 1 1 PHE O O 1.062 7.587 -4.941 1.00 . A A . 1 PHE O 1 1 20 6350 1 1 2 ASN C C -0.702 5.051 -3.475 1.00 . A A . 2 ASN C 1 1 20 6351 1 1 2 ASN CA C -0.491 5.296 -4.963 1.00 . A A . 2 ASN CA 1 1 20 6352 1 1 2 ASN CB C -1.158 4.185 -5.780 1.00 . A A . 2 ASN CB 1 1 20 6353 1 1 2 ASN CG C -2.647 4.076 -5.502 1.00 . A A . 2 ASN CG 1 1 20 6354 1 1 2 ASN H H 1.411 4.545 -5.490 1.00 . A A . 2 ASN H 1 1 20 6355 1 1 2 ASN HA H -0.934 6.245 -5.228 1.00 . A A . 2 ASN HA 1 1 20 6356 1 1 2 ASN HB2 H -1.021 4.387 -6.831 1.00 . A A . 2 ASN HB2 1 1 20 6357 1 1 2 ASN HB3 H -0.695 3.240 -5.534 1.00 . A A . 2 ASN HB3 1 1 20 6358 1 1 2 ASN HD21 H -2.624 2.146 -5.971 1.00 . A A . 2 ASN HD21 1 1 20 6359 1 1 2 ASN HD22 H -4.159 2.793 -5.516 1.00 . A A . 2 ASN HD22 1 1 20 6360 1 1 2 ASN N N 0.934 5.368 -5.260 1.00 . A A . 2 ASN N 1 1 20 6361 1 1 2 ASN ND2 N -3.199 2.885 -5.678 1.00 . A A . 2 ASN ND2 1 1 20 6362 1 1 2 ASN O O -0.678 3.909 -3.016 1.00 . A A . 2 ASN O 1 1 20 6363 1 1 2 ASN OD1 O -3.294 5.054 -5.128 1.00 . A A . 2 ASN OD1 1 1 20 6364 1 1 3 TRP C C -2.353 5.231 -0.946 1.00 . A A . 3 TRP C 1 1 20 6365 1 1 3 TRP CA C -1.112 6.051 -1.284 1.00 . A A . 3 TRP CA 1 1 20 6366 1 1 3 TRP CB C -1.225 7.456 -0.680 1.00 . A A . 3 TRP CB 1 1 20 6367 1 1 3 TRP CD1 C -2.375 8.954 -2.418 1.00 . A A . 3 TRP CD1 1 1 20 6368 1 1 3 TRP CD2 C -3.638 8.488 -0.629 1.00 . A A . 3 TRP CD2 1 1 20 6369 1 1 3 TRP CE2 C -4.379 9.309 -1.499 1.00 . A A . 3 TRP CE2 1 1 20 6370 1 1 3 TRP CE3 C -4.230 8.066 0.567 1.00 . A A . 3 TRP CE3 1 1 20 6371 1 1 3 TRP CG C -2.360 8.269 -1.237 1.00 . A A . 3 TRP CG 1 1 20 6372 1 1 3 TRP CH2 C -6.233 9.290 -0.034 1.00 . A A . 3 TRP CH2 1 1 20 6373 1 1 3 TRP CZ2 C -5.680 9.717 -1.211 1.00 . A A . 3 TRP CZ2 1 1 20 6374 1 1 3 TRP CZ3 C -5.520 8.473 0.851 1.00 . A A . 3 TRP CZ3 1 1 20 6375 1 1 3 TRP H H -0.920 7.011 -3.162 1.00 . A A . 3 TRP H 1 1 20 6376 1 1 3 TRP HA H -0.253 5.558 -0.862 1.00 . A A . 3 TRP HA 1 1 20 6377 1 1 3 TRP HB2 H -1.374 7.368 0.386 1.00 . A A . 3 TRP HB2 1 1 20 6378 1 1 3 TRP HB3 H -0.307 7.993 -0.865 1.00 . A A . 3 TRP HB3 1 1 20 6379 1 1 3 TRP HD1 H -1.549 8.988 -3.114 1.00 . A A . 3 TRP HD1 1 1 20 6380 1 1 3 TRP HE1 H -3.843 10.129 -3.355 1.00 . A A . 3 TRP HE1 1 1 20 6381 1 1 3 TRP HE3 H -3.696 7.435 1.263 1.00 . A A . 3 TRP HE3 1 1 20 6382 1 1 3 TRP HH2 H -7.238 9.584 0.230 1.00 . A A . 3 TRP HH2 1 1 20 6383 1 1 3 TRP HZ2 H -6.244 10.346 -1.884 1.00 . A A . 3 TRP HZ2 1 1 20 6384 1 1 3 TRP HZ3 H -5.992 8.158 1.771 1.00 . A A . 3 TRP HZ3 1 1 20 6385 1 1 3 TRP N N -0.907 6.131 -2.729 1.00 . A A . 3 TRP N 1 1 20 6386 1 1 3 TRP NE1 N -3.588 9.577 -2.584 1.00 . A A . 3 TRP NE1 1 1 20 6387 1 1 3 TRP O O -2.465 4.669 0.144 1.00 . A A . 3 TRP O 1 1 20 6388 1 1 4 ARG C C -4.210 2.919 -1.489 1.00 . A A . 4 ARG C 1 1 20 6389 1 1 4 ARG CA C -4.500 4.389 -1.706 1.00 . A A . 4 ARG CA 1 1 20 6390 1 1 4 ARG CB C -5.440 4.567 -2.891 1.00 . A A . 4 ARG CB 1 1 20 6391 1 1 4 ARG CD C -7.343 5.513 -1.550 1.00 . A A . 4 ARG CD 1 1 20 6392 1 1 4 ARG CG C -6.409 5.728 -2.732 1.00 . A A . 4 ARG CG 1 1 20 6393 1 1 4 ARG CZ C -8.996 6.810 -0.250 1.00 . A A . 4 ARG CZ 1 1 20 6394 1 1 4 ARG H H -3.108 5.587 -2.757 1.00 . A A . 4 ARG H 1 1 20 6395 1 1 4 ARG HA H -4.970 4.768 -0.821 1.00 . A A . 4 ARG HA 1 1 20 6396 1 1 4 ARG HB2 H -4.848 4.741 -3.779 1.00 . A A . 4 ARG HB2 1 1 20 6397 1 1 4 ARG HB3 H -6.004 3.660 -3.020 1.00 . A A . 4 ARG HB3 1 1 20 6398 1 1 4 ARG HD2 H -7.948 4.639 -1.740 1.00 . A A . 4 ARG HD2 1 1 20 6399 1 1 4 ARG HD3 H -6.748 5.352 -0.663 1.00 . A A . 4 ARG HD3 1 1 20 6400 1 1 4 ARG HE H -8.238 7.354 -2.023 1.00 . A A . 4 ARG HE 1 1 20 6401 1 1 4 ARG HG2 H -5.846 6.635 -2.573 1.00 . A A . 4 ARG HG2 1 1 20 6402 1 1 4 ARG HG3 H -6.998 5.819 -3.633 1.00 . A A . 4 ARG HG3 1 1 20 6403 1 1 4 ARG HH11 H -8.426 5.067 0.615 1.00 . A A . 4 ARG HH11 1 1 20 6404 1 1 4 ARG HH12 H -9.579 5.993 1.515 1.00 . A A . 4 ARG HH12 1 1 20 6405 1 1 4 ARG HH21 H -9.767 8.591 -0.843 1.00 . A A . 4 ARG HH21 1 1 20 6406 1 1 4 ARG HH22 H -10.345 8.007 0.682 1.00 . A A . 4 ARG HH22 1 1 20 6407 1 1 4 ARG N N -3.270 5.141 -1.900 1.00 . A A . 4 ARG N 1 1 20 6408 1 1 4 ARG NE N -8.225 6.660 -1.328 1.00 . A A . 4 ARG NE 1 1 20 6409 1 1 4 ARG NH1 N -9.001 5.883 0.704 1.00 . A A . 4 ARG NH1 1 1 20 6410 1 1 4 ARG NH2 N -9.765 7.889 -0.127 1.00 . A A . 4 ARG NH2 1 1 20 6411 1 1 4 ARG O O -5.007 2.198 -0.894 1.00 . A A . 4 ARG O 1 1 20 6412 1 1 5 CYS C C -2.503 0.771 -0.343 1.00 . A A . 5 CYS C 1 1 20 6413 1 1 5 CYS CA C -2.629 1.115 -1.816 1.00 . A A . 5 CYS CA 1 1 20 6414 1 1 5 CYS CB C -1.283 0.900 -2.496 1.00 . A A . 5 CYS CB 1 1 20 6415 1 1 5 CYS H H -2.495 3.129 -2.452 1.00 . A A . 5 CYS H 1 1 20 6416 1 1 5 CYS HA H -3.367 0.472 -2.270 1.00 . A A . 5 CYS HA 1 1 20 6417 1 1 5 CYS HB2 H -0.722 1.822 -2.453 1.00 . A A . 5 CYS HB2 1 1 20 6418 1 1 5 CYS HB3 H -0.741 0.131 -1.965 1.00 . A A . 5 CYS HB3 1 1 20 6419 1 1 5 CYS N N -3.065 2.493 -1.972 1.00 . A A . 5 CYS N 1 1 20 6420 1 1 5 CYS O O -2.770 -0.353 0.069 1.00 . A A . 5 CYS O 1 1 20 6421 1 1 5 CYS SG S -1.401 0.393 -4.241 1.00 . A A . 5 CYS SG 1 1 20 6422 1 1 6 CYS C C -3.312 1.368 2.567 1.00 . A A . 6 CYS C 1 1 20 6423 1 1 6 CYS CA C -1.962 1.562 1.885 1.00 . A A . 6 CYS CA 1 1 20 6424 1 1 6 CYS CB C -1.210 2.742 2.497 1.00 . A A . 6 CYS CB 1 1 20 6425 1 1 6 CYS H H -1.989 2.663 0.068 1.00 . A A . 6 CYS H 1 1 20 6426 1 1 6 CYS HA H -1.377 0.660 2.024 1.00 . A A . 6 CYS HA 1 1 20 6427 1 1 6 CYS HB2 H -1.896 3.560 2.655 1.00 . A A . 6 CYS HB2 1 1 20 6428 1 1 6 CYS HB3 H -0.791 2.436 3.445 1.00 . A A . 6 CYS HB3 1 1 20 6429 1 1 6 CYS N N -2.135 1.763 0.453 1.00 . A A . 6 CYS N 1 1 20 6430 1 1 6 CYS O O -3.389 0.912 3.706 1.00 . A A . 6 CYS O 1 1 20 6431 1 1 6 CYS SG S 0.159 3.349 1.457 1.00 . A A . 6 CYS SG 1 1 20 6432 1 1 7 LEU C C -6.300 0.222 1.892 1.00 . A A . 7 LEU C 1 1 20 6433 1 1 7 LEU CA C -5.726 1.545 2.377 1.00 . A A . 7 LEU CA 1 1 20 6434 1 1 7 LEU CB C -6.631 2.706 1.944 1.00 . A A . 7 LEU CB 1 1 20 6435 1 1 7 LEU CD1 C -6.377 3.764 4.211 1.00 . A A . 7 LEU CD1 1 1 20 6436 1 1 7 LEU CD2 C -5.202 4.759 2.236 1.00 . A A . 7 LEU CD2 1 1 20 6437 1 1 7 LEU CG C -6.445 4.021 2.714 1.00 . A A . 7 LEU CG 1 1 20 6438 1 1 7 LEU H H -4.254 2.076 0.956 1.00 . A A . 7 LEU H 1 1 20 6439 1 1 7 LEU HA H -5.664 1.521 3.451 1.00 . A A . 7 LEU HA 1 1 20 6440 1 1 7 LEU HB2 H -6.449 2.901 0.897 1.00 . A A . 7 LEU HB2 1 1 20 6441 1 1 7 LEU HB3 H -7.658 2.393 2.058 1.00 . A A . 7 LEU HB3 1 1 20 6442 1 1 7 LEU HD11 H -7.294 3.299 4.540 1.00 . A A . 7 LEU HD11 1 1 20 6443 1 1 7 LEU HD12 H -6.244 4.702 4.731 1.00 . A A . 7 LEU HD12 1 1 20 6444 1 1 7 LEU HD13 H -5.544 3.112 4.428 1.00 . A A . 7 LEU HD13 1 1 20 6445 1 1 7 LEU HD21 H -5.090 5.674 2.798 1.00 . A A . 7 LEU HD21 1 1 20 6446 1 1 7 LEU HD22 H -5.303 4.991 1.187 1.00 . A A . 7 LEU HD22 1 1 20 6447 1 1 7 LEU HD23 H -4.334 4.134 2.385 1.00 . A A . 7 LEU HD23 1 1 20 6448 1 1 7 LEU HG H -7.300 4.656 2.528 1.00 . A A . 7 LEU HG 1 1 20 6449 1 1 7 LEU N N -4.377 1.707 1.857 1.00 . A A . 7 LEU N 1 1 20 6450 1 1 7 LEU O O -7.360 -0.216 2.335 1.00 . A A . 7 LEU O 1 1 20 6451 1 1 8 ILE C C -5.004 -2.777 0.866 1.00 . A A . 8 ILE C 1 1 20 6452 1 1 8 ILE CA C -5.972 -1.688 0.423 1.00 . A A . 8 ILE CA 1 1 20 6453 1 1 8 ILE CB C -6.006 -1.637 -1.121 1.00 . A A . 8 ILE CB 1 1 20 6454 1 1 8 ILE CD1 C -6.735 -0.174 -3.077 1.00 . A A . 8 ILE CD1 1 1 20 6455 1 1 8 ILE CG1 C -6.873 -0.469 -1.599 1.00 . A A . 8 ILE CG1 1 1 20 6456 1 1 8 ILE CG2 C -6.527 -2.953 -1.686 1.00 . A A . 8 ILE CG2 1 1 20 6457 1 1 8 ILE H H -4.714 -0.017 0.713 1.00 . A A . 8 ILE H 1 1 20 6458 1 1 8 ILE HA H -6.964 -1.923 0.784 1.00 . A A . 8 ILE HA 1 1 20 6459 1 1 8 ILE HB H -4.997 -1.497 -1.476 1.00 . A A . 8 ILE HB 1 1 20 6460 1 1 8 ILE HD11 H -5.708 0.075 -3.300 1.00 . A A . 8 ILE HD11 1 1 20 6461 1 1 8 ILE HD12 H -7.372 0.658 -3.339 1.00 . A A . 8 ILE HD12 1 1 20 6462 1 1 8 ILE HD13 H -7.026 -1.045 -3.647 1.00 . A A . 8 ILE HD13 1 1 20 6463 1 1 8 ILE HG12 H -7.911 -0.696 -1.403 1.00 . A A . 8 ILE HG12 1 1 20 6464 1 1 8 ILE HG13 H -6.595 0.422 -1.053 1.00 . A A . 8 ILE HG13 1 1 20 6465 1 1 8 ILE HG21 H -5.880 -3.760 -1.375 1.00 . A A . 8 ILE HG21 1 1 20 6466 1 1 8 ILE HG22 H -6.545 -2.900 -2.765 1.00 . A A . 8 ILE HG22 1 1 20 6467 1 1 8 ILE HG23 H -7.528 -3.131 -1.319 1.00 . A A . 8 ILE HG23 1 1 20 6468 1 1 8 ILE N N -5.568 -0.413 0.992 1.00 . A A . 8 ILE N 1 1 20 6469 1 1 8 ILE O O -3.862 -2.820 0.412 1.00 . A A . 8 ILE O 1 1 20 6470 1 1 9 PRO C C -3.875 -5.546 1.215 1.00 . A A . 9 PRO C 1 1 20 6471 1 1 9 PRO CA C -4.634 -4.769 2.293 1.00 . A A . 9 PRO CA 1 1 20 6472 1 1 9 PRO CB C -5.661 -5.672 2.975 1.00 . A A . 9 PRO CB 1 1 20 6473 1 1 9 PRO CD C -6.821 -3.688 2.320 1.00 . A A . 9 PRO CD 1 1 20 6474 1 1 9 PRO CG C -6.756 -4.750 3.383 1.00 . A A . 9 PRO CG 1 1 20 6475 1 1 9 PRO HA H -3.932 -4.407 3.028 1.00 . A A . 9 PRO HA 1 1 20 6476 1 1 9 PRO HB2 H -6.010 -6.418 2.276 1.00 . A A . 9 PRO HB2 1 1 20 6477 1 1 9 PRO HB3 H -5.210 -6.153 3.831 1.00 . A A . 9 PRO HB3 1 1 20 6478 1 1 9 PRO HD2 H -7.547 -3.954 1.565 1.00 . A A . 9 PRO HD2 1 1 20 6479 1 1 9 PRO HD3 H -7.066 -2.731 2.758 1.00 . A A . 9 PRO HD3 1 1 20 6480 1 1 9 PRO HG2 H -7.690 -5.289 3.433 1.00 . A A . 9 PRO HG2 1 1 20 6481 1 1 9 PRO HG3 H -6.525 -4.307 4.341 1.00 . A A . 9 PRO HG3 1 1 20 6482 1 1 9 PRO N N -5.457 -3.674 1.757 1.00 . A A . 9 PRO N 1 1 20 6483 1 1 9 PRO O O -2.768 -6.023 1.454 1.00 . A A . 9 PRO O 1 1 20 6484 1 1 10 ALA C C -2.632 -5.631 -1.626 1.00 . A A . 10 ALA C 1 1 20 6485 1 1 10 ALA CA C -3.850 -6.372 -1.076 1.00 . A A . 10 ALA CA 1 1 20 6486 1 1 10 ALA CB C -4.869 -6.606 -2.181 1.00 . A A . 10 ALA CB 1 1 20 6487 1 1 10 ALA H H -5.342 -5.233 -0.100 1.00 . A A . 10 ALA H 1 1 20 6488 1 1 10 ALA HA H -3.532 -7.336 -0.706 1.00 . A A . 10 ALA HA 1 1 20 6489 1 1 10 ALA HB1 H -4.420 -7.198 -2.965 1.00 . A A . 10 ALA HB1 1 1 20 6490 1 1 10 ALA HB2 H -5.187 -5.656 -2.583 1.00 . A A . 10 ALA HB2 1 1 20 6491 1 1 10 ALA HB3 H -5.723 -7.131 -1.778 1.00 . A A . 10 ALA HB3 1 1 20 6492 1 1 10 ALA N N -4.467 -5.651 0.032 1.00 . A A . 10 ALA N 1 1 20 6493 1 1 10 ALA O O -1.634 -6.250 -1.989 1.00 . A A . 10 ALA O 1 1 20 6494 1 1 11 CYS C C -0.613 -3.157 -1.083 1.00 . A A . 11 CYS C 1 1 20 6495 1 1 11 CYS CA C -1.596 -3.514 -2.194 1.00 . A A . 11 CYS CA 1 1 20 6496 1 1 11 CYS CB C -2.116 -2.246 -2.880 1.00 . A A . 11 CYS CB 1 1 20 6497 1 1 11 CYS H H -3.496 -3.852 -1.314 1.00 . A A . 11 CYS H 1 1 20 6498 1 1 11 CYS HA H -1.080 -4.119 -2.926 1.00 . A A . 11 CYS HA 1 1 20 6499 1 1 11 CYS HB2 H -3.073 -2.458 -3.334 1.00 . A A . 11 CYS HB2 1 1 20 6500 1 1 11 CYS HB3 H -2.240 -1.469 -2.140 1.00 . A A . 11 CYS HB3 1 1 20 6501 1 1 11 CYS N N -2.700 -4.307 -1.665 1.00 . A A . 11 CYS N 1 1 20 6502 1 1 11 CYS O O 0.598 -3.097 -1.304 1.00 . A A . 11 CYS O 1 1 20 6503 1 1 11 CYS SG S -1.014 -1.601 -4.187 1.00 . A A . 11 CYS SG 1 1 20 6504 1 1 12 ARG C C 0.570 -3.778 1.644 1.00 . A A . 12 ARG C 1 1 20 6505 1 1 12 ARG CA C -0.313 -2.599 1.271 1.00 . A A . 12 ARG CA 1 1 20 6506 1 1 12 ARG CB C -1.194 -2.223 2.460 1.00 . A A . 12 ARG CB 1 1 20 6507 1 1 12 ARG CD C -1.111 -1.811 4.942 1.00 . A A . 12 ARG CD 1 1 20 6508 1 1 12 ARG CG C -0.436 -1.559 3.601 1.00 . A A . 12 ARG CG 1 1 20 6509 1 1 12 ARG CZ C -3.443 -1.688 5.759 1.00 . A A . 12 ARG CZ 1 1 20 6510 1 1 12 ARG H H -2.116 -2.988 0.227 1.00 . A A . 12 ARG H 1 1 20 6511 1 1 12 ARG HA H 0.310 -1.758 1.008 1.00 . A A . 12 ARG HA 1 1 20 6512 1 1 12 ARG HB2 H -1.959 -1.550 2.119 1.00 . A A . 12 ARG HB2 1 1 20 6513 1 1 12 ARG HB3 H -1.661 -3.114 2.841 1.00 . A A . 12 ARG HB3 1 1 20 6514 1 1 12 ARG HD2 H -1.185 -2.876 5.098 1.00 . A A . 12 ARG HD2 1 1 20 6515 1 1 12 ARG HD3 H -0.505 -1.374 5.722 1.00 . A A . 12 ARG HD3 1 1 20 6516 1 1 12 ARG HE H -2.622 -0.437 4.430 1.00 . A A . 12 ARG HE 1 1 20 6517 1 1 12 ARG HG2 H 0.567 -1.958 3.634 1.00 . A A . 12 ARG HG2 1 1 20 6518 1 1 12 ARG HG3 H -0.396 -0.495 3.422 1.00 . A A . 12 ARG HG3 1 1 20 6519 1 1 12 ARG HH11 H -2.354 -3.190 6.575 1.00 . A A . 12 ARG HH11 1 1 20 6520 1 1 12 ARG HH12 H -3.995 -3.086 7.123 1.00 . A A . 12 ARG HH12 1 1 20 6521 1 1 12 ARG HH21 H -4.769 -0.286 5.138 1.00 . A A . 12 ARG HH21 1 1 20 6522 1 1 12 ARG HH22 H -5.381 -1.420 6.299 1.00 . A A . 12 ARG HH22 1 1 20 6523 1 1 12 ARG N N -1.139 -2.935 0.116 1.00 . A A . 12 ARG N 1 1 20 6524 1 1 12 ARG NE N -2.451 -1.228 4.999 1.00 . A A . 12 ARG NE 1 1 20 6525 1 1 12 ARG NH1 N -3.250 -2.740 6.549 1.00 . A A . 12 ARG NH1 1 1 20 6526 1 1 12 ARG NH2 N -4.627 -1.085 5.731 1.00 . A A . 12 ARG NH2 1 1 20 6527 1 1 12 ARG O O 1.629 -3.616 2.236 1.00 . A A . 12 ARG O 1 1 20 6528 1 1 13 ARG C C 2.208 -6.177 0.887 1.00 . A A . 13 ARG C 1 1 20 6529 1 1 13 ARG CA C 0.842 -6.198 1.568 1.00 . A A . 13 ARG CA 1 1 20 6530 1 1 13 ARG CB C 0.034 -7.406 1.081 1.00 . A A . 13 ARG CB 1 1 20 6531 1 1 13 ARG CD C 0.281 -9.008 3.003 1.00 . A A . 13 ARG CD 1 1 20 6532 1 1 13 ARG CG C 0.583 -8.749 1.537 1.00 . A A . 13 ARG CG 1 1 20 6533 1 1 13 ARG CZ C 0.304 -10.905 4.590 1.00 . A A . 13 ARG CZ 1 1 20 6534 1 1 13 ARG H H -0.768 -5.018 0.854 1.00 . A A . 13 ARG H 1 1 20 6535 1 1 13 ARG HA H 0.985 -6.271 2.632 1.00 . A A . 13 ARG HA 1 1 20 6536 1 1 13 ARG HB2 H -0.978 -7.315 1.449 1.00 . A A . 13 ARG HB2 1 1 20 6537 1 1 13 ARG HB3 H 0.015 -7.398 0.001 1.00 . A A . 13 ARG HB3 1 1 20 6538 1 1 13 ARG HD2 H 0.883 -8.344 3.605 1.00 . A A . 13 ARG HD2 1 1 20 6539 1 1 13 ARG HD3 H -0.765 -8.805 3.183 1.00 . A A . 13 ARG HD3 1 1 20 6540 1 1 13 ARG HE H 0.976 -10.968 2.703 1.00 . A A . 13 ARG HE 1 1 20 6541 1 1 13 ARG HG2 H 0.132 -9.530 0.944 1.00 . A A . 13 ARG HG2 1 1 20 6542 1 1 13 ARG HG3 H 1.653 -8.755 1.392 1.00 . A A . 13 ARG HG3 1 1 20 6543 1 1 13 ARG HH11 H -0.470 -9.188 5.340 1.00 . A A . 13 ARG HH11 1 1 20 6544 1 1 13 ARG HH12 H -0.452 -10.529 6.437 1.00 . A A . 13 ARG HH12 1 1 20 6545 1 1 13 ARG HH21 H 1.005 -12.756 4.144 1.00 . A A . 13 ARG HH21 1 1 20 6546 1 1 13 ARG HH22 H 0.392 -12.566 5.752 1.00 . A A . 13 ARG HH22 1 1 20 6547 1 1 13 ARG N N 0.107 -4.967 1.295 1.00 . A A . 13 ARG N 1 1 20 6548 1 1 13 ARG NE N 0.569 -10.392 3.387 1.00 . A A . 13 ARG NE 1 1 20 6549 1 1 13 ARG NH1 N -0.250 -10.146 5.532 1.00 . A A . 13 ARG NH1 1 1 20 6550 1 1 13 ARG NH2 N 0.590 -12.177 4.850 1.00 . A A . 13 ARG NH2 1 1 20 6551 1 1 13 ARG O O 3.210 -6.607 1.462 1.00 . A A . 13 ARG O 1 1 20 6552 1 1 14 ASN C C 4.175 -4.252 -0.855 1.00 . A A . 14 ASN C 1 1 20 6553 1 1 14 ASN CA C 3.468 -5.581 -1.110 1.00 . A A . 14 ASN CA 1 1 20 6554 1 1 14 ASN CB C 3.151 -5.742 -2.605 1.00 . A A . 14 ASN CB 1 1 20 6555 1 1 14 ASN CG C 4.268 -5.256 -3.515 1.00 . A A . 14 ASN CG 1 1 20 6556 1 1 14 ASN H H 1.402 -5.338 -0.731 1.00 . A A . 14 ASN H 1 1 20 6557 1 1 14 ASN HA H 4.114 -6.387 -0.797 1.00 . A A . 14 ASN HA 1 1 20 6558 1 1 14 ASN HB2 H 2.976 -6.787 -2.816 1.00 . A A . 14 ASN HB2 1 1 20 6559 1 1 14 ASN HB3 H 2.256 -5.183 -2.835 1.00 . A A . 14 ASN HB3 1 1 20 6560 1 1 14 ASN HD21 H 5.128 -7.046 -3.471 1.00 . A A . 14 ASN HD21 1 1 20 6561 1 1 14 ASN HD22 H 5.934 -5.847 -4.417 1.00 . A A . 14 ASN HD22 1 1 20 6562 1 1 14 ASN N N 2.235 -5.667 -0.335 1.00 . A A . 14 ASN N 1 1 20 6563 1 1 14 ASN ND2 N 5.203 -6.138 -3.833 1.00 . A A . 14 ASN ND2 1 1 20 6564 1 1 14 ASN O O 5.397 -4.151 -0.956 1.00 . A A . 14 ASN O 1 1 20 6565 1 1 14 ASN OD1 O 4.281 -4.098 -3.937 1.00 . A A . 14 ASN OD1 1 1 20 6566 1 1 15 HIS C C 4.022 -1.606 1.253 1.00 . A A . 15 HIS C 1 1 20 6567 1 1 15 HIS CA C 3.961 -1.917 -0.236 1.00 . A A . 15 HIS CA 1 1 20 6568 1 1 15 HIS CB C 3.140 -0.851 -0.967 1.00 . A A . 15 HIS CB 1 1 20 6569 1 1 15 HIS CD2 C 2.299 -1.386 -3.362 1.00 . A A . 15 HIS CD2 1 1 20 6570 1 1 15 HIS CE1 C 4.108 -0.844 -4.470 1.00 . A A . 15 HIS CE1 1 1 20 6571 1 1 15 HIS CG C 3.214 -0.963 -2.460 1.00 . A A . 15 HIS CG 1 1 20 6572 1 1 15 HIS H H 2.444 -3.400 -0.335 1.00 . A A . 15 HIS H 1 1 20 6573 1 1 15 HIS HA H 4.966 -1.909 -0.629 1.00 . A A . 15 HIS HA 1 1 20 6574 1 1 15 HIS HB2 H 2.104 -0.943 -0.679 1.00 . A A . 15 HIS HB2 1 1 20 6575 1 1 15 HIS HB3 H 3.501 0.128 -0.687 1.00 . A A . 15 HIS HB3 1 1 20 6576 1 1 15 HIS HD1 H 5.180 -0.292 -2.818 1.00 . A A . 15 HIS HD1 1 1 20 6577 1 1 15 HIS HD2 H 1.297 -1.728 -3.144 1.00 . A A . 15 HIS HD2 1 1 20 6578 1 1 15 HIS HE1 H 4.809 -0.674 -5.273 1.00 . A A . 15 HIS HE1 1 1 20 6579 1 1 15 HIS HE2 H 2.527 -1.728 -5.417 1.00 . A A . 15 HIS HE2 1 1 20 6580 1 1 15 HIS N N 3.405 -3.244 -0.477 1.00 . A A . 15 HIS N 1 1 20 6581 1 1 15 HIS ND1 N 4.338 -0.629 -3.187 1.00 . A A . 15 HIS ND1 1 1 20 6582 1 1 15 HIS NE2 N 2.878 -1.304 -4.604 1.00 . A A . 15 HIS NE2 1 1 20 6583 1 1 15 HIS O O 3.897 -0.453 1.664 1.00 . A A . 15 HIS O 1 1 20 6584 1 1 16 LYS C C 5.556 -1.698 3.909 1.00 . A A . 16 LYS C 1 1 20 6585 1 1 16 LYS CA C 4.326 -2.500 3.502 1.00 . A A . 16 LYS CA 1 1 20 6586 1 1 16 LYS CB C 4.364 -3.881 4.161 1.00 . A A . 16 LYS CB 1 1 20 6587 1 1 16 LYS CD C 5.496 -6.121 4.334 1.00 . A A . 16 LYS CD 1 1 20 6588 1 1 16 LYS CE C 6.559 -7.035 3.750 1.00 . A A . 16 LYS CE 1 1 20 6589 1 1 16 LYS CG C 5.445 -4.792 3.601 1.00 . A A . 16 LYS CG 1 1 20 6590 1 1 16 LYS H H 4.338 -3.531 1.653 1.00 . A A . 16 LYS H 1 1 20 6591 1 1 16 LYS HA H 3.441 -1.976 3.835 1.00 . A A . 16 LYS HA 1 1 20 6592 1 1 16 LYS HB2 H 4.541 -3.757 5.219 1.00 . A A . 16 LYS HB2 1 1 20 6593 1 1 16 LYS HB3 H 3.408 -4.363 4.019 1.00 . A A . 16 LYS HB3 1 1 20 6594 1 1 16 LYS HD2 H 5.723 -5.939 5.374 1.00 . A A . 16 LYS HD2 1 1 20 6595 1 1 16 LYS HD3 H 4.533 -6.603 4.252 1.00 . A A . 16 LYS HD3 1 1 20 6596 1 1 16 LYS HE2 H 6.289 -7.278 2.733 1.00 . A A . 16 LYS HE2 1 1 20 6597 1 1 16 LYS HE3 H 7.506 -6.515 3.755 1.00 . A A . 16 LYS HE3 1 1 20 6598 1 1 16 LYS HG2 H 5.241 -4.976 2.557 1.00 . A A . 16 LYS HG2 1 1 20 6599 1 1 16 LYS HG3 H 6.402 -4.299 3.699 1.00 . A A . 16 LYS HG3 1 1 20 6600 1 1 16 LYS HZ1 H 5.801 -8.822 4.515 1.00 . A A . 16 LYS HZ1 1 1 20 6601 1 1 16 LYS HZ2 H 6.949 -8.083 5.514 1.00 . A A . 16 LYS HZ2 1 1 20 6602 1 1 16 LYS HZ3 H 7.442 -8.893 4.113 1.00 . A A . 16 LYS HZ3 1 1 20 6603 1 1 16 LYS N N 4.243 -2.640 2.050 1.00 . A A . 16 LYS N 1 1 20 6604 1 1 16 LYS NZ N 6.697 -8.297 4.528 1.00 . A A . 16 LYS NZ 1 1 20 6605 1 1 16 LYS O O 5.626 -1.165 5.011 1.00 . A A . 16 LYS O 1 1 20 6606 1 1 17 LYS C C 7.565 0.601 3.035 1.00 . A A . 17 LYS C 1 1 20 6607 1 1 17 LYS CA C 7.755 -0.888 3.273 1.00 . A A . 17 LYS CA 1 1 20 6608 1 1 17 LYS CB C 8.882 -1.406 2.388 1.00 . A A . 17 LYS CB 1 1 20 6609 1 1 17 LYS CD C 11.019 -2.727 2.249 1.00 . A A . 17 LYS CD 1 1 20 6610 1 1 17 LYS CE C 11.939 -1.517 2.191 1.00 . A A . 17 LYS CE 1 1 20 6611 1 1 17 LYS CG C 9.769 -2.438 3.067 1.00 . A A . 17 LYS CG 1 1 20 6612 1 1 17 LYS H H 6.409 -2.067 2.147 1.00 . A A . 17 LYS H 1 1 20 6613 1 1 17 LYS HA H 8.014 -1.043 4.306 1.00 . A A . 17 LYS HA 1 1 20 6614 1 1 17 LYS HB2 H 8.451 -1.857 1.506 1.00 . A A . 17 LYS HB2 1 1 20 6615 1 1 17 LYS HB3 H 9.497 -0.572 2.089 1.00 . A A . 17 LYS HB3 1 1 20 6616 1 1 17 LYS HD2 H 11.551 -3.550 2.702 1.00 . A A . 17 LYS HD2 1 1 20 6617 1 1 17 LYS HD3 H 10.726 -2.994 1.243 1.00 . A A . 17 LYS HD3 1 1 20 6618 1 1 17 LYS HE2 H 11.399 -0.691 1.754 1.00 . A A . 17 LYS HE2 1 1 20 6619 1 1 17 LYS HE3 H 12.237 -1.259 3.198 1.00 . A A . 17 LYS HE3 1 1 20 6620 1 1 17 LYS HG2 H 10.064 -2.064 4.035 1.00 . A A . 17 LYS HG2 1 1 20 6621 1 1 17 LYS HG3 H 9.209 -3.355 3.188 1.00 . A A . 17 LYS HG3 1 1 20 6622 1 1 17 LYS HZ1 H 13.757 -0.932 1.345 1.00 . A A . 17 LYS HZ1 1 1 20 6623 1 1 17 LYS HZ2 H 12.889 -2.043 0.407 1.00 . A A . 17 LYS HZ2 1 1 20 6624 1 1 17 LYS HZ3 H 13.705 -2.561 1.796 1.00 . A A . 17 LYS HZ3 1 1 20 6625 1 1 17 LYS N N 6.526 -1.621 3.008 1.00 . A A . 17 LYS N 1 1 20 6626 1 1 17 LYS NZ N 13.158 -1.782 1.378 1.00 . A A . 17 LYS NZ 1 1 20 6627 1 1 17 LYS O O 8.290 1.425 3.587 1.00 . A A . 17 LYS O 1 1 20 6628 1 1 18 PHE C C 5.269 2.861 2.843 1.00 . A A . 18 PHE C 1 1 20 6629 1 1 18 PHE CA C 6.317 2.320 1.881 1.00 . A A . 18 PHE CA 1 1 20 6630 1 1 18 PHE CB C 5.826 2.451 0.437 1.00 . A A . 18 PHE CB 1 1 20 6631 1 1 18 PHE CD1 C 5.592 4.936 0.138 1.00 . A A . 18 PHE CD1 1 1 20 6632 1 1 18 PHE CD2 C 7.195 3.778 -1.194 1.00 . A A . 18 PHE CD2 1 1 20 6633 1 1 18 PHE CE1 C 5.947 6.127 -0.465 1.00 . A A . 18 PHE CE1 1 1 20 6634 1 1 18 PHE CE2 C 7.553 4.966 -1.801 1.00 . A A . 18 PHE CE2 1 1 20 6635 1 1 18 PHE CG C 6.212 3.748 -0.218 1.00 . A A . 18 PHE CG 1 1 20 6636 1 1 18 PHE CZ C 6.929 6.142 -1.435 1.00 . A A . 18 PHE CZ 1 1 20 6637 1 1 18 PHE H H 6.075 0.226 1.779 1.00 . A A . 18 PHE H 1 1 20 6638 1 1 18 PHE HA H 7.229 2.886 1.998 1.00 . A A . 18 PHE HA 1 1 20 6639 1 1 18 PHE HB2 H 6.242 1.646 -0.151 1.00 . A A . 18 PHE HB2 1 1 20 6640 1 1 18 PHE HB3 H 4.748 2.378 0.424 1.00 . A A . 18 PHE HB3 1 1 20 6641 1 1 18 PHE HD1 H 4.824 4.924 0.899 1.00 . A A . 18 PHE HD1 1 1 20 6642 1 1 18 PHE HD2 H 7.684 2.858 -1.481 1.00 . A A . 18 PHE HD2 1 1 20 6643 1 1 18 PHE HE1 H 5.457 7.045 -0.177 1.00 . A A . 18 PHE HE1 1 1 20 6644 1 1 18 PHE HE2 H 8.322 4.975 -2.559 1.00 . A A . 18 PHE HE2 1 1 20 6645 1 1 18 PHE HZ H 7.208 7.073 -1.909 1.00 . A A . 18 PHE HZ 1 1 20 6646 1 1 18 PHE N N 6.606 0.932 2.193 1.00 . A A . 18 PHE N 1 1 20 6647 1 1 18 PHE O O 5.390 3.973 3.354 1.00 . A A . 18 PHE O 1 1 20 6648 1 1 19 CYS C C 3.469 2.008 5.419 1.00 . A A . 19 CYS C 1 1 20 6649 1 1 19 CYS CA C 3.175 2.462 3.993 1.00 . A A . 19 CYS CA 1 1 20 6650 1 1 19 CYS CB C 1.834 1.895 3.516 1.00 . A A . 19 CYS CB 1 1 20 6651 1 1 19 CYS H H 4.218 1.171 2.682 1.00 . A A . 19 CYS H 1 1 20 6652 1 1 19 CYS HA H 3.121 3.540 3.980 1.00 . A A . 19 CYS HA 1 1 20 6653 1 1 19 CYS HB2 H 1.749 0.867 3.828 1.00 . A A . 19 CYS HB2 1 1 20 6654 1 1 19 CYS HB3 H 1.034 2.466 3.964 1.00 . A A . 19 CYS HB3 1 1 20 6655 1 1 19 CYS N N 4.245 2.061 3.095 1.00 . A A . 19 CYS N 1 1 20 6656 1 1 19 CYS O O 2.738 1.196 5.989 1.00 . A A . 19 CYS O 1 1 20 6657 1 1 19 CYS SG S 1.606 1.949 1.708 1.00 . A A . 19 CYS SG 1 1 20 6658 1 1 20 NH2 HN1 H 5.080 3.169 5.477 1.00 . A A . 20 NH2 HN1 1 1 20 6659 1 1 20 NH2 HN2 H 4.762 2.249 6.906 1.00 . A A . 20 NH2 HN2 1 1 20 6660 1 1 20 NH2 N N 4.544 2.527 5.993 1.00 . A A . 20 NH2 N 1 1 stop_ save_
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