NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
587121 | 2mxh | 25409 | cing | 4-filtered-FRED | STAR | entry | full | 115 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2mxh # This FRED archive file contains, for PDB entry <2mxh>: # # - 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_2mxh _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2mxh _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all free" _Assembly.Molecular_mass 1747.14 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 $antimicrobial_peptide A . 1 1 stop_ save_ save_antimicrobial_peptide _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "antimicrobial peptide" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code VARGWKRKCPLFGKGG _Entity.Number_of_monomers 16 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 VAL . 1 1 2 ALA . 1 1 3 ARG . 1 1 4 GLY . 1 1 5 TRP . 1 1 6 LYS . 1 1 7 ARG . 1 1 8 LYS . 1 1 9 CYS . 1 1 10 PRO . 1 1 11 LEU . 1 1 12 PHE . 1 1 13 GLY . 1 1 14 LYS . 1 1 15 GLY . 1 1 16 GLY . 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 VAL 1 1 1 1 ALA 2 2 1 1 ARG 3 3 1 1 GLY 4 4 1 1 TRP 5 5 1 1 LYS 6 6 1 1 ARG 7 7 1 1 LYS 8 8 1 1 CYS 9 9 1 1 PRO 10 10 1 1 LEU 11 11 1 1 PHE 12 12 1 1 GLY 13 13 1 1 LYS 14 14 1 1 GLY 15 15 1 1 GLY 16 16 1 1 stop_ save_ save_DYANA/DIANA_distance_constraints_3_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 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 1 VAL HA . 1 VAL HA 1 1 1 1 2 1 1 2 ALA H . 2 ALA H 1 1 2 1 1 1 1 1 VAL QG . 1 VAL QQG 1 1 2 1 2 1 1 2 ALA H . 2 ALA H 1 1 3 1 1 1 1 2 ALA H . 2 ALA H 1 1 3 1 2 1 1 2 ALA MB . 2 ALA QB 1 1 4 1 1 1 1 2 ALA H . 2 ALA H 1 1 4 1 2 1 1 3 ARG H . 3 ARG H 1 1 5 1 1 1 1 2 ALA HA . 2 ALA HA 1 1 5 1 2 1 1 3 ARG H . 3 ARG H 1 1 6 1 1 1 1 2 ALA MB . 2 ALA QB 1 1 6 1 2 1 1 3 ARG H . 3 ARG H 1 1 7 1 1 1 1 2 ALA MB . 2 ALA QB 1 1 7 1 2 1 1 4 GLY H . 4 GLY H 1 1 8 1 1 1 1 2 ALA MB . 2 ALA QB 1 1 8 1 2 1 1 5 TRP H . 5 TRP H 1 1 9 1 1 1 1 2 ALA MB . 2 ALA QB 1 1 9 1 2 1 1 5 TRP HD1 . 5 TRP HD1 1 1 10 1 1 1 1 2 ALA MB . 2 ALA QB 1 1 10 1 2 1 1 13 GLY H . 13 GLY H 1 1 11 1 1 1 1 3 ARG H . 3 ARG H 1 1 11 1 2 1 1 3 ARG QB . 3 ARG QB 1 1 12 1 1 1 1 3 ARG H . 3 ARG H 1 1 12 1 2 1 1 3 ARG QD . 3 ARG QD 1 1 13 1 1 1 1 3 ARG H . 3 ARG H 1 1 13 1 2 1 1 3 ARG QG . 3 ARG QG 1 1 14 1 1 1 1 3 ARG H . 3 ARG H 1 1 14 1 2 1 1 4 GLY H . 4 GLY H 1 1 15 1 1 1 1 3 ARG HA . 3 ARG HA 1 1 15 1 2 1 1 4 GLY H . 4 GLY H 1 1 16 1 1 1 1 3 ARG HA . 3 ARG HA 1 1 16 1 2 1 1 5 TRP H . 5 TRP H 1 1 17 1 1 1 1 3 ARG QB . 3 ARG QB 1 1 17 1 2 1 1 4 GLY H . 4 GLY H 1 1 18 1 1 1 1 3 ARG QB . 3 ARG QB 1 1 18 1 2 1 1 5 TRP HD1 . 5 TRP HD1 1 1 19 1 1 1 1 3 ARG QD . 3 ARG QD 1 1 19 1 2 1 1 4 GLY H . 4 GLY H 1 1 20 1 1 1 1 3 ARG QG . 3 ARG QG 1 1 20 1 2 1 1 4 GLY H . 4 GLY H 1 1 21 1 1 1 1 3 ARG QG . 3 ARG QG 1 1 21 1 2 1 1 5 TRP HD1 . 5 TRP HD1 1 1 22 1 1 1 1 3 ARG QG . 3 ARG QG 1 1 22 1 2 1 1 7 ARG H . 7 ARG H 1 1 23 1 1 1 1 4 GLY H . 4 GLY H 1 1 23 1 2 1 1 5 TRP H . 5 TRP H 1 1 24 1 1 1 1 4 GLY QA . 4 GLY QA 1 1 24 1 2 1 1 5 TRP H . 5 TRP H 1 1 25 1 1 1 1 4 GLY QA . 4 GLY QA 1 1 25 1 2 1 1 16 GLY H . 16 GLY H 1 1 26 1 1 1 1 5 TRP H . 5 TRP H 1 1 26 1 2 1 1 5 TRP QB . 5 TRP QB 1 1 27 1 1 1 1 5 TRP H . 5 TRP H 1 1 27 1 2 1 1 6 LYS H . 6 LYS H 1 1 28 1 1 1 1 5 TRP HA . 5 TRP HA 1 1 28 1 2 1 1 6 LYS H . 6 LYS H 1 1 29 1 1 1 1 5 TRP HA . 5 TRP HA 1 1 29 1 2 1 1 9 CYS H . 9 CYS H 1 1 30 1 1 1 1 5 TRP QB . 5 TRP QB 1 1 30 1 2 1 1 5 TRP HE1 . 5 TRP HE1 1 1 31 1 1 1 1 5 TRP QB . 5 TRP QB 1 1 31 1 2 1 1 6 LYS H . 6 LYS H 1 1 32 1 1 1 1 5 TRP HD1 . 5 TRP HD1 1 1 32 1 2 1 1 12 PHE QB . 12 PHE QB 1 1 33 1 1 1 1 6 LYS H . 6 LYS H 1 1 33 1 2 1 1 6 LYS QB . 6 LYS QB 1 1 34 1 1 1 1 6 LYS H . 6 LYS H 1 1 34 1 2 1 1 6 LYS QD . 6 LYS QD 1 1 35 1 1 1 1 6 LYS H . 6 LYS H 1 1 35 1 2 1 1 6 LYS QG . 6 LYS QG 1 1 36 1 1 1 1 6 LYS H . 6 LYS H 1 1 36 1 2 1 1 7 ARG H . 7 ARG H 1 1 37 1 1 1 1 6 LYS HA . 6 LYS HA 1 1 37 1 2 1 1 7 ARG H . 7 ARG H 1 1 38 1 1 1 1 6 LYS QB . 6 LYS QB 1 1 38 1 2 1 1 7 ARG H . 7 ARG H 1 1 39 1 1 1 1 6 LYS QD . 6 LYS QD 1 1 39 1 2 1 1 7 ARG H . 7 ARG H 1 1 40 1 1 1 1 6 LYS QG . 6 LYS QG 1 1 40 1 2 1 1 7 ARG H . 7 ARG H 1 1 41 1 1 1 1 7 ARG H . 7 ARG H 1 1 41 1 2 1 1 7 ARG QB . 7 ARG QB 1 1 42 1 1 1 1 7 ARG H . 7 ARG H 1 1 42 1 2 1 1 7 ARG QD . 7 ARG QD 1 1 43 1 1 1 1 7 ARG H . 7 ARG H 1 1 43 1 2 1 1 7 ARG QG . 7 ARG QG 1 1 44 1 1 1 1 7 ARG H . 7 ARG H 1 1 44 1 2 1 1 8 LYS H . 8 LYS H 1 1 45 1 1 1 1 7 ARG HA . 7 ARG HA 1 1 45 1 2 1 1 8 LYS H . 8 LYS H 1 1 46 1 1 1 1 7 ARG QB . 7 ARG QB 1 1 46 1 2 1 1 8 LYS H . 8 LYS H 1 1 47 1 1 1 1 7 ARG QD . 7 ARG QD 1 1 47 1 2 1 1 8 LYS H . 8 LYS H 1 1 48 1 1 1 1 7 ARG QG . 7 ARG QG 1 1 48 1 2 1 1 8 LYS H . 8 LYS H 1 1 49 1 1 1 1 8 LYS H . 8 LYS H 1 1 49 1 2 1 1 8 LYS QB . 8 LYS QB 1 1 50 1 1 1 1 8 LYS H . 8 LYS H 1 1 50 1 2 1 1 8 LYS QD . 8 LYS QD 1 1 51 1 1 1 1 8 LYS H . 8 LYS H 1 1 51 1 2 1 1 8 LYS QG . 8 LYS QG 1 1 52 1 1 1 1 8 LYS H . 8 LYS H 1 1 52 1 2 1 1 9 CYS H . 9 CYS H 1 1 53 1 1 1 1 8 LYS HA . 8 LYS HA 1 1 53 1 2 1 1 9 CYS H . 9 CYS H 1 1 54 1 1 1 1 8 LYS QB . 8 LYS QB 1 1 54 1 2 1 1 9 CYS H . 9 CYS H 1 1 55 1 1 1 1 8 LYS QD . 8 LYS QD 1 1 55 1 2 1 1 9 CYS H . 9 CYS H 1 1 56 1 1 1 1 8 LYS QG . 8 LYS QG 1 1 56 1 2 1 1 9 CYS H . 9 CYS H 1 1 57 1 1 1 1 9 CYS H . 9 CYS H 1 1 57 1 2 1 1 9 CYS QB . 9 CYS QB 1 1 58 1 1 1 1 9 CYS QB . 9 CYS QB 1 1 58 1 2 1 1 11 LEU H . 11 LEU H 1 1 59 1 1 1 1 9 CYS QB . 9 CYS QB 1 1 59 1 2 1 1 12 PHE H . 12 PHE H 1 1 60 1 1 1 1 9 CYS QB . 9 CYS QB 1 1 60 1 2 1 1 12 PHE QD . 12 PHE QD 1 1 61 1 1 1 1 10 PRO HA . 10 PRO HA 1 1 61 1 2 1 1 12 PHE H . 12 PHE H 1 1 62 1 1 1 1 10 PRO QB . 10 PRO QB 1 1 62 1 2 1 1 11 LEU H . 11 LEU H 1 1 63 1 1 1 1 10 PRO QD . 10 PRO QD 1 1 63 1 2 1 1 12 PHE H . 12 PHE H 1 1 64 1 1 1 1 10 PRO QG . 10 PRO QG 1 1 64 1 2 1 1 11 LEU H . 11 LEU H 1 1 65 1 1 1 1 11 LEU H . 11 LEU H 1 1 65 1 2 1 1 11 LEU QB . 11 LEU QB 1 1 66 1 1 1 1 11 LEU H . 11 LEU H 1 1 66 1 2 1 1 11 LEU QD . 11 LEU QQD 1 1 67 1 1 1 1 11 LEU H . 11 LEU H 1 1 67 1 2 1 1 11 LEU HG . 11 LEU HG 1 1 68 1 1 1 1 11 LEU H . 11 LEU H 1 1 68 1 2 1 1 12 PHE H . 12 PHE H 1 1 69 1 1 1 1 11 LEU HA . 11 LEU HA 1 1 69 1 2 1 1 12 PHE H . 12 PHE H 1 1 70 1 1 1 1 11 LEU QB . 11 LEU QB 1 1 70 1 2 1 1 12 PHE H . 12 PHE H 1 1 71 1 1 1 1 11 LEU QD . 11 LEU QQD 1 1 71 1 2 1 1 12 PHE H . 12 PHE H 1 1 72 1 1 1 1 11 LEU HG . 11 LEU HG 1 1 72 1 2 1 1 12 PHE H . 12 PHE H 1 1 73 1 1 1 1 12 PHE H . 12 PHE H 1 1 73 1 2 1 1 12 PHE HB2 . 12 PHE HB2 1 1 74 1 1 1 1 12 PHE H . 12 PHE H 1 1 74 1 2 1 1 12 PHE HB3 . 12 PHE HB3 1 1 75 1 1 1 1 12 PHE H . 12 PHE H 1 1 75 1 2 1 1 13 GLY H . 13 GLY H 1 1 76 1 1 1 1 12 PHE HA . 12 PHE HA 1 1 76 1 2 1 1 13 GLY H . 13 GLY H 1 1 77 1 1 1 1 12 PHE QB . 12 PHE QB 1 1 77 1 2 1 1 13 GLY H . 13 GLY H 1 1 78 1 1 1 1 13 GLY H . 13 GLY H 1 1 78 1 2 1 1 14 LYS H . 14 LYS H 1 1 79 1 1 1 1 13 GLY QA . 13 GLY QA 1 1 79 1 2 1 1 14 LYS H . 14 LYS H 1 1 80 1 1 1 1 14 LYS H . 14 LYS H 1 1 80 1 2 1 1 14 LYS QB . 14 LYS QB 1 1 81 1 1 1 1 14 LYS H . 14 LYS H 1 1 81 1 2 1 1 14 LYS QD . 14 LYS QD 1 1 82 1 1 1 1 14 LYS H . 14 LYS H 1 1 82 1 2 1 1 14 LYS QG . 14 LYS QG 1 1 83 1 1 1 1 14 LYS H . 14 LYS H 1 1 83 1 2 1 1 15 GLY H . 15 GLY H 1 1 84 1 1 1 1 14 LYS HA . 14 LYS HA 1 1 84 1 2 1 1 15 GLY H . 15 GLY H 1 1 85 1 1 1 1 14 LYS QB . 14 LYS QB 1 1 85 1 2 1 1 15 GLY H . 15 GLY H 1 1 86 1 1 1 1 14 LYS QD . 14 LYS QD 1 1 86 1 2 1 1 15 GLY H . 15 GLY H 1 1 87 1 1 1 1 14 LYS QG . 14 LYS QG 1 1 87 1 2 1 1 15 GLY H . 15 GLY H 1 1 88 1 1 1 1 15 GLY H . 15 GLY H 1 1 88 1 2 1 1 16 GLY H . 16 GLY H 1 1 89 1 1 1 1 15 GLY QA . 15 GLY QA 1 1 89 1 2 1 1 16 GLY H . 16 GLY H 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . . . 3.3 1 1 2 1 . . . . . . . 4.0 1 1 3 1 . . . . . . . 3.5 1 1 4 1 . . . . . . . 3.5 1 1 5 1 . . . . . . . 3.3 1 1 6 1 . . . . . . . 3.8 1 1 7 1 . . . . . . . 4.5 1 1 8 1 . . . . . . . 4.2 1 1 9 1 . . . . . . . 4.5 1 1 10 1 . . . . . . . 4.5 1 1 11 1 . . . . . . . 3.5 1 1 12 1 . . . . . . . 4.2 1 1 13 1 . . . . . . . 4.0 1 1 14 1 . . . . . . . 3.5 1 1 15 1 . . . . . . . 3.5 1 1 16 1 . . . . . . . 4.5 1 1 17 1 . . . . . . . 3.5 1 1 18 1 . . . . . . . 4.8 1 1 19 1 . . . . . . . 4.5 1 1 20 1 . . . . . . . 4.5 1 1 21 1 . . . . . . . 4.8 1 1 22 1 . . . . . . . 4.5 1 1 23 1 . . . . . . . 3.5 1 1 24 1 . . . . . . . 3.5 1 1 25 1 . . . . . . . 4.0 1 1 26 1 . . . . . . . 3.8 1 1 27 1 . . . . . . . 3.5 1 1 28 1 . . . . . . . 3.5 1 1 29 1 . . . . . . . 4.2 1 1 30 1 . . . . . . . 4.5 1 1 31 1 . . . . . . . 3.5 1 1 32 1 . . . . . . . 4.5 1 1 33 1 . . . . . . . 3.8 1 1 34 1 . . . . . . . 3.8 1 1 35 1 . . . . . . . 4.0 1 1 36 1 . . . . . . . 3.5 1 1 37 1 . . . . . . . 3.3 1 1 38 1 . . . . . . . 3.5 1 1 39 1 . . . . . . . 4.5 1 1 40 1 . . . . . . . 4.2 1 1 41 1 . . . . . . . 3.5 1 1 42 1 . . . . . . . 3.8 1 1 43 1 . . . . . . . 3.8 1 1 44 1 . . . . . . . 3.5 1 1 45 1 . . . . . . . 3.5 1 1 46 1 . . . . . . . 3.5 1 1 47 1 . . . . . . . 4.0 1 1 48 1 . . . . . . . 3.7 1 1 49 1 . . . . . . . 3.8 1 1 50 1 . . . . . . . 3.8 1 1 51 1 . . . . . . . 3.8 1 1 52 1 . . . . . . . 3.5 1 1 53 1 . . . . . . . 3.5 1 1 54 1 . . . . . . . 3.5 1 1 55 1 . . . . . . . 4.0 1 1 56 1 . . . . . . . 3.8 1 1 57 1 . . . . . . . 3.8 1 1 58 1 . . . . . . . 4.5 1 1 59 1 . . . . . . . 4.5 1 1 60 1 . . . . . . . 4.5 1 1 61 1 . . . . . . . 4.8 1 1 62 1 . . . . . . . 5.3 1 1 63 1 . . . . . . . 4.5 1 1 64 1 . . . . . . . 5.3 1 1 65 1 . . . . . . . 3.5 1 1 66 1 . . . . . . . 3.8 1 1 67 1 . . . . . . . 3.8 1 1 68 1 . . . . . . . 3.5 1 1 69 1 . . . . . . . 3.5 1 1 70 1 . . . . . . . 3.8 1 1 71 1 . . . . . . . 4.1 1 1 72 1 . . . . . . . 3.9 1 1 73 1 . . . . . . . 3.8 1 1 74 1 . . . . . . . 3.8 1 1 75 1 . . . . . . . 3.5 1 1 76 1 . . . . . . . 3.3 1 1 77 1 . . . . . . . 3.8 1 1 78 1 . . . . . . . 3.5 1 1 79 1 . . . . . . . 3.5 1 1 80 1 . . . . . . . 3.8 1 1 81 1 . . . . . . . 4.0 1 1 82 1 . . . . . . . 4.0 1 1 83 1 . . . . . . . 3.5 1 1 84 1 . . . . . . . 3.5 1 1 85 1 . . . . . . . 3.5 1 1 86 1 . . . . . . . 4.0 1 1 87 1 . . . . . . . 3.8 1 1 88 1 . . . . . . . 3.5 1 1 89 1 . . . . . . . 3.5 1 1 stop_ save_ save_DYANA/DIANA_dihedral_2 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 PHI 1 1 1 VAL C 1 1 2 ALA N 1 1 2 ALA CA 1 1 2 ALA C -120.0 -30.0 . 2 ALA . . 2 ALA . . 2 ALA . . 2 ALA . 1 1 2 PSI 1 1 2 ALA N 1 1 2 ALA CA 1 1 2 ALA C 1 1 3 ARG N -120.0 120.0 . 2 ALA . . 2 ALA . . 2 ALA . . 2 ALA . 1 1 3 PHI 1 1 2 ALA C 1 1 3 ARG N 1 1 3 ARG CA 1 1 3 ARG C -89.99999 -30.0 . 3 ARG . . 3 ARG . . 3 ARG . . 3 ARG . 1 1 4 PSI 1 1 3 ARG N 1 1 3 ARG CA 1 1 3 ARG C 1 1 4 GLY N -75.0 -15.0 . 3 ARG . . 3 ARG . . 3 ARG . . 3 ARG . 1 1 5 PHI 1 1 3 ARG C 1 1 4 GLY N 1 1 4 GLY CA 1 1 4 GLY C -89.99999 -30.0 . 4 GLY . . 4 GLY . . 4 GLY . . 4 GLY . 1 1 6 PSI 1 1 4 GLY N 1 1 4 GLY CA 1 1 4 GLY C 1 1 5 TRP N -75.0 -15.0 . 4 GLY . . 4 GLY . . 4 GLY . . 4 GLY . 1 1 7 PHI 1 1 4 GLY C 1 1 5 TRP N 1 1 5 TRP CA 1 1 5 TRP C -89.99999 -30.0 . 5 TRP . . 5 TRP . . 5 TRP . . 5 TRP . 1 1 8 PSI 1 1 5 TRP N 1 1 5 TRP CA 1 1 5 TRP C 1 1 6 LYS N -75.0 -15.0 . 5 TRP . . 5 TRP . . 5 TRP . . 5 TRP . 1 1 9 PHI 1 1 5 TRP C 1 1 6 LYS N 1 1 6 LYS CA 1 1 6 LYS C -89.99999 -30.0 . 6 LYS . . 6 LYS . . 6 LYS . . 6 LYS . 1 1 10 PSI 1 1 6 LYS N 1 1 6 LYS CA 1 1 6 LYS C 1 1 7 ARG N -75.0 -15.0 . 6 LYS . . 6 LYS . . 6 LYS . . 6 LYS . 1 1 11 PHI 1 1 6 LYS C 1 1 7 ARG N 1 1 7 ARG CA 1 1 7 ARG C -89.99999 -30.0 . 7 ARG . . 7 ARG . . 7 ARG . . 7 ARG . 1 1 12 PSI 1 1 7 ARG N 1 1 7 ARG CA 1 1 7 ARG C 1 1 8 LYS N -75.0 -15.0 . 7 ARG . . 7 ARG . . 7 ARG . . 7 ARG . 1 1 13 PHI 1 1 7 ARG C 1 1 8 LYS N 1 1 8 LYS CA 1 1 8 LYS C -89.99999 -30.0 . 8 LYS . . 8 LYS . . 8 LYS . . 8 LYS . 1 1 14 PSI 1 1 8 LYS N 1 1 8 LYS CA 1 1 8 LYS C 1 1 9 CYS N -75.0 -15.0 . 8 LYS . . 8 LYS . . 8 LYS . . 8 LYS . 1 1 15 PHI 1 1 8 LYS C 1 1 9 CYS N 1 1 9 CYS CA 1 1 9 CYS C -120.0 -30.0 . 9 CYS . . 9 CYS . . 9 CYS . . 9 CYS . 1 1 16 PSI 1 1 9 CYS N 1 1 9 CYS CA 1 1 9 CYS C 1 1 10 PRO N -120.0 120.0 . 9 CYS . . 9 CYS . . 9 CYS . . 9 CYS . 1 1 17 PHI 1 1 10 PRO C 1 1 11 LEU N 1 1 11 LEU CA 1 1 11 LEU C -120.0 -30.0 . 11 LEU . . 11 LEU . . 11 LEU . . 11 LEU . 1 1 18 PSI 1 1 11 LEU N 1 1 11 LEU CA 1 1 11 LEU C 1 1 12 PHE N -120.0 120.0 . 11 LEU . . 11 LEU . . 11 LEU . . 11 LEU . 1 1 19 PHI 1 1 11 LEU C 1 1 12 PHE N 1 1 12 PHE CA 1 1 12 PHE C -120.0 -30.0 . 12 PHE . . 12 PHE . . 12 PHE . . 12 PHE . 1 1 20 PSI 1 1 12 PHE N 1 1 12 PHE CA 1 1 12 PHE C 1 1 13 GLY N -120.0 120.0 . 12 PHE . . 12 PHE . . 12 PHE . . 12 PHE . 1 1 21 PHI 1 1 12 PHE C 1 1 13 GLY N 1 1 13 GLY CA 1 1 13 GLY C -120.0 -30.0 . 13 GLY . . 13 GLY . . 13 GLY . . 13 GLY . 1 1 22 PSI 1 1 13 GLY N 1 1 13 GLY CA 1 1 13 GLY C 1 1 14 LYS N -120.0 120.0 . 13 GLY . . 13 GLY . . 13 GLY . . 13 GLY . 1 1 23 PHI 1 1 13 GLY C 1 1 14 LYS N 1 1 14 LYS CA 1 1 14 LYS C -120.0 -30.0 . 14 LYS . . 14 LYS . . 14 LYS . . 14 LYS . 1 1 24 PSI 1 1 14 LYS N 1 1 14 LYS CA 1 1 14 LYS C 1 1 15 GLY N -120.0 120.0 . 14 LYS . . 14 LYS . . 14 LYS . . 14 LYS . 1 1 25 PHI 1 1 14 LYS C 1 1 15 GLY N 1 1 15 GLY CA 1 1 15 GLY C -120.0 -30.0 . 15 GLY . . 15 GLY . . 15 GLY . . 15 GLY . 1 1 26 PSI 1 1 15 GLY N 1 1 15 GLY CA 1 1 15 GLY C 1 1 16 GLY N -120.0 120.0 . 15 GLY . . 15 GLY . . 15 GLY . . 15 GLY . 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 VAL C C 3.353 -0.851 -1.110 1.00 . A A . 1 VAL C 1 1 1 2 1 1 1 VAL CA C 2.094 -0.002 -1.242 1.00 . A A . 1 VAL CA 1 1 1 3 1 1 1 VAL CB C 2.492 1.427 -1.657 1.00 . A A . 1 VAL CB 1 1 1 4 1 1 1 VAL CG1 C 1.287 2.181 -2.198 1.00 . A A . 1 VAL CG1 1 1 1 5 1 1 1 VAL CG2 C 3.114 2.169 -0.484 1.00 . A A . 1 VAL CG2 1 1 1 6 1 1 1 VAL H1 H 1.807 0.001 0.856 1.00 . A A . 1 VAL H1 1 1 1 7 1 1 1 VAL HA H 1.469 -0.419 -2.018 1.00 . A A . 1 VAL HA 1 1 1 8 1 1 1 VAL HB H 3.229 1.358 -2.444 1.00 . A A . 1 VAL HB 1 1 1 9 1 1 1 VAL HG11 H 0.381 1.728 -1.823 1.00 . A A . 1 VAL HG11 1 1 1 10 1 1 1 VAL HG12 H 1.335 3.212 -1.879 1.00 . A A . 1 VAL HG12 1 1 1 11 1 1 1 VAL HG13 H 1.290 2.138 -3.277 1.00 . A A . 1 VAL HG13 1 1 1 12 1 1 1 VAL HG21 H 2.347 2.716 0.043 1.00 . A A . 1 VAL HG21 1 1 1 13 1 1 1 VAL HG22 H 3.576 1.459 0.186 1.00 . A A . 1 VAL HG22 1 1 1 14 1 1 1 VAL HG23 H 3.861 2.859 -0.849 1.00 . A A . 1 VAL HG23 1 1 1 15 1 1 1 VAL N N 1.329 0.000 0.000 1.00 . A A . 1 VAL N 1 1 1 16 1 1 1 VAL O O 4.437 -0.441 -1.524 1.00 . A A . 1 VAL O 1 1 1 17 1 1 2 ALA C C 4.083 -4.273 -1.060 1.00 . A A . 2 ALA C 1 1 1 18 1 1 2 ALA CA C 4.327 -2.947 -0.348 1.00 . A A . 2 ALA CA 1 1 1 19 1 1 2 ALA CB C 4.580 -3.180 1.134 1.00 . A A . 2 ALA CB 1 1 1 20 1 1 2 ALA H H 2.313 -2.309 -0.222 1.00 . A A . 2 ALA H 1 1 1 21 1 1 2 ALA HA H 5.206 -2.480 -0.769 1.00 . A A . 2 ALA HA 1 1 1 22 1 1 2 ALA HB1 H 5.039 -4.148 1.272 1.00 . A A . 2 ALA HB1 1 1 1 23 1 1 2 ALA HB2 H 5.237 -2.412 1.513 1.00 . A A . 2 ALA HB2 1 1 1 24 1 1 2 ALA HB3 H 3.642 -3.148 1.669 1.00 . A A . 2 ALA HB3 1 1 1 25 1 1 2 ALA N N 3.202 -2.038 -0.531 1.00 . A A . 2 ALA N 1 1 1 26 1 1 2 ALA O O 3.805 -5.289 -0.423 1.00 . A A . 2 ALA O 1 1 1 27 1 1 3 ARG C C 5.290 -6.207 -3.394 1.00 . A A . 3 ARG C 1 1 1 28 1 1 3 ARG CA C 3.978 -5.457 -3.184 1.00 . A A . 3 ARG CA 1 1 1 29 1 1 3 ARG CB C 3.363 -5.094 -4.537 1.00 . A A . 3 ARG CB 1 1 1 30 1 1 3 ARG CD C 2.405 -7.409 -4.736 1.00 . A A . 3 ARG CD 1 1 1 31 1 1 3 ARG CG C 3.149 -6.290 -5.449 1.00 . A A . 3 ARG CG 1 1 1 32 1 1 3 ARG CZ C 0.581 -7.881 -6.314 1.00 . A A . 3 ARG CZ 1 1 1 33 1 1 3 ARG H H 4.413 -3.415 -2.836 1.00 . A A . 3 ARG H 1 1 1 34 1 1 3 ARG HA H 3.293 -6.096 -2.647 1.00 . A A . 3 ARG HA 1 1 1 35 1 1 3 ARG HB2 H 2.407 -4.621 -4.369 1.00 . A A . 3 ARG HB2 1 1 1 36 1 1 3 ARG HB3 H 4.017 -4.397 -5.040 1.00 . A A . 3 ARG HB3 1 1 1 37 1 1 3 ARG HD2 H 3.120 -8.010 -4.194 1.00 . A A . 3 ARG HD2 1 1 1 38 1 1 3 ARG HD3 H 1.705 -6.971 -4.041 1.00 . A A . 3 ARG HD3 1 1 1 39 1 1 3 ARG HE H 2.023 -9.168 -5.821 1.00 . A A . 3 ARG HE 1 1 1 40 1 1 3 ARG HG2 H 2.571 -5.979 -6.307 1.00 . A A . 3 ARG HG2 1 1 1 41 1 1 3 ARG HG3 H 4.110 -6.659 -5.775 1.00 . A A . 3 ARG HG3 1 1 1 42 1 1 3 ARG HH11 H 0.545 -6.032 -5.502 1.00 . A A . 3 ARG HH11 1 1 1 43 1 1 3 ARG HH12 H -0.736 -6.378 -6.616 1.00 . A A . 3 ARG HH12 1 1 1 44 1 1 3 ARG HH21 H 0.342 -9.635 -7.290 1.00 . A A . 3 ARG HH21 1 1 1 45 1 1 3 ARG HH22 H -0.851 -8.428 -7.632 1.00 . A A . 3 ARG HH22 1 1 1 46 1 1 3 ARG N N 4.189 -4.256 -2.385 1.00 . A A . 3 ARG N 1 1 1 47 1 1 3 ARG NE N 1.677 -8.264 -5.669 1.00 . A A . 3 ARG NE 1 1 1 48 1 1 3 ARG NH1 N 0.089 -6.664 -6.128 1.00 . A A . 3 ARG NH1 1 1 1 49 1 1 3 ARG NH2 N -0.026 -8.717 -7.148 1.00 . A A . 3 ARG NH2 1 1 1 50 1 1 3 ARG O O 5.297 -7.348 -3.855 1.00 . A A . 3 ARG O 1 1 1 51 1 1 4 GLY C C 7.833 -7.461 -2.412 1.00 . A A . 4 GLY C 1 1 1 52 1 1 4 GLY CA C 7.701 -6.179 -3.210 1.00 . A A . 4 GLY CA 1 1 1 53 1 1 4 GLY H H 6.332 -4.650 -2.688 1.00 . A A . 4 GLY H 1 1 1 54 1 1 4 GLY HA2 H 7.857 -6.400 -4.256 1.00 . A A . 4 GLY HA2 1 1 1 55 1 1 4 GLY HA3 H 8.460 -5.485 -2.883 1.00 . A A . 4 GLY HA3 1 1 1 56 1 1 4 GLY N N 6.399 -5.558 -3.051 1.00 . A A . 4 GLY N 1 1 1 57 1 1 4 GLY O O 8.771 -8.232 -2.615 1.00 . A A . 4 GLY O 1 1 1 58 1 1 5 TRP C C 6.594 -10.128 -1.495 1.00 . A A . 5 TRP C 1 1 1 59 1 1 5 TRP CA C 6.910 -8.886 -0.669 1.00 . A A . 5 TRP CA 1 1 1 60 1 1 5 TRP CB C 5.905 -8.750 0.476 1.00 . A A . 5 TRP CB 1 1 1 61 1 1 5 TRP CD1 C 3.815 -8.104 -0.859 1.00 . A A . 5 TRP CD1 1 1 1 62 1 1 5 TRP CD2 C 3.544 -9.886 0.471 1.00 . A A . 5 TRP CD2 1 1 1 63 1 1 5 TRP CE2 C 2.331 -9.638 -0.201 1.00 . A A . 5 TRP CE2 1 1 1 64 1 1 5 TRP CE3 C 3.614 -10.961 1.361 1.00 . A A . 5 TRP CE3 1 1 1 65 1 1 5 TRP CG C 4.480 -8.894 0.035 1.00 . A A . 5 TRP CG 1 1 1 66 1 1 5 TRP CH2 C 1.296 -11.471 0.870 1.00 . A A . 5 TRP CH2 1 1 1 67 1 1 5 TRP CZ2 C 1.199 -10.426 -0.008 1.00 . A A . 5 TRP CZ2 1 1 1 68 1 1 5 TRP CZ3 C 2.489 -11.741 1.552 1.00 . A A . 5 TRP CZ3 1 1 1 69 1 1 5 TRP H H 6.170 -7.037 -1.388 1.00 . A A . 5 TRP H 1 1 1 70 1 1 5 TRP HA H 7.903 -8.986 -0.255 1.00 . A A . 5 TRP HA 1 1 1 71 1 1 5 TRP HB2 H 6.105 -9.512 1.214 1.00 . A A . 5 TRP HB2 1 1 1 72 1 1 5 TRP HB3 H 6.018 -7.776 0.930 1.00 . A A . 5 TRP HB3 1 1 1 73 1 1 5 TRP HD1 H 4.253 -7.259 -1.367 1.00 . A A . 5 TRP HD1 1 1 1 74 1 1 5 TRP HE1 H 1.847 -8.144 -1.592 1.00 . A A . 5 TRP HE1 1 1 1 75 1 1 5 TRP HE3 H 4.525 -11.185 1.896 1.00 . A A . 5 TRP HE3 1 1 1 76 1 1 5 TRP HH2 H 0.442 -12.107 1.050 1.00 . A A . 5 TRP HH2 1 1 1 77 1 1 5 TRP HZ2 H 0.272 -10.231 -0.527 1.00 . A A . 5 TRP HZ2 1 1 1 78 1 1 5 TRP HZ3 H 2.524 -12.576 2.237 1.00 . A A . 5 TRP HZ3 1 1 1 79 1 1 5 TRP N N 6.893 -7.689 -1.502 1.00 . A A . 5 TRP N 1 1 1 80 1 1 5 TRP NE1 N 2.522 -8.546 -1.005 1.00 . A A . 5 TRP NE1 1 1 1 81 1 1 5 TRP O O 7.163 -11.197 -1.270 1.00 . A A . 5 TRP O 1 1 1 82 1 1 6 LYS C C 6.392 -11.414 -4.318 1.00 . A A . 6 LYS C 1 1 1 83 1 1 6 LYS CA C 5.292 -11.091 -3.312 1.00 . A A . 6 LYS CA 1 1 1 84 1 1 6 LYS CB C 3.993 -10.758 -4.050 1.00 . A A . 6 LYS CB 1 1 1 85 1 1 6 LYS CD C 4.233 -11.164 -6.517 1.00 . A A . 6 LYS CD 1 1 1 86 1 1 6 LYS CE C 3.136 -11.040 -7.564 1.00 . A A . 6 LYS CE 1 1 1 87 1 1 6 LYS CG C 3.690 -11.699 -5.203 1.00 . A A . 6 LYS CG 1 1 1 88 1 1 6 LYS H H 5.265 -9.105 -2.582 1.00 . A A . 6 LYS H 1 1 1 89 1 1 6 LYS HA H 5.129 -11.955 -2.686 1.00 . A A . 6 LYS HA 1 1 1 90 1 1 6 LYS HB2 H 3.173 -10.805 -3.349 1.00 . A A . 6 LYS HB2 1 1 1 91 1 1 6 LYS HB3 H 4.064 -9.753 -4.442 1.00 . A A . 6 LYS HB3 1 1 1 92 1 1 6 LYS HD2 H 4.665 -10.189 -6.348 1.00 . A A . 6 LYS HD2 1 1 1 93 1 1 6 LYS HD3 H 4.994 -11.838 -6.884 1.00 . A A . 6 LYS HD3 1 1 1 94 1 1 6 LYS HE2 H 2.248 -10.649 -7.091 1.00 . A A . 6 LYS HE2 1 1 1 95 1 1 6 LYS HE3 H 3.465 -10.355 -8.332 1.00 . A A . 6 LYS HE3 1 1 1 96 1 1 6 LYS HG2 H 4.144 -12.658 -5.002 1.00 . A A . 6 LYS HG2 1 1 1 97 1 1 6 LYS HG3 H 2.619 -11.816 -5.287 1.00 . A A . 6 LYS HG3 1 1 1 98 1 1 6 LYS HZ1 H 2.841 -12.270 -9.226 1.00 . A A . 6 LYS HZ1 1 1 1 99 1 1 6 LYS HZ2 H 1.866 -12.663 -7.900 1.00 . A A . 6 LYS HZ2 1 1 1 100 1 1 6 LYS HZ3 H 3.508 -13.069 -7.892 1.00 . A A . 6 LYS HZ3 1 1 1 101 1 1 6 LYS N N 5.683 -9.982 -2.451 1.00 . A A . 6 LYS N 1 1 1 102 1 1 6 LYS NZ N 2.815 -12.352 -8.190 1.00 . A A . 6 LYS NZ 1 1 1 103 1 1 6 LYS O O 6.420 -12.501 -4.895 1.00 . A A . 6 LYS O 1 1 1 104 1 1 7 ARG C C 9.332 -11.760 -4.991 1.00 . A A . 7 ARG C 1 1 1 105 1 1 7 ARG CA C 8.400 -10.646 -5.460 1.00 . A A . 7 ARG CA 1 1 1 106 1 1 7 ARG CB C 9.184 -9.343 -5.619 1.00 . A A . 7 ARG CB 1 1 1 107 1 1 7 ARG CD C 8.688 -9.196 -8.078 1.00 . A A . 7 ARG CD 1 1 1 108 1 1 7 ARG CG C 8.677 -8.460 -6.747 1.00 . A A . 7 ARG CG 1 1 1 109 1 1 7 ARG CZ C 10.322 -7.869 -9.348 1.00 . A A . 7 ARG CZ 1 1 1 110 1 1 7 ARG H H 7.222 -9.617 -4.034 1.00 . A A . 7 ARG H 1 1 1 111 1 1 7 ARG HA H 7.981 -10.923 -6.416 1.00 . A A . 7 ARG HA 1 1 1 112 1 1 7 ARG HB2 H 9.121 -8.783 -4.697 1.00 . A A . 7 ARG HB2 1 1 1 113 1 1 7 ARG HB3 H 10.219 -9.581 -5.815 1.00 . A A . 7 ARG HB3 1 1 1 114 1 1 7 ARG HD2 H 9.383 -10.019 -8.013 1.00 . A A . 7 ARG HD2 1 1 1 115 1 1 7 ARG HD3 H 7.696 -9.577 -8.271 1.00 . A A . 7 ARG HD3 1 1 1 116 1 1 7 ARG HE H 8.396 -8.070 -9.829 1.00 . A A . 7 ARG HE 1 1 1 117 1 1 7 ARG HG2 H 7.665 -8.155 -6.526 1.00 . A A . 7 ARG HG2 1 1 1 118 1 1 7 ARG HG3 H 9.310 -7.588 -6.822 1.00 . A A . 7 ARG HG3 1 1 1 119 1 1 7 ARG HH11 H 11.064 -8.792 -7.712 1.00 . A A . 7 ARG HH11 1 1 1 120 1 1 7 ARG HH12 H 12.206 -7.854 -8.617 1.00 . A A . 7 ARG HH12 1 1 1 121 1 1 7 ARG HH21 H 9.889 -6.831 -11.028 1.00 . A A . 7 ARG HH21 1 1 1 122 1 1 7 ARG HH22 H 11.536 -6.738 -10.502 1.00 . A A . 7 ARG HH22 1 1 1 123 1 1 7 ARG N N 7.297 -10.463 -4.523 1.00 . A A . 7 ARG N 1 1 1 124 1 1 7 ARG NE N 9.085 -8.326 -9.181 1.00 . A A . 7 ARG NE 1 1 1 125 1 1 7 ARG NH1 N 11.275 -8.198 -8.488 1.00 . A A . 7 ARG NH1 1 1 1 126 1 1 7 ARG NH2 N 10.606 -7.081 -10.378 1.00 . A A . 7 ARG NH2 1 1 1 127 1 1 7 ARG O O 9.217 -12.905 -5.426 1.00 . A A . 7 ARG O 1 1 1 128 1 1 8 LYS C C 10.731 -12.939 -2.232 1.00 . A A . 8 LYS C 1 1 1 129 1 1 8 LYS CA C 11.208 -12.383 -3.570 1.00 . A A . 8 LYS CA 1 1 1 130 1 1 8 LYS CB C 12.585 -11.737 -3.404 1.00 . A A . 8 LYS CB 1 1 1 131 1 1 8 LYS CD C 14.429 -10.396 -4.458 1.00 . A A . 8 LYS CD 1 1 1 132 1 1 8 LYS CE C 15.284 -10.298 -5.712 1.00 . A A . 8 LYS CE 1 1 1 133 1 1 8 LYS CG C 13.171 -11.213 -4.704 1.00 . A A . 8 LYS CG 1 1 1 134 1 1 8 LYS H H 10.297 -10.485 -3.790 1.00 . A A . 8 LYS H 1 1 1 135 1 1 8 LYS HA H 11.283 -13.195 -4.277 1.00 . A A . 8 LYS HA 1 1 1 136 1 1 8 LYS HB2 H 12.502 -10.913 -2.712 1.00 . A A . 8 LYS HB2 1 1 1 137 1 1 8 LYS HB3 H 13.267 -12.470 -2.997 1.00 . A A . 8 LYS HB3 1 1 1 138 1 1 8 LYS HD2 H 14.146 -9.400 -4.151 1.00 . A A . 8 LYS HD2 1 1 1 139 1 1 8 LYS HD3 H 15.006 -10.866 -3.675 1.00 . A A . 8 LYS HD3 1 1 1 140 1 1 8 LYS HE2 H 16.280 -9.993 -5.431 1.00 . A A . 8 LYS HE2 1 1 1 141 1 1 8 LYS HE3 H 15.325 -11.271 -6.180 1.00 . A A . 8 LYS HE3 1 1 1 142 1 1 8 LYS HG2 H 13.417 -12.049 -5.341 1.00 . A A . 8 LYS HG2 1 1 1 143 1 1 8 LYS HG3 H 12.437 -10.588 -5.193 1.00 . A A . 8 LYS HG3 1 1 1 144 1 1 8 LYS HZ1 H 14.936 -9.621 -7.658 1.00 . A A . 8 LYS HZ1 1 1 1 145 1 1 8 LYS HZ2 H 15.161 -8.380 -6.530 1.00 . A A . 8 LYS HZ2 1 1 1 146 1 1 8 LYS HZ3 H 13.702 -9.235 -6.567 1.00 . A A . 8 LYS HZ3 1 1 1 147 1 1 8 LYS N N 10.256 -11.415 -4.100 1.00 . A A . 8 LYS N 1 1 1 148 1 1 8 LYS NZ N 14.732 -9.315 -6.685 1.00 . A A . 8 LYS NZ 1 1 1 149 1 1 8 LYS O O 10.228 -14.061 -2.159 1.00 . A A . 8 LYS O 1 1 1 150 1 1 9 CYS C C 9.211 -11.824 0.587 1.00 . A A . 9 CYS C 1 1 1 151 1 1 9 CYS CA C 10.475 -12.561 0.158 1.00 . A A . 9 CYS CA 1 1 1 152 1 1 9 CYS CB C 11.597 -12.304 1.166 1.00 . A A . 9 CYS CB 1 1 1 153 1 1 9 CYS H H 11.298 -11.265 -1.299 1.00 . A A . 9 CYS H 1 1 1 154 1 1 9 CYS HA H 10.267 -13.620 0.127 1.00 . A A . 9 CYS HA 1 1 1 155 1 1 9 CYS HB2 H 12.117 -11.399 0.891 1.00 . A A . 9 CYS HB2 1 1 1 156 1 1 9 CYS HB3 H 11.166 -12.179 2.148 1.00 . A A . 9 CYS HB3 1 1 1 157 1 1 9 CYS HG H 13.783 -13.365 0.394 1.00 . A A . 9 CYS HG 1 1 1 158 1 1 9 CYS N N 10.891 -12.148 -1.177 1.00 . A A . 9 CYS N 1 1 1 159 1 1 9 CYS O O 9.100 -10.605 0.459 1.00 . A A . 9 CYS O 1 1 1 160 1 1 9 CYS SG S 12.820 -13.632 1.264 1.00 . A A . 9 CYS SG 1 1 1 161 1 1 10 PRO C C 7.113 -11.180 2.827 1.00 . A A . 10 PRO C 1 1 1 162 1 1 10 PRO CA C 6.957 -12.020 1.564 1.00 . A A . 10 PRO CA 1 1 1 163 1 1 10 PRO CB C 6.107 -13.260 1.848 1.00 . A A . 10 PRO CB 1 1 1 164 1 1 10 PRO CD C 8.296 -14.040 1.289 1.00 . A A . 10 PRO CD 1 1 1 165 1 1 10 PRO CG C 7.093 -14.337 2.141 1.00 . A A . 10 PRO CG 1 1 1 166 1 1 10 PRO HA H 6.486 -11.427 0.794 1.00 . A A . 10 PRO HA 1 1 1 167 1 1 10 PRO HB2 H 5.463 -13.072 2.696 1.00 . A A . 10 PRO HB2 1 1 1 168 1 1 10 PRO HB3 H 5.509 -13.498 0.981 1.00 . A A . 10 PRO HB3 1 1 1 169 1 1 10 PRO HD2 H 9.202 -14.326 1.802 1.00 . A A . 10 PRO HD2 1 1 1 170 1 1 10 PRO HD3 H 8.221 -14.550 0.340 1.00 . A A . 10 PRO HD3 1 1 1 171 1 1 10 PRO HG2 H 7.360 -14.317 3.187 1.00 . A A . 10 PRO HG2 1 1 1 172 1 1 10 PRO HG3 H 6.676 -15.298 1.878 1.00 . A A . 10 PRO HG3 1 1 1 173 1 1 10 PRO N N 8.233 -12.580 1.107 1.00 . A A . 10 PRO N 1 1 1 174 1 1 10 PRO O O 6.171 -10.517 3.264 1.00 . A A . 10 PRO O 1 1 1 175 1 1 11 LEU C C 8.745 -8.967 4.312 1.00 . A A . 11 LEU C 1 1 1 176 1 1 11 LEU CA C 8.585 -10.451 4.623 1.00 . A A . 11 LEU CA 1 1 1 177 1 1 11 LEU CB C 9.851 -10.981 5.300 1.00 . A A . 11 LEU CB 1 1 1 178 1 1 11 LEU CD1 C 11.631 -9.225 5.467 1.00 . A A . 11 LEU CD1 1 1 1 179 1 1 11 LEU CD2 C 12.241 -11.562 4.817 1.00 . A A . 11 LEU CD2 1 1 1 180 1 1 11 LEU CG C 11.178 -10.477 4.732 1.00 . A A . 11 LEU CG 1 1 1 181 1 1 11 LEU H H 9.017 -11.757 3.015 1.00 . A A . 11 LEU H 1 1 1 182 1 1 11 LEU HA H 7.748 -10.578 5.293 1.00 . A A . 11 LEU HA 1 1 1 183 1 1 11 LEU HB2 H 9.810 -10.702 6.342 1.00 . A A . 11 LEU HB2 1 1 1 184 1 1 11 LEU HB3 H 9.842 -12.059 5.218 1.00 . A A . 11 LEU HB3 1 1 1 185 1 1 11 LEU HD11 H 12.702 -9.253 5.599 1.00 . A A . 11 LEU HD11 1 1 1 186 1 1 11 LEU HD12 H 11.150 -9.180 6.433 1.00 . A A . 11 LEU HD12 1 1 1 187 1 1 11 LEU HD13 H 11.362 -8.352 4.890 1.00 . A A . 11 LEU HD13 1 1 1 188 1 1 11 LEU HD21 H 12.095 -12.139 5.718 1.00 . A A . 11 LEU HD21 1 1 1 189 1 1 11 LEU HD22 H 13.220 -11.105 4.836 1.00 . A A . 11 LEU HD22 1 1 1 190 1 1 11 LEU HD23 H 12.163 -12.210 3.956 1.00 . A A . 11 LEU HD23 1 1 1 191 1 1 11 LEU HG H 11.042 -10.221 3.690 1.00 . A A . 11 LEU HG 1 1 1 192 1 1 11 LEU N N 8.306 -11.211 3.410 1.00 . A A . 11 LEU N 1 1 1 193 1 1 11 LEU O O 8.944 -8.151 5.212 1.00 . A A . 11 LEU O 1 1 1 194 1 1 12 PHE C C 7.445 -6.514 2.667 1.00 . A A . 12 PHE C 1 1 1 195 1 1 12 PHE CA C 8.788 -7.236 2.600 1.00 . A A . 12 PHE CA 1 1 1 196 1 1 12 PHE CB C 9.343 -7.173 1.176 1.00 . A A . 12 PHE CB 1 1 1 197 1 1 12 PHE CD1 C 11.680 -6.632 1.912 1.00 . A A . 12 PHE CD1 1 1 1 198 1 1 12 PHE CD2 C 10.744 -5.387 0.106 1.00 . A A . 12 PHE CD2 1 1 1 199 1 1 12 PHE CE1 C 12.851 -5.904 1.810 1.00 . A A . 12 PHE CE1 1 1 1 200 1 1 12 PHE CE2 C 11.912 -4.657 -0.001 1.00 . A A . 12 PHE CE2 1 1 1 201 1 1 12 PHE CG C 10.615 -6.382 1.062 1.00 . A A . 12 PHE CG 1 1 1 202 1 1 12 PHE CZ C 12.968 -4.916 0.851 1.00 . A A . 12 PHE CZ 1 1 1 203 1 1 12 PHE H H 8.495 -9.319 2.359 1.00 . A A . 12 PHE H 1 1 1 204 1 1 12 PHE HA H 9.480 -6.747 3.269 1.00 . A A . 12 PHE HA 1 1 1 205 1 1 12 PHE HB2 H 9.546 -8.176 0.832 1.00 . A A . 12 PHE HB2 1 1 1 206 1 1 12 PHE HB3 H 8.608 -6.717 0.531 1.00 . A A . 12 PHE HB3 1 1 1 207 1 1 12 PHE HD1 H 11.591 -7.405 2.661 1.00 . A A . 12 PHE HD1 1 1 1 208 1 1 12 PHE HD2 H 9.919 -5.184 -0.562 1.00 . A A . 12 PHE HD2 1 1 1 209 1 1 12 PHE HE1 H 13.675 -6.110 2.477 1.00 . A A . 12 PHE HE1 1 1 1 210 1 1 12 PHE HE2 H 12.000 -3.885 -0.751 1.00 . A A . 12 PHE HE2 1 1 1 211 1 1 12 PHE HZ H 13.881 -4.346 0.770 1.00 . A A . 12 PHE HZ 1 1 1 212 1 1 12 PHE N N 8.655 -8.623 3.031 1.00 . A A . 12 PHE N 1 1 1 213 1 1 12 PHE O O 7.284 -5.428 2.112 1.00 . A A . 12 PHE O 1 1 1 214 1 1 13 GLY C C 5.224 -5.105 3.990 1.00 . A A . 13 GLY C 1 1 1 215 1 1 13 GLY CA C 5.167 -6.530 3.478 1.00 . A A . 13 GLY CA 1 1 1 216 1 1 13 GLY H H 6.670 -7.993 3.773 1.00 . A A . 13 GLY H 1 1 1 217 1 1 13 GLY HA2 H 4.687 -6.536 2.511 1.00 . A A . 13 GLY HA2 1 1 1 218 1 1 13 GLY HA3 H 4.580 -7.124 4.164 1.00 . A A . 13 GLY HA3 1 1 1 219 1 1 13 GLY N N 6.484 -7.128 3.351 1.00 . A A . 13 GLY N 1 1 1 220 1 1 13 GLY O O 4.300 -4.321 3.772 1.00 . A A . 13 GLY O 1 1 1 221 1 1 14 LYS C C 7.044 -2.478 4.167 1.00 . A A . 14 LYS C 1 1 1 222 1 1 14 LYS CA C 6.486 -3.427 5.222 1.00 . A A . 14 LYS CA 1 1 1 223 1 1 14 LYS CB C 7.420 -3.465 6.434 1.00 . A A . 14 LYS CB 1 1 1 224 1 1 14 LYS CD C 8.156 -4.760 8.457 1.00 . A A . 14 LYS CD 1 1 1 225 1 1 14 LYS CE C 7.865 -5.967 9.335 1.00 . A A . 14 LYS CE 1 1 1 226 1 1 14 LYS CG C 7.028 -4.503 7.471 1.00 . A A . 14 LYS CG 1 1 1 227 1 1 14 LYS H H 7.014 -5.437 4.818 1.00 . A A . 14 LYS H 1 1 1 228 1 1 14 LYS HA H 5.518 -3.067 5.536 1.00 . A A . 14 LYS HA 1 1 1 229 1 1 14 LYS HB2 H 8.421 -3.686 6.094 1.00 . A A . 14 LYS HB2 1 1 1 230 1 1 14 LYS HB3 H 7.416 -2.494 6.907 1.00 . A A . 14 LYS HB3 1 1 1 231 1 1 14 LYS HD2 H 9.068 -4.940 7.908 1.00 . A A . 14 LYS HD2 1 1 1 232 1 1 14 LYS HD3 H 8.278 -3.889 9.086 1.00 . A A . 14 LYS HD3 1 1 1 233 1 1 14 LYS HE2 H 6.870 -5.868 9.743 1.00 . A A . 14 LYS HE2 1 1 1 234 1 1 14 LYS HE3 H 7.917 -6.858 8.727 1.00 . A A . 14 LYS HE3 1 1 1 235 1 1 14 LYS HG2 H 6.164 -4.149 8.014 1.00 . A A . 14 LYS HG2 1 1 1 236 1 1 14 LYS HG3 H 6.785 -5.428 6.968 1.00 . A A . 14 LYS HG3 1 1 1 237 1 1 14 LYS HZ1 H 9.783 -5.783 10.142 1.00 . A A . 14 LYS HZ1 1 1 1 238 1 1 14 LYS HZ2 H 8.892 -7.073 10.778 1.00 . A A . 14 LYS HZ2 1 1 1 239 1 1 14 LYS HZ3 H 8.541 -5.488 11.252 1.00 . A A . 14 LYS HZ3 1 1 1 240 1 1 14 LYS N N 6.311 -4.767 4.676 1.00 . A A . 14 LYS N 1 1 1 241 1 1 14 LYS NZ N 8.838 -6.086 10.455 1.00 . A A . 14 LYS NZ 1 1 1 242 1 1 14 LYS O O 6.420 -1.473 3.829 1.00 . A A . 14 LYS O 1 1 1 243 1 1 15 GLY C C 8.064 -1.959 1.335 1.00 . A A . 15 GLY C 1 1 1 244 1 1 15 GLY CA C 8.845 -1.972 2.634 1.00 . A A . 15 GLY CA 1 1 1 245 1 1 15 GLY H H 8.676 -3.619 3.955 1.00 . A A . 15 GLY H 1 1 1 246 1 1 15 GLY HA2 H 8.917 -0.962 3.009 1.00 . A A . 15 GLY HA2 1 1 1 247 1 1 15 GLY HA3 H 9.840 -2.345 2.439 1.00 . A A . 15 GLY HA3 1 1 1 248 1 1 15 GLY N N 8.224 -2.805 3.647 1.00 . A A . 15 GLY N 1 1 1 249 1 1 15 GLY O O 7.138 -1.167 1.167 1.00 . A A . 15 GLY O 1 1 1 250 1 1 16 GLY C C 8.721 -3.059 -2.029 1.00 . A A . 16 GLY C 1 1 1 251 1 1 16 GLY CA C 7.758 -2.909 -0.868 1.00 . A A . 16 GLY CA 1 1 1 252 1 1 16 GLY H H 9.185 -3.447 0.601 1.00 . A A . 16 GLY H 1 1 1 253 1 1 16 GLY HA2 H 7.085 -3.753 -0.860 1.00 . A A . 16 GLY HA2 1 1 1 254 1 1 16 GLY HA3 H 7.184 -2.004 -1.006 1.00 . A A . 16 GLY HA3 1 1 1 255 1 1 16 GLY N N 8.439 -2.840 0.412 1.00 . A A . 16 GLY N 1 1 1 256 1 1 16 GLY O O 9.387 -2.101 -2.420 1.00 . A A . 16 GLY O 1 1 2 257 1 1 1 VAL C C 3.834 -1.322 -0.687 1.00 . A A . 1 VAL C 1 1 2 258 1 1 1 VAL CA C 2.549 -0.559 -0.383 1.00 . A A . 1 VAL CA 1 1 2 259 1 1 1 VAL CB C 1.968 -0.009 -1.699 1.00 . A A . 1 VAL CB 1 1 2 260 1 1 1 VAL CG1 C 1.553 -1.148 -2.617 1.00 . A A . 1 VAL CG1 1 1 2 261 1 1 1 VAL CG2 C 0.792 0.914 -1.417 1.00 . A A . 1 VAL CG2 1 1 2 262 1 1 1 VAL H1 H 3.528 0.423 1.217 1.00 . A A . 1 VAL H1 1 1 2 263 1 1 1 VAL HA H 1.830 -1.241 0.047 1.00 . A A . 1 VAL HA 1 1 2 264 1 1 1 VAL HB H 2.737 0.564 -2.197 1.00 . A A . 1 VAL HB 1 1 2 265 1 1 1 VAL HG11 H 2.435 -1.650 -2.988 1.00 . A A . 1 VAL HG11 1 1 2 266 1 1 1 VAL HG12 H 0.943 -1.850 -2.068 1.00 . A A . 1 VAL HG12 1 1 2 267 1 1 1 VAL HG13 H 0.988 -0.753 -3.449 1.00 . A A . 1 VAL HG13 1 1 2 268 1 1 1 VAL HG21 H 0.014 0.740 -2.145 1.00 . A A . 1 VAL HG21 1 1 2 269 1 1 1 VAL HG22 H 0.410 0.717 -0.427 1.00 . A A . 1 VAL HG22 1 1 2 270 1 1 1 VAL HG23 H 1.119 1.943 -1.478 1.00 . A A . 1 VAL HG23 1 1 2 271 1 1 1 VAL N N 2.788 0.510 0.580 1.00 . A A . 1 VAL N 1 1 2 272 1 1 1 VAL O O 4.596 -0.944 -1.576 1.00 . A A . 1 VAL O 1 1 2 273 1 1 2 ALA C C 4.926 -4.500 -0.885 1.00 . A A . 2 ALA C 1 1 2 274 1 1 2 ALA CA C 5.258 -3.215 -0.134 1.00 . A A . 2 ALA CA 1 1 2 275 1 1 2 ALA CB C 5.899 -3.537 1.208 1.00 . A A . 2 ALA CB 1 1 2 276 1 1 2 ALA H H 3.422 -2.647 0.751 1.00 . A A . 2 ALA H 1 1 2 277 1 1 2 ALA HA H 5.966 -2.643 -0.715 1.00 . A A . 2 ALA HA 1 1 2 278 1 1 2 ALA HB1 H 6.696 -4.252 1.064 1.00 . A A . 2 ALA HB1 1 1 2 279 1 1 2 ALA HB2 H 6.300 -2.632 1.641 1.00 . A A . 2 ALA HB2 1 1 2 280 1 1 2 ALA HB3 H 5.156 -3.955 1.871 1.00 . A A . 2 ALA HB3 1 1 2 281 1 1 2 ALA N N 4.067 -2.397 0.058 1.00 . A A . 2 ALA N 1 1 2 282 1 1 2 ALA O O 5.399 -5.579 -0.526 1.00 . A A . 2 ALA O 1 1 2 283 1 1 3 ARG C C 4.928 -6.380 -3.095 1.00 . A A . 3 ARG C 1 1 2 284 1 1 3 ARG CA C 3.715 -5.530 -2.728 1.00 . A A . 3 ARG CA 1 1 2 285 1 1 3 ARG CB C 2.996 -5.073 -3.998 1.00 . A A . 3 ARG CB 1 1 2 286 1 1 3 ARG CD C 2.475 -5.593 -6.401 1.00 . A A . 3 ARG CD 1 1 2 287 1 1 3 ARG CG C 2.853 -6.166 -5.044 1.00 . A A . 3 ARG CG 1 1 2 288 1 1 3 ARG CZ C 0.790 -5.965 -8.153 1.00 . A A . 3 ARG CZ 1 1 2 289 1 1 3 ARG H H 3.767 -3.491 -2.164 1.00 . A A . 3 ARG H 1 1 2 290 1 1 3 ARG HA H 3.038 -6.127 -2.136 1.00 . A A . 3 ARG HA 1 1 2 291 1 1 3 ARG HB2 H 2.008 -4.727 -3.734 1.00 . A A . 3 ARG HB2 1 1 2 292 1 1 3 ARG HB3 H 3.550 -4.256 -4.436 1.00 . A A . 3 ARG HB3 1 1 2 293 1 1 3 ARG HD2 H 2.314 -4.531 -6.296 1.00 . A A . 3 ARG HD2 1 1 2 294 1 1 3 ARG HD3 H 3.287 -5.768 -7.090 1.00 . A A . 3 ARG HD3 1 1 2 295 1 1 3 ARG HE H 0.772 -6.826 -6.354 1.00 . A A . 3 ARG HE 1 1 2 296 1 1 3 ARG HG2 H 3.794 -6.689 -5.136 1.00 . A A . 3 ARG HG2 1 1 2 297 1 1 3 ARG HG3 H 2.085 -6.856 -4.727 1.00 . A A . 3 ARG HG3 1 1 2 298 1 1 3 ARG HH11 H 2.268 -4.681 -8.652 1.00 . A A . 3 ARG HH11 1 1 2 299 1 1 3 ARG HH12 H 1.074 -4.952 -9.878 1.00 . A A . 3 ARG HH12 1 1 2 300 1 1 3 ARG HH21 H -0.806 -7.190 -7.960 1.00 . A A . 3 ARG HH21 1 1 2 301 1 1 3 ARG HH22 H -0.674 -6.379 -9.483 1.00 . A A . 3 ARG HH22 1 1 2 302 1 1 3 ARG N N 4.111 -4.377 -1.927 1.00 . A A . 3 ARG N 1 1 2 303 1 1 3 ARG NE N 1.260 -6.205 -6.934 1.00 . A A . 3 ARG NE 1 1 2 304 1 1 3 ARG NH1 N 1.429 -5.130 -8.961 1.00 . A A . 3 ARG NH1 1 1 2 305 1 1 3 ARG NH2 N -0.321 -6.560 -8.566 1.00 . A A . 3 ARG NH2 1 1 2 306 1 1 3 ARG O O 4.806 -7.577 -3.349 1.00 . A A . 3 ARG O 1 1 2 307 1 1 4 GLY C C 7.492 -7.731 -2.644 1.00 . A A . 4 GLY C 1 1 2 308 1 1 4 GLY CA C 7.318 -6.464 -3.457 1.00 . A A . 4 GLY CA 1 1 2 309 1 1 4 GLY H H 6.137 -4.795 -2.908 1.00 . A A . 4 GLY H 1 1 2 310 1 1 4 GLY HA2 H 7.292 -6.722 -4.506 1.00 . A A . 4 GLY HA2 1 1 2 311 1 1 4 GLY HA3 H 8.162 -5.815 -3.278 1.00 . A A . 4 GLY HA3 1 1 2 312 1 1 4 GLY N N 6.100 -5.751 -3.120 1.00 . A A . 4 GLY N 1 1 2 313 1 1 4 GLY O O 8.268 -8.612 -3.013 1.00 . A A . 4 GLY O 1 1 2 314 1 1 5 TRP C C 6.563 -10.269 -1.442 1.00 . A A . 5 TRP C 1 1 2 315 1 1 5 TRP CA C 6.851 -8.990 -0.663 1.00 . A A . 5 TRP CA 1 1 2 316 1 1 5 TRP CB C 5.866 -8.855 0.500 1.00 . A A . 5 TRP CB 1 1 2 317 1 1 5 TRP CD1 C 3.575 -7.861 -0.077 1.00 . A A . 5 TRP CD1 1 1 2 318 1 1 5 TRP CD2 C 3.683 -10.091 -0.256 1.00 . A A . 5 TRP CD2 1 1 2 319 1 1 5 TRP CE2 C 2.382 -9.675 -0.597 1.00 . A A . 5 TRP CE2 1 1 2 320 1 1 5 TRP CE3 C 3.988 -11.454 -0.297 1.00 . A A . 5 TRP CE3 1 1 2 321 1 1 5 TRP CG C 4.431 -8.915 0.073 1.00 . A A . 5 TRP CG 1 1 2 322 1 1 5 TRP CH2 C 1.713 -11.904 -1.005 1.00 . A A . 5 TRP CH2 1 1 2 323 1 1 5 TRP CZ2 C 1.388 -10.575 -0.973 1.00 . A A . 5 TRP CZ2 1 1 2 324 1 1 5 TRP CZ3 C 3.000 -12.346 -0.670 1.00 . A A . 5 TRP CZ3 1 1 2 325 1 1 5 TRP H H 6.169 -7.087 -1.291 1.00 . A A . 5 TRP H 1 1 2 326 1 1 5 TRP HA H 7.855 -9.041 -0.269 1.00 . A A . 5 TRP HA 1 1 2 327 1 1 5 TRP HB2 H 6.039 -9.654 1.205 1.00 . A A . 5 TRP HB2 1 1 2 328 1 1 5 TRP HB3 H 6.029 -7.906 0.991 1.00 . A A . 5 TRP HB3 1 1 2 329 1 1 5 TRP HD1 H 3.843 -6.831 0.100 1.00 . A A . 5 TRP HD1 1 1 2 330 1 1 5 TRP HE1 H 1.559 -7.746 -0.656 1.00 . A A . 5 TRP HE1 1 1 2 331 1 1 5 TRP HE3 H 4.973 -11.815 -0.042 1.00 . A A . 5 TRP HE3 1 1 2 332 1 1 5 TRP HH2 H 0.973 -12.636 -1.290 1.00 . A A . 5 TRP HH2 1 1 2 333 1 1 5 TRP HZ2 H 0.391 -10.250 -1.235 1.00 . A A . 5 TRP HZ2 1 1 2 334 1 1 5 TRP HZ3 H 3.216 -13.404 -0.707 1.00 . A A . 5 TRP HZ3 1 1 2 335 1 1 5 TRP N N 6.770 -7.822 -1.533 1.00 . A A . 5 TRP N 1 1 2 336 1 1 5 TRP NE1 N 2.341 -8.311 -0.480 1.00 . A A . 5 TRP NE1 1 1 2 337 1 1 5 TRP O O 7.143 -11.320 -1.166 1.00 . A A . 5 TRP O 1 1 2 338 1 1 6 LYS C C 6.358 -11.585 -4.306 1.00 . A A . 6 LYS C 1 1 2 339 1 1 6 LYS CA C 5.302 -11.323 -3.237 1.00 . A A . 6 LYS CA 1 1 2 340 1 1 6 LYS CB C 3.940 -11.095 -3.896 1.00 . A A . 6 LYS CB 1 1 2 341 1 1 6 LYS CD C 4.038 -11.575 -6.360 1.00 . A A . 6 LYS CD 1 1 2 342 1 1 6 LYS CE C 2.841 -11.410 -7.284 1.00 . A A . 6 LYS CE 1 1 2 343 1 1 6 LYS CG C 3.620 -12.094 -4.994 1.00 . A A . 6 LYS CG 1 1 2 344 1 1 6 LYS H H 5.237 -9.309 -2.589 1.00 . A A . 6 LYS H 1 1 2 345 1 1 6 LYS HA H 5.239 -12.186 -2.591 1.00 . A A . 6 LYS HA 1 1 2 346 1 1 6 LYS HB2 H 3.171 -11.164 -3.140 1.00 . A A . 6 LYS HB2 1 1 2 347 1 1 6 LYS HB3 H 3.923 -10.103 -4.325 1.00 . A A . 6 LYS HB3 1 1 2 348 1 1 6 LYS HD2 H 4.519 -10.616 -6.239 1.00 . A A . 6 LYS HD2 1 1 2 349 1 1 6 LYS HD3 H 4.731 -12.275 -6.805 1.00 . A A . 6 LYS HD3 1 1 2 350 1 1 6 LYS HE2 H 2.009 -11.030 -6.710 1.00 . A A . 6 LYS HE2 1 1 2 351 1 1 6 LYS HE3 H 3.096 -10.703 -8.059 1.00 . A A . 6 LYS HE3 1 1 2 352 1 1 6 LYS HG2 H 4.147 -13.016 -4.795 1.00 . A A . 6 LYS HG2 1 1 2 353 1 1 6 LYS HG3 H 2.555 -12.281 -5.000 1.00 . A A . 6 LYS HG3 1 1 2 354 1 1 6 LYS HZ1 H 3.084 -13.460 -7.606 1.00 . A A . 6 LYS HZ1 1 1 2 355 1 1 6 LYS HZ2 H 2.494 -12.620 -8.951 1.00 . A A . 6 LYS HZ2 1 1 2 356 1 1 6 LYS HZ3 H 1.472 -12.947 -7.643 1.00 . A A . 6 LYS HZ3 1 1 2 357 1 1 6 LYS N N 5.665 -10.174 -2.416 1.00 . A A . 6 LYS N 1 1 2 358 1 1 6 LYS NZ N 2.445 -12.700 -7.915 1.00 . A A . 6 LYS NZ 1 1 2 359 1 1 6 LYS O O 6.374 -12.646 -4.930 1.00 . A A . 6 LYS O 1 1 2 360 1 1 7 ARG C C 9.406 -11.662 -5.005 1.00 . A A . 7 ARG C 1 1 2 361 1 1 7 ARG CA C 8.300 -10.737 -5.504 1.00 . A A . 7 ARG CA 1 1 2 362 1 1 7 ARG CB C 8.882 -9.362 -5.836 1.00 . A A . 7 ARG CB 1 1 2 363 1 1 7 ARG CD C 8.496 -7.050 -6.743 1.00 . A A . 7 ARG CD 1 1 2 364 1 1 7 ARG CG C 7.863 -8.393 -6.414 1.00 . A A . 7 ARG CG 1 1 2 365 1 1 7 ARG CZ C 8.076 -6.716 -9.142 1.00 . A A . 7 ARG CZ 1 1 2 366 1 1 7 ARG H H 7.176 -9.789 -3.982 1.00 . A A . 7 ARG H 1 1 2 367 1 1 7 ARG HA H 7.868 -11.161 -6.398 1.00 . A A . 7 ARG HA 1 1 2 368 1 1 7 ARG HB2 H 9.287 -8.928 -4.934 1.00 . A A . 7 ARG HB2 1 1 2 369 1 1 7 ARG HB3 H 9.677 -9.486 -6.556 1.00 . A A . 7 ARG HB3 1 1 2 370 1 1 7 ARG HD2 H 7.777 -6.270 -6.545 1.00 . A A . 7 ARG HD2 1 1 2 371 1 1 7 ARG HD3 H 9.361 -6.911 -6.112 1.00 . A A . 7 ARG HD3 1 1 2 372 1 1 7 ARG HE H 9.860 -7.109 -8.342 1.00 . A A . 7 ARG HE 1 1 2 373 1 1 7 ARG HG2 H 7.452 -8.816 -7.319 1.00 . A A . 7 ARG HG2 1 1 2 374 1 1 7 ARG HG3 H 7.074 -8.243 -5.693 1.00 . A A . 7 ARG HG3 1 1 2 375 1 1 7 ARG HH11 H 6.442 -6.564 -7.963 1.00 . A A . 7 ARG HH11 1 1 2 376 1 1 7 ARG HH12 H 6.160 -6.330 -9.657 1.00 . A A . 7 ARG HH12 1 1 2 377 1 1 7 ARG HH21 H 9.501 -6.803 -10.573 1.00 . A A . 7 ARG HH21 1 1 2 378 1 1 7 ARG HH22 H 7.900 -6.467 -11.140 1.00 . A A . 7 ARG HH22 1 1 2 379 1 1 7 ARG N N 7.240 -10.612 -4.511 1.00 . A A . 7 ARG N 1 1 2 380 1 1 7 ARG NE N 8.911 -6.968 -8.141 1.00 . A A . 7 ARG NE 1 1 2 381 1 1 7 ARG NH1 N 6.787 -6.521 -8.901 1.00 . A A . 7 ARG NH1 1 1 2 382 1 1 7 ARG NH2 N 8.529 -6.657 -10.388 1.00 . A A . 7 ARG NH2 1 1 2 383 1 1 7 ARG O O 9.502 -12.816 -5.424 1.00 . A A . 7 ARG O 1 1 2 384 1 1 8 LYS C C 10.919 -12.606 -2.248 1.00 . A A . 8 LYS C 1 1 2 385 1 1 8 LYS CA C 11.338 -11.928 -3.548 1.00 . A A . 8 LYS CA 1 1 2 386 1 1 8 LYS CB C 12.552 -11.029 -3.298 1.00 . A A . 8 LYS CB 1 1 2 387 1 1 8 LYS CD C 14.204 -9.398 -4.255 1.00 . A A . 8 LYS CD 1 1 2 388 1 1 8 LYS CE C 15.486 -10.043 -3.751 1.00 . A A . 8 LYS CE 1 1 2 389 1 1 8 LYS CG C 13.142 -10.438 -4.567 1.00 . A A . 8 LYS CG 1 1 2 390 1 1 8 LYS H H 10.111 -10.223 -3.810 1.00 . A A . 8 LYS H 1 1 2 391 1 1 8 LYS HA H 11.605 -12.687 -4.267 1.00 . A A . 8 LYS HA 1 1 2 392 1 1 8 LYS HB2 H 12.256 -10.217 -2.651 1.00 . A A . 8 LYS HB2 1 1 2 393 1 1 8 LYS HB3 H 13.319 -11.609 -2.806 1.00 . A A . 8 LYS HB3 1 1 2 394 1 1 8 LYS HD2 H 14.425 -8.840 -5.154 1.00 . A A . 8 LYS HD2 1 1 2 395 1 1 8 LYS HD3 H 13.827 -8.726 -3.497 1.00 . A A . 8 LYS HD3 1 1 2 396 1 1 8 LYS HE2 H 15.335 -10.365 -2.732 1.00 . A A . 8 LYS HE2 1 1 2 397 1 1 8 LYS HE3 H 15.709 -10.900 -4.370 1.00 . A A . 8 LYS HE3 1 1 2 398 1 1 8 LYS HG2 H 13.589 -11.231 -5.148 1.00 . A A . 8 LYS HG2 1 1 2 399 1 1 8 LYS HG3 H 12.351 -9.972 -5.138 1.00 . A A . 8 LYS HG3 1 1 2 400 1 1 8 LYS HZ1 H 16.300 -8.132 -3.972 1.00 . A A . 8 LYS HZ1 1 1 2 401 1 1 8 LYS HZ2 H 17.291 -9.371 -4.558 1.00 . A A . 8 LYS HZ2 1 1 2 402 1 1 8 LYS HZ3 H 17.150 -9.119 -2.892 1.00 . A A . 8 LYS HZ3 1 1 2 403 1 1 8 LYS N N 10.239 -11.149 -4.106 1.00 . A A . 8 LYS N 1 1 2 404 1 1 8 LYS NZ N 16.637 -9.100 -3.797 1.00 . A A . 8 LYS NZ 1 1 2 405 1 1 8 LYS O O 10.575 -13.789 -2.237 1.00 . A A . 8 LYS O 1 1 2 406 1 1 9 CYS C C 9.283 -11.732 0.648 1.00 . A A . 9 CYS C 1 1 2 407 1 1 9 CYS CA C 10.571 -12.380 0.150 1.00 . A A . 9 CYS CA 1 1 2 408 1 1 9 CYS CB C 11.695 -12.151 1.161 1.00 . A A . 9 CYS CB 1 1 2 409 1 1 9 CYS H H 11.231 -10.916 -1.228 1.00 . A A . 9 CYS H 1 1 2 410 1 1 9 CYS HA H 10.406 -13.442 0.042 1.00 . A A . 9 CYS HA 1 1 2 411 1 1 9 CYS HB2 H 11.744 -11.100 1.402 1.00 . A A . 9 CYS HB2 1 1 2 412 1 1 9 CYS HB3 H 11.480 -12.710 2.060 1.00 . A A . 9 CYS HB3 1 1 2 413 1 1 9 CYS HG H 13.199 -13.820 -0.044 1.00 . A A . 9 CYS HG 1 1 2 414 1 1 9 CYS N N 10.948 -11.851 -1.156 1.00 . A A . 9 CYS N 1 1 2 415 1 1 9 CYS O O 9.129 -10.511 0.635 1.00 . A A . 9 CYS O 1 1 2 416 1 1 9 CYS SG S 13.329 -12.657 0.575 1.00 . A A . 9 CYS SG 1 1 2 417 1 1 10 PRO C C 7.174 -11.374 2.941 1.00 . A A . 10 PRO C 1 1 2 418 1 1 10 PRO CA C 7.042 -12.098 1.605 1.00 . A A . 10 PRO CA 1 1 2 419 1 1 10 PRO CB C 6.237 -13.389 1.774 1.00 . A A . 10 PRO CB 1 1 2 420 1 1 10 PRO CD C 8.450 -14.035 1.141 1.00 . A A . 10 PRO CD 1 1 2 421 1 1 10 PRO CG C 7.263 -14.453 1.963 1.00 . A A . 10 PRO CG 1 1 2 422 1 1 10 PRO HA H 6.546 -11.453 0.895 1.00 . A A . 10 PRO HA 1 1 2 423 1 1 10 PRO HB2 H 5.591 -13.304 2.637 1.00 . A A . 10 PRO HB2 1 1 2 424 1 1 10 PRO HB3 H 5.644 -13.566 0.889 1.00 . A A . 10 PRO HB3 1 1 2 425 1 1 10 PRO HD2 H 9.368 -14.335 1.624 1.00 . A A . 10 PRO HD2 1 1 2 426 1 1 10 PRO HD3 H 8.389 -14.456 0.148 1.00 . A A . 10 PRO HD3 1 1 2 427 1 1 10 PRO HG2 H 7.534 -14.521 3.006 1.00 . A A . 10 PRO HG2 1 1 2 428 1 1 10 PRO HG3 H 6.879 -15.399 1.612 1.00 . A A . 10 PRO HG3 1 1 2 429 1 1 10 PRO N N 8.334 -12.568 1.096 1.00 . A A . 10 PRO N 1 1 2 430 1 1 10 PRO O O 6.226 -10.745 3.414 1.00 . A A . 10 PRO O 1 1 2 431 1 1 11 LEU C C 8.648 -9.303 4.673 1.00 . A A . 11 LEU C 1 1 2 432 1 1 11 LEU CA C 8.610 -10.820 4.827 1.00 . A A . 11 LEU CA 1 1 2 433 1 1 11 LEU CB C 9.930 -11.318 5.417 1.00 . A A . 11 LEU CB 1 1 2 434 1 1 11 LEU CD1 C 11.884 -9.797 5.027 1.00 . A A . 11 LEU CD1 1 1 2 435 1 1 11 LEU CD2 C 12.123 -12.258 4.649 1.00 . A A . 11 LEU CD2 1 1 2 436 1 1 11 LEU CG C 11.180 -11.066 4.573 1.00 . A A . 11 LEU CG 1 1 2 437 1 1 11 LEU H H 9.070 -11.982 3.119 1.00 . A A . 11 LEU H 1 1 2 438 1 1 11 LEU HA H 7.804 -11.081 5.497 1.00 . A A . 11 LEU HA 1 1 2 439 1 1 11 LEU HB2 H 10.071 -10.830 6.370 1.00 . A A . 11 LEU HB2 1 1 2 440 1 1 11 LEU HB3 H 9.842 -12.384 5.570 1.00 . A A . 11 LEU HB3 1 1 2 441 1 1 11 LEU HD11 H 12.720 -9.596 4.374 1.00 . A A . 11 LEU HD11 1 1 2 442 1 1 11 LEU HD12 H 12.240 -9.925 6.038 1.00 . A A . 11 LEU HD12 1 1 2 443 1 1 11 LEU HD13 H 11.191 -8.969 4.992 1.00 . A A . 11 LEU HD13 1 1 2 444 1 1 11 LEU HD21 H 11.679 -13.101 4.141 1.00 . A A . 11 LEU HD21 1 1 2 445 1 1 11 LEU HD22 H 12.300 -12.512 5.683 1.00 . A A . 11 LEU HD22 1 1 2 446 1 1 11 LEU HD23 H 13.061 -12.005 4.175 1.00 . A A . 11 LEU HD23 1 1 2 447 1 1 11 LEU HG H 10.888 -10.934 3.540 1.00 . A A . 11 LEU HG 1 1 2 448 1 1 11 LEU N N 8.354 -11.467 3.545 1.00 . A A . 11 LEU N 1 1 2 449 1 1 11 LEU O O 8.682 -8.569 5.661 1.00 . A A . 11 LEU O 1 1 2 450 1 1 12 PHE C C 7.292 -6.788 3.317 1.00 . A A . 12 PHE C 1 1 2 451 1 1 12 PHE CA C 8.675 -7.409 3.144 1.00 . A A . 12 PHE CA 1 1 2 452 1 1 12 PHE CB C 9.183 -7.161 1.723 1.00 . A A . 12 PHE CB 1 1 2 453 1 1 12 PHE CD1 C 11.278 -8.543 1.727 1.00 . A A . 12 PHE CD1 1 1 2 454 1 1 12 PHE CD2 C 11.466 -6.202 1.314 1.00 . A A . 12 PHE CD2 1 1 2 455 1 1 12 PHE CE1 C 12.648 -8.678 1.600 1.00 . A A . 12 PHE CE1 1 1 2 456 1 1 12 PHE CE2 C 12.836 -6.332 1.186 1.00 . A A . 12 PHE CE2 1 1 2 457 1 1 12 PHE CG C 10.672 -7.305 1.585 1.00 . A A . 12 PHE CG 1 1 2 458 1 1 12 PHE CZ C 13.427 -7.571 1.331 1.00 . A A . 12 PHE CZ 1 1 2 459 1 1 12 PHE H H 8.615 -9.474 2.681 1.00 . A A . 12 PHE H 1 1 2 460 1 1 12 PHE HA H 9.353 -6.948 3.846 1.00 . A A . 12 PHE HA 1 1 2 461 1 1 12 PHE HB2 H 8.719 -7.869 1.053 1.00 . A A . 12 PHE HB2 1 1 2 462 1 1 12 PHE HB3 H 8.916 -6.159 1.422 1.00 . A A . 12 PHE HB3 1 1 2 463 1 1 12 PHE HD1 H 10.668 -9.410 1.939 1.00 . A A . 12 PHE HD1 1 1 2 464 1 1 12 PHE HD2 H 11.005 -5.231 1.201 1.00 . A A . 12 PHE HD2 1 1 2 465 1 1 12 PHE HE1 H 13.107 -9.649 1.714 1.00 . A A . 12 PHE HE1 1 1 2 466 1 1 12 PHE HE2 H 13.443 -5.464 0.975 1.00 . A A . 12 PHE HE2 1 1 2 467 1 1 12 PHE HZ H 14.498 -7.675 1.231 1.00 . A A . 12 PHE HZ 1 1 2 468 1 1 12 PHE N N 8.642 -8.839 3.428 1.00 . A A . 12 PHE N 1 1 2 469 1 1 12 PHE O O 6.750 -6.184 2.392 1.00 . A A . 12 PHE O 1 1 2 470 1 1 13 GLY C C 5.389 -4.878 4.716 1.00 . A A . 13 GLY C 1 1 2 471 1 1 13 GLY CA C 5.410 -6.392 4.784 1.00 . A A . 13 GLY CA 1 1 2 472 1 1 13 GLY H H 7.204 -7.433 5.211 1.00 . A A . 13 GLY H 1 1 2 473 1 1 13 GLY HA2 H 4.711 -6.785 4.061 1.00 . A A . 13 GLY HA2 1 1 2 474 1 1 13 GLY HA3 H 5.102 -6.701 5.772 1.00 . A A . 13 GLY HA3 1 1 2 475 1 1 13 GLY N N 6.725 -6.942 4.510 1.00 . A A . 13 GLY N 1 1 2 476 1 1 13 GLY O O 4.337 -4.273 4.509 1.00 . A A . 13 GLY O 1 1 2 477 1 1 14 LYS C C 7.621 -2.370 3.744 1.00 . A A . 14 LYS C 1 1 2 478 1 1 14 LYS CA C 6.667 -2.810 4.850 1.00 . A A . 14 LYS CA 1 1 2 479 1 1 14 LYS CB C 7.152 -2.277 6.200 1.00 . A A . 14 LYS CB 1 1 2 480 1 1 14 LYS CD C 7.777 -4.025 7.891 1.00 . A A . 14 LYS CD 1 1 2 481 1 1 14 LYS CE C 8.210 -3.559 9.273 1.00 . A A . 14 LYS CE 1 1 2 482 1 1 14 LYS CG C 8.282 -3.091 6.805 1.00 . A A . 14 LYS CG 1 1 2 483 1 1 14 LYS H H 7.358 -4.801 5.053 1.00 . A A . 14 LYS H 1 1 2 484 1 1 14 LYS HA H 5.687 -2.407 4.644 1.00 . A A . 14 LYS HA 1 1 2 485 1 1 14 LYS HB2 H 7.496 -1.262 6.069 1.00 . A A . 14 LYS HB2 1 1 2 486 1 1 14 LYS HB3 H 6.323 -2.280 6.893 1.00 . A A . 14 LYS HB3 1 1 2 487 1 1 14 LYS HD2 H 6.698 -4.055 7.855 1.00 . A A . 14 LYS HD2 1 1 2 488 1 1 14 LYS HD3 H 8.173 -5.015 7.714 1.00 . A A . 14 LYS HD3 1 1 2 489 1 1 14 LYS HE2 H 8.183 -2.481 9.299 1.00 . A A . 14 LYS HE2 1 1 2 490 1 1 14 LYS HE3 H 7.520 -3.955 10.004 1.00 . A A . 14 LYS HE3 1 1 2 491 1 1 14 LYS HG2 H 8.747 -3.678 6.027 1.00 . A A . 14 LYS HG2 1 1 2 492 1 1 14 LYS HG3 H 9.010 -2.416 7.233 1.00 . A A . 14 LYS HG3 1 1 2 493 1 1 14 LYS HZ1 H 10.257 -3.228 9.521 1.00 . A A . 14 LYS HZ1 1 1 2 494 1 1 14 LYS HZ2 H 9.877 -4.778 8.959 1.00 . A A . 14 LYS HZ2 1 1 2 495 1 1 14 LYS HZ3 H 9.616 -4.379 10.582 1.00 . A A . 14 LYS HZ3 1 1 2 496 1 1 14 LYS N N 6.554 -4.263 4.892 1.00 . A A . 14 LYS N 1 1 2 497 1 1 14 LYS NZ N 9.586 -4.018 9.607 1.00 . A A . 14 LYS NZ 1 1 2 498 1 1 14 LYS O O 7.503 -1.268 3.211 1.00 . A A . 14 LYS O 1 1 2 499 1 1 15 GLY C C 8.870 -2.705 1.015 1.00 . A A . 15 GLY C 1 1 2 500 1 1 15 GLY CA C 9.528 -2.923 2.364 1.00 . A A . 15 GLY CA 1 1 2 501 1 1 15 GLY H H 8.614 -4.105 3.864 1.00 . A A . 15 GLY H 1 1 2 502 1 1 15 GLY HA2 H 10.061 -2.027 2.642 1.00 . A A . 15 GLY HA2 1 1 2 503 1 1 15 GLY HA3 H 10.232 -3.738 2.279 1.00 . A A . 15 GLY HA3 1 1 2 504 1 1 15 GLY N N 8.568 -3.241 3.405 1.00 . A A . 15 GLY N 1 1 2 505 1 1 15 GLY O O 8.334 -1.631 0.746 1.00 . A A . 15 GLY O 1 1 2 506 1 1 16 GLY C C 9.319 -3.846 -2.266 1.00 . A A . 16 GLY C 1 1 2 507 1 1 16 GLY CA C 8.315 -3.619 -1.153 1.00 . A A . 16 GLY CA 1 1 2 508 1 1 16 GLY H H 9.355 -4.558 0.434 1.00 . A A . 16 GLY H 1 1 2 509 1 1 16 GLY HA2 H 7.526 -4.351 -1.239 1.00 . A A . 16 GLY HA2 1 1 2 510 1 1 16 GLY HA3 H 7.889 -2.632 -1.264 1.00 . A A . 16 GLY HA3 1 1 2 511 1 1 16 GLY N N 8.913 -3.726 0.165 1.00 . A A . 16 GLY N 1 1 2 512 1 1 16 GLY O O 10.491 -3.492 -2.135 1.00 . A A . 16 GLY O 1 1 3 513 1 1 1 VAL C C 3.167 -1.549 -1.259 1.00 . A A . 1 VAL C 1 1 3 514 1 1 1 VAL CA C 1.819 -0.842 -1.344 1.00 . A A . 1 VAL CA 1 1 3 515 1 1 1 VAL CB C 2.052 0.679 -1.395 1.00 . A A . 1 VAL CB 1 1 3 516 1 1 1 VAL CG1 C 0.762 1.405 -1.744 1.00 . A A . 1 VAL CG1 1 1 3 517 1 1 1 VAL CG2 C 2.612 1.177 -0.072 1.00 . A A . 1 VAL CG2 1 1 3 518 1 1 1 VAL H1 H -0.006 -1.067 -0.296 1.00 . A A . 1 VAL H1 1 1 3 519 1 1 1 VAL HA H 1.324 -1.141 -2.257 1.00 . A A . 1 VAL HA 1 1 3 520 1 1 1 VAL HB H 2.776 0.886 -2.170 1.00 . A A . 1 VAL HB 1 1 3 521 1 1 1 VAL HG11 H -0.072 0.725 -1.646 1.00 . A A . 1 VAL HG11 1 1 3 522 1 1 1 VAL HG12 H 0.627 2.242 -1.075 1.00 . A A . 1 VAL HG12 1 1 3 523 1 1 1 VAL HG13 H 0.815 1.763 -2.762 1.00 . A A . 1 VAL HG13 1 1 3 524 1 1 1 VAL HG21 H 3.495 0.609 0.183 1.00 . A A . 1 VAL HG21 1 1 3 525 1 1 1 VAL HG22 H 2.870 2.222 -0.161 1.00 . A A . 1 VAL HG22 1 1 3 526 1 1 1 VAL HG23 H 1.870 1.054 0.703 1.00 . A A . 1 VAL HG23 1 1 3 527 1 1 1 VAL N N 0.961 -1.211 -0.225 1.00 . A A . 1 VAL N 1 1 3 528 1 1 1 VAL O O 4.191 -1.008 -1.675 1.00 . A A . 1 VAL O 1 1 3 529 1 1 2 ALA C C 4.279 -4.863 -1.342 1.00 . A A . 2 ALA C 1 1 3 530 1 1 2 ALA CA C 4.382 -3.546 -0.580 1.00 . A A . 2 ALA CA 1 1 3 531 1 1 2 ALA CB C 4.680 -3.806 0.889 1.00 . A A . 2 ALA CB 1 1 3 532 1 1 2 ALA H H 2.312 -3.141 -0.404 1.00 . A A . 2 ALA H 1 1 3 533 1 1 2 ALA HA H 5.197 -2.967 -0.991 1.00 . A A . 2 ALA HA 1 1 3 534 1 1 2 ALA HB1 H 3.754 -3.986 1.416 1.00 . A A . 2 ALA HB1 1 1 3 535 1 1 2 ALA HB2 H 5.320 -4.670 0.979 1.00 . A A . 2 ALA HB2 1 1 3 536 1 1 2 ALA HB3 H 5.174 -2.945 1.313 1.00 . A A . 2 ALA HB3 1 1 3 537 1 1 2 ALA N N 3.160 -2.763 -0.718 1.00 . A A . 2 ALA N 1 1 3 538 1 1 2 ALA O O 4.462 -5.937 -0.770 1.00 . A A . 2 ALA O 1 1 3 539 1 1 3 ARG C C 5.147 -6.767 -3.473 1.00 . A A . 3 ARG C 1 1 3 540 1 1 3 ARG CA C 3.854 -5.956 -3.474 1.00 . A A . 3 ARG CA 1 1 3 541 1 1 3 ARG CB C 3.492 -5.556 -4.906 1.00 . A A . 3 ARG CB 1 1 3 542 1 1 3 ARG CD C 4.295 -4.903 -7.196 1.00 . A A . 3 ARG CD 1 1 3 543 1 1 3 ARG CG C 4.696 -5.421 -5.823 1.00 . A A . 3 ARG CG 1 1 3 544 1 1 3 ARG CZ C 4.076 -6.903 -8.609 1.00 . A A . 3 ARG CZ 1 1 3 545 1 1 3 ARG H H 3.849 -3.886 -3.034 1.00 . A A . 3 ARG H 1 1 3 546 1 1 3 ARG HA H 3.060 -6.566 -3.068 1.00 . A A . 3 ARG HA 1 1 3 547 1 1 3 ARG HB2 H 2.833 -6.305 -5.321 1.00 . A A . 3 ARG HB2 1 1 3 548 1 1 3 ARG HB3 H 2.976 -4.608 -4.882 1.00 . A A . 3 ARG HB3 1 1 3 549 1 1 3 ARG HD2 H 3.220 -4.810 -7.231 1.00 . A A . 3 ARG HD2 1 1 3 550 1 1 3 ARG HD3 H 4.745 -3.933 -7.345 1.00 . A A . 3 ARG HD3 1 1 3 551 1 1 3 ARG HE H 5.544 -5.560 -8.753 1.00 . A A . 3 ARG HE 1 1 3 552 1 1 3 ARG HG2 H 5.398 -4.730 -5.381 1.00 . A A . 3 ARG HG2 1 1 3 553 1 1 3 ARG HG3 H 5.162 -6.389 -5.935 1.00 . A A . 3 ARG HG3 1 1 3 554 1 1 3 ARG HH11 H 2.621 -6.676 -7.226 1.00 . A A . 3 ARG HH11 1 1 3 555 1 1 3 ARG HH12 H 2.479 -8.081 -8.229 1.00 . A A . 3 ARG HH12 1 1 3 556 1 1 3 ARG HH21 H 5.368 -7.407 -10.080 1.00 . A A . 3 ARG HH21 1 1 3 557 1 1 3 ARG HH22 H 4.043 -8.497 -9.851 1.00 . A A . 3 ARG HH22 1 1 3 558 1 1 3 ARG N N 3.983 -4.771 -2.635 1.00 . A A . 3 ARG N 1 1 3 559 1 1 3 ARG NE N 4.728 -5.797 -8.266 1.00 . A A . 3 ARG NE 1 1 3 560 1 1 3 ARG NH1 N 2.968 -7.249 -7.968 1.00 . A A . 3 ARG NH1 1 1 3 561 1 1 3 ARG NH2 N 4.533 -7.665 -9.594 1.00 . A A . 3 ARG NH2 1 1 3 562 1 1 3 ARG O O 5.144 -7.960 -3.777 1.00 . A A . 3 ARG O 1 1 3 563 1 1 4 GLY C C 7.521 -8.014 -2.206 1.00 . A A . 4 GLY C 1 1 3 564 1 1 4 GLY CA C 7.535 -6.786 -3.095 1.00 . A A . 4 GLY CA 1 1 3 565 1 1 4 GLY H H 6.193 -5.161 -2.896 1.00 . A A . 4 GLY H 1 1 3 566 1 1 4 GLY HA2 H 7.799 -7.084 -4.099 1.00 . A A . 4 GLY HA2 1 1 3 567 1 1 4 GLY HA3 H 8.281 -6.098 -2.727 1.00 . A A . 4 GLY HA3 1 1 3 568 1 1 4 GLY N N 6.251 -6.111 -3.129 1.00 . A A . 4 GLY N 1 1 3 569 1 1 4 GLY O O 8.364 -8.900 -2.348 1.00 . A A . 4 GLY O 1 1 3 570 1 1 5 TRP C C 6.158 -10.485 -1.130 1.00 . A A . 5 TRP C 1 1 3 571 1 1 5 TRP CA C 6.445 -9.194 -0.371 1.00 . A A . 5 TRP CA 1 1 3 572 1 1 5 TRP CB C 5.339 -8.933 0.652 1.00 . A A . 5 TRP CB 1 1 3 573 1 1 5 TRP CD1 C 3.429 -8.624 -1.029 1.00 . A A . 5 TRP CD1 1 1 3 574 1 1 5 TRP CD2 C 2.939 -9.985 0.681 1.00 . A A . 5 TRP CD2 1 1 3 575 1 1 5 TRP CE2 C 1.815 -9.901 -0.163 1.00 . A A . 5 TRP CE2 1 1 3 576 1 1 5 TRP CE3 C 2.865 -10.786 1.823 1.00 . A A . 5 TRP CE3 1 1 3 577 1 1 5 TRP CG C 3.961 -9.161 0.108 1.00 . A A . 5 TRP CG 1 1 3 578 1 1 5 TRP CH2 C 0.588 -11.365 1.227 1.00 . A A . 5 TRP CH2 1 1 3 579 1 1 5 TRP CZ2 C 0.633 -10.588 0.101 1.00 . A A . 5 TRP CZ2 1 1 3 580 1 1 5 TRP CZ3 C 1.692 -11.467 2.085 1.00 . A A . 5 TRP CZ3 1 1 3 581 1 1 5 TRP H H 5.921 -7.329 -1.224 1.00 . A A . 5 TRP H 1 1 3 582 1 1 5 TRP HA H 7.386 -9.298 0.149 1.00 . A A . 5 TRP HA 1 1 3 583 1 1 5 TRP HB2 H 5.476 -9.589 1.498 1.00 . A A . 5 TRP HB2 1 1 3 584 1 1 5 TRP HB3 H 5.401 -7.906 0.984 1.00 . A A . 5 TRP HB3 1 1 3 585 1 1 5 TRP HD1 H 3.957 -7.952 -1.689 1.00 . A A . 5 TRP HD1 1 1 3 586 1 1 5 TRP HE1 H 1.547 -8.820 -1.942 1.00 . A A . 5 TRP HE1 1 1 3 587 1 1 5 TRP HE3 H 3.705 -10.877 2.497 1.00 . A A . 5 TRP HE3 1 1 3 588 1 1 5 TRP HH2 H -0.308 -11.914 1.470 1.00 . A A . 5 TRP HH2 1 1 3 589 1 1 5 TRP HZ2 H -0.226 -10.520 -0.551 1.00 . A A . 5 TRP HZ2 1 1 3 590 1 1 5 TRP HZ3 H 1.616 -12.091 2.963 1.00 . A A . 5 TRP HZ3 1 1 3 591 1 1 5 TRP N N 6.564 -8.066 -1.288 1.00 . A A . 5 TRP N 1 1 3 592 1 1 5 TRP NE1 N 2.139 -9.065 -1.199 1.00 . A A . 5 TRP NE1 1 1 3 593 1 1 5 TRP O O 6.469 -11.578 -0.657 1.00 . A A . 5 TRP O 1 1 3 594 1 1 6 LYS C C 6.343 -11.790 -4.144 1.00 . A A . 6 LYS C 1 1 3 595 1 1 6 LYS CA C 5.233 -11.508 -3.136 1.00 . A A . 6 LYS CA 1 1 3 596 1 1 6 LYS CB C 3.910 -11.277 -3.870 1.00 . A A . 6 LYS CB 1 1 3 597 1 1 6 LYS CD C 2.816 -10.015 -5.747 1.00 . A A . 6 LYS CD 1 1 3 598 1 1 6 LYS CE C 1.729 -11.021 -6.096 1.00 . A A . 6 LYS CE 1 1 3 599 1 1 6 LYS CG C 4.081 -10.707 -5.267 1.00 . A A . 6 LYS CG 1 1 3 600 1 1 6 LYS H H 5.338 -9.454 -2.634 1.00 . A A . 6 LYS H 1 1 3 601 1 1 6 LYS HA H 5.129 -12.363 -2.485 1.00 . A A . 6 LYS HA 1 1 3 602 1 1 6 LYS HB2 H 3.387 -12.218 -3.949 1.00 . A A . 6 LYS HB2 1 1 3 603 1 1 6 LYS HB3 H 3.309 -10.588 -3.294 1.00 . A A . 6 LYS HB3 1 1 3 604 1 1 6 LYS HD2 H 2.452 -9.367 -4.964 1.00 . A A . 6 LYS HD2 1 1 3 605 1 1 6 LYS HD3 H 3.047 -9.429 -6.624 1.00 . A A . 6 LYS HD3 1 1 3 606 1 1 6 LYS HE2 H 2.105 -12.016 -5.912 1.00 . A A . 6 LYS HE2 1 1 3 607 1 1 6 LYS HE3 H 0.872 -10.837 -5.465 1.00 . A A . 6 LYS HE3 1 1 3 608 1 1 6 LYS HG2 H 4.889 -9.990 -5.258 1.00 . A A . 6 LYS HG2 1 1 3 609 1 1 6 LYS HG3 H 4.320 -11.512 -5.948 1.00 . A A . 6 LYS HG3 1 1 3 610 1 1 6 LYS HZ1 H 1.491 -11.815 -8.013 1.00 . A A . 6 LYS HZ1 1 1 3 611 1 1 6 LYS HZ2 H 1.852 -10.162 -7.996 1.00 . A A . 6 LYS HZ2 1 1 3 612 1 1 6 LYS HZ3 H 0.300 -10.693 -7.583 1.00 . A A . 6 LYS HZ3 1 1 3 613 1 1 6 LYS N N 5.562 -10.352 -2.310 1.00 . A A . 6 LYS N 1 1 3 614 1 1 6 LYS NZ N 1.314 -10.916 -7.522 1.00 . A A . 6 LYS NZ 1 1 3 615 1 1 6 LYS O O 6.357 -12.838 -4.789 1.00 . A A . 6 LYS O 1 1 3 616 1 1 7 ARG C C 9.499 -11.838 -4.586 1.00 . A A . 7 ARG C 1 1 3 617 1 1 7 ARG CA C 8.386 -10.996 -5.201 1.00 . A A . 7 ARG CA 1 1 3 618 1 1 7 ARG CB C 8.931 -9.623 -5.599 1.00 . A A . 7 ARG CB 1 1 3 619 1 1 7 ARG CD C 8.481 -7.363 -6.603 1.00 . A A . 7 ARG CD 1 1 3 620 1 1 7 ARG CG C 7.899 -8.726 -6.262 1.00 . A A . 7 ARG CG 1 1 3 621 1 1 7 ARG CZ C 8.971 -7.627 -8.998 1.00 . A A . 7 ARG CZ 1 1 3 622 1 1 7 ARG H H 7.206 -10.034 -3.730 1.00 . A A . 7 ARG H 1 1 3 623 1 1 7 ARG HA H 8.018 -11.497 -6.084 1.00 . A A . 7 ARG HA 1 1 3 624 1 1 7 ARG HB2 H 9.295 -9.122 -4.714 1.00 . A A . 7 ARG HB2 1 1 3 625 1 1 7 ARG HB3 H 9.752 -9.761 -6.287 1.00 . A A . 7 ARG HB3 1 1 3 626 1 1 7 ARG HD2 H 7.671 -6.687 -6.829 1.00 . A A . 7 ARG HD2 1 1 3 627 1 1 7 ARG HD3 H 9.028 -6.997 -5.747 1.00 . A A . 7 ARG HD3 1 1 3 628 1 1 7 ARG HE H 10.340 -7.309 -7.583 1.00 . A A . 7 ARG HE 1 1 3 629 1 1 7 ARG HG2 H 7.558 -9.197 -7.173 1.00 . A A . 7 ARG HG2 1 1 3 630 1 1 7 ARG HG3 H 7.065 -8.594 -5.589 1.00 . A A . 7 ARG HG3 1 1 3 631 1 1 7 ARG HH11 H 7.014 -7.754 -8.511 1.00 . A A . 7 ARG HH11 1 1 3 632 1 1 7 ARG HH12 H 7.373 -7.938 -10.196 1.00 . A A . 7 ARG HH12 1 1 3 633 1 1 7 ARG HH21 H 10.825 -7.550 -9.799 1.00 . A A . 7 ARG HH21 1 1 3 634 1 1 7 ARG HH22 H 9.541 -7.823 -10.927 1.00 . A A . 7 ARG HH22 1 1 3 635 1 1 7 ARG N N 7.272 -10.848 -4.272 1.00 . A A . 7 ARG N 1 1 3 636 1 1 7 ARG NE N 9.382 -7.425 -7.751 1.00 . A A . 7 ARG NE 1 1 3 637 1 1 7 ARG NH1 N 7.680 -7.787 -9.256 1.00 . A A . 7 ARG NH1 1 1 3 638 1 1 7 ARG NH2 N 9.851 -7.670 -9.990 1.00 . A A . 7 ARG NH2 1 1 3 639 1 1 7 ARG O O 9.608 -13.035 -4.854 1.00 . A A . 7 ARG O 1 1 3 640 1 1 8 LYS C C 11.056 -12.290 -1.679 1.00 . A A . 8 LYS C 1 1 3 641 1 1 8 LYS CA C 11.430 -11.895 -3.104 1.00 . A A . 8 LYS CA 1 1 3 642 1 1 8 LYS CB C 12.676 -11.007 -3.089 1.00 . A A . 8 LYS CB 1 1 3 643 1 1 8 LYS CD C 14.267 -9.591 -4.421 1.00 . A A . 8 LYS CD 1 1 3 644 1 1 8 LYS CE C 15.072 -9.536 -5.710 1.00 . A A . 8 LYS CE 1 1 3 645 1 1 8 LYS CG C 13.203 -10.675 -4.474 1.00 . A A . 8 LYS CG 1 1 3 646 1 1 8 LYS H H 10.187 -10.250 -3.585 1.00 . A A . 8 LYS H 1 1 3 647 1 1 8 LYS HA H 11.643 -12.790 -3.669 1.00 . A A . 8 LYS HA 1 1 3 648 1 1 8 LYS HB2 H 12.437 -10.081 -2.586 1.00 . A A . 8 LYS HB2 1 1 3 649 1 1 8 LYS HB3 H 13.457 -11.513 -2.541 1.00 . A A . 8 LYS HB3 1 1 3 650 1 1 8 LYS HD2 H 13.788 -8.636 -4.268 1.00 . A A . 8 LYS HD2 1 1 3 651 1 1 8 LYS HD3 H 14.937 -9.796 -3.597 1.00 . A A . 8 LYS HD3 1 1 3 652 1 1 8 LYS HE2 H 16.111 -9.711 -5.478 1.00 . A A . 8 LYS HE2 1 1 3 653 1 1 8 LYS HE3 H 14.716 -10.310 -6.374 1.00 . A A . 8 LYS HE3 1 1 3 654 1 1 8 LYS HG2 H 13.633 -11.565 -4.909 1.00 . A A . 8 LYS HG2 1 1 3 655 1 1 8 LYS HG3 H 12.383 -10.332 -5.089 1.00 . A A . 8 LYS HG3 1 1 3 656 1 1 8 LYS HZ1 H 15.675 -8.117 -7.119 1.00 . A A . 8 LYS HZ1 1 1 3 657 1 1 8 LYS HZ2 H 15.048 -7.448 -5.698 1.00 . A A . 8 LYS HZ2 1 1 3 658 1 1 8 LYS HZ3 H 14.007 -8.137 -6.838 1.00 . A A . 8 LYS HZ3 1 1 3 659 1 1 8 LYS N N 10.325 -11.206 -3.759 1.00 . A A . 8 LYS N 1 1 3 660 1 1 8 LYS NZ N 14.942 -8.217 -6.389 1.00 . A A . 8 LYS NZ 1 1 3 661 1 1 8 LYS O O 10.699 -13.439 -1.417 1.00 . A A . 8 LYS O 1 1 3 662 1 1 9 CYS C C 9.317 -11.840 0.804 1.00 . A A . 9 CYS C 1 1 3 663 1 1 9 CYS CA C 10.810 -11.580 0.635 1.00 . A A . 9 CYS CA 1 1 3 664 1 1 9 CYS CB C 11.233 -10.391 1.499 1.00 . A A . 9 CYS CB 1 1 3 665 1 1 9 CYS H H 11.432 -10.436 -1.034 1.00 . A A . 9 CYS H 1 1 3 666 1 1 9 CYS HA H 11.354 -12.456 0.953 1.00 . A A . 9 CYS HA 1 1 3 667 1 1 9 CYS HB2 H 11.517 -9.571 0.856 1.00 . A A . 9 CYS HB2 1 1 3 668 1 1 9 CYS HB3 H 10.398 -10.086 2.113 1.00 . A A . 9 CYS HB3 1 1 3 669 1 1 9 CYS HG H 13.453 -9.700 2.545 1.00 . A A . 9 CYS HG 1 1 3 670 1 1 9 CYS N N 11.140 -11.332 -0.764 1.00 . A A . 9 CYS N 1 1 3 671 1 1 9 CYS O O 8.475 -10.998 0.491 1.00 . A A . 9 CYS O 1 1 3 672 1 1 9 CYS SG S 12.629 -10.735 2.597 1.00 . A A . 9 CYS SG 1 1 3 673 1 1 10 PRO C C 6.932 -12.661 2.668 1.00 . A A . 10 PRO C 1 1 3 674 1 1 10 PRO CA C 7.585 -13.436 1.529 1.00 . A A . 10 PRO CA 1 1 3 675 1 1 10 PRO CB C 7.695 -14.921 1.886 1.00 . A A . 10 PRO CB 1 1 3 676 1 1 10 PRO CD C 9.929 -14.089 1.703 1.00 . A A . 10 PRO CD 1 1 3 677 1 1 10 PRO CG C 9.068 -15.076 2.443 1.00 . A A . 10 PRO CG 1 1 3 678 1 1 10 PRO HA H 6.993 -13.323 0.632 1.00 . A A . 10 PRO HA 1 1 3 679 1 1 10 PRO HB2 H 6.940 -15.174 2.617 1.00 . A A . 10 PRO HB2 1 1 3 680 1 1 10 PRO HB3 H 7.559 -15.519 0.998 1.00 . A A . 10 PRO HB3 1 1 3 681 1 1 10 PRO HD2 H 10.694 -13.693 2.354 1.00 . A A . 10 PRO HD2 1 1 3 682 1 1 10 PRO HD3 H 10.372 -14.552 0.834 1.00 . A A . 10 PRO HD3 1 1 3 683 1 1 10 PRO HG2 H 9.063 -14.852 3.499 1.00 . A A . 10 PRO HG2 1 1 3 684 1 1 10 PRO HG3 H 9.421 -16.082 2.272 1.00 . A A . 10 PRO HG3 1 1 3 685 1 1 10 PRO N N 8.978 -13.036 1.308 1.00 . A A . 10 PRO N 1 1 3 686 1 1 10 PRO O O 5.715 -12.709 2.848 1.00 . A A . 10 PRO O 1 1 3 687 1 1 11 LEU C C 7.615 -9.687 4.395 1.00 . A A . 11 LEU C 1 1 3 688 1 1 11 LEU CA C 7.250 -11.159 4.557 1.00 . A A . 11 LEU CA 1 1 3 689 1 1 11 LEU CB C 7.817 -11.695 5.873 1.00 . A A . 11 LEU CB 1 1 3 690 1 1 11 LEU CD1 C 10.066 -11.665 6.980 1.00 . A A . 11 LEU CD1 1 1 3 691 1 1 11 LEU CD2 C 9.266 -13.741 5.837 1.00 . A A . 11 LEU CD2 1 1 3 692 1 1 11 LEU CG C 9.253 -12.219 5.821 1.00 . A A . 11 LEU CG 1 1 3 693 1 1 11 LEU H H 8.709 -11.947 3.242 1.00 . A A . 11 LEU H 1 1 3 694 1 1 11 LEU HA H 6.174 -11.251 4.575 1.00 . A A . 11 LEU HA 1 1 3 695 1 1 11 LEU HB2 H 7.784 -10.896 6.597 1.00 . A A . 11 LEU HB2 1 1 3 696 1 1 11 LEU HB3 H 7.180 -12.504 6.202 1.00 . A A . 11 LEU HB3 1 1 3 697 1 1 11 LEU HD11 H 9.537 -11.838 7.906 1.00 . A A . 11 LEU HD11 1 1 3 698 1 1 11 LEU HD12 H 10.213 -10.604 6.842 1.00 . A A . 11 LEU HD12 1 1 3 699 1 1 11 LEU HD13 H 11.026 -12.160 7.015 1.00 . A A . 11 LEU HD13 1 1 3 700 1 1 11 LEU HD21 H 9.170 -14.091 6.854 1.00 . A A . 11 LEU HD21 1 1 3 701 1 1 11 LEU HD22 H 10.196 -14.097 5.419 1.00 . A A . 11 LEU HD22 1 1 3 702 1 1 11 LEU HD23 H 8.441 -14.114 5.248 1.00 . A A . 11 LEU HD23 1 1 3 703 1 1 11 LEU HG H 9.717 -11.890 4.901 1.00 . A A . 11 LEU HG 1 1 3 704 1 1 11 LEU N N 7.748 -11.946 3.435 1.00 . A A . 11 LEU N 1 1 3 705 1 1 11 LEU O O 7.705 -8.947 5.375 1.00 . A A . 11 LEU O 1 1 3 706 1 1 12 PHE C C 6.948 -6.981 2.935 1.00 . A A . 12 PHE C 1 1 3 707 1 1 12 PHE CA C 8.176 -7.884 2.860 1.00 . A A . 12 PHE CA 1 1 3 708 1 1 12 PHE CB C 8.816 -7.779 1.474 1.00 . A A . 12 PHE CB 1 1 3 709 1 1 12 PHE CD1 C 9.820 -5.576 2.133 1.00 . A A . 12 PHE CD1 1 1 3 710 1 1 12 PHE CD2 C 11.000 -6.936 0.570 1.00 . A A . 12 PHE CD2 1 1 3 711 1 1 12 PHE CE1 C 10.816 -4.621 2.059 1.00 . A A . 12 PHE CE1 1 1 3 712 1 1 12 PHE CE2 C 11.999 -5.985 0.492 1.00 . A A . 12 PHE CE2 1 1 3 713 1 1 12 PHE CG C 9.900 -6.743 1.391 1.00 . A A . 12 PHE CG 1 1 3 714 1 1 12 PHE CZ C 11.906 -4.825 1.237 1.00 . A A . 12 PHE CZ 1 1 3 715 1 1 12 PHE H H 7.736 -9.905 2.411 1.00 . A A . 12 PHE H 1 1 3 716 1 1 12 PHE HA H 8.890 -7.562 3.602 1.00 . A A . 12 PHE HA 1 1 3 717 1 1 12 PHE HB2 H 9.248 -8.733 1.212 1.00 . A A . 12 PHE HB2 1 1 3 718 1 1 12 PHE HB3 H 8.055 -7.524 0.752 1.00 . A A . 12 PHE HB3 1 1 3 719 1 1 12 PHE HD1 H 8.966 -5.415 2.777 1.00 . A A . 12 PHE HD1 1 1 3 720 1 1 12 PHE HD2 H 11.073 -7.842 -0.014 1.00 . A A . 12 PHE HD2 1 1 3 721 1 1 12 PHE HE1 H 10.740 -3.715 2.643 1.00 . A A . 12 PHE HE1 1 1 3 722 1 1 12 PHE HE2 H 12.850 -6.147 -0.151 1.00 . A A . 12 PHE HE2 1 1 3 723 1 1 12 PHE HZ H 12.686 -4.081 1.178 1.00 . A A . 12 PHE HZ 1 1 3 724 1 1 12 PHE N N 7.822 -9.268 3.151 1.00 . A A . 12 PHE N 1 1 3 725 1 1 12 PHE O O 6.628 -6.270 1.983 1.00 . A A . 12 PHE O 1 1 3 726 1 1 13 GLY C C 5.384 -4.869 4.910 1.00 . A A . 13 GLY C 1 1 3 727 1 1 13 GLY CA C 5.077 -6.200 4.252 1.00 . A A . 13 GLY CA 1 1 3 728 1 1 13 GLY H H 6.564 -7.604 4.798 1.00 . A A . 13 GLY H 1 1 3 729 1 1 13 GLY HA2 H 4.630 -6.017 3.286 1.00 . A A . 13 GLY HA2 1 1 3 730 1 1 13 GLY HA3 H 4.372 -6.738 4.868 1.00 . A A . 13 GLY HA3 1 1 3 731 1 1 13 GLY N N 6.262 -7.017 4.073 1.00 . A A . 13 GLY N 1 1 3 732 1 1 13 GLY O O 4.520 -4.270 5.551 1.00 . A A . 13 GLY O 1 1 3 733 1 1 14 LYS C C 7.491 -2.162 4.253 1.00 . A A . 14 LYS C 1 1 3 734 1 1 14 LYS CA C 7.039 -3.136 5.337 1.00 . A A . 14 LYS CA 1 1 3 735 1 1 14 LYS CB C 8.174 -3.363 6.338 1.00 . A A . 14 LYS CB 1 1 3 736 1 1 14 LYS CD C 10.653 -3.760 6.244 1.00 . A A . 14 LYS CD 1 1 3 737 1 1 14 LYS CE C 10.982 -4.207 7.660 1.00 . A A . 14 LYS CE 1 1 3 738 1 1 14 LYS CG C 9.284 -4.255 5.807 1.00 . A A . 14 LYS CG 1 1 3 739 1 1 14 LYS H H 7.263 -4.927 4.231 1.00 . A A . 14 LYS H 1 1 3 740 1 1 14 LYS HA H 6.193 -2.712 5.855 1.00 . A A . 14 LYS HA 1 1 3 741 1 1 14 LYS HB2 H 8.603 -2.408 6.601 1.00 . A A . 14 LYS HB2 1 1 3 742 1 1 14 LYS HB3 H 7.767 -3.822 7.227 1.00 . A A . 14 LYS HB3 1 1 3 743 1 1 14 LYS HD2 H 11.400 -4.155 5.571 1.00 . A A . 14 LYS HD2 1 1 3 744 1 1 14 LYS HD3 H 10.665 -2.680 6.204 1.00 . A A . 14 LYS HD3 1 1 3 745 1 1 14 LYS HE2 H 10.269 -3.763 8.338 1.00 . A A . 14 LYS HE2 1 1 3 746 1 1 14 LYS HE3 H 10.905 -5.283 7.711 1.00 . A A . 14 LYS HE3 1 1 3 747 1 1 14 LYS HG2 H 9.139 -5.257 6.183 1.00 . A A . 14 LYS HG2 1 1 3 748 1 1 14 LYS HG3 H 9.241 -4.263 4.727 1.00 . A A . 14 LYS HG3 1 1 3 749 1 1 14 LYS HZ1 H 13.041 -4.079 7.336 1.00 . A A . 14 LYS HZ1 1 1 3 750 1 1 14 LYS HZ2 H 12.613 -4.257 8.963 1.00 . A A . 14 LYS HZ2 1 1 3 751 1 1 14 LYS HZ3 H 12.400 -2.768 8.191 1.00 . A A . 14 LYS HZ3 1 1 3 752 1 1 14 LYS N N 6.619 -4.404 4.753 1.00 . A A . 14 LYS N 1 1 3 753 1 1 14 LYS NZ N 12.355 -3.799 8.065 1.00 . A A . 14 LYS NZ 1 1 3 754 1 1 14 LYS O O 7.326 -0.950 4.387 1.00 . A A . 14 LYS O 1 1 3 755 1 1 15 GLY C C 7.824 -2.175 0.780 1.00 . A A . 15 GLY C 1 1 3 756 1 1 15 GLY CA C 8.524 -1.864 2.088 1.00 . A A . 15 GLY CA 1 1 3 757 1 1 15 GLY H H 8.165 -3.673 3.127 1.00 . A A . 15 GLY H 1 1 3 758 1 1 15 GLY HA2 H 8.348 -0.829 2.341 1.00 . A A . 15 GLY HA2 1 1 3 759 1 1 15 GLY HA3 H 9.586 -2.016 1.959 1.00 . A A . 15 GLY HA3 1 1 3 760 1 1 15 GLY N N 8.060 -2.700 3.179 1.00 . A A . 15 GLY N 1 1 3 761 1 1 15 GLY O O 6.803 -1.570 0.455 1.00 . A A . 15 GLY O 1 1 3 762 1 1 16 GLY C C 8.823 -3.681 -2.335 1.00 . A A . 16 GLY C 1 1 3 763 1 1 16 GLY CA C 7.785 -3.493 -1.247 1.00 . A A . 16 GLY CA 1 1 3 764 1 1 16 GLY H H 9.190 -3.569 0.335 1.00 . A A . 16 GLY H 1 1 3 765 1 1 16 GLY HA2 H 7.239 -4.416 -1.121 1.00 . A A . 16 GLY HA2 1 1 3 766 1 1 16 GLY HA3 H 7.097 -2.718 -1.552 1.00 . A A . 16 GLY HA3 1 1 3 767 1 1 16 GLY N N 8.375 -3.121 0.025 1.00 . A A . 16 GLY N 1 1 3 768 1 1 16 GLY O O 9.555 -2.750 -2.671 1.00 . A A . 16 GLY O 1 1 4 769 1 1 1 VAL C C 2.946 -1.343 -0.684 1.00 . A A . 1 VAL C 1 1 4 770 1 1 1 VAL CA C 1.567 -0.714 -0.526 1.00 . A A . 1 VAL CA 1 1 4 771 1 1 1 VAL CB C 1.647 0.775 -0.913 1.00 . A A . 1 VAL CB 1 1 4 772 1 1 1 VAL CG1 C 0.253 1.372 -1.030 1.00 . A A . 1 VAL CG1 1 1 4 773 1 1 1 VAL CG2 C 2.482 1.544 0.099 1.00 . A A . 1 VAL CG2 1 1 4 774 1 1 1 VAL H1 H 1.573 -1.431 1.465 1.00 . A A . 1 VAL H1 1 1 4 775 1 1 1 VAL HA H 0.879 -1.203 -1.201 1.00 . A A . 1 VAL HA 1 1 4 776 1 1 1 VAL HB H 2.128 0.850 -1.877 1.00 . A A . 1 VAL HB 1 1 4 777 1 1 1 VAL HG11 H 0.301 2.291 -1.595 1.00 . A A . 1 VAL HG11 1 1 4 778 1 1 1 VAL HG12 H -0.398 0.672 -1.534 1.00 . A A . 1 VAL HG12 1 1 4 779 1 1 1 VAL HG13 H -0.135 1.577 -0.043 1.00 . A A . 1 VAL HG13 1 1 4 780 1 1 1 VAL HG21 H 3.483 1.141 0.121 1.00 . A A . 1 VAL HG21 1 1 4 781 1 1 1 VAL HG22 H 2.518 2.586 -0.183 1.00 . A A . 1 VAL HG22 1 1 4 782 1 1 1 VAL HG23 H 2.035 1.452 1.079 1.00 . A A . 1 VAL HG23 1 1 4 783 1 1 1 VAL N N 1.064 -0.884 0.832 1.00 . A A . 1 VAL N 1 1 4 784 1 1 1 VAL O O 3.818 -0.793 -1.356 1.00 . A A . 1 VAL O 1 1 4 785 1 1 2 ALA C C 4.259 -4.537 -0.865 1.00 . A A . 2 ALA C 1 1 4 786 1 1 2 ALA CA C 4.410 -3.208 -0.133 1.00 . A A . 2 ALA CA 1 1 4 787 1 1 2 ALA CB C 4.970 -3.433 1.264 1.00 . A A . 2 ALA CB 1 1 4 788 1 1 2 ALA H H 2.404 -2.890 0.460 1.00 . A A . 2 ALA H 1 1 4 789 1 1 2 ALA HA H 5.106 -2.586 -0.677 1.00 . A A . 2 ALA HA 1 1 4 790 1 1 2 ALA HB1 H 4.591 -4.366 1.656 1.00 . A A . 2 ALA HB1 1 1 4 791 1 1 2 ALA HB2 H 6.048 -3.472 1.217 1.00 . A A . 2 ALA HB2 1 1 4 792 1 1 2 ALA HB3 H 4.666 -2.621 1.908 1.00 . A A . 2 ALA HB3 1 1 4 793 1 1 2 ALA N N 3.137 -2.501 -0.060 1.00 . A A . 2 ALA N 1 1 4 794 1 1 2 ALA O O 4.442 -5.604 -0.279 1.00 . A A . 2 ALA O 1 1 4 795 1 1 3 ARG C C 5.072 -6.394 -3.148 1.00 . A A . 3 ARG C 1 1 4 796 1 1 3 ARG CA C 3.746 -5.663 -2.961 1.00 . A A . 3 ARG CA 1 1 4 797 1 1 3 ARG CB C 3.156 -5.299 -4.324 1.00 . A A . 3 ARG CB 1 1 4 798 1 1 3 ARG CD C 3.907 -6.467 -6.418 1.00 . A A . 3 ARG CD 1 1 4 799 1 1 3 ARG CG C 2.949 -6.496 -5.238 1.00 . A A . 3 ARG CG 1 1 4 800 1 1 3 ARG CZ C 3.855 -6.909 -8.836 1.00 . A A . 3 ARG CZ 1 1 4 801 1 1 3 ARG H H 3.791 -3.585 -2.561 1.00 . A A . 3 ARG H 1 1 4 802 1 1 3 ARG HA H 3.059 -6.316 -2.443 1.00 . A A . 3 ARG HA 1 1 4 803 1 1 3 ARG HB2 H 2.199 -4.820 -4.173 1.00 . A A . 3 ARG HB2 1 1 4 804 1 1 3 ARG HB3 H 3.821 -4.607 -4.818 1.00 . A A . 3 ARG HB3 1 1 4 805 1 1 3 ARG HD2 H 4.214 -5.447 -6.591 1.00 . A A . 3 ARG HD2 1 1 4 806 1 1 3 ARG HD3 H 4.772 -7.067 -6.177 1.00 . A A . 3 ARG HD3 1 1 4 807 1 1 3 ARG HE H 2.416 -7.421 -7.552 1.00 . A A . 3 ARG HE 1 1 4 808 1 1 3 ARG HG2 H 3.118 -7.401 -4.674 1.00 . A A . 3 ARG HG2 1 1 4 809 1 1 3 ARG HG3 H 1.935 -6.483 -5.608 1.00 . A A . 3 ARG HG3 1 1 4 810 1 1 3 ARG HH11 H 5.511 -5.955 -8.182 1.00 . A A . 3 ARG HH11 1 1 4 811 1 1 3 ARG HH12 H 5.461 -6.273 -9.884 1.00 . A A . 3 ARG HH12 1 1 4 812 1 1 3 ARG HH21 H 2.339 -7.845 -9.792 1.00 . A A . 3 ARG HH21 1 1 4 813 1 1 3 ARG HH22 H 3.656 -7.348 -10.799 1.00 . A A . 3 ARG HH22 1 1 4 814 1 1 3 ARG N N 3.924 -4.465 -2.149 1.00 . A A . 3 ARG N 1 1 4 815 1 1 3 ARG NE N 3.292 -6.990 -7.635 1.00 . A A . 3 ARG NE 1 1 4 816 1 1 3 ARG NH1 N 5.039 -6.331 -8.979 1.00 . A A . 3 ARG NH1 1 1 4 817 1 1 3 ARG NH2 N 3.232 -7.409 -9.896 1.00 . A A . 3 ARG NH2 1 1 4 818 1 1 3 ARG O O 5.104 -7.536 -3.606 1.00 . A A . 3 ARG O 1 1 4 819 1 1 4 GLY C C 7.612 -7.617 -2.139 1.00 . A A . 4 GLY C 1 1 4 820 1 1 4 GLY CA C 7.479 -6.329 -2.927 1.00 . A A . 4 GLY CA 1 1 4 821 1 1 4 GLY H H 6.080 -4.820 -2.431 1.00 . A A . 4 GLY H 1 1 4 822 1 1 4 GLY HA2 H 7.661 -6.537 -3.971 1.00 . A A . 4 GLY HA2 1 1 4 823 1 1 4 GLY HA3 H 8.222 -5.628 -2.576 1.00 . A A . 4 GLY HA3 1 1 4 824 1 1 4 GLY N N 6.166 -5.728 -2.790 1.00 . A A . 4 GLY N 1 1 4 825 1 1 4 GLY O O 8.563 -8.374 -2.331 1.00 . A A . 4 GLY O 1 1 4 826 1 1 5 TRP C C 6.393 -10.308 -1.271 1.00 . A A . 5 TRP C 1 1 4 827 1 1 5 TRP CA C 6.674 -9.070 -0.427 1.00 . A A . 5 TRP CA 1 1 4 828 1 1 5 TRP CB C 5.643 -8.959 0.697 1.00 . A A . 5 TRP CB 1 1 4 829 1 1 5 TRP CD1 C 3.570 -8.376 -0.691 1.00 . A A . 5 TRP CD1 1 1 4 830 1 1 5 TRP CD2 C 3.307 -10.144 0.658 1.00 . A A . 5 TRP CD2 1 1 4 831 1 1 5 TRP CE2 C 2.104 -9.931 -0.043 1.00 . A A . 5 TRP CE2 1 1 4 832 1 1 5 TRP CE3 C 3.379 -11.204 1.566 1.00 . A A . 5 TRP CE3 1 1 4 833 1 1 5 TRP CG C 4.231 -9.138 0.228 1.00 . A A . 5 TRP CG 1 1 4 834 1 1 5 TRP CH2 C 1.083 -11.770 1.032 1.00 . A A . 5 TRP CH2 1 1 4 835 1 1 5 TRP CZ2 C 0.985 -10.740 0.137 1.00 . A A . 5 TRP CZ2 1 1 4 836 1 1 5 TRP CZ3 C 2.267 -12.005 1.744 1.00 . A A . 5 TRP CZ3 1 1 4 837 1 1 5 TRP H H 5.925 -7.222 -1.141 1.00 . A A . 5 TRP H 1 1 4 838 1 1 5 TRP HA H 7.659 -9.161 0.007 1.00 . A A . 5 TRP HA 1 1 4 839 1 1 5 TRP HB2 H 5.847 -9.715 1.440 1.00 . A A . 5 TRP HB2 1 1 4 840 1 1 5 TRP HB3 H 5.722 -7.982 1.153 1.00 . A A . 5 TRP HB3 1 1 4 841 1 1 5 TRP HD1 H 4.001 -7.529 -1.202 1.00 . A A . 5 TRP HD1 1 1 4 842 1 1 5 TRP HE1 H 1.619 -8.468 -1.466 1.00 . A A . 5 TRP HE1 1 1 4 843 1 1 5 TRP HE3 H 4.282 -11.401 2.124 1.00 . A A . 5 TRP HE3 1 1 4 844 1 1 5 TRP HH2 H 0.240 -12.421 1.202 1.00 . A A . 5 TRP HH2 1 1 4 845 1 1 5 TRP HZ2 H 0.065 -10.572 -0.405 1.00 . A A . 5 TRP HZ2 1 1 4 846 1 1 5 TRP HZ3 H 2.304 -12.829 2.441 1.00 . A A . 5 TRP HZ3 1 1 4 847 1 1 5 TRP N N 6.658 -7.865 -1.249 1.00 . A A . 5 TRP N 1 1 4 848 1 1 5 TRP NE1 N 2.290 -8.847 -0.859 1.00 . A A . 5 TRP NE1 1 1 4 849 1 1 5 TRP O O 6.972 -11.371 -1.045 1.00 . A A . 5 TRP O 1 1 4 850 1 1 6 LYS C C 6.258 -11.552 -4.126 1.00 . A A . 6 LYS C 1 1 4 851 1 1 6 LYS CA C 5.142 -11.271 -3.124 1.00 . A A . 6 LYS CA 1 1 4 852 1 1 6 LYS CB C 3.841 -10.959 -3.868 1.00 . A A . 6 LYS CB 1 1 4 853 1 1 6 LYS CD C 4.109 -11.330 -6.337 1.00 . A A . 6 LYS CD 1 1 4 854 1 1 6 LYS CE C 2.995 -11.083 -7.343 1.00 . A A . 6 LYS CE 1 1 4 855 1 1 6 LYS CG C 3.568 -11.893 -5.034 1.00 . A A . 6 LYS CG 1 1 4 856 1 1 6 LYS H H 5.071 -9.292 -2.375 1.00 . A A . 6 LYS H 1 1 4 857 1 1 6 LYS HA H 4.995 -12.148 -2.512 1.00 . A A . 6 LYS HA 1 1 4 858 1 1 6 LYS HB2 H 3.017 -11.033 -3.173 1.00 . A A . 6 LYS HB2 1 1 4 859 1 1 6 LYS HB3 H 3.892 -9.948 -4.247 1.00 . A A . 6 LYS HB3 1 1 4 860 1 1 6 LYS HD2 H 4.610 -10.395 -6.136 1.00 . A A . 6 LYS HD2 1 1 4 861 1 1 6 LYS HD3 H 4.813 -12.034 -6.759 1.00 . A A . 6 LYS HD3 1 1 4 862 1 1 6 LYS HE2 H 2.719 -12.024 -7.793 1.00 . A A . 6 LYS HE2 1 1 4 863 1 1 6 LYS HE3 H 2.143 -10.670 -6.822 1.00 . A A . 6 LYS HE3 1 1 4 864 1 1 6 LYS HG2 H 4.042 -12.844 -4.841 1.00 . A A . 6 LYS HG2 1 1 4 865 1 1 6 LYS HG3 H 2.500 -12.033 -5.128 1.00 . A A . 6 LYS HG3 1 1 4 866 1 1 6 LYS HZ1 H 4.162 -9.507 -8.062 1.00 . A A . 6 LYS HZ1 1 1 4 867 1 1 6 LYS HZ2 H 2.603 -9.560 -8.717 1.00 . A A . 6 LYS HZ2 1 1 4 868 1 1 6 LYS HZ3 H 3.775 -10.664 -9.234 1.00 . A A . 6 LYS HZ3 1 1 4 869 1 1 6 LYS N N 5.500 -10.165 -2.245 1.00 . A A . 6 LYS N 1 1 4 870 1 1 6 LYS NZ N 3.413 -10.137 -8.414 1.00 . A A . 6 LYS NZ 1 1 4 871 1 1 6 LYS O O 6.314 -12.629 -4.720 1.00 . A A . 6 LYS O 1 1 4 872 1 1 7 ARG C C 9.215 -11.817 -4.773 1.00 . A A . 7 ARG C 1 1 4 873 1 1 7 ARG CA C 8.258 -10.722 -5.236 1.00 . A A . 7 ARG CA 1 1 4 874 1 1 7 ARG CB C 9.009 -9.397 -5.373 1.00 . A A . 7 ARG CB 1 1 4 875 1 1 7 ARG CD C 8.527 -9.237 -7.835 1.00 . A A . 7 ARG CD 1 1 4 876 1 1 7 ARG CG C 8.489 -8.515 -6.497 1.00 . A A . 7 ARG CG 1 1 4 877 1 1 7 ARG CZ C 9.317 -8.783 -10.118 1.00 . A A . 7 ARG CZ 1 1 4 878 1 1 7 ARG H H 7.046 -9.743 -3.804 1.00 . A A . 7 ARG H 1 1 4 879 1 1 7 ARG HA H 7.853 -10.998 -6.199 1.00 . A A . 7 ARG HA 1 1 4 880 1 1 7 ARG HB2 H 8.922 -8.849 -4.446 1.00 . A A . 7 ARG HB2 1 1 4 881 1 1 7 ARG HB3 H 10.051 -9.606 -5.562 1.00 . A A . 7 ARG HB3 1 1 4 882 1 1 7 ARG HD2 H 9.233 -10.052 -7.769 1.00 . A A . 7 ARG HD2 1 1 4 883 1 1 7 ARG HD3 H 7.543 -9.629 -8.045 1.00 . A A . 7 ARG HD3 1 1 4 884 1 1 7 ARG HE H 8.905 -7.386 -8.756 1.00 . A A . 7 ARG HE 1 1 4 885 1 1 7 ARG HG2 H 7.469 -8.236 -6.280 1.00 . A A . 7 ARG HG2 1 1 4 886 1 1 7 ARG HG3 H 9.102 -7.628 -6.558 1.00 . A A . 7 ARG HG3 1 1 4 887 1 1 7 ARG HH11 H 9.094 -10.740 -9.669 1.00 . A A . 7 ARG HH11 1 1 4 888 1 1 7 ARG HH12 H 9.650 -10.406 -11.276 1.00 . A A . 7 ARG HH12 1 1 4 889 1 1 7 ARG HH21 H 9.636 -6.933 -10.868 1.00 . A A . 7 ARG HH21 1 1 4 890 1 1 7 ARG HH22 H 9.959 -8.240 -11.956 1.00 . A A . 7 ARG HH22 1 1 4 891 1 1 7 ARG N N 7.144 -10.579 -4.307 1.00 . A A . 7 ARG N 1 1 4 892 1 1 7 ARG NE N 8.928 -8.351 -8.924 1.00 . A A . 7 ARG NE 1 1 4 893 1 1 7 ARG NH1 N 9.357 -10.083 -10.375 1.00 . A A . 7 ARG NH1 1 1 4 894 1 1 7 ARG NH2 N 9.666 -7.914 -11.058 1.00 . A A . 7 ARG NH2 1 1 4 895 1 1 7 ARG O O 9.137 -12.958 -5.227 1.00 . A A . 7 ARG O 1 1 4 896 1 1 8 LYS C C 10.611 -13.004 -2.018 1.00 . A A . 8 LYS C 1 1 4 897 1 1 8 LYS CA C 11.090 -12.411 -3.339 1.00 . A A . 8 LYS CA 1 1 4 898 1 1 8 LYS CB C 12.446 -11.728 -3.141 1.00 . A A . 8 LYS CB 1 1 4 899 1 1 8 LYS CD C 14.265 -10.317 -4.145 1.00 . A A . 8 LYS CD 1 1 4 900 1 1 8 LYS CE C 15.113 -10.137 -5.396 1.00 . A A . 8 LYS CE 1 1 4 901 1 1 8 LYS CG C 13.036 -11.166 -4.423 1.00 . A A . 8 LYS CG 1 1 4 902 1 1 8 LYS H H 10.130 -10.535 -3.541 1.00 . A A . 8 LYS H 1 1 4 903 1 1 8 LYS HA H 11.199 -13.207 -4.059 1.00 . A A . 8 LYS HA 1 1 4 904 1 1 8 LYS HB2 H 12.328 -10.917 -2.438 1.00 . A A . 8 LYS HB2 1 1 4 905 1 1 8 LYS HB3 H 13.142 -12.448 -2.735 1.00 . A A . 8 LYS HB3 1 1 4 906 1 1 8 LYS HD2 H 13.950 -9.345 -3.796 1.00 . A A . 8 LYS HD2 1 1 4 907 1 1 8 LYS HD3 H 14.861 -10.800 -3.384 1.00 . A A . 8 LYS HD3 1 1 4 908 1 1 8 LYS HE2 H 15.904 -9.436 -5.181 1.00 . A A . 8 LYS HE2 1 1 4 909 1 1 8 LYS HE3 H 15.541 -11.092 -5.664 1.00 . A A . 8 LYS HE3 1 1 4 910 1 1 8 LYS HG2 H 13.316 -11.984 -5.070 1.00 . A A . 8 LYS HG2 1 1 4 911 1 1 8 LYS HG3 H 12.291 -10.555 -4.914 1.00 . A A . 8 LYS HG3 1 1 4 912 1 1 8 LYS HZ1 H 14.216 -10.364 -7.269 1.00 . A A . 8 LYS HZ1 1 1 4 913 1 1 8 LYS HZ2 H 14.775 -8.797 -6.962 1.00 . A A . 8 LYS HZ2 1 1 4 914 1 1 8 LYS HZ3 H 13.361 -9.351 -6.218 1.00 . A A . 8 LYS HZ3 1 1 4 915 1 1 8 LYS N N 10.118 -11.460 -3.865 1.00 . A A . 8 LYS N 1 1 4 916 1 1 8 LYS NZ N 14.309 -9.627 -6.541 1.00 . A A . 8 LYS NZ 1 1 4 917 1 1 8 LYS O O 10.138 -14.140 -1.973 1.00 . A A . 8 LYS O 1 1 4 918 1 1 9 CYS C C 9.035 -11.967 0.809 1.00 . A A . 9 CYS C 1 1 4 919 1 1 9 CYS CA C 10.313 -12.678 0.375 1.00 . A A . 9 CYS CA 1 1 4 920 1 1 9 CYS CB C 11.422 -12.429 1.399 1.00 . A A . 9 CYS CB 1 1 4 921 1 1 9 CYS H H 11.120 -11.333 -1.046 1.00 . A A . 9 CYS H 1 1 4 922 1 1 9 CYS HA H 10.120 -13.738 0.318 1.00 . A A . 9 CYS HA 1 1 4 923 1 1 9 CYS HB2 H 11.807 -11.428 1.265 1.00 . A A . 9 CYS HB2 1 1 4 924 1 1 9 CYS HB3 H 11.010 -12.518 2.393 1.00 . A A . 9 CYS HB3 1 1 4 925 1 1 9 CYS HG H 12.978 -13.879 -0.006 1.00 . A A . 9 CYS HG 1 1 4 926 1 1 9 CYS N N 10.735 -12.228 -0.947 1.00 . A A . 9 CYS N 1 1 4 927 1 1 9 CYS O O 8.912 -10.746 0.716 1.00 . A A . 9 CYS O 1 1 4 928 1 1 9 CYS SG S 12.815 -13.575 1.272 1.00 . A A . 9 CYS SG 1 1 4 929 1 1 10 PRO C C 6.902 -11.412 3.039 1.00 . A A . 10 PRO C 1 1 4 930 1 1 10 PRO CA C 6.772 -12.217 1.750 1.00 . A A . 10 PRO CA 1 1 4 931 1 1 10 PRO CB C 5.932 -13.474 1.987 1.00 . A A . 10 PRO CB 1 1 4 932 1 1 10 PRO CD C 8.137 -14.213 1.434 1.00 . A A . 10 PRO CD 1 1 4 933 1 1 10 PRO CG C 6.927 -14.548 2.261 1.00 . A A . 10 PRO CG 1 1 4 934 1 1 10 PRO HA H 6.303 -11.606 0.992 1.00 . A A . 10 PRO HA 1 1 4 935 1 1 10 PRO HB2 H 5.275 -13.318 2.832 1.00 . A A . 10 PRO HB2 1 1 4 936 1 1 10 PRO HB3 H 5.348 -13.693 1.106 1.00 . A A . 10 PRO HB3 1 1 4 937 1 1 10 PRO HD2 H 9.039 -14.503 1.950 1.00 . A A . 10 PRO HD2 1 1 4 938 1 1 10 PRO HD3 H 8.080 -14.695 0.469 1.00 . A A . 10 PRO HD3 1 1 4 939 1 1 10 PRO HG2 H 7.180 -14.555 3.310 1.00 . A A . 10 PRO HG2 1 1 4 940 1 1 10 PRO HG3 H 6.524 -15.506 1.965 1.00 . A A . 10 PRO HG3 1 1 4 941 1 1 10 PRO N N 8.059 -12.749 1.294 1.00 . A A . 10 PRO N 1 1 4 942 1 1 10 PRO O O 5.951 -10.761 3.475 1.00 . A A . 10 PRO O 1 1 4 943 1 1 11 LEU C C 8.414 -9.233 4.631 1.00 . A A . 11 LEU C 1 1 4 944 1 1 11 LEU CA C 8.337 -10.735 4.885 1.00 . A A . 11 LEU CA 1 1 4 945 1 1 11 LEU CB C 9.638 -11.223 5.526 1.00 . A A . 11 LEU CB 1 1 4 946 1 1 11 LEU CD1 C 11.428 -9.480 5.333 1.00 . A A . 11 LEU CD1 1 1 4 947 1 1 11 LEU CD2 C 11.994 -11.893 4.994 1.00 . A A . 11 LEU CD2 1 1 4 948 1 1 11 LEU CG C 10.930 -10.820 4.815 1.00 . A A . 11 LEU CG 1 1 4 949 1 1 11 LEU H H 8.802 -11.997 3.250 1.00 . A A . 11 LEU H 1 1 4 950 1 1 11 LEU HA H 7.517 -10.933 5.558 1.00 . A A . 11 LEU HA 1 1 4 951 1 1 11 LEU HB2 H 9.678 -10.831 6.531 1.00 . A A . 11 LEU HB2 1 1 4 952 1 1 11 LEU HB3 H 9.602 -12.303 5.564 1.00 . A A . 11 LEU HB3 1 1 4 953 1 1 11 LEU HD11 H 10.898 -9.223 6.237 1.00 . A A . 11 LEU HD11 1 1 4 954 1 1 11 LEU HD12 H 11.257 -8.719 4.586 1.00 . A A . 11 LEU HD12 1 1 4 955 1 1 11 LEU HD13 H 12.486 -9.546 5.542 1.00 . A A . 11 LEU HD13 1 1 4 956 1 1 11 LEU HD21 H 11.858 -12.662 4.248 1.00 . A A . 11 LEU HD21 1 1 4 957 1 1 11 LEU HD22 H 11.905 -12.326 5.979 1.00 . A A . 11 LEU HD22 1 1 4 958 1 1 11 LEU HD23 H 12.973 -11.450 4.882 1.00 . A A . 11 LEU HD23 1 1 4 959 1 1 11 LEU HG H 10.733 -10.716 3.757 1.00 . A A . 11 LEU HG 1 1 4 960 1 1 11 LEU N N 8.083 -11.461 3.645 1.00 . A A . 11 LEU N 1 1 4 961 1 1 11 LEU O O 8.515 -8.439 5.567 1.00 . A A . 11 LEU O 1 1 4 962 1 1 12 PHE C C 7.043 -6.803 3.037 1.00 . A A . 12 PHE C 1 1 4 963 1 1 12 PHE CA C 8.428 -7.443 2.982 1.00 . A A . 12 PHE CA 1 1 4 964 1 1 12 PHE CB C 9.015 -7.295 1.577 1.00 . A A . 12 PHE CB 1 1 4 965 1 1 12 PHE CD1 C 11.128 -6.151 2.299 1.00 . A A . 12 PHE CD1 1 1 4 966 1 1 12 PHE CD2 C 9.868 -5.186 0.519 1.00 . A A . 12 PHE CD2 1 1 4 967 1 1 12 PHE CE1 C 12.059 -5.134 2.196 1.00 . A A . 12 PHE CE1 1 1 4 968 1 1 12 PHE CE2 C 10.796 -4.167 0.411 1.00 . A A . 12 PHE CE2 1 1 4 969 1 1 12 PHE CG C 10.024 -6.189 1.463 1.00 . A A . 12 PHE CG 1 1 4 970 1 1 12 PHE CZ C 11.892 -4.141 1.251 1.00 . A A . 12 PHE CZ 1 1 4 971 1 1 12 PHE H H 8.284 -9.530 2.658 1.00 . A A . 12 PHE H 1 1 4 972 1 1 12 PHE HA H 9.071 -6.940 3.687 1.00 . A A . 12 PHE HA 1 1 4 973 1 1 12 PHE HB2 H 9.502 -8.218 1.300 1.00 . A A . 12 PHE HB2 1 1 4 974 1 1 12 PHE HB3 H 8.216 -7.091 0.881 1.00 . A A . 12 PHE HB3 1 1 4 975 1 1 12 PHE HD1 H 11.260 -6.928 3.039 1.00 . A A . 12 PHE HD1 1 1 4 976 1 1 12 PHE HD2 H 9.011 -5.205 -0.138 1.00 . A A . 12 PHE HD2 1 1 4 977 1 1 12 PHE HE1 H 12.915 -5.116 2.854 1.00 . A A . 12 PHE HE1 1 1 4 978 1 1 12 PHE HE2 H 10.663 -3.392 -0.328 1.00 . A A . 12 PHE HE2 1 1 4 979 1 1 12 PHE HZ H 12.618 -3.346 1.168 1.00 . A A . 12 PHE HZ 1 1 4 980 1 1 12 PHE N N 8.365 -8.850 3.360 1.00 . A A . 12 PHE N 1 1 4 981 1 1 12 PHE O O 6.640 -6.091 2.118 1.00 . A A . 12 PHE O 1 1 4 982 1 1 13 GLY C C 5.014 -5.069 4.758 1.00 . A A . 13 GLY C 1 1 4 983 1 1 13 GLY CA C 4.989 -6.506 4.276 1.00 . A A . 13 GLY CA 1 1 4 984 1 1 13 GLY H H 6.693 -7.638 4.822 1.00 . A A . 13 GLY H 1 1 4 985 1 1 13 GLY HA2 H 4.480 -6.547 3.324 1.00 . A A . 13 GLY HA2 1 1 4 986 1 1 13 GLY HA3 H 4.442 -7.104 4.991 1.00 . A A . 13 GLY HA3 1 1 4 987 1 1 13 GLY N N 6.320 -7.063 4.121 1.00 . A A . 13 GLY N 1 1 4 988 1 1 13 GLY O O 3.982 -4.398 4.787 1.00 . A A . 13 GLY O 1 1 4 989 1 1 14 LYS C C 7.277 -2.431 4.710 1.00 . A A . 14 LYS C 1 1 4 990 1 1 14 LYS CA C 6.352 -3.229 5.623 1.00 . A A . 14 LYS CA 1 1 4 991 1 1 14 LYS CB C 6.904 -3.232 7.050 1.00 . A A . 14 LYS CB 1 1 4 992 1 1 14 LYS CD C 9.026 -4.446 6.473 1.00 . A A . 14 LYS CD 1 1 4 993 1 1 14 LYS CE C 10.256 -4.895 7.246 1.00 . A A . 14 LYS CE 1 1 4 994 1 1 14 LYS CG C 7.790 -4.426 7.357 1.00 . A A . 14 LYS CG 1 1 4 995 1 1 14 LYS H H 6.981 -5.179 5.093 1.00 . A A . 14 LYS H 1 1 4 996 1 1 14 LYS HA H 5.378 -2.763 5.624 1.00 . A A . 14 LYS HA 1 1 4 997 1 1 14 LYS HB2 H 7.482 -2.332 7.201 1.00 . A A . 14 LYS HB2 1 1 4 998 1 1 14 LYS HB3 H 6.075 -3.237 7.744 1.00 . A A . 14 LYS HB3 1 1 4 999 1 1 14 LYS HD2 H 8.860 -5.129 5.653 1.00 . A A . 14 LYS HD2 1 1 4 1000 1 1 14 LYS HD3 H 9.197 -3.451 6.087 1.00 . A A . 14 LYS HD3 1 1 4 1001 1 1 14 LYS HE2 H 9.965 -5.125 8.259 1.00 . A A . 14 LYS HE2 1 1 4 1002 1 1 14 LYS HE3 H 10.656 -5.782 6.776 1.00 . A A . 14 LYS HE3 1 1 4 1003 1 1 14 LYS HG2 H 8.100 -4.377 8.390 1.00 . A A . 14 LYS HG2 1 1 4 1004 1 1 14 LYS HG3 H 7.226 -5.333 7.192 1.00 . A A . 14 LYS HG3 1 1 4 1005 1 1 14 LYS HZ1 H 11.849 -3.898 8.158 1.00 . A A . 14 LYS HZ1 1 1 4 1006 1 1 14 LYS HZ2 H 10.876 -2.901 7.197 1.00 . A A . 14 LYS HZ2 1 1 4 1007 1 1 14 LYS HZ3 H 11.964 -3.974 6.472 1.00 . A A . 14 LYS HZ3 1 1 4 1008 1 1 14 LYS N N 6.195 -4.595 5.139 1.00 . A A . 14 LYS N 1 1 4 1009 1 1 14 LYS NZ N 11.310 -3.844 7.270 1.00 . A A . 14 LYS NZ 1 1 4 1010 1 1 14 LYS O O 7.261 -1.201 4.715 1.00 . A A . 14 LYS O 1 1 4 1011 1 1 15 GLY C C 8.289 -1.632 1.984 1.00 . A A . 15 GLY C 1 1 4 1012 1 1 15 GLY CA C 9.003 -2.481 3.017 1.00 . A A . 15 GLY CA 1 1 4 1013 1 1 15 GLY H H 8.052 -4.119 3.964 1.00 . A A . 15 GLY H 1 1 4 1014 1 1 15 GLY HA2 H 9.668 -1.852 3.589 1.00 . A A . 15 GLY HA2 1 1 4 1015 1 1 15 GLY HA3 H 9.587 -3.233 2.506 1.00 . A A . 15 GLY HA3 1 1 4 1016 1 1 15 GLY N N 8.083 -3.141 3.925 1.00 . A A . 15 GLY N 1 1 4 1017 1 1 15 GLY O O 7.924 -0.489 2.256 1.00 . A A . 15 GLY O 1 1 4 1018 1 1 16 GLY C C 8.334 -0.475 -0.961 1.00 . A A . 16 GLY C 1 1 4 1019 1 1 16 GLY CA C 7.419 -1.462 -0.265 1.00 . A A . 16 GLY CA 1 1 4 1020 1 1 16 GLY H H 8.404 -3.106 0.635 1.00 . A A . 16 GLY H 1 1 4 1021 1 1 16 GLY HA2 H 7.047 -2.168 -0.993 1.00 . A A . 16 GLY HA2 1 1 4 1022 1 1 16 GLY HA3 H 6.583 -0.923 0.158 1.00 . A A . 16 GLY HA3 1 1 4 1023 1 1 16 GLY N N 8.091 -2.191 0.794 1.00 . A A . 16 GLY N 1 1 4 1024 1 1 16 GLY O O 9.557 -0.599 -0.894 1.00 . A A . 16 GLY O 1 1 5 1025 1 1 1 VAL C C 2.725 -1.465 -1.272 1.00 . A A . 1 VAL C 1 1 5 1026 1 1 1 VAL CA C 1.425 -0.681 -1.402 1.00 . A A . 1 VAL CA 1 1 5 1027 1 1 1 VAL CB C 1.749 0.762 -1.832 1.00 . A A . 1 VAL CB 1 1 5 1028 1 1 1 VAL CG1 C 0.470 1.541 -2.097 1.00 . A A . 1 VAL CG1 1 1 5 1029 1 1 1 VAL CG2 C 2.595 1.455 -0.775 1.00 . A A . 1 VAL CG2 1 1 5 1030 1 1 1 VAL H1 H -0.273 -0.434 -0.162 1.00 . A A . 1 VAL H1 1 1 5 1031 1 1 1 VAL HA H 0.817 -1.135 -2.171 1.00 . A A . 1 VAL HA 1 1 5 1032 1 1 1 VAL HB H 2.317 0.724 -2.750 1.00 . A A . 1 VAL HB 1 1 5 1033 1 1 1 VAL HG11 H -0.147 1.531 -1.211 1.00 . A A . 1 VAL HG11 1 1 5 1034 1 1 1 VAL HG12 H 0.715 2.561 -2.355 1.00 . A A . 1 VAL HG12 1 1 5 1035 1 1 1 VAL HG13 H -0.068 1.082 -2.914 1.00 . A A . 1 VAL HG13 1 1 5 1036 1 1 1 VAL HG21 H 2.566 0.885 0.141 1.00 . A A . 1 VAL HG21 1 1 5 1037 1 1 1 VAL HG22 H 3.616 1.527 -1.122 1.00 . A A . 1 VAL HG22 1 1 5 1038 1 1 1 VAL HG23 H 2.206 2.447 -0.595 1.00 . A A . 1 VAL HG23 1 1 5 1039 1 1 1 VAL N N 0.668 -0.706 -0.156 1.00 . A A . 1 VAL N 1 1 5 1040 1 1 1 VAL O O 3.769 -1.044 -1.771 1.00 . A A . 1 VAL O 1 1 5 1041 1 1 2 ALA C C 3.611 -4.838 -1.007 1.00 . A A . 2 ALA C 1 1 5 1042 1 1 2 ALA CA C 3.827 -3.454 -0.405 1.00 . A A . 2 ALA CA 1 1 5 1043 1 1 2 ALA CB C 4.158 -3.567 1.076 1.00 . A A . 2 ALA CB 1 1 5 1044 1 1 2 ALA H H 1.795 -2.891 -0.225 1.00 . A A . 2 ALA H 1 1 5 1045 1 1 2 ALA HA H 4.664 -2.984 -0.901 1.00 . A A . 2 ALA HA 1 1 5 1046 1 1 2 ALA HB1 H 4.639 -4.515 1.265 1.00 . A A . 2 ALA HB1 1 1 5 1047 1 1 2 ALA HB2 H 4.821 -2.763 1.358 1.00 . A A . 2 ALA HB2 1 1 5 1048 1 1 2 ALA HB3 H 3.248 -3.502 1.653 1.00 . A A . 2 ALA HB3 1 1 5 1049 1 1 2 ALA N N 2.655 -2.609 -0.599 1.00 . A A . 2 ALA N 1 1 5 1050 1 1 2 ALA O O 3.419 -5.817 -0.285 1.00 . A A . 2 ALA O 1 1 5 1051 1 1 3 ARG C C 4.785 -6.856 -3.312 1.00 . A A . 3 ARG C 1 1 5 1052 1 1 3 ARG CA C 3.447 -6.177 -3.033 1.00 . A A . 3 ARG CA 1 1 5 1053 1 1 3 ARG CB C 2.696 -5.949 -4.346 1.00 . A A . 3 ARG CB 1 1 5 1054 1 1 3 ARG CD C 2.884 -5.612 -6.829 1.00 . A A . 3 ARG CD 1 1 5 1055 1 1 3 ARG CG C 3.548 -6.177 -5.583 1.00 . A A . 3 ARG CG 1 1 5 1056 1 1 3 ARG CZ C 1.822 -6.430 -8.889 1.00 . A A . 3 ARG CZ 1 1 5 1057 1 1 3 ARG H H 3.799 -4.098 -2.855 1.00 . A A . 3 ARG H 1 1 5 1058 1 1 3 ARG HA H 2.857 -6.820 -2.398 1.00 . A A . 3 ARG HA 1 1 5 1059 1 1 3 ARG HB2 H 1.853 -6.623 -4.387 1.00 . A A . 3 ARG HB2 1 1 5 1060 1 1 3 ARG HB3 H 2.334 -4.932 -4.367 1.00 . A A . 3 ARG HB3 1 1 5 1061 1 1 3 ARG HD2 H 2.020 -5.037 -6.531 1.00 . A A . 3 ARG HD2 1 1 5 1062 1 1 3 ARG HD3 H 3.588 -4.967 -7.334 1.00 . A A . 3 ARG HD3 1 1 5 1063 1 1 3 ARG HE H 2.659 -7.591 -7.501 1.00 . A A . 3 ARG HE 1 1 5 1064 1 1 3 ARG HG2 H 4.503 -5.691 -5.446 1.00 . A A . 3 ARG HG2 1 1 5 1065 1 1 3 ARG HG3 H 3.698 -7.238 -5.715 1.00 . A A . 3 ARG HG3 1 1 5 1066 1 1 3 ARG HH11 H 1.804 -4.422 -8.663 1.00 . A A . 3 ARG HH11 1 1 5 1067 1 1 3 ARG HH12 H 1.058 -5.012 -10.111 1.00 . A A . 3 ARG HH12 1 1 5 1068 1 1 3 ARG HH21 H 1.680 -8.379 -9.404 1.00 . A A . 3 ARG HH21 1 1 5 1069 1 1 3 ARG HH22 H 0.988 -7.263 -10.531 1.00 . A A . 3 ARG HH22 1 1 5 1070 1 1 3 ARG N N 3.642 -4.913 -2.334 1.00 . A A . 3 ARG N 1 1 5 1071 1 1 3 ARG NE N 2.459 -6.664 -7.748 1.00 . A A . 3 ARG NE 1 1 5 1072 1 1 3 ARG NH1 N 1.537 -5.186 -9.250 1.00 . A A . 3 ARG NH1 1 1 5 1073 1 1 3 ARG NH2 N 1.467 -7.440 -9.673 1.00 . A A . 3 ARG NH2 1 1 5 1074 1 1 3 ARG O O 4.833 -8.030 -3.678 1.00 . A A . 3 ARG O 1 1 5 1075 1 1 4 GLY C C 7.426 -7.955 -2.633 1.00 . A A . 4 GLY C 1 1 5 1076 1 1 4 GLY CA C 7.194 -6.654 -3.374 1.00 . A A . 4 GLY CA 1 1 5 1077 1 1 4 GLY H H 5.772 -5.178 -2.843 1.00 . A A . 4 GLY H 1 1 5 1078 1 1 4 GLY HA2 H 7.315 -6.827 -4.433 1.00 . A A . 4 GLY HA2 1 1 5 1079 1 1 4 GLY HA3 H 7.931 -5.933 -3.052 1.00 . A A . 4 GLY HA3 1 1 5 1080 1 1 4 GLY N N 5.871 -6.108 -3.137 1.00 . A A . 4 GLY N 1 1 5 1081 1 1 4 GLY O O 8.251 -8.772 -3.043 1.00 . A A . 4 GLY O 1 1 5 1082 1 1 5 TRP C C 6.564 -10.603 -1.582 1.00 . A A . 5 TRP C 1 1 5 1083 1 1 5 TRP CA C 6.831 -9.361 -0.738 1.00 . A A . 5 TRP CA 1 1 5 1084 1 1 5 TRP CB C 5.868 -9.319 0.449 1.00 . A A . 5 TRP CB 1 1 5 1085 1 1 5 TRP CD1 C 3.731 -8.559 -0.742 1.00 . A A . 5 TRP CD1 1 1 5 1086 1 1 5 TRP CD2 C 3.508 -10.457 0.426 1.00 . A A . 5 TRP CD2 1 1 5 1087 1 1 5 TRP CE2 C 2.271 -10.151 -0.175 1.00 . A A . 5 TRP CE2 1 1 5 1088 1 1 5 TRP CE3 C 3.609 -11.609 1.211 1.00 . A A . 5 TRP CE3 1 1 5 1089 1 1 5 TRP CG C 4.428 -9.426 0.050 1.00 . A A . 5 TRP CG 1 1 5 1090 1 1 5 TRP CH2 C 1.275 -12.078 0.759 1.00 . A A . 5 TRP CH2 1 1 5 1091 1 1 5 TRP CZ2 C 1.147 -10.956 -0.014 1.00 . A A . 5 TRP CZ2 1 1 5 1092 1 1 5 TRP CZ3 C 2.492 -12.407 1.370 1.00 . A A . 5 TRP CZ3 1 1 5 1093 1 1 5 TRP H H 6.057 -7.461 -1.263 1.00 . A A . 5 TRP H 1 1 5 1094 1 1 5 TRP HA H 7.845 -9.403 -0.367 1.00 . A A . 5 TRP HA 1 1 5 1095 1 1 5 TRP HB2 H 6.091 -10.140 1.114 1.00 . A A . 5 TRP HB2 1 1 5 1096 1 1 5 TRP HB3 H 6.001 -8.386 0.978 1.00 . A A . 5 TRP HB3 1 1 5 1097 1 1 5 TRP HD1 H 4.150 -7.669 -1.186 1.00 . A A . 5 TRP HD1 1 1 5 1098 1 1 5 TRP HE1 H 1.737 -8.537 -1.403 1.00 . A A . 5 TRP HE1 1 1 5 1099 1 1 5 TRP HE3 H 4.539 -11.879 1.689 1.00 . A A . 5 TRP HE3 1 1 5 1100 1 1 5 TRP HH2 H 0.428 -12.730 0.911 1.00 . A A . 5 TRP HH2 1 1 5 1101 1 1 5 TRP HZ2 H 0.201 -10.717 -0.478 1.00 . A A . 5 TRP HZ2 1 1 5 1102 1 1 5 TRP HZ3 H 2.552 -13.301 1.973 1.00 . A A . 5 TRP HZ3 1 1 5 1103 1 1 5 TRP N N 6.699 -8.149 -1.539 1.00 . A A . 5 TRP N 1 1 5 1104 1 1 5 TRP NE1 N 2.433 -8.989 -0.881 1.00 . A A . 5 TRP NE1 1 1 5 1105 1 1 5 TRP O O 7.123 -11.670 -1.328 1.00 . A A . 5 TRP O 1 1 5 1106 1 1 6 LYS C C 6.494 -11.838 -4.461 1.00 . A A . 6 LYS C 1 1 5 1107 1 1 6 LYS CA C 5.367 -11.567 -3.469 1.00 . A A . 6 LYS CA 1 1 5 1108 1 1 6 LYS CB C 4.070 -11.266 -4.224 1.00 . A A . 6 LYS CB 1 1 5 1109 1 1 6 LYS CD C 2.109 -9.740 -3.859 1.00 . A A . 6 LYS CD 1 1 5 1110 1 1 6 LYS CE C 1.318 -10.129 -5.098 1.00 . A A . 6 LYS CE 1 1 5 1111 1 1 6 LYS CG C 2.905 -10.914 -3.315 1.00 . A A . 6 LYS CG 1 1 5 1112 1 1 6 LYS H H 5.294 -9.581 -2.739 1.00 . A A . 6 LYS H 1 1 5 1113 1 1 6 LYS HA H 5.223 -12.445 -2.858 1.00 . A A . 6 LYS HA 1 1 5 1114 1 1 6 LYS HB2 H 4.242 -10.436 -4.893 1.00 . A A . 6 LYS HB2 1 1 5 1115 1 1 6 LYS HB3 H 3.796 -12.135 -4.805 1.00 . A A . 6 LYS HB3 1 1 5 1116 1 1 6 LYS HD2 H 1.421 -9.399 -3.099 1.00 . A A . 6 LYS HD2 1 1 5 1117 1 1 6 LYS HD3 H 2.791 -8.941 -4.114 1.00 . A A . 6 LYS HD3 1 1 5 1118 1 1 6 LYS HE2 H 1.150 -11.195 -5.082 1.00 . A A . 6 LYS HE2 1 1 5 1119 1 1 6 LYS HE3 H 0.368 -9.615 -5.079 1.00 . A A . 6 LYS HE3 1 1 5 1120 1 1 6 LYS HG2 H 2.253 -11.770 -3.233 1.00 . A A . 6 LYS HG2 1 1 5 1121 1 1 6 LYS HG3 H 3.288 -10.656 -2.338 1.00 . A A . 6 LYS HG3 1 1 5 1122 1 1 6 LYS HZ1 H 1.392 -9.290 -7.010 1.00 . A A . 6 LYS HZ1 1 1 5 1123 1 1 6 LYS HZ2 H 2.408 -10.629 -6.808 1.00 . A A . 6 LYS HZ2 1 1 5 1124 1 1 6 LYS HZ3 H 2.833 -9.136 -6.137 1.00 . A A . 6 LYS HZ3 1 1 5 1125 1 1 6 LYS N N 5.707 -10.457 -2.587 1.00 . A A . 6 LYS N 1 1 5 1126 1 1 6 LYS NZ N 2.038 -9.771 -6.351 1.00 . A A . 6 LYS NZ 1 1 5 1127 1 1 6 LYS O O 6.517 -12.879 -5.119 1.00 . A A . 6 LYS O 1 1 5 1128 1 1 7 ARG C C 9.535 -12.091 -4.970 1.00 . A A . 7 ARG C 1 1 5 1129 1 1 7 ARG CA C 8.556 -11.035 -5.474 1.00 . A A . 7 ARG CA 1 1 5 1130 1 1 7 ARG CB C 9.274 -9.694 -5.637 1.00 . A A . 7 ARG CB 1 1 5 1131 1 1 7 ARG CD C 9.138 -7.273 -6.297 1.00 . A A . 7 ARG CD 1 1 5 1132 1 1 7 ARG CG C 8.385 -8.590 -6.186 1.00 . A A . 7 ARG CG 1 1 5 1133 1 1 7 ARG CZ C 10.767 -7.439 -8.130 1.00 . A A . 7 ARG CZ 1 1 5 1134 1 1 7 ARG H H 7.353 -10.090 -4.012 1.00 . A A . 7 ARG H 1 1 5 1135 1 1 7 ARG HA H 8.171 -11.347 -6.434 1.00 . A A . 7 ARG HA 1 1 5 1136 1 1 7 ARG HB2 H 9.648 -9.380 -4.674 1.00 . A A . 7 ARG HB2 1 1 5 1137 1 1 7 ARG HB3 H 10.106 -9.826 -6.312 1.00 . A A . 7 ARG HB3 1 1 5 1138 1 1 7 ARG HD2 H 8.480 -6.472 -5.995 1.00 . A A . 7 ARG HD2 1 1 5 1139 1 1 7 ARG HD3 H 9.992 -7.306 -5.638 1.00 . A A . 7 ARG HD3 1 1 5 1140 1 1 7 ARG HE H 9.006 -6.511 -8.252 1.00 . A A . 7 ARG HE 1 1 5 1141 1 1 7 ARG HG2 H 8.036 -8.876 -7.167 1.00 . A A . 7 ARG HG2 1 1 5 1142 1 1 7 ARG HG3 H 7.542 -8.458 -5.525 1.00 . A A . 7 ARG HG3 1 1 5 1143 1 1 7 ARG HH11 H 11.329 -8.336 -6.409 1.00 . A A . 7 ARG HH11 1 1 5 1144 1 1 7 ARG HH12 H 12.469 -8.446 -7.710 1.00 . A A . 7 ARG HH12 1 1 5 1145 1 1 7 ARG HH21 H 10.498 -6.649 -9.971 1.00 . A A . 7 ARG HH21 1 1 5 1146 1 1 7 ARG HH22 H 11.996 -7.485 -9.735 1.00 . A A . 7 ARG HH22 1 1 5 1147 1 1 7 ARG N N 7.426 -10.897 -4.563 1.00 . A A . 7 ARG N 1 1 5 1148 1 1 7 ARG NE N 9.598 -7.020 -7.660 1.00 . A A . 7 ARG NE 1 1 5 1149 1 1 7 ARG NH1 N 11.590 -8.130 -7.352 1.00 . A A . 7 ARG NH1 1 1 5 1150 1 1 7 ARG NH2 N 11.116 -7.169 -9.382 1.00 . A A . 7 ARG NH2 1 1 5 1151 1 1 7 ARG O O 9.526 -13.233 -5.431 1.00 . A A . 7 ARG O 1 1 5 1152 1 1 8 LYS C C 10.881 -13.178 -2.121 1.00 . A A . 8 LYS C 1 1 5 1153 1 1 8 LYS CA C 11.366 -12.613 -3.452 1.00 . A A . 8 LYS CA 1 1 5 1154 1 1 8 LYS CB C 12.702 -11.895 -3.257 1.00 . A A . 8 LYS CB 1 1 5 1155 1 1 8 LYS CD C 14.502 -10.482 -4.294 1.00 . A A . 8 LYS CD 1 1 5 1156 1 1 8 LYS CE C 15.378 -10.332 -5.528 1.00 . A A . 8 LYS CE 1 1 5 1157 1 1 8 LYS CG C 13.328 -11.411 -4.554 1.00 . A A . 8 LYS CG 1 1 5 1158 1 1 8 LYS H H 10.338 -10.778 -3.694 1.00 . A A . 8 LYS H 1 1 5 1159 1 1 8 LYS HA H 11.503 -13.428 -4.147 1.00 . A A . 8 LYS HA 1 1 5 1160 1 1 8 LYS HB2 H 12.547 -11.040 -2.616 1.00 . A A . 8 LYS HB2 1 1 5 1161 1 1 8 LYS HB3 H 13.395 -12.572 -2.778 1.00 . A A . 8 LYS HB3 1 1 5 1162 1 1 8 LYS HD2 H 14.126 -9.510 -4.013 1.00 . A A . 8 LYS HD2 1 1 5 1163 1 1 8 LYS HD3 H 15.098 -10.886 -3.487 1.00 . A A . 8 LYS HD3 1 1 5 1164 1 1 8 LYS HE2 H 15.882 -11.268 -5.712 1.00 . A A . 8 LYS HE2 1 1 5 1165 1 1 8 LYS HE3 H 14.749 -10.089 -6.372 1.00 . A A . 8 LYS HE3 1 1 5 1166 1 1 8 LYS HG2 H 13.676 -12.265 -5.115 1.00 . A A . 8 LYS HG2 1 1 5 1167 1 1 8 LYS HG3 H 12.581 -10.881 -5.127 1.00 . A A . 8 LYS HG3 1 1 5 1168 1 1 8 LYS HZ1 H 16.779 -8.979 -6.284 1.00 . A A . 8 LYS HZ1 1 1 5 1169 1 1 8 LYS HZ2 H 17.178 -9.599 -4.761 1.00 . A A . 8 LYS HZ2 1 1 5 1170 1 1 8 LYS HZ3 H 15.967 -8.427 -4.906 1.00 . A A . 8 LYS HZ3 1 1 5 1171 1 1 8 LYS N N 10.380 -11.702 -4.021 1.00 . A A . 8 LYS N 1 1 5 1172 1 1 8 LYS NZ N 16.397 -9.259 -5.358 1.00 . A A . 8 LYS NZ 1 1 5 1173 1 1 8 LYS O O 10.389 -14.306 -2.056 1.00 . A A . 8 LYS O 1 1 5 1174 1 1 9 CYS C C 9.258 -12.177 0.637 1.00 . A A . 9 CYS C 1 1 5 1175 1 1 9 CYS CA C 10.596 -12.809 0.268 1.00 . A A . 9 CYS CA 1 1 5 1176 1 1 9 CYS CB C 11.654 -12.435 1.306 1.00 . A A . 9 CYS CB 1 1 5 1177 1 1 9 CYS H H 11.420 -11.500 -1.177 1.00 . A A . 9 CYS H 1 1 5 1178 1 1 9 CYS HA H 10.481 -13.883 0.254 1.00 . A A . 9 CYS HA 1 1 5 1179 1 1 9 CYS HB2 H 11.307 -12.731 2.286 1.00 . A A . 9 CYS HB2 1 1 5 1180 1 1 9 CYS HB3 H 12.570 -12.963 1.082 1.00 . A A . 9 CYS HB3 1 1 5 1181 1 1 9 CYS HG H 13.302 -10.511 1.018 1.00 . A A . 9 CYS HG 1 1 5 1182 1 1 9 CYS N N 11.021 -12.388 -1.063 1.00 . A A . 9 CYS N 1 1 5 1183 1 1 9 CYS O O 9.051 -10.972 0.490 1.00 . A A . 9 CYS O 1 1 5 1184 1 1 9 CYS SG S 12.035 -10.669 1.369 1.00 . A A . 9 CYS SG 1 1 5 1185 1 1 10 PRO C C 7.024 -11.692 2.783 1.00 . A A . 10 PRO C 1 1 5 1186 1 1 10 PRO CA C 6.991 -12.553 1.525 1.00 . A A . 10 PRO CA 1 1 5 1187 1 1 10 PRO CB C 6.235 -13.858 1.790 1.00 . A A . 10 PRO CB 1 1 5 1188 1 1 10 PRO CD C 8.503 -14.456 1.328 1.00 . A A . 10 PRO CD 1 1 5 1189 1 1 10 PRO CG C 7.295 -14.846 2.135 1.00 . A A . 10 PRO CG 1 1 5 1190 1 1 10 PRO HA H 6.503 -12.008 0.730 1.00 . A A . 10 PRO HA 1 1 5 1191 1 1 10 PRO HB2 H 5.544 -13.716 2.609 1.00 . A A . 10 PRO HB2 1 1 5 1192 1 1 10 PRO HB3 H 5.695 -14.152 0.903 1.00 . A A . 10 PRO HB3 1 1 5 1193 1 1 10 PRO HD2 H 9.408 -14.660 1.880 1.00 . A A . 10 PRO HD2 1 1 5 1194 1 1 10 PRO HD3 H 8.510 -14.978 0.382 1.00 . A A . 10 PRO HD3 1 1 5 1195 1 1 10 PRO HG2 H 7.517 -14.794 3.190 1.00 . A A . 10 PRO HG2 1 1 5 1196 1 1 10 PRO HG3 H 6.971 -15.840 1.866 1.00 . A A . 10 PRO HG3 1 1 5 1197 1 1 10 PRO N N 8.326 -13.008 1.126 1.00 . A A . 10 PRO N 1 1 5 1198 1 1 10 PRO O O 6.014 -11.104 3.172 1.00 . A A . 10 PRO O 1 1 5 1199 1 1 11 LEU C C 8.528 -9.352 4.299 1.00 . A A . 11 LEU C 1 1 5 1200 1 1 11 LEU CA C 8.355 -10.831 4.631 1.00 . A A . 11 LEU CA 1 1 5 1201 1 1 11 LEU CB C 9.561 -11.331 5.428 1.00 . A A . 11 LEU CB 1 1 5 1202 1 1 11 LEU CD1 C 11.368 -9.645 5.850 1.00 . A A . 11 LEU CD1 1 1 5 1203 1 1 11 LEU CD2 C 11.960 -11.926 5.010 1.00 . A A . 11 LEU CD2 1 1 5 1204 1 1 11 LEU CG C 10.926 -10.810 4.977 1.00 . A A . 11 LEU CG 1 1 5 1205 1 1 11 LEU H H 8.959 -12.112 3.058 1.00 . A A . 11 LEU H 1 1 5 1206 1 1 11 LEU HA H 7.463 -10.952 5.228 1.00 . A A . 11 LEU HA 1 1 5 1207 1 1 11 LEU HB2 H 9.420 -11.040 6.458 1.00 . A A . 11 LEU HB2 1 1 5 1208 1 1 11 LEU HB3 H 9.578 -12.409 5.359 1.00 . A A . 11 LEU HB3 1 1 5 1209 1 1 11 LEU HD11 H 10.539 -9.319 6.461 1.00 . A A . 11 LEU HD11 1 1 5 1210 1 1 11 LEU HD12 H 11.697 -8.830 5.223 1.00 . A A . 11 LEU HD12 1 1 5 1211 1 1 11 LEU HD13 H 12.182 -9.961 6.486 1.00 . A A . 11 LEU HD13 1 1 5 1212 1 1 11 LEU HD21 H 12.897 -11.561 4.616 1.00 . A A . 11 LEU HD21 1 1 5 1213 1 1 11 LEU HD22 H 11.614 -12.754 4.410 1.00 . A A . 11 LEU HD22 1 1 5 1214 1 1 11 LEU HD23 H 12.102 -12.255 6.030 1.00 . A A . 11 LEU HD23 1 1 5 1215 1 1 11 LEU HG H 10.850 -10.453 3.959 1.00 . A A . 11 LEU HG 1 1 5 1216 1 1 11 LEU N N 8.190 -11.621 3.416 1.00 . A A . 11 LEU N 1 1 5 1217 1 1 11 LEU O O 8.685 -8.519 5.192 1.00 . A A . 11 LEU O 1 1 5 1218 1 1 12 PHE C C 7.295 -6.949 2.498 1.00 . A A . 12 PHE C 1 1 5 1219 1 1 12 PHE CA C 8.647 -7.654 2.559 1.00 . A A . 12 PHE CA 1 1 5 1220 1 1 12 PHE CB C 9.318 -7.614 1.185 1.00 . A A . 12 PHE CB 1 1 5 1221 1 1 12 PHE CD1 C 11.677 -6.861 1.590 1.00 . A A . 12 PHE CD1 1 1 5 1222 1 1 12 PHE CD2 C 10.186 -5.369 0.478 1.00 . A A . 12 PHE CD2 1 1 5 1223 1 1 12 PHE CE1 C 12.689 -5.925 1.497 1.00 . A A . 12 PHE CE1 1 1 5 1224 1 1 12 PHE CE2 C 11.195 -4.429 0.382 1.00 . A A . 12 PHE CE2 1 1 5 1225 1 1 12 PHE CG C 10.416 -6.595 1.082 1.00 . A A . 12 PHE CG 1 1 5 1226 1 1 12 PHE CZ C 12.448 -4.707 0.893 1.00 . A A . 12 PHE CZ 1 1 5 1227 1 1 12 PHE H H 8.367 -9.741 2.344 1.00 . A A . 12 PHE H 1 1 5 1228 1 1 12 PHE HA H 9.275 -7.141 3.271 1.00 . A A . 12 PHE HA 1 1 5 1229 1 1 12 PHE HB2 H 9.745 -8.583 0.973 1.00 . A A . 12 PHE HB2 1 1 5 1230 1 1 12 PHE HB3 H 8.575 -7.381 0.437 1.00 . A A . 12 PHE HB3 1 1 5 1231 1 1 12 PHE HD1 H 11.867 -7.814 2.064 1.00 . A A . 12 PHE HD1 1 1 5 1232 1 1 12 PHE HD2 H 9.207 -5.150 0.079 1.00 . A A . 12 PHE HD2 1 1 5 1233 1 1 12 PHE HE1 H 13.667 -6.146 1.898 1.00 . A A . 12 PHE HE1 1 1 5 1234 1 1 12 PHE HE2 H 11.003 -3.477 -0.091 1.00 . A A . 12 PHE HE2 1 1 5 1235 1 1 12 PHE HZ H 13.237 -3.974 0.819 1.00 . A A . 12 PHE HZ 1 1 5 1236 1 1 12 PHE N N 8.495 -9.032 3.009 1.00 . A A . 12 PHE N 1 1 5 1237 1 1 12 PHE O O 7.022 -6.185 1.574 1.00 . A A . 12 PHE O 1 1 5 1238 1 1 13 GLY C C 5.181 -5.171 4.037 1.00 . A A . 13 GLY C 1 1 5 1239 1 1 13 GLY CA C 5.137 -6.599 3.532 1.00 . A A . 13 GLY CA 1 1 5 1240 1 1 13 GLY H H 6.723 -7.832 4.202 1.00 . A A . 13 GLY H 1 1 5 1241 1 1 13 GLY HA2 H 4.717 -6.606 2.537 1.00 . A A . 13 GLY HA2 1 1 5 1242 1 1 13 GLY HA3 H 4.500 -7.180 4.183 1.00 . A A . 13 GLY HA3 1 1 5 1243 1 1 13 GLY N N 6.451 -7.214 3.491 1.00 . A A . 13 GLY N 1 1 5 1244 1 1 13 GLY O O 4.207 -4.428 3.907 1.00 . A A . 13 GLY O 1 1 5 1245 1 1 14 LYS C C 7.234 -2.554 4.154 1.00 . A A . 14 LYS C 1 1 5 1246 1 1 14 LYS CA C 6.480 -3.436 5.144 1.00 . A A . 14 LYS CA 1 1 5 1247 1 1 14 LYS CB C 7.229 -3.477 6.478 1.00 . A A . 14 LYS CB 1 1 5 1248 1 1 14 LYS CD C 9.615 -3.626 7.248 1.00 . A A . 14 LYS CD 1 1 5 1249 1 1 14 LYS CE C 10.349 -4.642 8.110 1.00 . A A . 14 LYS CE 1 1 5 1250 1 1 14 LYS CG C 8.516 -4.281 6.428 1.00 . A A . 14 LYS CG 1 1 5 1251 1 1 14 LYS H H 7.053 -5.422 4.691 1.00 . A A . 14 LYS H 1 1 5 1252 1 1 14 LYS HA H 5.498 -3.018 5.305 1.00 . A A . 14 LYS HA 1 1 5 1253 1 1 14 LYS HB2 H 7.471 -2.467 6.773 1.00 . A A . 14 LYS HB2 1 1 5 1254 1 1 14 LYS HB3 H 6.584 -3.917 7.226 1.00 . A A . 14 LYS HB3 1 1 5 1255 1 1 14 LYS HD2 H 10.323 -3.160 6.579 1.00 . A A . 14 LYS HD2 1 1 5 1256 1 1 14 LYS HD3 H 9.175 -2.874 7.888 1.00 . A A . 14 LYS HD3 1 1 5 1257 1 1 14 LYS HE2 H 11.072 -4.122 8.719 1.00 . A A . 14 LYS HE2 1 1 5 1258 1 1 14 LYS HE3 H 9.632 -5.138 8.748 1.00 . A A . 14 LYS HE3 1 1 5 1259 1 1 14 LYS HG2 H 8.329 -5.269 6.822 1.00 . A A . 14 LYS HG2 1 1 5 1260 1 1 14 LYS HG3 H 8.843 -4.357 5.401 1.00 . A A . 14 LYS HG3 1 1 5 1261 1 1 14 LYS HZ1 H 11.265 -5.278 6.344 1.00 . A A . 14 LYS HZ1 1 1 5 1262 1 1 14 LYS HZ2 H 10.455 -6.507 7.177 1.00 . A A . 14 LYS HZ2 1 1 5 1263 1 1 14 LYS HZ3 H 11.944 -5.940 7.744 1.00 . A A . 14 LYS HZ3 1 1 5 1264 1 1 14 LYS N N 6.312 -4.784 4.617 1.00 . A A . 14 LYS N 1 1 5 1265 1 1 14 LYS NZ N 11.053 -5.663 7.286 1.00 . A A . 14 LYS NZ 1 1 5 1266 1 1 14 LYS O O 7.019 -1.344 4.097 1.00 . A A . 14 LYS O 1 1 5 1267 1 1 15 GLY C C 8.018 -1.822 1.309 1.00 . A A . 15 GLY C 1 1 5 1268 1 1 15 GLY CA C 8.887 -2.425 2.394 1.00 . A A . 15 GLY CA 1 1 5 1269 1 1 15 GLY H H 8.246 -4.137 3.463 1.00 . A A . 15 GLY H 1 1 5 1270 1 1 15 GLY HA2 H 9.418 -1.631 2.898 1.00 . A A . 15 GLY HA2 1 1 5 1271 1 1 15 GLY HA3 H 9.605 -3.090 1.937 1.00 . A A . 15 GLY HA3 1 1 5 1272 1 1 15 GLY N N 8.117 -3.169 3.373 1.00 . A A . 15 GLY N 1 1 5 1273 1 1 15 GLY O O 7.469 -0.734 1.476 1.00 . A A . 15 GLY O 1 1 5 1274 1 1 16 GLY C C 7.903 -1.287 -1.940 1.00 . A A . 16 GLY C 1 1 5 1275 1 1 16 GLY CA C 7.085 -2.043 -0.911 1.00 . A A . 16 GLY CA 1 1 5 1276 1 1 16 GLY H H 8.354 -3.393 0.113 1.00 . A A . 16 GLY H 1 1 5 1277 1 1 16 GLY HA2 H 6.607 -2.883 -1.393 1.00 . A A . 16 GLY HA2 1 1 5 1278 1 1 16 GLY HA3 H 6.323 -1.384 -0.520 1.00 . A A . 16 GLY HA3 1 1 5 1279 1 1 16 GLY N N 7.893 -2.531 0.190 1.00 . A A . 16 GLY N 1 1 5 1280 1 1 16 GLY O O 8.442 -0.219 -1.651 1.00 . A A . 16 GLY O 1 1 6 1281 1 1 1 VAL C C 3.433 -1.588 -0.785 1.00 . A A . 1 VAL C 1 1 6 1282 1 1 1 VAL CA C 2.243 -0.637 -0.836 1.00 . A A . 1 VAL CA 1 1 6 1283 1 1 1 VAL CB C 2.754 0.795 -1.084 1.00 . A A . 1 VAL CB 1 1 6 1284 1 1 1 VAL CG1 C 1.595 1.730 -1.395 1.00 . A A . 1 VAL CG1 1 1 6 1285 1 1 1 VAL CG2 C 3.545 1.293 0.115 1.00 . A A . 1 VAL CG2 1 1 6 1286 1 1 1 VAL H1 H 0.799 -1.435 0.489 1.00 . A A . 1 VAL H1 1 1 6 1287 1 1 1 VAL HA H 1.605 -0.917 -1.662 1.00 . A A . 1 VAL HA 1 1 6 1288 1 1 1 VAL HB H 3.412 0.777 -1.941 1.00 . A A . 1 VAL HB 1 1 6 1289 1 1 1 VAL HG11 H 1.312 1.620 -2.431 1.00 . A A . 1 VAL HG11 1 1 6 1290 1 1 1 VAL HG12 H 0.755 1.484 -0.762 1.00 . A A . 1 VAL HG12 1 1 6 1291 1 1 1 VAL HG13 H 1.897 2.751 -1.212 1.00 . A A . 1 VAL HG13 1 1 6 1292 1 1 1 VAL HG21 H 4.423 0.678 0.249 1.00 . A A . 1 VAL HG21 1 1 6 1293 1 1 1 VAL HG22 H 3.845 2.317 -0.052 1.00 . A A . 1 VAL HG22 1 1 6 1294 1 1 1 VAL HG23 H 2.929 1.239 1.001 1.00 . A A . 1 VAL HG23 1 1 6 1295 1 1 1 VAL N N 1.455 -0.714 0.388 1.00 . A A . 1 VAL N 1 1 6 1296 1 1 1 VAL O O 4.548 -1.224 -1.158 1.00 . A A . 1 VAL O 1 1 6 1297 1 1 2 ALA C C 3.910 -5.037 -1.072 1.00 . A A . 2 ALA C 1 1 6 1298 1 1 2 ALA CA C 4.239 -3.814 -0.222 1.00 . A A . 2 ALA CA 1 1 6 1299 1 1 2 ALA CB C 4.449 -4.219 1.229 1.00 . A A . 2 ALA CB 1 1 6 1300 1 1 2 ALA H H 2.278 -3.039 -0.038 1.00 . A A . 2 ALA H 1 1 6 1301 1 1 2 ALA HA H 5.157 -3.373 -0.584 1.00 . A A . 2 ALA HA 1 1 6 1302 1 1 2 ALA HB1 H 3.548 -4.019 1.791 1.00 . A A . 2 ALA HB1 1 1 6 1303 1 1 2 ALA HB2 H 4.678 -5.273 1.279 1.00 . A A . 2 ALA HB2 1 1 6 1304 1 1 2 ALA HB3 H 5.267 -3.651 1.646 1.00 . A A . 2 ALA HB3 1 1 6 1305 1 1 2 ALA N N 3.188 -2.809 -0.320 1.00 . A A . 2 ALA N 1 1 6 1306 1 1 2 ALA O O 3.581 -6.100 -0.546 1.00 . A A . 2 ALA O 1 1 6 1307 1 1 3 ARG C C 4.980 -6.744 -3.654 1.00 . A A . 3 ARG C 1 1 6 1308 1 1 3 ARG CA C 3.710 -5.969 -3.311 1.00 . A A . 3 ARG CA 1 1 6 1309 1 1 3 ARG CB C 3.070 -5.427 -4.591 1.00 . A A . 3 ARG CB 1 1 6 1310 1 1 3 ARG CD C 2.781 -5.751 -7.066 1.00 . A A . 3 ARG CD 1 1 6 1311 1 1 3 ARG CG C 3.044 -6.431 -5.732 1.00 . A A . 3 ARG CG 1 1 6 1312 1 1 3 ARG CZ C 0.339 -5.531 -7.241 1.00 . A A . 3 ARG CZ 1 1 6 1313 1 1 3 ARG H H 4.268 -4.006 -2.748 1.00 . A A . 3 ARG H 1 1 6 1314 1 1 3 ARG HA H 3.014 -6.637 -2.827 1.00 . A A . 3 ARG HA 1 1 6 1315 1 1 3 ARG HB2 H 2.053 -5.134 -4.375 1.00 . A A . 3 ARG HB2 1 1 6 1316 1 1 3 ARG HB3 H 3.625 -4.560 -4.916 1.00 . A A . 3 ARG HB3 1 1 6 1317 1 1 3 ARG HD2 H 2.821 -4.682 -6.924 1.00 . A A . 3 ARG HD2 1 1 6 1318 1 1 3 ARG HD3 H 3.549 -6.051 -7.764 1.00 . A A . 3 ARG HD3 1 1 6 1319 1 1 3 ARG HE H 1.446 -6.813 -8.294 1.00 . A A . 3 ARG HE 1 1 6 1320 1 1 3 ARG HG2 H 3.999 -6.934 -5.778 1.00 . A A . 3 ARG HG2 1 1 6 1321 1 1 3 ARG HG3 H 2.263 -7.153 -5.545 1.00 . A A . 3 ARG HG3 1 1 6 1322 1 1 3 ARG HH11 H 1.212 -4.285 -5.912 1.00 . A A . 3 ARG HH11 1 1 6 1323 1 1 3 ARG HH12 H -0.509 -4.139 -6.045 1.00 . A A . 3 ARG HH12 1 1 6 1324 1 1 3 ARG HH21 H -0.820 -6.631 -8.479 1.00 . A A . 3 ARG HH21 1 1 6 1325 1 1 3 ARG HH22 H -1.664 -5.475 -7.505 1.00 . A A . 3 ARG HH22 1 1 6 1326 1 1 3 ARG N N 4.000 -4.878 -2.389 1.00 . A A . 3 ARG N 1 1 6 1327 1 1 3 ARG NE N 1.476 -6.108 -7.615 1.00 . A A . 3 ARG NE 1 1 6 1328 1 1 3 ARG NH1 N 0.348 -4.573 -6.324 1.00 . A A . 3 ARG NH1 1 1 6 1329 1 1 3 ARG NH2 N -0.810 -5.910 -7.786 1.00 . A A . 3 ARG NH2 1 1 6 1330 1 1 3 ARG O O 4.922 -7.910 -4.041 1.00 . A A . 3 ARG O 1 1 6 1331 1 1 4 GLY C C 7.618 -7.978 -2.978 1.00 . A A . 4 GLY C 1 1 6 1332 1 1 4 GLY CA C 7.393 -6.728 -3.805 1.00 . A A . 4 GLY CA 1 1 6 1333 1 1 4 GLY H H 6.111 -5.157 -3.194 1.00 . A A . 4 GLY H 1 1 6 1334 1 1 4 GLY HA2 H 7.412 -6.993 -4.852 1.00 . A A . 4 GLY HA2 1 1 6 1335 1 1 4 GLY HA3 H 8.193 -6.030 -3.606 1.00 . A A . 4 GLY HA3 1 1 6 1336 1 1 4 GLY N N 6.126 -6.086 -3.507 1.00 . A A . 4 GLY N 1 1 6 1337 1 1 4 GLY O O 8.495 -8.785 -3.287 1.00 . A A . 4 GLY O 1 1 6 1338 1 1 5 TRP C C 6.756 -10.594 -1.833 1.00 . A A . 5 TRP C 1 1 6 1339 1 1 5 TRP CA C 6.944 -9.300 -1.049 1.00 . A A . 5 TRP CA 1 1 6 1340 1 1 5 TRP CB C 5.917 -9.219 0.081 1.00 . A A . 5 TRP CB 1 1 6 1341 1 1 5 TRP CD1 C 3.760 -8.833 -1.249 1.00 . A A . 5 TRP CD1 1 1 6 1342 1 1 5 TRP CD2 C 3.720 -10.646 0.066 1.00 . A A . 5 TRP CD2 1 1 6 1343 1 1 5 TRP CE2 C 2.485 -10.549 -0.604 1.00 . A A . 5 TRP CE2 1 1 6 1344 1 1 5 TRP CE3 C 3.926 -11.711 0.947 1.00 . A A . 5 TRP CE3 1 1 6 1345 1 1 5 TRP CG C 4.521 -9.539 -0.361 1.00 . A A . 5 TRP CG 1 1 6 1346 1 1 5 TRP CH2 C 1.692 -12.508 0.451 1.00 . A A . 5 TRP CH2 1 1 6 1347 1 1 5 TRP CZ2 C 1.462 -11.476 -0.418 1.00 . A A . 5 TRP CZ2 1 1 6 1348 1 1 5 TRP CZ3 C 2.910 -12.629 1.131 1.00 . A A . 5 TRP CZ3 1 1 6 1349 1 1 5 TRP H H 6.145 -7.461 -1.730 1.00 . A A . 5 TRP H 1 1 6 1350 1 1 5 TRP HA H 7.937 -9.292 -0.623 1.00 . A A . 5 TRP HA 1 1 6 1351 1 1 5 TRP HB2 H 6.190 -9.918 0.857 1.00 . A A . 5 TRP HB2 1 1 6 1352 1 1 5 TRP HB3 H 5.918 -8.218 0.487 1.00 . A A . 5 TRP HB3 1 1 6 1353 1 1 5 TRP HD1 H 4.087 -7.935 -1.749 1.00 . A A . 5 TRP HD1 1 1 6 1354 1 1 5 TRP HE1 H 1.813 -9.118 -1.983 1.00 . A A . 5 TRP HE1 1 1 6 1355 1 1 5 TRP HE3 H 4.859 -11.821 1.481 1.00 . A A . 5 TRP HE3 1 1 6 1356 1 1 5 TRP HH2 H 0.926 -13.248 0.626 1.00 . A A . 5 TRP HH2 1 1 6 1357 1 1 5 TRP HZ2 H 0.517 -11.396 -0.935 1.00 . A A . 5 TRP HZ2 1 1 6 1358 1 1 5 TRP HZ3 H 3.051 -13.459 1.809 1.00 . A A . 5 TRP HZ3 1 1 6 1359 1 1 5 TRP N N 6.826 -8.139 -1.925 1.00 . A A . 5 TRP N 1 1 6 1360 1 1 5 TRP NE1 N 2.534 -9.435 -1.399 1.00 . A A . 5 TRP NE1 1 1 6 1361 1 1 5 TRP O O 7.454 -11.581 -1.599 1.00 . A A . 5 TRP O 1 1 6 1362 1 1 6 LYS C C 6.601 -11.942 -4.653 1.00 . A A . 6 LYS C 1 1 6 1363 1 1 6 LYS CA C 5.528 -11.756 -3.584 1.00 . A A . 6 LYS CA 1 1 6 1364 1 1 6 LYS CB C 4.153 -11.627 -4.243 1.00 . A A . 6 LYS CB 1 1 6 1365 1 1 6 LYS CD C 2.796 -10.252 -5.849 1.00 . A A . 6 LYS CD 1 1 6 1366 1 1 6 LYS CE C 1.824 -11.345 -6.265 1.00 . A A . 6 LYS CE 1 1 6 1367 1 1 6 LYS CG C 4.169 -10.819 -5.529 1.00 . A A . 6 LYS CG 1 1 6 1368 1 1 6 LYS H H 5.285 -9.767 -2.904 1.00 . A A . 6 LYS H 1 1 6 1369 1 1 6 LYS HA H 5.528 -12.621 -2.938 1.00 . A A . 6 LYS HA 1 1 6 1370 1 1 6 LYS HB2 H 3.780 -12.615 -4.468 1.00 . A A . 6 LYS HB2 1 1 6 1371 1 1 6 LYS HB3 H 3.479 -11.146 -3.549 1.00 . A A . 6 LYS HB3 1 1 6 1372 1 1 6 LYS HD2 H 2.407 -9.757 -4.971 1.00 . A A . 6 LYS HD2 1 1 6 1373 1 1 6 LYS HD3 H 2.889 -9.538 -6.655 1.00 . A A . 6 LYS HD3 1 1 6 1374 1 1 6 LYS HE2 H 1.270 -11.007 -7.127 1.00 . A A . 6 LYS HE2 1 1 6 1375 1 1 6 LYS HE3 H 2.388 -12.229 -6.525 1.00 . A A . 6 LYS HE3 1 1 6 1376 1 1 6 LYS HG2 H 4.868 -10.002 -5.423 1.00 . A A . 6 LYS HG2 1 1 6 1377 1 1 6 LYS HG3 H 4.482 -11.459 -6.342 1.00 . A A . 6 LYS HG3 1 1 6 1378 1 1 6 LYS HZ1 H -0.091 -11.793 -5.562 1.00 . A A . 6 LYS HZ1 1 1 6 1379 1 1 6 LYS HZ2 H 0.858 -10.926 -4.462 1.00 . A A . 6 LYS HZ2 1 1 6 1380 1 1 6 LYS HZ3 H 1.149 -12.572 -4.716 1.00 . A A . 6 LYS HZ3 1 1 6 1381 1 1 6 LYS N N 5.808 -10.584 -2.764 1.00 . A A . 6 LYS N 1 1 6 1382 1 1 6 LYS NZ N 0.868 -11.683 -5.175 1.00 . A A . 6 LYS NZ 1 1 6 1383 1 1 6 LYS O O 6.711 -13.009 -5.257 1.00 . A A . 6 LYS O 1 1 6 1384 1 1 7 ARG C C 9.596 -11.841 -5.409 1.00 . A A . 7 ARG C 1 1 6 1385 1 1 7 ARG CA C 8.453 -10.945 -5.877 1.00 . A A . 7 ARG CA 1 1 6 1386 1 1 7 ARG CB C 8.979 -9.536 -6.161 1.00 . A A . 7 ARG CB 1 1 6 1387 1 1 7 ARG CD C 8.705 -7.583 -7.719 1.00 . A A . 7 ARG CD 1 1 6 1388 1 1 7 ARG CG C 8.793 -9.097 -7.604 1.00 . A A . 7 ARG CG 1 1 6 1389 1 1 7 ARG CZ C 9.486 -5.824 -9.249 1.00 . A A . 7 ARG CZ 1 1 6 1390 1 1 7 ARG H H 7.252 -10.073 -4.368 1.00 . A A . 7 ARG H 1 1 6 1391 1 1 7 ARG HA H 8.039 -11.355 -6.786 1.00 . A A . 7 ARG HA 1 1 6 1392 1 1 7 ARG HB2 H 8.459 -8.835 -5.525 1.00 . A A . 7 ARG HB2 1 1 6 1393 1 1 7 ARG HB3 H 10.033 -9.506 -5.931 1.00 . A A . 7 ARG HB3 1 1 6 1394 1 1 7 ARG HD2 H 7.672 -7.287 -7.619 1.00 . A A . 7 ARG HD2 1 1 6 1395 1 1 7 ARG HD3 H 9.284 -7.141 -6.922 1.00 . A A . 7 ARG HD3 1 1 6 1396 1 1 7 ARG HE H 9.362 -7.761 -9.708 1.00 . A A . 7 ARG HE 1 1 6 1397 1 1 7 ARG HG2 H 9.634 -9.443 -8.187 1.00 . A A . 7 ARG HG2 1 1 6 1398 1 1 7 ARG HG3 H 7.883 -9.532 -7.989 1.00 . A A . 7 ARG HG3 1 1 6 1399 1 1 7 ARG HH11 H 8.951 -5.177 -7.412 1.00 . A A . 7 ARG HH11 1 1 6 1400 1 1 7 ARG HH12 H 9.503 -3.947 -8.500 1.00 . A A . 7 ARG HH12 1 1 6 1401 1 1 7 ARG HH21 H 10.091 -6.151 -11.150 1.00 . A A . 7 ARG HH21 1 1 6 1402 1 1 7 ARG HH22 H 10.151 -4.502 -10.626 1.00 . A A . 7 ARG HH22 1 1 6 1403 1 1 7 ARG N N 7.389 -10.896 -4.881 1.00 . A A . 7 ARG N 1 1 6 1404 1 1 7 ARG NE N 9.215 -7.101 -9.000 1.00 . A A . 7 ARG NE 1 1 6 1405 1 1 7 ARG NH1 N 9.297 -4.907 -8.310 1.00 . A A . 7 ARG NH1 1 1 6 1406 1 1 7 ARG NH2 N 9.947 -5.463 -10.439 1.00 . A A . 7 ARG NH2 1 1 6 1407 1 1 7 ARG O O 9.710 -12.991 -5.832 1.00 . A A . 7 ARG O 1 1 6 1408 1 1 8 LYS C C 11.214 -12.728 -2.685 1.00 . A A . 8 LYS C 1 1 6 1409 1 1 8 LYS CA C 11.574 -12.056 -4.006 1.00 . A A . 8 LYS CA 1 1 6 1410 1 1 8 LYS CB C 12.776 -11.130 -3.809 1.00 . A A . 8 LYS CB 1 1 6 1411 1 1 8 LYS CD C 14.107 -10.978 -1.683 1.00 . A A . 8 LYS CD 1 1 6 1412 1 1 8 LYS CE C 15.355 -10.113 -1.754 1.00 . A A . 8 LYS CE 1 1 6 1413 1 1 8 LYS CG C 13.888 -11.746 -2.976 1.00 . A A . 8 LYS CG 1 1 6 1414 1 1 8 LYS H H 10.296 -10.383 -4.233 1.00 . A A . 8 LYS H 1 1 6 1415 1 1 8 LYS HA H 11.831 -12.818 -4.726 1.00 . A A . 8 LYS HA 1 1 6 1416 1 1 8 LYS HB2 H 13.180 -10.873 -4.777 1.00 . A A . 8 LYS HB2 1 1 6 1417 1 1 8 LYS HB3 H 12.444 -10.228 -3.316 1.00 . A A . 8 LYS HB3 1 1 6 1418 1 1 8 LYS HD2 H 13.252 -10.343 -1.502 1.00 . A A . 8 LYS HD2 1 1 6 1419 1 1 8 LYS HD3 H 14.213 -11.683 -0.870 1.00 . A A . 8 LYS HD3 1 1 6 1420 1 1 8 LYS HE2 H 15.518 -9.822 -2.780 1.00 . A A . 8 LYS HE2 1 1 6 1421 1 1 8 LYS HE3 H 15.201 -9.231 -1.150 1.00 . A A . 8 LYS HE3 1 1 6 1422 1 1 8 LYS HG2 H 13.623 -12.765 -2.737 1.00 . A A . 8 LYS HG2 1 1 6 1423 1 1 8 LYS HG3 H 14.803 -11.735 -3.551 1.00 . A A . 8 LYS HG3 1 1 6 1424 1 1 8 LYS HZ1 H 17.146 -11.145 -2.058 1.00 . A A . 8 LYS HZ1 1 1 6 1425 1 1 8 LYS HZ2 H 16.273 -11.670 -0.708 1.00 . A A . 8 LYS HZ2 1 1 6 1426 1 1 8 LYS HZ3 H 17.125 -10.210 -0.648 1.00 . A A . 8 LYS HZ3 1 1 6 1427 1 1 8 LYS N N 10.440 -11.306 -4.533 1.00 . A A . 8 LYS N 1 1 6 1428 1 1 8 LYS NZ N 16.560 -10.835 -1.257 1.00 . A A . 8 LYS NZ 1 1 6 1429 1 1 8 LYS O O 10.949 -13.930 -2.642 1.00 . A A . 8 LYS O 1 1 6 1430 1 1 9 CYS C C 9.556 -11.894 0.209 1.00 . A A . 9 CYS C 1 1 6 1431 1 1 9 CYS CA C 10.879 -12.467 -0.289 1.00 . A A . 9 CYS CA 1 1 6 1432 1 1 9 CYS CB C 11.996 -12.138 0.703 1.00 . A A . 9 CYS CB 1 1 6 1433 1 1 9 CYS H H 11.427 -10.997 -1.709 1.00 . A A . 9 CYS H 1 1 6 1434 1 1 9 CYS HA H 10.785 -13.539 -0.369 1.00 . A A . 9 CYS HA 1 1 6 1435 1 1 9 CYS HB2 H 12.554 -11.289 0.336 1.00 . A A . 9 CYS HB2 1 1 6 1436 1 1 9 CYS HB3 H 11.557 -11.887 1.657 1.00 . A A . 9 CYS HB3 1 1 6 1437 1 1 9 CYS HG H 12.885 -14.452 0.105 1.00 . A A . 9 CYS HG 1 1 6 1438 1 1 9 CYS N N 11.207 -11.946 -1.611 1.00 . A A . 9 CYS N 1 1 6 1439 1 1 9 CYS O O 9.336 -10.683 0.206 1.00 . A A . 9 CYS O 1 1 6 1440 1 1 9 CYS SG S 13.166 -13.490 0.971 1.00 . A A . 9 CYS SG 1 1 6 1441 1 1 10 PRO C C 7.421 -11.672 2.495 1.00 . A A . 10 PRO C 1 1 6 1442 1 1 10 PRO CA C 7.334 -12.390 1.152 1.00 . A A . 10 PRO CA 1 1 6 1443 1 1 10 PRO CB C 6.600 -13.724 1.305 1.00 . A A . 10 PRO CB 1 1 6 1444 1 1 10 PRO CD C 8.847 -14.243 0.677 1.00 . A A . 10 PRO CD 1 1 6 1445 1 1 10 PRO CG C 7.680 -14.732 1.490 1.00 . A A . 10 PRO CG 1 1 6 1446 1 1 10 PRO HA H 6.807 -11.766 0.445 1.00 . A A . 10 PRO HA 1 1 6 1447 1 1 10 PRO HB2 H 5.946 -13.681 2.165 1.00 . A A . 10 PRO HB2 1 1 6 1448 1 1 10 PRO HB3 H 6.021 -13.924 0.416 1.00 . A A . 10 PRO HB3 1 1 6 1449 1 1 10 PRO HD2 H 9.778 -14.497 1.162 1.00 . A A . 10 PRO HD2 1 1 6 1450 1 1 10 PRO HD3 H 8.813 -14.658 -0.320 1.00 . A A . 10 PRO HD3 1 1 6 1451 1 1 10 PRO HG2 H 7.950 -14.795 2.533 1.00 . A A . 10 PRO HG2 1 1 6 1452 1 1 10 PRO HG3 H 7.350 -15.695 1.128 1.00 . A A . 10 PRO HG3 1 1 6 1453 1 1 10 PRO N N 8.652 -12.784 0.645 1.00 . A A . 10 PRO N 1 1 6 1454 1 1 10 PRO O O 6.432 -11.122 2.981 1.00 . A A . 10 PRO O 1 1 6 1455 1 1 11 LEU C C 8.646 -9.519 4.260 1.00 . A A . 11 LEU C 1 1 6 1456 1 1 11 LEU CA C 8.825 -11.030 4.377 1.00 . A A . 11 LEU CA 1 1 6 1457 1 1 11 LEU CB C 10.224 -11.350 4.904 1.00 . A A . 11 LEU CB 1 1 6 1458 1 1 11 LEU CD1 C 11.698 -9.323 4.869 1.00 . A A . 11 LEU CD1 1 1 6 1459 1 1 11 LEU CD2 C 12.616 -11.545 4.177 1.00 . A A . 11 LEU CD2 1 1 6 1460 1 1 11 LEU CG C 11.385 -10.650 4.196 1.00 . A A . 11 LEU CG 1 1 6 1461 1 1 11 LEU H H 9.359 -12.135 2.653 1.00 . A A . 11 LEU H 1 1 6 1462 1 1 11 LEU HA H 8.091 -11.414 5.070 1.00 . A A . 11 LEU HA 1 1 6 1463 1 1 11 LEU HB2 H 10.257 -11.071 5.946 1.00 . A A . 11 LEU HB2 1 1 6 1464 1 1 11 LEU HB3 H 10.375 -12.416 4.814 1.00 . A A . 11 LEU HB3 1 1 6 1465 1 1 11 LEU HD11 H 11.157 -8.531 4.373 1.00 . A A . 11 LEU HD11 1 1 6 1466 1 1 11 LEU HD12 H 12.759 -9.128 4.805 1.00 . A A . 11 LEU HD12 1 1 6 1467 1 1 11 LEU HD13 H 11.403 -9.367 5.907 1.00 . A A . 11 LEU HD13 1 1 6 1468 1 1 11 LEU HD21 H 12.404 -12.436 3.606 1.00 . A A . 11 LEU HD21 1 1 6 1469 1 1 11 LEU HD22 H 12.877 -11.818 5.189 1.00 . A A . 11 LEU HD22 1 1 6 1470 1 1 11 LEU HD23 H 13.440 -11.013 3.724 1.00 . A A . 11 LEU HD23 1 1 6 1471 1 1 11 LEU HG H 11.103 -10.446 3.172 1.00 . A A . 11 LEU HG 1 1 6 1472 1 1 11 LEU N N 8.609 -11.681 3.089 1.00 . A A . 11 LEU N 1 1 6 1473 1 1 11 LEU O O 8.572 -8.813 5.266 1.00 . A A . 11 LEU O 1 1 6 1474 1 1 12 PHE C C 6.954 -7.184 2.999 1.00 . A A . 12 PHE C 1 1 6 1475 1 1 12 PHE CA C 8.404 -7.604 2.778 1.00 . A A . 12 PHE CA 1 1 6 1476 1 1 12 PHE CB C 8.835 -7.258 1.351 1.00 . A A . 12 PHE CB 1 1 6 1477 1 1 12 PHE CD1 C 10.901 -5.994 2.009 1.00 . A A . 12 PHE CD1 1 1 6 1478 1 1 12 PHE CD2 C 11.085 -7.663 0.316 1.00 . A A . 12 PHE CD2 1 1 6 1479 1 1 12 PHE CE1 C 12.251 -5.723 1.894 1.00 . A A . 12 PHE CE1 1 1 6 1480 1 1 12 PHE CE2 C 12.436 -7.396 0.196 1.00 . A A . 12 PHE CE2 1 1 6 1481 1 1 12 PHE CG C 10.303 -6.966 1.223 1.00 . A A . 12 PHE CG 1 1 6 1482 1 1 12 PHE CZ C 13.020 -6.424 0.985 1.00 . A A . 12 PHE CZ 1 1 6 1483 1 1 12 PHE H H 8.641 -9.644 2.265 1.00 . A A . 12 PHE H 1 1 6 1484 1 1 12 PHE HA H 9.032 -7.069 3.474 1.00 . A A . 12 PHE HA 1 1 6 1485 1 1 12 PHE HB2 H 8.605 -8.089 0.702 1.00 . A A . 12 PHE HB2 1 1 6 1486 1 1 12 PHE HB3 H 8.292 -6.386 1.020 1.00 . A A . 12 PHE HB3 1 1 6 1487 1 1 12 PHE HD1 H 10.300 -5.444 2.720 1.00 . A A . 12 PHE HD1 1 1 6 1488 1 1 12 PHE HD2 H 10.630 -8.422 -0.303 1.00 . A A . 12 PHE HD2 1 1 6 1489 1 1 12 PHE HE1 H 12.704 -4.962 2.512 1.00 . A A . 12 PHE HE1 1 1 6 1490 1 1 12 PHE HE2 H 13.034 -7.946 -0.515 1.00 . A A . 12 PHE HE2 1 1 6 1491 1 1 12 PHE HZ H 14.075 -6.215 0.894 1.00 . A A . 12 PHE HZ 1 1 6 1492 1 1 12 PHE N N 8.576 -9.031 3.026 1.00 . A A . 12 PHE N 1 1 6 1493 1 1 12 PHE O O 6.310 -6.641 2.103 1.00 . A A . 12 PHE O 1 1 6 1494 1 1 13 GLY C C 4.840 -5.587 4.468 1.00 . A A . 13 GLY C 1 1 6 1495 1 1 13 GLY CA C 5.076 -7.084 4.519 1.00 . A A . 13 GLY CA 1 1 6 1496 1 1 13 GLY H H 7.007 -7.876 4.877 1.00 . A A . 13 GLY H 1 1 6 1497 1 1 13 GLY HA2 H 4.417 -7.566 3.813 1.00 . A A . 13 GLY HA2 1 1 6 1498 1 1 13 GLY HA3 H 4.845 -7.439 5.513 1.00 . A A . 13 GLY HA3 1 1 6 1499 1 1 13 GLY N N 6.446 -7.441 4.201 1.00 . A A . 13 GLY N 1 1 6 1500 1 1 13 GLY O O 3.712 -5.135 4.271 1.00 . A A . 13 GLY O 1 1 6 1501 1 1 14 LYS C C 6.689 -2.777 3.519 1.00 . A A . 14 LYS C 1 1 6 1502 1 1 14 LYS CA C 5.812 -3.360 4.622 1.00 . A A . 14 LYS CA 1 1 6 1503 1 1 14 LYS CB C 6.223 -2.778 5.977 1.00 . A A . 14 LYS CB 1 1 6 1504 1 1 14 LYS CD C 8.403 -2.348 7.147 1.00 . A A . 14 LYS CD 1 1 6 1505 1 1 14 LYS CE C 8.971 -2.799 8.484 1.00 . A A . 14 LYS CE 1 1 6 1506 1 1 14 LYS CG C 7.485 -3.400 6.548 1.00 . A A . 14 LYS CG 1 1 6 1507 1 1 14 LYS H H 6.780 -5.235 4.801 1.00 . A A . 14 LYS H 1 1 6 1508 1 1 14 LYS HA H 4.783 -3.098 4.424 1.00 . A A . 14 LYS HA 1 1 6 1509 1 1 14 LYS HB2 H 6.389 -1.717 5.863 1.00 . A A . 14 LYS HB2 1 1 6 1510 1 1 14 LYS HB3 H 5.419 -2.935 6.681 1.00 . A A . 14 LYS HB3 1 1 6 1511 1 1 14 LYS HD2 H 9.221 -2.166 6.465 1.00 . A A . 14 LYS HD2 1 1 6 1512 1 1 14 LYS HD3 H 7.844 -1.435 7.292 1.00 . A A . 14 LYS HD3 1 1 6 1513 1 1 14 LYS HE2 H 8.437 -2.294 9.275 1.00 . A A . 14 LYS HE2 1 1 6 1514 1 1 14 LYS HE3 H 8.830 -3.865 8.578 1.00 . A A . 14 LYS HE3 1 1 6 1515 1 1 14 LYS HG2 H 7.211 -4.104 7.320 1.00 . A A . 14 LYS HG2 1 1 6 1516 1 1 14 LYS HG3 H 8.011 -3.916 5.757 1.00 . A A . 14 LYS HG3 1 1 6 1517 1 1 14 LYS HZ1 H 10.599 -1.932 9.465 1.00 . A A . 14 LYS HZ1 1 1 6 1518 1 1 14 LYS HZ2 H 10.739 -1.940 7.779 1.00 . A A . 14 LYS HZ2 1 1 6 1519 1 1 14 LYS HZ3 H 10.973 -3.368 8.653 1.00 . A A . 14 LYS HZ3 1 1 6 1520 1 1 14 LYS N N 5.907 -4.815 4.648 1.00 . A A . 14 LYS N 1 1 6 1521 1 1 14 LYS NZ N 10.422 -2.488 8.604 1.00 . A A . 14 LYS NZ 1 1 6 1522 1 1 14 LYS O O 6.399 -1.710 2.981 1.00 . A A . 14 LYS O 1 1 6 1523 1 1 15 GLY C C 7.984 -2.910 0.797 1.00 . A A . 15 GLY C 1 1 6 1524 1 1 15 GLY CA C 8.665 -3.024 2.147 1.00 . A A . 15 GLY CA 1 1 6 1525 1 1 15 GLY H H 7.944 -4.331 3.649 1.00 . A A . 15 GLY H 1 1 6 1526 1 1 15 GLY HA2 H 9.051 -2.055 2.426 1.00 . A A . 15 GLY HA2 1 1 6 1527 1 1 15 GLY HA3 H 9.487 -3.719 2.065 1.00 . A A . 15 GLY HA3 1 1 6 1528 1 1 15 GLY N N 7.763 -3.487 3.186 1.00 . A A . 15 GLY N 1 1 6 1529 1 1 15 GLY O O 7.296 -1.929 0.522 1.00 . A A . 15 GLY O 1 1 6 1530 1 1 16 GLY C C 8.604 -3.842 -2.478 1.00 . A A . 16 GLY C 1 1 6 1531 1 1 16 GLY CA C 7.574 -3.905 -1.368 1.00 . A A . 16 GLY CA 1 1 6 1532 1 1 16 GLY H H 8.738 -4.674 0.225 1.00 . A A . 16 GLY H 1 1 6 1533 1 1 16 GLY HA2 H 6.984 -4.802 -1.490 1.00 . A A . 16 GLY HA2 1 1 6 1534 1 1 16 GLY HA3 H 6.925 -3.046 -1.446 1.00 . A A . 16 GLY HA3 1 1 6 1535 1 1 16 GLY N N 8.179 -3.917 -0.049 1.00 . A A . 16 GLY N 1 1 6 1536 1 1 16 GLY O O 9.774 -4.161 -2.267 1.00 . A A . 16 GLY O 1 1 7 1537 1 1 1 VAL C C 3.165 -1.462 -0.611 1.00 . A A . 1 VAL C 1 1 7 1538 1 1 1 VAL CA C 1.901 -0.615 -0.711 1.00 . A A . 1 VAL CA 1 1 7 1539 1 1 1 VAL CB C 2.078 0.420 -1.838 1.00 . A A . 1 VAL CB 1 1 7 1540 1 1 1 VAL CG1 C 2.278 -0.276 -3.175 1.00 . A A . 1 VAL CG1 1 1 7 1541 1 1 1 VAL CG2 C 0.883 1.360 -1.890 1.00 . A A . 1 VAL CG2 1 1 7 1542 1 1 1 VAL H1 H 1.527 1.007 0.596 1.00 . A A . 1 VAL H1 1 1 7 1543 1 1 1 VAL HA H 1.069 -1.255 -0.966 1.00 . A A . 1 VAL HA 1 1 7 1544 1 1 1 VAL HB H 2.960 1.005 -1.626 1.00 . A A . 1 VAL HB 1 1 7 1545 1 1 1 VAL HG11 H 1.462 -0.962 -3.349 1.00 . A A . 1 VAL HG11 1 1 7 1546 1 1 1 VAL HG12 H 2.305 0.461 -3.964 1.00 . A A . 1 VAL HG12 1 1 7 1547 1 1 1 VAL HG13 H 3.210 -0.822 -3.161 1.00 . A A . 1 VAL HG13 1 1 7 1548 1 1 1 VAL HG21 H 1.172 2.331 -1.518 1.00 . A A . 1 VAL HG21 1 1 7 1549 1 1 1 VAL HG22 H 0.541 1.450 -2.910 1.00 . A A . 1 VAL HG22 1 1 7 1550 1 1 1 VAL HG23 H 0.085 0.963 -1.278 1.00 . A A . 1 VAL HG23 1 1 7 1551 1 1 1 VAL N N 1.599 0.031 0.561 1.00 . A A . 1 VAL N 1 1 7 1552 1 1 1 VAL O O 4.248 -1.028 -1.001 1.00 . A A . 1 VAL O 1 1 7 1553 1 1 2 ALA C C 3.918 -4.875 -0.714 1.00 . A A . 2 ALA C 1 1 7 1554 1 1 2 ALA CA C 4.147 -3.584 0.064 1.00 . A A . 2 ALA CA 1 1 7 1555 1 1 2 ALA CB C 4.389 -3.887 1.535 1.00 . A A . 2 ALA CB 1 1 7 1556 1 1 2 ALA H H 2.129 -2.963 0.208 1.00 . A A . 2 ALA H 1 1 7 1557 1 1 2 ALA HA H 5.026 -3.091 -0.326 1.00 . A A . 2 ALA HA 1 1 7 1558 1 1 2 ALA HB1 H 3.442 -3.942 2.051 1.00 . A A . 2 ALA HB1 1 1 7 1559 1 1 2 ALA HB2 H 4.905 -4.831 1.627 1.00 . A A . 2 ALA HB2 1 1 7 1560 1 1 2 ALA HB3 H 4.991 -3.103 1.969 1.00 . A A . 2 ALA HB3 1 1 7 1561 1 1 2 ALA N N 3.018 -2.674 -0.085 1.00 . A A . 2 ALA N 1 1 7 1562 1 1 2 ALA O O 3.665 -5.928 -0.127 1.00 . A A . 2 ALA O 1 1 7 1563 1 1 3 ARG C C 5.132 -6.651 -3.178 1.00 . A A . 3 ARG C 1 1 7 1564 1 1 3 ARG CA C 3.807 -5.949 -2.895 1.00 . A A . 3 ARG CA 1 1 7 1565 1 1 3 ARG CB C 3.148 -5.531 -4.211 1.00 . A A . 3 ARG CB 1 1 7 1566 1 1 3 ARG CD C 3.535 -4.692 -6.548 1.00 . A A . 3 ARG CD 1 1 7 1567 1 1 3 ARG CG C 4.110 -5.488 -5.387 1.00 . A A . 3 ARG CG 1 1 7 1568 1 1 3 ARG CZ C 2.222 -5.134 -8.579 1.00 . A A . 3 ARG CZ 1 1 7 1569 1 1 3 ARG H H 4.211 -3.921 -2.446 1.00 . A A . 3 ARG H 1 1 7 1570 1 1 3 ARG HA H 3.153 -6.635 -2.377 1.00 . A A . 3 ARG HA 1 1 7 1571 1 1 3 ARG HB2 H 2.360 -6.232 -4.444 1.00 . A A . 3 ARG HB2 1 1 7 1572 1 1 3 ARG HB3 H 2.720 -4.548 -4.088 1.00 . A A . 3 ARG HB3 1 1 7 1573 1 1 3 ARG HD2 H 2.734 -4.070 -6.179 1.00 . A A . 3 ARG HD2 1 1 7 1574 1 1 3 ARG HD3 H 4.314 -4.069 -6.960 1.00 . A A . 3 ARG HD3 1 1 7 1575 1 1 3 ARG HE H 3.268 -6.505 -7.577 1.00 . A A . 3 ARG HE 1 1 7 1576 1 1 3 ARG HG2 H 5.032 -5.025 -5.069 1.00 . A A . 3 ARG HG2 1 1 7 1577 1 1 3 ARG HG3 H 4.306 -6.498 -5.716 1.00 . A A . 3 ARG HG3 1 1 7 1578 1 1 3 ARG HH11 H 2.187 -3.216 -7.944 1.00 . A A . 3 ARG HH11 1 1 7 1579 1 1 3 ARG HH12 H 1.266 -3.541 -9.375 1.00 . A A . 3 ARG HH12 1 1 7 1580 1 1 3 ARG HH21 H 2.059 -6.945 -9.461 1.00 . A A . 3 ARG HH21 1 1 7 1581 1 1 3 ARG HH22 H 1.193 -5.663 -10.236 1.00 . A A . 3 ARG HH22 1 1 7 1582 1 1 3 ARG N N 4.007 -4.788 -2.037 1.00 . A A . 3 ARG N 1 1 7 1583 1 1 3 ARG NE N 3.014 -5.560 -7.601 1.00 . A A . 3 ARG NE 1 1 7 1584 1 1 3 ARG NH1 N 1.862 -3.859 -8.637 1.00 . A A . 3 ARG NH1 1 1 7 1585 1 1 3 ARG NH2 N 1.789 -5.984 -9.501 1.00 . A A . 3 ARG NH2 1 1 7 1586 1 1 3 ARG O O 5.157 -7.773 -3.680 1.00 . A A . 3 ARG O 1 1 7 1587 1 1 4 GLY C C 7.758 -7.840 -2.306 1.00 . A A . 4 GLY C 1 1 7 1588 1 1 4 GLY CA C 7.546 -6.553 -3.079 1.00 . A A . 4 GLY CA 1 1 7 1589 1 1 4 GLY H H 6.152 -5.087 -2.454 1.00 . A A . 4 GLY H 1 1 7 1590 1 1 4 GLY HA2 H 7.662 -6.755 -4.133 1.00 . A A . 4 GLY HA2 1 1 7 1591 1 1 4 GLY HA3 H 8.296 -5.837 -2.775 1.00 . A A . 4 GLY HA3 1 1 7 1592 1 1 4 GLY N N 6.233 -5.979 -2.852 1.00 . A A . 4 GLY N 1 1 7 1593 1 1 4 GLY O O 8.718 -8.570 -2.555 1.00 . A A . 4 GLY O 1 1 7 1594 1 1 5 TRP C C 6.721 -10.571 -1.400 1.00 . A A . 5 TRP C 1 1 7 1595 1 1 5 TRP CA C 6.957 -9.325 -0.553 1.00 . A A . 5 TRP CA 1 1 7 1596 1 1 5 TRP CB C 5.945 -9.273 0.593 1.00 . A A . 5 TRP CB 1 1 7 1597 1 1 5 TRP CD1 C 3.818 -8.702 -0.717 1.00 . A A . 5 TRP CD1 1 1 7 1598 1 1 5 TRP CD2 C 3.656 -10.546 0.543 1.00 . A A . 5 TRP CD2 1 1 7 1599 1 1 5 TRP CE2 C 2.429 -10.345 -0.120 1.00 . A A . 5 TRP CE2 1 1 7 1600 1 1 5 TRP CE3 C 3.790 -11.648 1.392 1.00 . A A . 5 TRP CE3 1 1 7 1601 1 1 5 TRP CG C 4.530 -9.484 0.147 1.00 . A A . 5 TRP CG 1 1 7 1602 1 1 5 TRP CH2 C 1.506 -12.276 0.879 1.00 . A A . 5 TRP CH2 1 1 7 1603 1 1 5 TRP CZ2 C 1.346 -11.205 0.042 1.00 . A A . 5 TRP CZ2 1 1 7 1604 1 1 5 TRP CZ3 C 2.714 -12.501 1.552 1.00 . A A . 5 TRP CZ3 1 1 7 1605 1 1 5 TRP H H 6.119 -7.496 -1.215 1.00 . A A . 5 TRP H 1 1 7 1606 1 1 5 TRP HA H 7.954 -9.368 -0.140 1.00 . A A . 5 TRP HA 1 1 7 1607 1 1 5 TRP HB2 H 6.186 -10.042 1.312 1.00 . A A . 5 TRP HB2 1 1 7 1608 1 1 5 TRP HB3 H 6.004 -8.306 1.072 1.00 . A A . 5 TRP HB3 1 1 7 1609 1 1 5 TRP HD1 H 4.205 -7.813 -1.192 1.00 . A A . 5 TRP HD1 1 1 7 1610 1 1 5 TRP HE1 H 1.855 -8.831 -1.453 1.00 . A A . 5 TRP HE1 1 1 7 1611 1 1 5 TRP HE3 H 4.714 -11.838 1.918 1.00 . A A . 5 TRP HE3 1 1 7 1612 1 1 5 TRP HH2 H 0.692 -12.968 1.034 1.00 . A A . 5 TRP HH2 1 1 7 1613 1 1 5 TRP HZ2 H 0.408 -11.046 -0.469 1.00 . A A . 5 TRP HZ2 1 1 7 1614 1 1 5 TRP HZ3 H 2.799 -13.358 2.204 1.00 . A A . 5 TRP HZ3 1 1 7 1615 1 1 5 TRP N N 6.862 -8.118 -1.366 1.00 . A A . 5 TRP N 1 1 7 1616 1 1 5 TRP NE1 N 2.553 -9.213 -0.881 1.00 . A A . 5 TRP NE1 1 1 7 1617 1 1 5 TRP O O 7.374 -11.597 -1.208 1.00 . A A . 5 TRP O 1 1 7 1618 1 1 6 LYS C C 6.574 -11.822 -4.236 1.00 . A A . 6 LYS C 1 1 7 1619 1 1 6 LYS CA C 5.464 -11.595 -3.215 1.00 . A A . 6 LYS CA 1 1 7 1620 1 1 6 LYS CB C 4.138 -11.340 -3.936 1.00 . A A . 6 LYS CB 1 1 7 1621 1 1 6 LYS CD C 3.024 -9.505 -5.241 1.00 . A A . 6 LYS CD 1 1 7 1622 1 1 6 LYS CE C 1.990 -10.133 -6.162 1.00 . A A . 6 LYS CE 1 1 7 1623 1 1 6 LYS CG C 4.258 -10.382 -5.109 1.00 . A A . 6 LYS CG 1 1 7 1624 1 1 6 LYS H H 5.298 -9.631 -2.442 1.00 . A A . 6 LYS H 1 1 7 1625 1 1 6 LYS HA H 5.367 -12.479 -2.604 1.00 . A A . 6 LYS HA 1 1 7 1626 1 1 6 LYS HB2 H 3.755 -12.281 -4.304 1.00 . A A . 6 LYS HB2 1 1 7 1627 1 1 6 LYS HB3 H 3.432 -10.925 -3.231 1.00 . A A . 6 LYS HB3 1 1 7 1628 1 1 6 LYS HD2 H 2.584 -9.368 -4.264 1.00 . A A . 6 LYS HD2 1 1 7 1629 1 1 6 LYS HD3 H 3.317 -8.546 -5.644 1.00 . A A . 6 LYS HD3 1 1 7 1630 1 1 6 LYS HE2 H 1.847 -9.488 -7.015 1.00 . A A . 6 LYS HE2 1 1 7 1631 1 1 6 LYS HE3 H 2.358 -11.093 -6.494 1.00 . A A . 6 LYS HE3 1 1 7 1632 1 1 6 LYS HG2 H 5.121 -9.751 -4.960 1.00 . A A . 6 LYS HG2 1 1 7 1633 1 1 6 LYS HG3 H 4.381 -10.954 -6.018 1.00 . A A . 6 LYS HG3 1 1 7 1634 1 1 6 LYS HZ1 H 0.071 -9.500 -5.631 1.00 . A A . 6 LYS HZ1 1 1 7 1635 1 1 6 LYS HZ2 H 0.830 -10.450 -4.454 1.00 . A A . 6 LYS HZ2 1 1 7 1636 1 1 6 LYS HZ3 H 0.205 -11.172 -5.849 1.00 . A A . 6 LYS HZ3 1 1 7 1637 1 1 6 LYS N N 5.785 -10.476 -2.337 1.00 . A A . 6 LYS N 1 1 7 1638 1 1 6 LYS NZ N 0.682 -10.327 -5.476 1.00 . A A . 6 LYS NZ 1 1 7 1639 1 1 6 LYS O O 6.712 -12.916 -4.783 1.00 . A A . 6 LYS O 1 1 7 1640 1 1 7 ARG C C 9.474 -11.927 -5.009 1.00 . A A . 7 ARG C 1 1 7 1641 1 1 7 ARG CA C 8.463 -10.869 -5.440 1.00 . A A . 7 ARG CA 1 1 7 1642 1 1 7 ARG CB C 9.155 -9.512 -5.578 1.00 . A A . 7 ARG CB 1 1 7 1643 1 1 7 ARG CD C 8.694 -9.400 -8.046 1.00 . A A . 7 ARG CD 1 1 7 1644 1 1 7 ARG CG C 8.613 -8.665 -6.717 1.00 . A A . 7 ARG CG 1 1 7 1645 1 1 7 ARG CZ C 9.423 -8.931 -10.346 1.00 . A A . 7 ARG CZ 1 1 7 1646 1 1 7 ARG H H 7.204 -9.937 -4.017 1.00 . A A . 7 ARG H 1 1 7 1647 1 1 7 ARG HA H 8.049 -11.152 -6.396 1.00 . A A . 7 ARG HA 1 1 7 1648 1 1 7 ARG HB2 H 9.029 -8.962 -4.657 1.00 . A A . 7 ARG HB2 1 1 7 1649 1 1 7 ARG HB3 H 10.208 -9.675 -5.749 1.00 . A A . 7 ARG HB3 1 1 7 1650 1 1 7 ARG HD2 H 9.442 -10.174 -7.968 1.00 . A A . 7 ARG HD2 1 1 7 1651 1 1 7 ARG HD3 H 7.733 -9.846 -8.253 1.00 . A A . 7 ARG HD3 1 1 7 1652 1 1 7 ARG HE H 9.008 -7.542 -8.977 1.00 . A A . 7 ARG HE 1 1 7 1653 1 1 7 ARG HG2 H 7.580 -8.424 -6.514 1.00 . A A . 7 ARG HG2 1 1 7 1654 1 1 7 ARG HG3 H 9.190 -7.755 -6.782 1.00 . A A . 7 ARG HG3 1 1 7 1655 1 1 7 ARG HH11 H 9.256 -10.892 -9.890 1.00 . A A . 7 ARG HH11 1 1 7 1656 1 1 7 ARG HH12 H 9.768 -10.548 -11.509 1.00 . A A . 7 ARG HH12 1 1 7 1657 1 1 7 ARG HH21 H 9.683 -7.076 -11.105 1.00 . A A . 7 ARG HH21 1 1 7 1658 1 1 7 ARG HH22 H 10.012 -8.377 -12.199 1.00 . A A . 7 ARG HH22 1 1 7 1659 1 1 7 ARG N N 7.364 -10.782 -4.485 1.00 . A A . 7 ARG N 1 1 7 1660 1 1 7 ARG NE N 9.050 -8.506 -9.144 1.00 . A A . 7 ARG NE 1 1 7 1661 1 1 7 ARG NH1 N 9.488 -10.230 -10.602 1.00 . A A . 7 ARG NH1 1 1 7 1662 1 1 7 ARG NH2 N 9.731 -8.056 -11.295 1.00 . A A . 7 ARG NH2 1 1 7 1663 1 1 7 ARG O O 9.437 -13.065 -5.478 1.00 . A A . 7 ARG O 1 1 7 1664 1 1 8 LYS C C 10.970 -13.094 -2.301 1.00 . A A . 8 LYS C 1 1 7 1665 1 1 8 LYS CA C 11.400 -12.459 -3.619 1.00 . A A . 8 LYS CA 1 1 7 1666 1 1 8 LYS CB C 12.728 -11.720 -3.432 1.00 . A A . 8 LYS CB 1 1 7 1667 1 1 8 LYS CD C 14.473 -10.225 -4.446 1.00 . A A . 8 LYS CD 1 1 7 1668 1 1 8 LYS CE C 15.291 -9.991 -5.707 1.00 . A A . 8 LYS CE 1 1 7 1669 1 1 8 LYS CG C 13.279 -11.125 -4.716 1.00 . A A . 8 LYS CG 1 1 7 1670 1 1 8 LYS H H 10.357 -10.624 -3.777 1.00 . A A . 8 LYS H 1 1 7 1671 1 1 8 LYS HA H 11.533 -13.238 -4.354 1.00 . A A . 8 LYS HA 1 1 7 1672 1 1 8 LYS HB2 H 12.583 -10.920 -2.721 1.00 . A A . 8 LYS HB2 1 1 7 1673 1 1 8 LYS HB3 H 13.458 -12.412 -3.038 1.00 . A A . 8 LYS HB3 1 1 7 1674 1 1 8 LYS HD2 H 14.120 -9.273 -4.078 1.00 . A A . 8 LYS HD2 1 1 7 1675 1 1 8 LYS HD3 H 15.102 -10.691 -3.700 1.00 . A A . 8 LYS HD3 1 1 7 1676 1 1 8 LYS HE2 H 16.219 -10.536 -5.625 1.00 . A A . 8 LYS HE2 1 1 7 1677 1 1 8 LYS HE3 H 14.732 -10.358 -6.555 1.00 . A A . 8 LYS HE3 1 1 7 1678 1 1 8 LYS HG2 H 13.586 -11.926 -5.371 1.00 . A A . 8 LYS HG2 1 1 7 1679 1 1 8 LYS HG3 H 12.503 -10.544 -5.194 1.00 . A A . 8 LYS HG3 1 1 7 1680 1 1 8 LYS HZ1 H 16.516 -8.438 -6.378 1.00 . A A . 8 LYS HZ1 1 1 7 1681 1 1 8 LYS HZ2 H 15.617 -8.054 -4.997 1.00 . A A . 8 LYS HZ2 1 1 7 1682 1 1 8 LYS HZ3 H 14.861 -8.111 -6.509 1.00 . A A . 8 LYS HZ3 1 1 7 1683 1 1 8 LYS N N 10.378 -11.545 -4.114 1.00 . A A . 8 LYS N 1 1 7 1684 1 1 8 LYS NZ N 15.592 -8.547 -5.912 1.00 . A A . 8 LYS NZ 1 1 7 1685 1 1 8 LYS O O 10.537 -14.247 -2.268 1.00 . A A . 8 LYS O 1 1 7 1686 1 1 9 CYS C C 9.416 -12.173 0.575 1.00 . A A . 9 CYS C 1 1 7 1687 1 1 9 CYS CA C 10.712 -12.824 0.104 1.00 . A A . 9 CYS CA 1 1 7 1688 1 1 9 CYS CB C 11.830 -12.550 1.112 1.00 . A A . 9 CYS CB 1 1 7 1689 1 1 9 CYS H H 11.441 -11.425 -1.306 1.00 . A A . 9 CYS H 1 1 7 1690 1 1 9 CYS HA H 10.559 -13.890 0.031 1.00 . A A . 9 CYS HA 1 1 7 1691 1 1 9 CYS HB2 H 11.977 -11.483 1.193 1.00 . A A . 9 CYS HB2 1 1 7 1692 1 1 9 CYS HB3 H 11.540 -12.941 2.075 1.00 . A A . 9 CYS HB3 1 1 7 1693 1 1 9 CYS HG H 14.360 -12.376 0.851 1.00 . A A . 9 CYS HG 1 1 7 1694 1 1 9 CYS N N 11.090 -12.335 -1.217 1.00 . A A . 9 CYS N 1 1 7 1695 1 1 9 CYS O O 9.246 -10.955 0.514 1.00 . A A . 9 CYS O 1 1 7 1696 1 1 9 CYS SG S 13.419 -13.290 0.670 1.00 . A A . 9 CYS SG 1 1 7 1697 1 1 10 PRO C C 7.299 -11.751 2.851 1.00 . A A . 10 PRO C 1 1 7 1698 1 1 10 PRO CA C 7.178 -12.529 1.545 1.00 . A A . 10 PRO CA 1 1 7 1699 1 1 10 PRO CB C 6.389 -13.822 1.763 1.00 . A A . 10 PRO CB 1 1 7 1700 1 1 10 PRO CD C 8.611 -14.464 1.158 1.00 . A A . 10 PRO CD 1 1 7 1701 1 1 10 PRO CG C 7.427 -14.865 1.995 1.00 . A A . 10 PRO CG 1 1 7 1702 1 1 10 PRO HA H 6.676 -11.918 0.809 1.00 . A A . 10 PRO HA 1 1 7 1703 1 1 10 PRO HB2 H 5.741 -13.710 2.621 1.00 . A A . 10 PRO HB2 1 1 7 1704 1 1 10 PRO HB3 H 5.799 -14.041 0.886 1.00 . A A . 10 PRO HB3 1 1 7 1705 1 1 10 PRO HD2 H 9.532 -14.734 1.653 1.00 . A A . 10 PRO HD2 1 1 7 1706 1 1 10 PRO HD3 H 8.556 -14.925 0.182 1.00 . A A . 10 PRO HD3 1 1 7 1707 1 1 10 PRO HG2 H 7.698 -14.888 3.040 1.00 . A A . 10 PRO HG2 1 1 7 1708 1 1 10 PRO HG3 H 7.056 -15.829 1.681 1.00 . A A . 10 PRO HG3 1 1 7 1709 1 1 10 PRO N N 8.477 -13.002 1.055 1.00 . A A . 10 PRO N 1 1 7 1710 1 1 10 PRO O O 6.332 -11.150 3.319 1.00 . A A . 10 PRO O 1 1 7 1711 1 1 11 LEU C C 8.758 -9.552 4.469 1.00 . A A . 11 LEU C 1 1 7 1712 1 1 11 LEU CA C 8.741 -11.062 4.688 1.00 . A A . 11 LEU CA 1 1 7 1713 1 1 11 LEU CB C 10.068 -11.516 5.297 1.00 . A A . 11 LEU CB 1 1 7 1714 1 1 11 LEU CD1 C 11.719 -9.639 5.477 1.00 . A A . 11 LEU CD1 1 1 7 1715 1 1 11 LEU CD2 C 12.473 -11.892 4.696 1.00 . A A . 11 LEU CD2 1 1 7 1716 1 1 11 LEU CG C 11.329 -10.888 4.702 1.00 . A A . 11 LEU CG 1 1 7 1717 1 1 11 LEU H H 9.225 -12.263 3.014 1.00 . A A . 11 LEU H 1 1 7 1718 1 1 11 LEU HA H 7.939 -11.306 5.369 1.00 . A A . 11 LEU HA 1 1 7 1719 1 1 11 LEU HB2 H 10.046 -11.280 6.350 1.00 . A A . 11 LEU HB2 1 1 7 1720 1 1 11 LEU HB3 H 10.139 -12.587 5.171 1.00 . A A . 11 LEU HB3 1 1 7 1721 1 1 11 LEU HD11 H 11.822 -8.810 4.793 1.00 . A A . 11 LEU HD11 1 1 7 1722 1 1 11 LEU HD12 H 12.659 -9.807 5.982 1.00 . A A . 11 LEU HD12 1 1 7 1723 1 1 11 LEU HD13 H 10.954 -9.413 6.205 1.00 . A A . 11 LEU HD13 1 1 7 1724 1 1 11 LEU HD21 H 13.332 -11.456 4.208 1.00 . A A . 11 LEU HD21 1 1 7 1725 1 1 11 LEU HD22 H 12.168 -12.781 4.162 1.00 . A A . 11 LEU HD22 1 1 7 1726 1 1 11 LEU HD23 H 12.728 -12.153 5.713 1.00 . A A . 11 LEU HD23 1 1 7 1727 1 1 11 LEU HG H 11.131 -10.598 3.680 1.00 . A A . 11 LEU HG 1 1 7 1728 1 1 11 LEU N N 8.493 -11.767 3.434 1.00 . A A . 11 LEU N 1 1 7 1729 1 1 11 LEU O O 8.861 -8.778 5.421 1.00 . A A . 11 LEU O 1 1 7 1730 1 1 12 PHE C C 7.243 -7.152 2.905 1.00 . A A . 12 PHE C 1 1 7 1731 1 1 12 PHE CA C 8.657 -7.723 2.866 1.00 . A A . 12 PHE CA 1 1 7 1732 1 1 12 PHE CB C 9.267 -7.515 1.478 1.00 . A A . 12 PHE CB 1 1 7 1733 1 1 12 PHE CD1 C 11.333 -6.362 2.313 1.00 . A A . 12 PHE CD1 1 1 7 1734 1 1 12 PHE CD2 C 10.148 -5.384 0.490 1.00 . A A . 12 PHE CD2 1 1 7 1735 1 1 12 PHE CE1 C 12.258 -5.335 2.267 1.00 . A A . 12 PHE CE1 1 1 7 1736 1 1 12 PHE CE2 C 11.070 -4.355 0.439 1.00 . A A . 12 PHE CE2 1 1 7 1737 1 1 12 PHE CG C 10.270 -6.398 1.426 1.00 . A A . 12 PHE CG 1 1 7 1738 1 1 12 PHE CZ C 12.126 -4.330 1.329 1.00 . A A . 12 PHE CZ 1 1 7 1739 1 1 12 PHE H H 8.575 -9.806 2.494 1.00 . A A . 12 PHE H 1 1 7 1740 1 1 12 PHE HA H 9.261 -7.207 3.597 1.00 . A A . 12 PHE HA 1 1 7 1741 1 1 12 PHE HB2 H 9.765 -8.422 1.172 1.00 . A A . 12 PHE HB2 1 1 7 1742 1 1 12 PHE HB3 H 8.478 -7.287 0.778 1.00 . A A . 12 PHE HB3 1 1 7 1743 1 1 12 PHE HD1 H 11.437 -7.148 3.048 1.00 . A A . 12 PHE HD1 1 1 7 1744 1 1 12 PHE HD2 H 9.323 -5.401 -0.207 1.00 . A A . 12 PHE HD2 1 1 7 1745 1 1 12 PHE HE1 H 13.082 -5.319 2.965 1.00 . A A . 12 PHE HE1 1 1 7 1746 1 1 12 PHE HE2 H 10.965 -3.571 -0.296 1.00 . A A . 12 PHE HE2 1 1 7 1747 1 1 12 PHE HZ H 12.847 -3.528 1.291 1.00 . A A . 12 PHE HZ 1 1 7 1748 1 1 12 PHE N N 8.655 -9.141 3.210 1.00 . A A . 12 PHE N 1 1 7 1749 1 1 12 PHE O O 6.870 -6.332 2.066 1.00 . A A . 12 PHE O 1 1 7 1750 1 1 13 GLY C C 5.027 -5.668 4.463 1.00 . A A . 13 GLY C 1 1 7 1751 1 1 13 GLY CA C 5.095 -7.115 4.014 1.00 . A A . 13 GLY CA 1 1 7 1752 1 1 13 GLY H H 6.811 -8.246 4.525 1.00 . A A . 13 GLY H 1 1 7 1753 1 1 13 GLY HA2 H 4.600 -7.208 3.059 1.00 . A A . 13 GLY HA2 1 1 7 1754 1 1 13 GLY HA3 H 4.579 -7.728 4.738 1.00 . A A . 13 GLY HA3 1 1 7 1755 1 1 13 GLY N N 6.459 -7.592 3.885 1.00 . A A . 13 GLY N 1 1 7 1756 1 1 13 GLY O O 3.968 -5.043 4.409 1.00 . A A . 13 GLY O 1 1 7 1757 1 1 14 LYS C C 7.139 -2.923 4.472 1.00 . A A . 14 LYS C 1 1 7 1758 1 1 14 LYS CA C 6.225 -3.753 5.368 1.00 . A A . 14 LYS CA 1 1 7 1759 1 1 14 LYS CB C 6.725 -3.698 6.814 1.00 . A A . 14 LYS CB 1 1 7 1760 1 1 14 LYS CD C 8.930 -3.930 7.995 1.00 . A A . 14 LYS CD 1 1 7 1761 1 1 14 LYS CE C 8.332 -3.631 9.361 1.00 . A A . 14 LYS CE 1 1 7 1762 1 1 14 LYS CG C 7.919 -4.599 7.079 1.00 . A A . 14 LYS CG 1 1 7 1763 1 1 14 LYS H H 6.972 -5.684 4.926 1.00 . A A . 14 LYS H 1 1 7 1764 1 1 14 LYS HA H 5.228 -3.341 5.326 1.00 . A A . 14 LYS HA 1 1 7 1765 1 1 14 LYS HB2 H 7.009 -2.682 7.046 1.00 . A A . 14 LYS HB2 1 1 7 1766 1 1 14 LYS HB3 H 5.922 -3.998 7.471 1.00 . A A . 14 LYS HB3 1 1 7 1767 1 1 14 LYS HD2 H 9.778 -4.587 8.122 1.00 . A A . 14 LYS HD2 1 1 7 1768 1 1 14 LYS HD3 H 9.255 -3.004 7.543 1.00 . A A . 14 LYS HD3 1 1 7 1769 1 1 14 LYS HE2 H 7.488 -2.971 9.233 1.00 . A A . 14 LYS HE2 1 1 7 1770 1 1 14 LYS HE3 H 8.000 -4.558 9.804 1.00 . A A . 14 LYS HE3 1 1 7 1771 1 1 14 LYS HG2 H 7.575 -5.510 7.545 1.00 . A A . 14 LYS HG2 1 1 7 1772 1 1 14 LYS HG3 H 8.398 -4.832 6.138 1.00 . A A . 14 LYS HG3 1 1 7 1773 1 1 14 LYS HZ1 H 9.061 -3.160 11.261 1.00 . A A . 14 LYS HZ1 1 1 7 1774 1 1 14 LYS HZ2 H 9.339 -1.959 10.103 1.00 . A A . 14 LYS HZ2 1 1 7 1775 1 1 14 LYS HZ3 H 10.269 -3.371 10.097 1.00 . A A . 14 LYS HZ3 1 1 7 1776 1 1 14 LYS N N 6.159 -5.134 4.908 1.00 . A A . 14 LYS N 1 1 7 1777 1 1 14 LYS NZ N 9.319 -2.985 10.269 1.00 . A A . 14 LYS NZ 1 1 7 1778 1 1 14 LYS O O 6.960 -1.714 4.336 1.00 . A A . 14 LYS O 1 1 7 1779 1 1 15 GLY C C 8.336 -2.071 1.923 1.00 . A A . 15 GLY C 1 1 7 1780 1 1 15 GLY CA C 9.044 -2.890 2.983 1.00 . A A . 15 GLY CA 1 1 7 1781 1 1 15 GLY H H 8.213 -4.548 4.006 1.00 . A A . 15 GLY H 1 1 7 1782 1 1 15 GLY HA2 H 9.663 -2.234 3.577 1.00 . A A . 15 GLY HA2 1 1 7 1783 1 1 15 GLY HA3 H 9.674 -3.620 2.496 1.00 . A A . 15 GLY HA3 1 1 7 1784 1 1 15 GLY N N 8.118 -3.583 3.860 1.00 . A A . 15 GLY N 1 1 7 1785 1 1 15 GLY O O 8.048 -0.893 2.128 1.00 . A A . 15 GLY O 1 1 7 1786 1 1 16 GLY C C 8.292 -1.033 -1.023 1.00 . A A . 16 GLY C 1 1 7 1787 1 1 16 GLY CA C 7.380 -2.001 -0.297 1.00 . A A . 16 GLY CA 1 1 7 1788 1 1 16 GLY H H 8.308 -3.637 0.676 1.00 . A A . 16 GLY H 1 1 7 1789 1 1 16 GLY HA2 H 7.010 -2.729 -1.003 1.00 . A A . 16 GLY HA2 1 1 7 1790 1 1 16 GLY HA3 H 6.543 -1.452 0.110 1.00 . A A . 16 GLY HA3 1 1 7 1791 1 1 16 GLY N N 8.055 -2.696 0.783 1.00 . A A . 16 GLY N 1 1 7 1792 1 1 16 GLY O O 8.064 0.177 -1.007 1.00 . A A . 16 GLY O 1 1 8 1793 1 1 1 VAL C C 2.851 -1.464 -0.838 1.00 . A A . 1 VAL C 1 1 8 1794 1 1 1 VAL CA C 1.486 -0.824 -0.614 1.00 . A A . 1 VAL CA 1 1 8 1795 1 1 1 VAL CB C 0.857 -0.489 -1.980 1.00 . A A . 1 VAL CB 1 1 8 1796 1 1 1 VAL CG1 C 0.576 -1.762 -2.764 1.00 . A A . 1 VAL CG1 1 1 8 1797 1 1 1 VAL CG2 C -0.414 0.325 -1.795 1.00 . A A . 1 VAL CG2 1 1 8 1798 1 1 1 VAL H1 H 1.969 1.184 -0.152 1.00 . A A . 1 VAL H1 1 1 8 1799 1 1 1 VAL HA H 0.845 -1.533 -0.110 1.00 . A A . 1 VAL HA 1 1 8 1800 1 1 1 VAL HB H 1.562 0.106 -2.542 1.00 . A A . 1 VAL HB 1 1 8 1801 1 1 1 VAL HG11 H 0.006 -2.444 -2.151 1.00 . A A . 1 VAL HG11 1 1 8 1802 1 1 1 VAL HG12 H 0.014 -1.519 -3.654 1.00 . A A . 1 VAL HG12 1 1 8 1803 1 1 1 VAL HG13 H 1.511 -2.226 -3.044 1.00 . A A . 1 VAL HG13 1 1 8 1804 1 1 1 VAL HG21 H -0.192 1.374 -1.918 1.00 . A A . 1 VAL HG21 1 1 8 1805 1 1 1 VAL HG22 H -1.144 0.023 -2.532 1.00 . A A . 1 VAL HG22 1 1 8 1806 1 1 1 VAL HG23 H -0.811 0.155 -0.805 1.00 . A A . 1 VAL HG23 1 1 8 1807 1 1 1 VAL N N 1.593 0.363 0.227 1.00 . A A . 1 VAL N 1 1 8 1808 1 1 1 VAL O O 3.591 -1.072 -1.740 1.00 . A A . 1 VAL O 1 1 8 1809 1 1 2 ALA C C 4.313 -4.429 -0.933 1.00 . A A . 2 ALA C 1 1 8 1810 1 1 2 ALA CA C 4.455 -3.147 -0.120 1.00 . A A . 2 ALA CA 1 1 8 1811 1 1 2 ALA CB C 5.008 -3.456 1.264 1.00 . A A . 2 ALA CB 1 1 8 1812 1 1 2 ALA H H 2.547 -2.717 0.689 1.00 . A A . 2 ALA H 1 1 8 1813 1 1 2 ALA HA H 5.152 -2.490 -0.621 1.00 . A A . 2 ALA HA 1 1 8 1814 1 1 2 ALA HB1 H 4.655 -2.714 1.965 1.00 . A A . 2 ALA HB1 1 1 8 1815 1 1 2 ALA HB2 H 4.673 -4.434 1.575 1.00 . A A . 2 ALA HB2 1 1 8 1816 1 1 2 ALA HB3 H 6.087 -3.437 1.232 1.00 . A A . 2 ALA HB3 1 1 8 1817 1 1 2 ALA N N 3.179 -2.450 -0.010 1.00 . A A . 2 ALA N 1 1 8 1818 1 1 2 ALA O O 4.622 -5.519 -0.451 1.00 . A A . 2 ALA O 1 1 8 1819 1 1 3 ARG C C 4.964 -6.210 -3.218 1.00 . A A . 3 ARG C 1 1 8 1820 1 1 3 ARG CA C 3.658 -5.439 -3.048 1.00 . A A . 3 ARG CA 1 1 8 1821 1 1 3 ARG CB C 3.140 -4.985 -4.413 1.00 . A A . 3 ARG CB 1 1 8 1822 1 1 3 ARG CD C 3.680 -4.317 -6.775 1.00 . A A . 3 ARG CD 1 1 8 1823 1 1 3 ARG CG C 4.224 -4.884 -5.473 1.00 . A A . 3 ARG CG 1 1 8 1824 1 1 3 ARG CZ C 2.719 -5.130 -8.887 1.00 . A A . 3 ARG CZ 1 1 8 1825 1 1 3 ARG H H 3.614 -3.397 -2.497 1.00 . A A . 3 ARG H 1 1 8 1826 1 1 3 ARG HA H 2.926 -6.091 -2.594 1.00 . A A . 3 ARG HA 1 1 8 1827 1 1 3 ARG HB2 H 2.397 -5.689 -4.757 1.00 . A A . 3 ARG HB2 1 1 8 1828 1 1 3 ARG HB3 H 2.681 -4.014 -4.305 1.00 . A A . 3 ARG HB3 1 1 8 1829 1 1 3 ARG HD2 H 2.833 -3.686 -6.551 1.00 . A A . 3 ARG HD2 1 1 8 1830 1 1 3 ARG HD3 H 4.453 -3.728 -7.247 1.00 . A A . 3 ARG HD3 1 1 8 1831 1 1 3 ARG HE H 3.379 -6.298 -7.411 1.00 . A A . 3 ARG HE 1 1 8 1832 1 1 3 ARG HG2 H 5.009 -4.235 -5.112 1.00 . A A . 3 ARG HG2 1 1 8 1833 1 1 3 ARG HG3 H 4.625 -5.869 -5.660 1.00 . A A . 3 ARG HG3 1 1 8 1834 1 1 3 ARG HH11 H 2.812 -3.120 -8.714 1.00 . A A . 3 ARG HH11 1 1 8 1835 1 1 3 ARG HH12 H 2.137 -3.706 -10.198 1.00 . A A . 3 ARG HH12 1 1 8 1836 1 1 3 ARG HH21 H 2.493 -7.082 -9.360 1.00 . A A . 3 ARG HH21 1 1 8 1837 1 1 3 ARG HH22 H 1.955 -5.960 -10.564 1.00 . A A . 3 ARG HH22 1 1 8 1838 1 1 3 ARG N N 3.843 -4.291 -2.168 1.00 . A A . 3 ARG N 1 1 8 1839 1 1 3 ARG NE N 3.257 -5.369 -7.696 1.00 . A A . 3 ARG NE 1 1 8 1840 1 1 3 ARG NH1 N 2.541 -3.883 -9.300 1.00 . A A . 3 ARG NH1 1 1 8 1841 1 1 3 ARG NH2 N 2.360 -6.141 -9.668 1.00 . A A . 3 ARG NH2 1 1 8 1842 1 1 3 ARG O O 4.960 -7.388 -3.573 1.00 . A A . 3 ARG O 1 1 8 1843 1 1 4 GLY C C 7.480 -7.452 -2.290 1.00 . A A . 4 GLY C 1 1 8 1844 1 1 4 GLY CA C 7.379 -6.171 -3.094 1.00 . A A . 4 GLY CA 1 1 8 1845 1 1 4 GLY H H 6.023 -4.597 -2.684 1.00 . A A . 4 GLY H 1 1 8 1846 1 1 4 GLY HA2 H 7.553 -6.398 -4.136 1.00 . A A . 4 GLY HA2 1 1 8 1847 1 1 4 GLY HA3 H 8.140 -5.485 -2.754 1.00 . A A . 4 GLY HA3 1 1 8 1848 1 1 4 GLY N N 6.081 -5.535 -2.963 1.00 . A A . 4 GLY N 1 1 8 1849 1 1 4 GLY O O 8.319 -8.307 -2.575 1.00 . A A . 4 GLY O 1 1 8 1850 1 1 5 TRP C C 6.186 -10.001 -1.216 1.00 . A A . 5 TRP C 1 1 8 1851 1 1 5 TRP CA C 6.625 -8.770 -0.432 1.00 . A A . 5 TRP CA 1 1 8 1852 1 1 5 TRP CB C 5.702 -8.560 0.770 1.00 . A A . 5 TRP CB 1 1 8 1853 1 1 5 TRP CD1 C 3.575 -8.184 -0.609 1.00 . A A . 5 TRP CD1 1 1 8 1854 1 1 5 TRP CD2 C 3.295 -9.514 1.171 1.00 . A A . 5 TRP CD2 1 1 8 1855 1 1 5 TRP CE2 C 2.061 -9.390 0.504 1.00 . A A . 5 TRP CE2 1 1 8 1856 1 1 5 TRP CE3 C 3.363 -10.306 2.320 1.00 . A A . 5 TRP CE3 1 1 8 1857 1 1 5 TRP CG C 4.250 -8.736 0.442 1.00 . A A . 5 TRP CG 1 1 8 1858 1 1 5 TRP CH2 C 1.001 -10.796 2.079 1.00 . A A . 5 TRP CH2 1 1 8 1859 1 1 5 TRP CZ2 C 0.906 -10.027 0.951 1.00 . A A . 5 TRP CZ2 1 1 8 1860 1 1 5 TRP CZ3 C 2.216 -10.938 2.762 1.00 . A A . 5 TRP CZ3 1 1 8 1861 1 1 5 TRP H H 5.980 -6.868 -1.104 1.00 . A A . 5 TRP H 1 1 8 1862 1 1 5 TRP HA H 7.633 -8.923 -0.077 1.00 . A A . 5 TRP HA 1 1 8 1863 1 1 5 TRP HB2 H 5.958 -9.271 1.541 1.00 . A A . 5 TRP HB2 1 1 8 1864 1 1 5 TRP HB3 H 5.840 -7.558 1.149 1.00 . A A . 5 TRP HB3 1 1 8 1865 1 1 5 TRP HD1 H 4.023 -7.537 -1.348 1.00 . A A . 5 TRP HD1 1 1 8 1866 1 1 5 TRP HE1 H 1.571 -8.309 -1.226 1.00 . A A . 5 TRP HE1 1 1 8 1867 1 1 5 TRP HE3 H 4.290 -10.428 2.860 1.00 . A A . 5 TRP HE3 1 1 8 1868 1 1 5 TRP HH2 H 0.131 -11.307 2.460 1.00 . A A . 5 TRP HH2 1 1 8 1869 1 1 5 TRP HZ2 H -0.038 -9.928 0.434 1.00 . A A . 5 TRP HZ2 1 1 8 1870 1 1 5 TRP HZ3 H 2.249 -11.553 3.649 1.00 . A A . 5 TRP HZ3 1 1 8 1871 1 1 5 TRP N N 6.626 -7.584 -1.282 1.00 . A A . 5 TRP N 1 1 8 1872 1 1 5 TRP NE1 N 2.257 -8.573 -0.578 1.00 . A A . 5 TRP NE1 1 1 8 1873 1 1 5 TRP O O 6.469 -11.133 -0.824 1.00 . A A . 5 TRP O 1 1 8 1874 1 1 6 LYS C C 6.048 -11.221 -4.235 1.00 . A A . 6 LYS C 1 1 8 1875 1 1 6 LYS CA C 5.017 -10.866 -3.169 1.00 . A A . 6 LYS CA 1 1 8 1876 1 1 6 LYS CB C 3.692 -10.484 -3.832 1.00 . A A . 6 LYS CB 1 1 8 1877 1 1 6 LYS CD C 3.684 -10.962 -6.298 1.00 . A A . 6 LYS CD 1 1 8 1878 1 1 6 LYS CE C 4.175 -12.109 -7.168 1.00 . A A . 6 LYS CE 1 1 8 1879 1 1 6 LYS CG C 3.258 -11.448 -4.923 1.00 . A A . 6 LYS CG 1 1 8 1880 1 1 6 LYS H H 5.299 -8.849 -2.589 1.00 . A A . 6 LYS H 1 1 8 1881 1 1 6 LYS HA H 4.859 -11.727 -2.537 1.00 . A A . 6 LYS HA 1 1 8 1882 1 1 6 LYS HB2 H 2.920 -10.456 -3.078 1.00 . A A . 6 LYS HB2 1 1 8 1883 1 1 6 LYS HB3 H 3.792 -9.500 -4.269 1.00 . A A . 6 LYS HB3 1 1 8 1884 1 1 6 LYS HD2 H 2.840 -10.494 -6.783 1.00 . A A . 6 LYS HD2 1 1 8 1885 1 1 6 LYS HD3 H 4.481 -10.240 -6.185 1.00 . A A . 6 LYS HD3 1 1 8 1886 1 1 6 LYS HE2 H 5.237 -11.998 -7.321 1.00 . A A . 6 LYS HE2 1 1 8 1887 1 1 6 LYS HE3 H 3.981 -13.040 -6.655 1.00 . A A . 6 LYS HE3 1 1 8 1888 1 1 6 LYS HG2 H 3.708 -12.412 -4.739 1.00 . A A . 6 LYS HG2 1 1 8 1889 1 1 6 LYS HG3 H 2.181 -11.540 -4.901 1.00 . A A . 6 LYS HG3 1 1 8 1890 1 1 6 LYS HZ1 H 2.479 -12.325 -8.368 1.00 . A A . 6 LYS HZ1 1 1 8 1891 1 1 6 LYS HZ2 H 3.906 -12.876 -9.092 1.00 . A A . 6 LYS HZ2 1 1 8 1892 1 1 6 LYS HZ3 H 3.607 -11.216 -8.968 1.00 . A A . 6 LYS HZ3 1 1 8 1893 1 1 6 LYS N N 5.494 -9.774 -2.327 1.00 . A A . 6 LYS N 1 1 8 1894 1 1 6 LYS NZ N 3.494 -12.133 -8.492 1.00 . A A . 6 LYS NZ 1 1 8 1895 1 1 6 LYS O O 5.954 -12.266 -4.880 1.00 . A A . 6 LYS O 1 1 8 1896 1 1 7 ARG C C 9.124 -11.550 -4.878 1.00 . A A . 7 ARG C 1 1 8 1897 1 1 7 ARG CA C 8.081 -10.568 -5.404 1.00 . A A . 7 ARG CA 1 1 8 1898 1 1 7 ARG CB C 8.752 -9.244 -5.772 1.00 . A A . 7 ARG CB 1 1 8 1899 1 1 7 ARG CD C 7.849 -9.298 -8.117 1.00 . A A . 7 ARG CD 1 1 8 1900 1 1 7 ARG CG C 8.017 -8.469 -6.854 1.00 . A A . 7 ARG CG 1 1 8 1901 1 1 7 ARG CZ C 8.195 -9.014 -10.535 1.00 . A A . 7 ARG CZ 1 1 8 1902 1 1 7 ARG H H 7.053 -9.531 -3.871 1.00 . A A . 7 ARG H 1 1 8 1903 1 1 7 ARG HA H 7.621 -10.987 -6.286 1.00 . A A . 7 ARG HA 1 1 8 1904 1 1 7 ARG HB2 H 8.807 -8.623 -4.890 1.00 . A A . 7 ARG HB2 1 1 8 1905 1 1 7 ARG HB3 H 9.753 -9.447 -6.123 1.00 . A A . 7 ARG HB3 1 1 8 1906 1 1 7 ARG HD2 H 8.588 -10.085 -8.116 1.00 . A A . 7 ARG HD2 1 1 8 1907 1 1 7 ARG HD3 H 6.860 -9.732 -8.118 1.00 . A A . 7 ARG HD3 1 1 8 1908 1 1 7 ARG HE H 7.992 -7.520 -9.229 1.00 . A A . 7 ARG HE 1 1 8 1909 1 1 7 ARG HG2 H 7.040 -8.193 -6.485 1.00 . A A . 7 ARG HG2 1 1 8 1910 1 1 7 ARG HG3 H 8.579 -7.578 -7.090 1.00 . A A . 7 ARG HG3 1 1 8 1911 1 1 7 ARG HH11 H 8.122 -10.933 -9.906 1.00 . A A . 7 ARG HH11 1 1 8 1912 1 1 7 ARG HH12 H 8.365 -10.719 -11.608 1.00 . A A . 7 ARG HH12 1 1 8 1913 1 1 7 ARG HH21 H 8.311 -7.225 -11.468 1.00 . A A . 7 ARG HH21 1 1 8 1914 1 1 7 ARG HH22 H 8.473 -8.609 -12.495 1.00 . A A . 7 ARG HH22 1 1 8 1915 1 1 7 ARG N N 7.032 -10.346 -4.415 1.00 . A A . 7 ARG N 1 1 8 1916 1 1 7 ARG NE N 8.015 -8.495 -9.325 1.00 . A A . 7 ARG NE 1 1 8 1917 1 1 7 ARG NH1 N 8.231 -10.330 -10.696 1.00 . A A . 7 ARG NH1 1 1 8 1918 1 1 7 ARG NH2 N 8.338 -8.217 -11.586 1.00 . A A . 7 ARG NH2 1 1 8 1919 1 1 7 ARG O O 9.042 -12.753 -5.130 1.00 . A A . 7 ARG O 1 1 8 1920 1 1 8 LYS C C 10.874 -12.196 -2.126 1.00 . A A . 8 LYS C 1 1 8 1921 1 1 8 LYS CA C 11.163 -11.859 -3.586 1.00 . A A . 8 LYS CA 1 1 8 1922 1 1 8 LYS CB C 12.512 -11.145 -3.698 1.00 . A A . 8 LYS CB 1 1 8 1923 1 1 8 LYS CD C 14.135 -9.927 -5.177 1.00 . A A . 8 LYS CD 1 1 8 1924 1 1 8 LYS CE C 15.401 -10.662 -4.766 1.00 . A A . 8 LYS CE 1 1 8 1925 1 1 8 LYS CG C 12.921 -10.838 -5.128 1.00 . A A . 8 LYS CG 1 1 8 1926 1 1 8 LYS H H 10.115 -10.063 -3.981 1.00 . A A . 8 LYS H 1 1 8 1927 1 1 8 LYS HA H 11.203 -12.777 -4.153 1.00 . A A . 8 LYS HA 1 1 8 1928 1 1 8 LYS HB2 H 12.459 -10.214 -3.152 1.00 . A A . 8 LYS HB2 1 1 8 1929 1 1 8 LYS HB3 H 13.274 -11.770 -3.254 1.00 . A A . 8 LYS HB3 1 1 8 1930 1 1 8 LYS HD2 H 14.258 -9.558 -6.185 1.00 . A A . 8 LYS HD2 1 1 8 1931 1 1 8 LYS HD3 H 13.978 -9.095 -4.504 1.00 . A A . 8 LYS HD3 1 1 8 1932 1 1 8 LYS HE2 H 15.371 -10.837 -3.702 1.00 . A A . 8 LYS HE2 1 1 8 1933 1 1 8 LYS HE3 H 15.437 -11.608 -5.286 1.00 . A A . 8 LYS HE3 1 1 8 1934 1 1 8 LYS HG2 H 13.158 -11.764 -5.631 1.00 . A A . 8 LYS HG2 1 1 8 1935 1 1 8 LYS HG3 H 12.097 -10.353 -5.632 1.00 . A A . 8 LYS HG3 1 1 8 1936 1 1 8 LYS HZ1 H 17.273 -9.872 -4.280 1.00 . A A . 8 LYS HZ1 1 1 8 1937 1 1 8 LYS HZ2 H 16.373 -8.903 -5.336 1.00 . A A . 8 LYS HZ2 1 1 8 1938 1 1 8 LYS HZ3 H 17.117 -10.312 -5.906 1.00 . A A . 8 LYS HZ3 1 1 8 1939 1 1 8 LYS N N 10.104 -11.030 -4.148 1.00 . A A . 8 LYS N 1 1 8 1940 1 1 8 LYS NZ N 16.627 -9.883 -5.095 1.00 . A A . 8 LYS NZ 1 1 8 1941 1 1 8 LYS O O 10.435 -13.303 -1.810 1.00 . A A . 8 LYS O 1 1 8 1942 1 1 9 CYS C C 9.400 -11.620 0.470 1.00 . A A . 9 CYS C 1 1 8 1943 1 1 9 CYS CA C 10.886 -11.431 0.184 1.00 . A A . 9 CYS CA 1 1 8 1944 1 1 9 CYS CB C 11.423 -10.240 0.978 1.00 . A A . 9 CYS CB 1 1 8 1945 1 1 9 CYS H H 11.470 -10.376 -1.555 1.00 . A A . 9 CYS H 1 1 8 1946 1 1 9 CYS HA H 11.414 -12.323 0.487 1.00 . A A . 9 CYS HA 1 1 8 1947 1 1 9 CYS HB2 H 11.209 -9.330 0.437 1.00 . A A . 9 CYS HB2 1 1 8 1948 1 1 9 CYS HB3 H 10.929 -10.205 1.938 1.00 . A A . 9 CYS HB3 1 1 8 1949 1 1 9 CYS HG H 13.765 -9.310 0.588 1.00 . A A . 9 CYS HG 1 1 8 1950 1 1 9 CYS N N 11.121 -11.236 -1.242 1.00 . A A . 9 CYS N 1 1 8 1951 1 1 9 CYS O O 8.587 -10.714 0.286 1.00 . A A . 9 CYS O 1 1 8 1952 1 1 9 CYS SG S 13.206 -10.294 1.276 1.00 . A A . 9 CYS SG 1 1 8 1953 1 1 10 PRO C C 7.139 -12.430 2.487 1.00 . A A . 10 PRO C 1 1 8 1954 1 1 10 PRO CA C 7.643 -13.163 1.248 1.00 . A A . 10 PRO CA 1 1 8 1955 1 1 10 PRO CB C 7.693 -14.671 1.503 1.00 . A A . 10 PRO CB 1 1 8 1956 1 1 10 PRO CD C 9.949 -13.954 1.172 1.00 . A A . 10 PRO CD 1 1 8 1957 1 1 10 PRO CG C 9.097 -14.938 1.924 1.00 . A A . 10 PRO CG 1 1 8 1958 1 1 10 PRO HA H 6.984 -12.958 0.417 1.00 . A A . 10 PRO HA 1 1 8 1959 1 1 10 PRO HB2 H 6.990 -14.931 2.282 1.00 . A A . 10 PRO HB2 1 1 8 1960 1 1 10 PRO HB3 H 7.445 -15.202 0.596 1.00 . A A . 10 PRO HB3 1 1 8 1961 1 1 10 PRO HD2 H 10.790 -13.645 1.774 1.00 . A A . 10 PRO HD2 1 1 8 1962 1 1 10 PRO HD3 H 10.288 -14.382 0.240 1.00 . A A . 10 PRO HD3 1 1 8 1963 1 1 10 PRO HG2 H 9.197 -14.785 2.987 1.00 . A A . 10 PRO HG2 1 1 8 1964 1 1 10 PRO HG3 H 9.373 -15.949 1.661 1.00 . A A . 10 PRO HG3 1 1 8 1965 1 1 10 PRO N N 9.034 -12.826 0.929 1.00 . A A . 10 PRO N 1 1 8 1966 1 1 10 PRO O O 5.944 -12.440 2.783 1.00 . A A . 10 PRO O 1 1 8 1967 1 1 11 LEU C C 8.101 -9.587 4.288 1.00 . A A . 11 LEU C 1 1 8 1968 1 1 11 LEU CA C 7.705 -11.055 4.414 1.00 . A A . 11 LEU CA 1 1 8 1969 1 1 11 LEU CB C 8.389 -11.676 5.633 1.00 . A A . 11 LEU CB 1 1 8 1970 1 1 11 LEU CD1 C 10.733 -11.802 6.512 1.00 . A A . 11 LEU CD1 1 1 8 1971 1 1 11 LEU CD2 C 9.745 -13.759 5.308 1.00 . A A . 11 LEU CD2 1 1 8 1972 1 1 11 LEU CG C 9.791 -12.241 5.402 1.00 . A A . 11 LEU CG 1 1 8 1973 1 1 11 LEU H H 8.994 -11.822 2.920 1.00 . A A . 11 LEU H 1 1 8 1974 1 1 11 LEU HA H 6.635 -11.117 4.541 1.00 . A A . 11 LEU HA 1 1 8 1975 1 1 11 LEU HB2 H 8.461 -10.915 6.395 1.00 . A A . 11 LEU HB2 1 1 8 1976 1 1 11 LEU HB3 H 7.761 -12.481 5.989 1.00 . A A . 11 LEU HB3 1 1 8 1977 1 1 11 LEU HD11 H 11.682 -12.304 6.398 1.00 . A A . 11 LEU HD11 1 1 8 1978 1 1 11 LEU HD12 H 10.304 -12.055 7.470 1.00 . A A . 11 LEU HD12 1 1 8 1979 1 1 11 LEU HD13 H 10.882 -10.733 6.456 1.00 . A A . 11 LEU HD13 1 1 8 1980 1 1 11 LEU HD21 H 10.595 -14.110 4.742 1.00 . A A . 11 LEU HD21 1 1 8 1981 1 1 11 LEU HD22 H 8.833 -14.061 4.815 1.00 . A A . 11 LEU HD22 1 1 8 1982 1 1 11 LEU HD23 H 9.774 -14.182 6.302 1.00 . A A . 11 LEU HD23 1 1 8 1983 1 1 11 LEU HG H 10.176 -11.858 4.467 1.00 . A A . 11 LEU HG 1 1 8 1984 1 1 11 LEU N N 8.057 -11.794 3.207 1.00 . A A . 11 LEU N 1 1 8 1985 1 1 11 LEU O O 8.317 -8.903 5.289 1.00 . A A . 11 LEU O 1 1 8 1986 1 1 12 PHE C C 7.356 -6.798 2.966 1.00 . A A . 12 PHE C 1 1 8 1987 1 1 12 PHE CA C 8.559 -7.720 2.795 1.00 . A A . 12 PHE CA 1 1 8 1988 1 1 12 PHE CB C 9.130 -7.575 1.383 1.00 . A A . 12 PHE CB 1 1 8 1989 1 1 12 PHE CD1 C 11.381 -6.760 2.134 1.00 . A A . 12 PHE CD1 1 1 8 1990 1 1 12 PHE CD2 C 10.274 -5.578 0.383 1.00 . A A . 12 PHE CD2 1 1 8 1991 1 1 12 PHE CE1 C 12.445 -5.880 2.059 1.00 . A A . 12 PHE CE1 1 1 8 1992 1 1 12 PHE CE2 C 11.335 -4.696 0.303 1.00 . A A . 12 PHE CE2 1 1 8 1993 1 1 12 PHE CG C 10.285 -6.618 1.298 1.00 . A A . 12 PHE CG 1 1 8 1994 1 1 12 PHE CZ C 12.422 -4.848 1.141 1.00 . A A . 12 PHE CZ 1 1 8 1995 1 1 12 PHE H H 8.007 -9.702 2.294 1.00 . A A . 12 PHE H 1 1 8 1996 1 1 12 PHE HA H 9.317 -7.441 3.511 1.00 . A A . 12 PHE HA 1 1 8 1997 1 1 12 PHE HB2 H 9.474 -8.540 1.040 1.00 . A A . 12 PHE HB2 1 1 8 1998 1 1 12 PHE HB3 H 8.353 -7.219 0.723 1.00 . A A . 12 PHE HB3 1 1 8 1999 1 1 12 PHE HD1 H 11.401 -7.568 2.851 1.00 . A A . 12 PHE HD1 1 1 8 2000 1 1 12 PHE HD2 H 9.424 -5.458 -0.273 1.00 . A A . 12 PHE HD2 1 1 8 2001 1 1 12 PHE HE1 H 13.294 -6.002 2.715 1.00 . A A . 12 PHE HE1 1 1 8 2002 1 1 12 PHE HE2 H 11.314 -3.889 -0.415 1.00 . A A . 12 PHE HE2 1 1 8 2003 1 1 12 PHE HZ H 13.252 -4.159 1.081 1.00 . A A . 12 PHE HZ 1 1 8 2004 1 1 12 PHE N N 8.191 -9.108 3.052 1.00 . A A . 12 PHE N 1 1 8 2005 1 1 12 PHE O O 7.086 -5.947 2.119 1.00 . A A . 12 PHE O 1 1 8 2006 1 1 13 GLY C C 5.831 -4.711 4.635 1.00 . A A . 13 GLY C 1 1 8 2007 1 1 13 GLY CA C 5.469 -6.151 4.333 1.00 . A A . 13 GLY CA 1 1 8 2008 1 1 13 GLY H H 6.898 -7.668 4.710 1.00 . A A . 13 GLY H 1 1 8 2009 1 1 13 GLY HA2 H 4.823 -6.176 3.468 1.00 . A A . 13 GLY HA2 1 1 8 2010 1 1 13 GLY HA3 H 4.937 -6.561 5.179 1.00 . A A . 13 GLY HA3 1 1 8 2011 1 1 13 GLY N N 6.635 -6.974 4.070 1.00 . A A . 13 GLY N 1 1 8 2012 1 1 13 GLY O O 5.190 -3.784 4.139 1.00 . A A . 13 GLY O 1 1 8 2013 1 1 14 LYS C C 8.208 -2.592 4.740 1.00 . A A . 14 LYS C 1 1 8 2014 1 1 14 LYS CA C 7.309 -3.183 5.821 1.00 . A A . 14 LYS CA 1 1 8 2015 1 1 14 LYS CB C 8.058 -3.223 7.155 1.00 . A A . 14 LYS CB 1 1 8 2016 1 1 14 LYS CD C 9.829 -4.574 8.316 1.00 . A A . 14 LYS CD 1 1 8 2017 1 1 14 LYS CE C 10.449 -3.652 9.354 1.00 . A A . 14 LYS CE 1 1 8 2018 1 1 14 LYS CG C 9.452 -3.818 7.053 1.00 . A A . 14 LYS CG 1 1 8 2019 1 1 14 LYS H H 7.333 -5.300 5.816 1.00 . A A . 14 LYS H 1 1 8 2020 1 1 14 LYS HA H 6.435 -2.558 5.927 1.00 . A A . 14 LYS HA 1 1 8 2021 1 1 14 LYS HB2 H 8.146 -2.216 7.536 1.00 . A A . 14 LYS HB2 1 1 8 2022 1 1 14 LYS HB3 H 7.487 -3.815 7.857 1.00 . A A . 14 LYS HB3 1 1 8 2023 1 1 14 LYS HD2 H 8.941 -5.024 8.735 1.00 . A A . 14 LYS HD2 1 1 8 2024 1 1 14 LYS HD3 H 10.541 -5.348 8.063 1.00 . A A . 14 LYS HD3 1 1 8 2025 1 1 14 LYS HE2 H 11.451 -3.993 9.567 1.00 . A A . 14 LYS HE2 1 1 8 2026 1 1 14 LYS HE3 H 10.489 -2.651 8.949 1.00 . A A . 14 LYS HE3 1 1 8 2027 1 1 14 LYS HG2 H 9.482 -4.500 6.216 1.00 . A A . 14 LYS HG2 1 1 8 2028 1 1 14 LYS HG3 H 10.163 -3.020 6.896 1.00 . A A . 14 LYS HG3 1 1 8 2029 1 1 14 LYS HZ1 H 8.731 -3.204 10.454 1.00 . A A . 14 LYS HZ1 1 1 8 2030 1 1 14 LYS HZ2 H 10.166 -3.078 11.342 1.00 . A A . 14 LYS HZ2 1 1 8 2031 1 1 14 LYS HZ3 H 9.531 -4.601 10.972 1.00 . A A . 14 LYS HZ3 1 1 8 2032 1 1 14 LYS N N 6.862 -4.521 5.452 1.00 . A A . 14 LYS N 1 1 8 2033 1 1 14 LYS NZ N 9.664 -3.632 10.619 1.00 . A A . 14 LYS NZ 1 1 8 2034 1 1 14 LYS O O 8.224 -1.381 4.525 1.00 . A A . 14 LYS O 1 1 8 2035 1 1 15 GLY C C 9.141 -2.120 1.994 1.00 . A A . 15 GLY C 1 1 8 2036 1 1 15 GLY CA C 9.844 -3.002 3.007 1.00 . A A . 15 GLY CA 1 1 8 2037 1 1 15 GLY H H 8.901 -4.412 4.273 1.00 . A A . 15 GLY H 1 1 8 2038 1 1 15 GLY HA2 H 10.655 -2.445 3.452 1.00 . A A . 15 GLY HA2 1 1 8 2039 1 1 15 GLY HA3 H 10.250 -3.863 2.496 1.00 . A A . 15 GLY HA3 1 1 8 2040 1 1 15 GLY N N 8.954 -3.457 4.059 1.00 . A A . 15 GLY N 1 1 8 2041 1 1 15 GLY O O 9.121 -0.898 2.133 1.00 . A A . 15 GLY O 1 1 8 2042 1 1 16 GLY C C 6.834 -1.040 0.522 1.00 . A A . 16 GLY C 1 1 8 2043 1 1 16 GLY CA C 7.865 -1.989 -0.056 1.00 . A A . 16 GLY CA 1 1 8 2044 1 1 16 GLY H H 8.611 -3.719 0.912 1.00 . A A . 16 GLY H 1 1 8 2045 1 1 16 GLY HA2 H 8.587 -1.419 -0.622 1.00 . A A . 16 GLY HA2 1 1 8 2046 1 1 16 GLY HA3 H 7.369 -2.682 -0.719 1.00 . A A . 16 GLY HA3 1 1 8 2047 1 1 16 GLY N N 8.563 -2.741 0.971 1.00 . A A . 16 GLY N 1 1 8 2048 1 1 16 GLY O O 6.567 -1.059 1.723 1.00 . A A . 16 GLY O 1 1 9 2049 1 1 1 VAL C C 3.891 -0.687 -0.822 1.00 . A A . 1 VAL C 1 1 9 2050 1 1 1 VAL CA C 2.695 0.249 -0.958 1.00 . A A . 1 VAL CA 1 1 9 2051 1 1 1 VAL CB C 2.276 0.317 -2.438 1.00 . A A . 1 VAL CB 1 1 9 2052 1 1 1 VAL CG1 C 1.813 -1.047 -2.925 1.00 . A A . 1 VAL CG1 1 1 9 2053 1 1 1 VAL CG2 C 1.187 1.361 -2.636 1.00 . A A . 1 VAL CG2 1 1 9 2054 1 1 1 VAL H1 H 3.594 2.165 -0.941 1.00 . A A . 1 VAL H1 1 1 9 2055 1 1 1 VAL HA H 1.869 -0.153 -0.389 1.00 . A A . 1 VAL HA 1 1 9 2056 1 1 1 VAL HB H 3.136 0.610 -3.022 1.00 . A A . 1 VAL HB 1 1 9 2057 1 1 1 VAL HG11 H 0.852 -0.949 -3.409 1.00 . A A . 1 VAL HG11 1 1 9 2058 1 1 1 VAL HG12 H 2.532 -1.442 -3.628 1.00 . A A . 1 VAL HG12 1 1 9 2059 1 1 1 VAL HG13 H 1.724 -1.718 -2.084 1.00 . A A . 1 VAL HG13 1 1 9 2060 1 1 1 VAL HG21 H 1.630 2.346 -2.650 1.00 . A A . 1 VAL HG21 1 1 9 2061 1 1 1 VAL HG22 H 0.681 1.180 -3.572 1.00 . A A . 1 VAL HG22 1 1 9 2062 1 1 1 VAL HG23 H 0.476 1.299 -1.824 1.00 . A A . 1 VAL HG23 1 1 9 2063 1 1 1 VAL N N 3.002 1.574 -0.431 1.00 . A A . 1 VAL N 1 1 9 2064 1 1 1 VAL O O 5.013 -0.335 -1.187 1.00 . A A . 1 VAL O 1 1 9 2065 1 1 2 ALA C C 4.397 -4.146 -0.893 1.00 . A A . 2 ALA C 1 1 9 2066 1 1 2 ALA CA C 4.699 -2.870 -0.114 1.00 . A A . 2 ALA CA 1 1 9 2067 1 1 2 ALA CB C 4.882 -3.182 1.364 1.00 . A A . 2 ALA CB 1 1 9 2068 1 1 2 ALA H H 2.729 -2.104 -0.024 1.00 . A A . 2 ALA H 1 1 9 2069 1 1 2 ALA HA H 5.622 -2.445 -0.484 1.00 . A A . 2 ALA HA 1 1 9 2070 1 1 2 ALA HB1 H 5.183 -2.285 1.885 1.00 . A A . 2 ALA HB1 1 1 9 2071 1 1 2 ALA HB2 H 3.950 -3.542 1.773 1.00 . A A . 2 ALA HB2 1 1 9 2072 1 1 2 ALA HB3 H 5.643 -3.939 1.480 1.00 . A A . 2 ALA HB3 1 1 9 2073 1 1 2 ALA N N 3.644 -1.882 -0.296 1.00 . A A . 2 ALA N 1 1 9 2074 1 1 2 ALA O O 4.053 -5.174 -0.309 1.00 . A A . 2 ALA O 1 1 9 2075 1 1 3 ARG C C 5.537 -6.030 -3.302 1.00 . A A . 3 ARG C 1 1 9 2076 1 1 3 ARG CA C 4.263 -5.222 -3.072 1.00 . A A . 3 ARG CA 1 1 9 2077 1 1 3 ARG CB C 3.688 -4.763 -4.413 1.00 . A A . 3 ARG CB 1 1 9 2078 1 1 3 ARG CD C 2.622 -7.013 -4.753 1.00 . A A . 3 ARG CD 1 1 9 2079 1 1 3 ARG CG C 3.439 -5.900 -5.390 1.00 . A A . 3 ARG CG 1 1 9 2080 1 1 3 ARG CZ C 0.810 -8.555 -5.371 1.00 . A A . 3 ARG CZ 1 1 9 2081 1 1 3 ARG H H 4.802 -3.225 -2.621 1.00 . A A . 3 ARG H 1 1 9 2082 1 1 3 ARG HA H 3.538 -5.849 -2.575 1.00 . A A . 3 ARG HA 1 1 9 2083 1 1 3 ARG HB2 H 2.750 -4.258 -4.235 1.00 . A A . 3 ARG HB2 1 1 9 2084 1 1 3 ARG HB3 H 4.379 -4.070 -4.869 1.00 . A A . 3 ARG HB3 1 1 9 2085 1 1 3 ARG HD2 H 3.296 -7.767 -4.377 1.00 . A A . 3 ARG HD2 1 1 9 2086 1 1 3 ARG HD3 H 2.053 -6.599 -3.934 1.00 . A A . 3 ARG HD3 1 1 9 2087 1 1 3 ARG HE H 1.755 -7.341 -6.640 1.00 . A A . 3 ARG HE 1 1 9 2088 1 1 3 ARG HG2 H 2.901 -5.517 -6.245 1.00 . A A . 3 ARG HG2 1 1 9 2089 1 1 3 ARG HG3 H 4.389 -6.301 -5.710 1.00 . A A . 3 ARG HG3 1 1 9 2090 1 1 3 ARG HH11 H 1.318 -8.580 -3.416 1.00 . A A . 3 ARG HH11 1 1 9 2091 1 1 3 ARG HH12 H 0.042 -9.662 -3.865 1.00 . A A . 3 ARG HH12 1 1 9 2092 1 1 3 ARG HH21 H 0.076 -8.762 -7.243 1.00 . A A . 3 ARG HH21 1 1 9 2093 1 1 3 ARG HH22 H -0.663 -9.766 -6.042 1.00 . A A . 3 ARG HH22 1 1 9 2094 1 1 3 ARG N N 4.525 -4.073 -2.213 1.00 . A A . 3 ARG N 1 1 9 2095 1 1 3 ARG NE N 1.703 -7.630 -5.705 1.00 . A A . 3 ARG NE 1 1 9 2096 1 1 3 ARG NH1 N 0.716 -8.967 -4.114 1.00 . A A . 3 ARG NH1 1 1 9 2097 1 1 3 ARG NH2 N 0.008 -9.070 -6.295 1.00 . A A . 3 ARG NH2 1 1 9 2098 1 1 3 ARG O O 5.491 -7.147 -3.814 1.00 . A A . 3 ARG O 1 1 9 2099 1 1 4 GLY C C 8.007 -7.448 -2.338 1.00 . A A . 4 GLY C 1 1 9 2100 1 1 4 GLY CA C 7.944 -6.135 -3.094 1.00 . A A . 4 GLY CA 1 1 9 2101 1 1 4 GLY H H 6.650 -4.562 -2.518 1.00 . A A . 4 GLY H 1 1 9 2102 1 1 4 GLY HA2 H 8.095 -6.330 -4.145 1.00 . A A . 4 GLY HA2 1 1 9 2103 1 1 4 GLY HA3 H 8.736 -5.491 -2.740 1.00 . A A . 4 GLY HA3 1 1 9 2104 1 1 4 GLY N N 6.674 -5.455 -2.920 1.00 . A A . 4 GLY N 1 1 9 2105 1 1 4 GLY O O 8.910 -8.255 -2.557 1.00 . A A . 4 GLY O 1 1 9 2106 1 1 5 TRP C C 6.662 -10.087 -1.530 1.00 . A A . 5 TRP C 1 1 9 2107 1 1 5 TRP CA C 6.997 -8.885 -0.654 1.00 . A A . 5 TRP CA 1 1 9 2108 1 1 5 TRP CB C 5.964 -8.751 0.466 1.00 . A A . 5 TRP CB 1 1 9 2109 1 1 5 TRP CD1 C 3.939 -7.964 -0.893 1.00 . A A . 5 TRP CD1 1 1 9 2110 1 1 5 TRP CD2 C 3.565 -9.796 0.339 1.00 . A A . 5 TRP CD2 1 1 9 2111 1 1 5 TRP CE2 C 2.382 -9.471 -0.353 1.00 . A A . 5 TRP CE2 1 1 9 2112 1 1 5 TRP CE3 C 3.569 -10.914 1.177 1.00 . A A . 5 TRP CE3 1 1 9 2113 1 1 5 TRP CG C 4.548 -8.820 -0.021 1.00 . A A . 5 TRP CG 1 1 9 2114 1 1 5 TRP CH2 C 1.250 -11.313 0.596 1.00 . A A . 5 TRP CH2 1 1 9 2115 1 1 5 TRP CZ2 C 1.217 -10.224 -0.231 1.00 . A A . 5 TRP CZ2 1 1 9 2116 1 1 5 TRP CZ3 C 2.412 -11.660 1.298 1.00 . A A . 5 TRP CZ3 1 1 9 2117 1 1 5 TRP H H 6.353 -6.980 -1.317 1.00 . A A . 5 TRP H 1 1 9 2118 1 1 5 TRP HA H 7.973 -9.034 -0.216 1.00 . A A . 5 TRP HA 1 1 9 2119 1 1 5 TRP HB2 H 6.110 -9.548 1.179 1.00 . A A . 5 TRP HB2 1 1 9 2120 1 1 5 TRP HB3 H 6.102 -7.800 0.960 1.00 . A A . 5 TRP HB3 1 1 9 2121 1 1 5 TRP HD1 H 4.422 -7.112 -1.346 1.00 . A A . 5 TRP HD1 1 1 9 2122 1 1 5 TRP HE1 H 1.993 -7.895 -1.682 1.00 . A A . 5 TRP HE1 1 1 9 2123 1 1 5 TRP HE3 H 4.455 -11.198 1.726 1.00 . A A . 5 TRP HE3 1 1 9 2124 1 1 5 TRP HH2 H 0.369 -11.925 0.721 1.00 . A A . 5 TRP HH2 1 1 9 2125 1 1 5 TRP HZ2 H 0.313 -9.970 -0.765 1.00 . A A . 5 TRP HZ2 1 1 9 2126 1 1 5 TRP HZ3 H 2.396 -12.528 1.941 1.00 . A A . 5 TRP HZ3 1 1 9 2127 1 1 5 TRP N N 7.046 -7.661 -1.446 1.00 . A A . 5 TRP N 1 1 9 2128 1 1 5 TRP NE1 N 2.636 -8.349 -1.097 1.00 . A A . 5 TRP NE1 1 1 9 2129 1 1 5 TRP O O 7.197 -11.179 -1.334 1.00 . A A . 5 TRP O 1 1 9 2130 1 1 6 LYS C C 6.483 -11.271 -4.396 1.00 . A A . 6 LYS C 1 1 9 2131 1 1 6 LYS CA C 5.369 -10.948 -3.404 1.00 . A A . 6 LYS CA 1 1 9 2132 1 1 6 LYS CB C 4.100 -10.548 -4.160 1.00 . A A . 6 LYS CB 1 1 9 2133 1 1 6 LYS CD C 4.388 -10.872 -6.634 1.00 . A A . 6 LYS CD 1 1 9 2134 1 1 6 LYS CE C 3.304 -10.525 -7.643 1.00 . A A . 6 LYS CE 1 1 9 2135 1 1 6 LYS CG C 3.797 -11.437 -5.353 1.00 . A A . 6 LYS CG 1 1 9 2136 1 1 6 LYS H H 5.383 -8.988 -2.603 1.00 . A A . 6 LYS H 1 1 9 2137 1 1 6 LYS HA H 5.164 -11.827 -2.812 1.00 . A A . 6 LYS HA 1 1 9 2138 1 1 6 LYS HB2 H 3.261 -10.594 -3.480 1.00 . A A . 6 LYS HB2 1 1 9 2139 1 1 6 LYS HB3 H 4.210 -9.533 -4.512 1.00 . A A . 6 LYS HB3 1 1 9 2140 1 1 6 LYS HD2 H 4.945 -9.977 -6.399 1.00 . A A . 6 LYS HD2 1 1 9 2141 1 1 6 LYS HD3 H 5.051 -11.607 -7.069 1.00 . A A . 6 LYS HD3 1 1 9 2142 1 1 6 LYS HE2 H 2.856 -11.440 -7.999 1.00 . A A . 6 LYS HE2 1 1 9 2143 1 1 6 LYS HE3 H 2.553 -9.924 -7.152 1.00 . A A . 6 LYS HE3 1 1 9 2144 1 1 6 LYS HG2 H 4.216 -12.416 -5.177 1.00 . A A . 6 LYS HG2 1 1 9 2145 1 1 6 LYS HG3 H 2.725 -11.518 -5.467 1.00 . A A . 6 LYS HG3 1 1 9 2146 1 1 6 LYS HZ1 H 4.818 -9.452 -8.601 1.00 . A A . 6 LYS HZ1 1 1 9 2147 1 1 6 LYS HZ2 H 3.257 -8.935 -8.996 1.00 . A A . 6 LYS HZ2 1 1 9 2148 1 1 6 LYS HZ3 H 3.862 -10.372 -9.650 1.00 . A A . 6 LYS HZ3 1 1 9 2149 1 1 6 LYS N N 5.775 -9.881 -2.497 1.00 . A A . 6 LYS N 1 1 9 2150 1 1 6 LYS NZ N 3.849 -9.768 -8.804 1.00 . A A . 6 LYS NZ 1 1 9 2151 1 1 6 LYS O O 6.502 -12.348 -4.992 1.00 . A A . 6 LYS O 1 1 9 2152 1 1 7 ARG C C 9.411 -11.678 -5.035 1.00 . A A . 7 ARG C 1 1 9 2153 1 1 7 ARG CA C 8.525 -10.519 -5.484 1.00 . A A . 7 ARG CA 1 1 9 2154 1 1 7 ARG CB C 9.354 -9.237 -5.579 1.00 . A A . 7 ARG CB 1 1 9 2155 1 1 7 ARG CD C 8.968 -9.042 -8.055 1.00 . A A . 7 ARG CD 1 1 9 2156 1 1 7 ARG CG C 8.931 -8.321 -6.717 1.00 . A A . 7 ARG CG 1 1 9 2157 1 1 7 ARG CZ C 9.475 -8.541 -10.408 1.00 . A A . 7 ARG CZ 1 1 9 2158 1 1 7 ARG H H 7.339 -9.495 -4.061 1.00 . A A . 7 ARG H 1 1 9 2159 1 1 7 ARG HA H 8.119 -10.748 -6.458 1.00 . A A . 7 ARG HA 1 1 9 2160 1 1 7 ARG HB2 H 9.258 -8.690 -4.653 1.00 . A A . 7 ARG HB2 1 1 9 2161 1 1 7 ARG HB3 H 10.390 -9.502 -5.726 1.00 . A A . 7 ARG HB3 1 1 9 2162 1 1 7 ARG HD2 H 9.642 -9.882 -7.978 1.00 . A A . 7 ARG HD2 1 1 9 2163 1 1 7 ARG HD3 H 7.975 -9.397 -8.285 1.00 . A A . 7 ARG HD3 1 1 9 2164 1 1 7 ARG HE H 9.702 -7.261 -8.896 1.00 . A A . 7 ARG HE 1 1 9 2165 1 1 7 ARG HG2 H 7.923 -7.977 -6.534 1.00 . A A . 7 ARG HG2 1 1 9 2166 1 1 7 ARG HG3 H 9.601 -7.475 -6.754 1.00 . A A . 7 ARG HG3 1 1 9 2167 1 1 7 ARG HH11 H 8.782 -10.408 -10.066 1.00 . A A . 7 ARG HH11 1 1 9 2168 1 1 7 ARG HH12 H 9.142 -10.042 -11.721 1.00 . A A . 7 ARG HH12 1 1 9 2169 1 1 7 ARG HH21 H 10.180 -6.767 -11.071 1.00 . A A . 7 ARG HH21 1 1 9 2170 1 1 7 ARG HH22 H 9.939 -7.971 -12.291 1.00 . A A . 7 ARG HH22 1 1 9 2171 1 1 7 ARG N N 7.408 -10.333 -4.565 1.00 . A A . 7 ARG N 1 1 9 2172 1 1 7 ARG NE N 9.422 -8.169 -9.134 1.00 . A A . 7 ARG NE 1 1 9 2173 1 1 7 ARG NH1 N 9.103 -9.764 -10.761 1.00 . A A . 7 ARG NH1 1 1 9 2174 1 1 7 ARG NH2 N 9.899 -7.690 -11.333 1.00 . A A . 7 ARG NH2 1 1 9 2175 1 1 7 ARG O O 9.282 -12.799 -5.527 1.00 . A A . 7 ARG O 1 1 9 2176 1 1 8 LYS C C 10.697 -12.996 -2.272 1.00 . A A . 8 LYS C 1 1 9 2177 1 1 8 LYS CA C 11.219 -12.416 -3.583 1.00 . A A . 8 LYS CA 1 1 9 2178 1 1 8 LYS CB C 12.615 -11.824 -3.371 1.00 . A A . 8 LYS CB 1 1 9 2179 1 1 8 LYS CD C 12.637 -9.537 -4.408 1.00 . A A . 8 LYS CD 1 1 9 2180 1 1 8 LYS CE C 13.993 -8.884 -4.631 1.00 . A A . 8 LYS CE 1 1 9 2181 1 1 8 LYS CG C 12.607 -10.328 -3.111 1.00 . A A . 8 LYS CG 1 1 9 2182 1 1 8 LYS H H 10.367 -10.486 -3.746 1.00 . A A . 8 LYS H 1 1 9 2183 1 1 8 LYS HA H 11.281 -13.208 -4.314 1.00 . A A . 8 LYS HA 1 1 9 2184 1 1 8 LYS HB2 H 13.075 -12.313 -2.525 1.00 . A A . 8 LYS HB2 1 1 9 2185 1 1 8 LYS HB3 H 13.210 -12.012 -4.253 1.00 . A A . 8 LYS HB3 1 1 9 2186 1 1 8 LYS HD2 H 12.431 -10.204 -5.232 1.00 . A A . 8 LYS HD2 1 1 9 2187 1 1 8 LYS HD3 H 11.880 -8.767 -4.367 1.00 . A A . 8 LYS HD3 1 1 9 2188 1 1 8 LYS HE2 H 13.841 -7.912 -5.074 1.00 . A A . 8 LYS HE2 1 1 9 2189 1 1 8 LYS HE3 H 14.486 -8.773 -3.677 1.00 . A A . 8 LYS HE3 1 1 9 2190 1 1 8 LYS HG2 H 11.712 -10.071 -2.566 1.00 . A A . 8 LYS HG2 1 1 9 2191 1 1 8 LYS HG3 H 13.476 -10.070 -2.522 1.00 . A A . 8 LYS HG3 1 1 9 2192 1 1 8 LYS HZ1 H 14.446 -9.733 -6.486 1.00 . A A . 8 LYS HZ1 1 1 9 2193 1 1 8 LYS HZ2 H 14.943 -10.666 -5.165 1.00 . A A . 8 LYS HZ2 1 1 9 2194 1 1 8 LYS HZ3 H 15.807 -9.276 -5.590 1.00 . A A . 8 LYS HZ3 1 1 9 2195 1 1 8 LYS N N 10.312 -11.399 -4.099 1.00 . A A . 8 LYS N 1 1 9 2196 1 1 8 LYS NZ N 14.858 -9.697 -5.532 1.00 . A A . 8 LYS NZ 1 1 9 2197 1 1 8 LYS O O 10.144 -14.097 -2.246 1.00 . A A . 8 LYS O 1 1 9 2198 1 1 9 CYS C C 9.166 -11.935 0.549 1.00 . A A . 9 CYS C 1 1 9 2199 1 1 9 CYS CA C 10.421 -12.691 0.127 1.00 . A A . 9 CYS CA 1 1 9 2200 1 1 9 CYS CB C 11.526 -12.490 1.165 1.00 . A A . 9 CYS CB 1 1 9 2201 1 1 9 CYS H H 11.323 -11.382 -1.272 1.00 . A A . 9 CYS H 1 1 9 2202 1 1 9 CYS HA H 10.188 -13.742 0.060 1.00 . A A . 9 CYS HA 1 1 9 2203 1 1 9 CYS HB2 H 11.655 -11.432 1.342 1.00 . A A . 9 CYS HB2 1 1 9 2204 1 1 9 CYS HB3 H 11.234 -12.969 2.087 1.00 . A A . 9 CYS HB3 1 1 9 2205 1 1 9 CYS HG H 12.939 -14.398 0.237 1.00 . A A . 9 CYS HG 1 1 9 2206 1 1 9 CYS N N 10.875 -12.250 -1.188 1.00 . A A . 9 CYS N 1 1 9 2207 1 1 9 CYS O O 9.097 -10.708 0.479 1.00 . A A . 9 CYS O 1 1 9 2208 1 1 9 CYS SG S 13.131 -13.163 0.675 1.00 . A A . 9 CYS SG 1 1 9 2209 1 1 10 PRO C C 7.012 -11.334 2.748 1.00 . A A . 10 PRO C 1 1 9 2210 1 1 10 PRO CA C 6.875 -12.105 1.440 1.00 . A A . 10 PRO CA 1 1 9 2211 1 1 10 PRO CB C 5.977 -13.330 1.633 1.00 . A A . 10 PRO CB 1 1 9 2212 1 1 10 PRO CD C 8.159 -14.152 1.108 1.00 . A A . 10 PRO CD 1 1 9 2213 1 1 10 PRO CG C 6.919 -14.452 1.904 1.00 . A A . 10 PRO CG 1 1 9 2214 1 1 10 PRO HA H 6.449 -11.460 0.685 1.00 . A A . 10 PRO HA 1 1 9 2215 1 1 10 PRO HB2 H 5.310 -13.163 2.467 1.00 . A A . 10 PRO HB2 1 1 9 2216 1 1 10 PRO HB3 H 5.403 -13.505 0.736 1.00 . A A . 10 PRO HB3 1 1 9 2217 1 1 10 PRO HD2 H 9.038 -14.491 1.637 1.00 . A A . 10 PRO HD2 1 1 9 2218 1 1 10 PRO HD3 H 8.102 -14.612 0.133 1.00 . A A . 10 PRO HD3 1 1 9 2219 1 1 10 PRO HG2 H 7.150 -14.491 2.958 1.00 . A A . 10 PRO HG2 1 1 9 2220 1 1 10 PRO HG3 H 6.482 -15.384 1.579 1.00 . A A . 10 PRO HG3 1 1 9 2221 1 1 10 PRO N N 8.147 -12.683 0.998 1.00 . A A . 10 PRO N 1 1 9 2222 1 1 10 PRO O O 6.080 -10.654 3.180 1.00 . A A . 10 PRO O 1 1 9 2223 1 1 11 LEU C C 8.615 -9.255 4.408 1.00 . A A . 11 LEU C 1 1 9 2224 1 1 11 LEU CA C 8.438 -10.753 4.633 1.00 . A A . 11 LEU CA 1 1 9 2225 1 1 11 LEU CB C 9.685 -11.330 5.305 1.00 . A A . 11 LEU CB 1 1 9 2226 1 1 11 LEU CD1 C 11.729 -10.011 4.700 1.00 . A A . 11 LEU CD1 1 1 9 2227 1 1 11 LEU CD2 C 11.842 -12.507 4.808 1.00 . A A . 11 LEU CD2 1 1 9 2228 1 1 11 LEU CG C 10.967 -11.308 4.473 1.00 . A A . 11 LEU CG 1 1 9 2229 1 1 11 LEU H H 8.883 -11.998 2.980 1.00 . A A . 11 LEU H 1 1 9 2230 1 1 11 LEU HA H 7.586 -10.910 5.278 1.00 . A A . 11 LEU HA 1 1 9 2231 1 1 11 LEU HB2 H 9.866 -10.765 6.206 1.00 . A A . 11 LEU HB2 1 1 9 2232 1 1 11 LEU HB3 H 9.475 -12.358 5.563 1.00 . A A . 11 LEU HB3 1 1 9 2233 1 1 11 LEU HD11 H 12.780 -10.174 4.517 1.00 . A A . 11 LEU HD11 1 1 9 2234 1 1 11 LEU HD12 H 11.587 -9.684 5.719 1.00 . A A . 11 LEU HD12 1 1 9 2235 1 1 11 LEU HD13 H 11.358 -9.253 4.025 1.00 . A A . 11 LEU HD13 1 1 9 2236 1 1 11 LEU HD21 H 11.852 -12.658 5.877 1.00 . A A . 11 LEU HD21 1 1 9 2237 1 1 11 LEU HD22 H 12.848 -12.327 4.459 1.00 . A A . 11 LEU HD22 1 1 9 2238 1 1 11 LEU HD23 H 11.445 -13.388 4.323 1.00 . A A . 11 LEU HD23 1 1 9 2239 1 1 11 LEU HG H 10.709 -11.363 3.424 1.00 . A A . 11 LEU HG 1 1 9 2240 1 1 11 LEU N N 8.178 -11.442 3.373 1.00 . A A . 11 LEU N 1 1 9 2241 1 1 11 LEU O O 8.746 -8.485 5.360 1.00 . A A . 11 LEU O 1 1 9 2242 1 1 12 PHE C C 7.427 -6.724 2.795 1.00 . A A . 12 PHE C 1 1 9 2243 1 1 12 PHE CA C 8.774 -7.441 2.792 1.00 . A A . 12 PHE CA 1 1 9 2244 1 1 12 PHE CB C 9.434 -7.308 1.418 1.00 . A A . 12 PHE CB 1 1 9 2245 1 1 12 PHE CD1 C 11.526 -6.204 2.256 1.00 . A A . 12 PHE CD1 1 1 9 2246 1 1 12 PHE CD2 C 10.398 -5.230 0.394 1.00 . A A . 12 PHE CD2 1 1 9 2247 1 1 12 PHE CE1 C 12.483 -5.209 2.200 1.00 . A A . 12 PHE CE1 1 1 9 2248 1 1 12 PHE CE2 C 11.353 -4.232 0.334 1.00 . A A . 12 PHE CE2 1 1 9 2249 1 1 12 PHE CG C 10.473 -6.225 1.355 1.00 . A A . 12 PHE CG 1 1 9 2250 1 1 12 PHE CZ C 12.398 -4.223 1.237 1.00 . A A . 12 PHE CZ 1 1 9 2251 1 1 12 PHE H H 8.506 -9.509 2.428 1.00 . A A . 12 PHE H 1 1 9 2252 1 1 12 PHE HA H 9.412 -6.986 3.534 1.00 . A A . 12 PHE HA 1 1 9 2253 1 1 12 PHE HB2 H 9.912 -8.241 1.164 1.00 . A A . 12 PHE HB2 1 1 9 2254 1 1 12 PHE HB3 H 8.675 -7.084 0.683 1.00 . A A . 12 PHE HB3 1 1 9 2255 1 1 12 PHE HD1 H 11.595 -6.976 3.009 1.00 . A A . 12 PHE HD1 1 1 9 2256 1 1 12 PHE HD2 H 9.581 -5.236 -0.313 1.00 . A A . 12 PHE HD2 1 1 9 2257 1 1 12 PHE HE1 H 13.299 -5.204 2.907 1.00 . A A . 12 PHE HE1 1 1 9 2258 1 1 12 PHE HE2 H 11.283 -3.463 -0.421 1.00 . A A . 12 PHE HE2 1 1 9 2259 1 1 12 PHE HZ H 13.144 -3.444 1.192 1.00 . A A . 12 PHE HZ 1 1 9 2260 1 1 12 PHE N N 8.615 -8.848 3.143 1.00 . A A . 12 PHE N 1 1 9 2261 1 1 12 PHE O O 7.117 -5.960 1.882 1.00 . A A . 12 PHE O 1 1 9 2262 1 1 13 GLY C C 5.410 -4.907 4.386 1.00 . A A . 13 GLY C 1 1 9 2263 1 1 13 GLY CA C 5.325 -6.350 3.930 1.00 . A A . 13 GLY CA 1 1 9 2264 1 1 13 GLY H H 6.930 -7.596 4.527 1.00 . A A . 13 GLY H 1 1 9 2265 1 1 13 GLY HA2 H 4.845 -6.384 2.964 1.00 . A A . 13 GLY HA2 1 1 9 2266 1 1 13 GLY HA3 H 4.727 -6.904 4.638 1.00 . A A . 13 GLY HA3 1 1 9 2267 1 1 13 GLY N N 6.630 -6.978 3.828 1.00 . A A . 13 GLY N 1 1 9 2268 1 1 13 GLY O O 4.440 -4.157 4.283 1.00 . A A . 13 GLY O 1 1 9 2269 1 1 14 LYS C C 7.757 -2.406 4.463 1.00 . A A . 14 LYS C 1 1 9 2270 1 1 14 LYS CA C 6.784 -3.153 5.369 1.00 . A A . 14 LYS CA 1 1 9 2271 1 1 14 LYS CB C 7.313 -3.167 6.804 1.00 . A A . 14 LYS CB 1 1 9 2272 1 1 14 LYS CD C 8.058 -5.394 7.697 1.00 . A A . 14 LYS CD 1 1 9 2273 1 1 14 LYS CE C 7.710 -5.155 9.159 1.00 . A A . 14 LYS CE 1 1 9 2274 1 1 14 LYS CG C 8.488 -4.108 7.010 1.00 . A A . 14 LYS CG 1 1 9 2275 1 1 14 LYS H H 7.311 -5.161 4.951 1.00 . A A . 14 LYS H 1 1 9 2276 1 1 14 LYS HA H 5.831 -2.646 5.350 1.00 . A A . 14 LYS HA 1 1 9 2277 1 1 14 LYS HB2 H 7.628 -2.168 7.068 1.00 . A A . 14 LYS HB2 1 1 9 2278 1 1 14 LYS HB3 H 6.515 -3.470 7.467 1.00 . A A . 14 LYS HB3 1 1 9 2279 1 1 14 LYS HD2 H 7.189 -5.789 7.192 1.00 . A A . 14 LYS HD2 1 1 9 2280 1 1 14 LYS HD3 H 8.866 -6.109 7.641 1.00 . A A . 14 LYS HD3 1 1 9 2281 1 1 14 LYS HE2 H 7.711 -4.093 9.347 1.00 . A A . 14 LYS HE2 1 1 9 2282 1 1 14 LYS HE3 H 6.724 -5.553 9.349 1.00 . A A . 14 LYS HE3 1 1 9 2283 1 1 14 LYS HG2 H 8.915 -4.352 6.049 1.00 . A A . 14 LYS HG2 1 1 9 2284 1 1 14 LYS HG3 H 9.230 -3.615 7.622 1.00 . A A . 14 LYS HG3 1 1 9 2285 1 1 14 LYS HZ1 H 8.604 -6.846 9.999 1.00 . A A . 14 LYS HZ1 1 1 9 2286 1 1 14 LYS HZ2 H 8.493 -5.531 11.058 1.00 . A A . 14 LYS HZ2 1 1 9 2287 1 1 14 LYS HZ3 H 9.653 -5.530 9.827 1.00 . A A . 14 LYS HZ3 1 1 9 2288 1 1 14 LYS N N 6.574 -4.516 4.894 1.00 . A A . 14 LYS N 1 1 9 2289 1 1 14 LYS NZ N 8.683 -5.812 10.075 1.00 . A A . 14 LYS NZ 1 1 9 2290 1 1 14 LYS O O 7.677 -1.186 4.322 1.00 . A A . 14 LYS O 1 1 9 2291 1 1 15 GLY C C 9.007 -1.667 1.904 1.00 . A A . 15 GLY C 1 1 9 2292 1 1 15 GLY CA C 9.651 -2.536 2.966 1.00 . A A . 15 GLY CA 1 1 9 2293 1 1 15 GLY H H 8.693 -4.115 4.001 1.00 . A A . 15 GLY H 1 1 9 2294 1 1 15 GLY HA2 H 10.324 -1.929 3.553 1.00 . A A . 15 GLY HA2 1 1 9 2295 1 1 15 GLY HA3 H 10.218 -3.317 2.480 1.00 . A A . 15 GLY HA3 1 1 9 2296 1 1 15 GLY N N 8.677 -3.146 3.851 1.00 . A A . 15 GLY N 1 1 9 2297 1 1 15 GLY O O 8.818 -0.468 2.103 1.00 . A A . 15 GLY O 1 1 9 2298 1 1 16 GLY C C 9.016 -0.595 -1.004 1.00 . A A . 16 GLY C 1 1 9 2299 1 1 16 GLY CA C 8.047 -1.532 -0.312 1.00 . A A . 16 GLY CA 1 1 9 2300 1 1 16 GLY H H 8.843 -3.233 0.667 1.00 . A A . 16 GLY H 1 1 9 2301 1 1 16 GLY HA2 H 7.659 -2.232 -1.037 1.00 . A A . 16 GLY HA2 1 1 9 2302 1 1 16 GLY HA3 H 7.228 -0.953 0.089 1.00 . A A . 16 GLY HA3 1 1 9 2303 1 1 16 GLY N N 8.669 -2.274 0.770 1.00 . A A . 16 GLY N 1 1 9 2304 1 1 16 GLY O O 9.575 0.305 -0.376 1.00 . A A . 16 GLY O 1 1 10 2305 1 1 1 VAL C C 3.194 -0.985 -0.777 1.00 . A A . 1 VAL C 1 1 10 2306 1 1 1 VAL CA C 1.843 -0.307 -0.580 1.00 . A A . 1 VAL CA 1 1 10 2307 1 1 1 VAL CB C 1.338 0.211 -1.940 1.00 . A A . 1 VAL CB 1 1 10 2308 1 1 1 VAL CG1 C 1.092 -0.948 -2.895 1.00 . A A . 1 VAL CG1 1 1 10 2309 1 1 1 VAL CG2 C 0.075 1.040 -1.759 1.00 . A A . 1 VAL CG2 1 1 10 2310 1 1 1 VAL H1 H 2.017 1.695 0.084 1.00 . A A . 1 VAL H1 1 1 10 2311 1 1 1 VAL HA H 1.136 -1.035 -0.211 1.00 . A A . 1 VAL HA 1 1 10 2312 1 1 1 VAL HB H 2.101 0.844 -2.368 1.00 . A A . 1 VAL HB 1 1 10 2313 1 1 1 VAL HG11 H 2.027 -1.248 -3.344 1.00 . A A . 1 VAL HG11 1 1 10 2314 1 1 1 VAL HG12 H 0.669 -1.780 -2.350 1.00 . A A . 1 VAL HG12 1 1 10 2315 1 1 1 VAL HG13 H 0.405 -0.637 -3.668 1.00 . A A . 1 VAL HG13 1 1 10 2316 1 1 1 VAL HG21 H -0.585 0.544 -1.063 1.00 . A A . 1 VAL HG21 1 1 10 2317 1 1 1 VAL HG22 H 0.338 2.014 -1.375 1.00 . A A . 1 VAL HG22 1 1 10 2318 1 1 1 VAL HG23 H -0.423 1.151 -2.711 1.00 . A A . 1 VAL HG23 1 1 10 2319 1 1 1 VAL N N 1.933 0.771 0.398 1.00 . A A . 1 VAL N 1 1 10 2320 1 1 1 VAL O O 4.059 -0.473 -1.488 1.00 . A A . 1 VAL O 1 1 10 2321 1 1 2 ALA C C 4.385 -4.240 -0.919 1.00 . A A . 2 ALA C 1 1 10 2322 1 1 2 ALA CA C 4.614 -2.889 -0.250 1.00 . A A . 2 ALA CA 1 1 10 2323 1 1 2 ALA CB C 5.237 -3.078 1.126 1.00 . A A . 2 ALA CB 1 1 10 2324 1 1 2 ALA H H 2.642 -2.496 0.410 1.00 . A A . 2 ALA H 1 1 10 2325 1 1 2 ALA HA H 5.301 -2.312 -0.852 1.00 . A A . 2 ALA HA 1 1 10 2326 1 1 2 ALA HB1 H 6.187 -3.581 1.023 1.00 . A A . 2 ALA HB1 1 1 10 2327 1 1 2 ALA HB2 H 5.386 -2.114 1.588 1.00 . A A . 2 ALA HB2 1 1 10 2328 1 1 2 ALA HB3 H 4.578 -3.674 1.740 1.00 . A A . 2 ALA HB3 1 1 10 2329 1 1 2 ALA N N 3.369 -2.139 -0.143 1.00 . A A . 2 ALA N 1 1 10 2330 1 1 2 ALA O O 4.536 -5.288 -0.291 1.00 . A A . 2 ALA O 1 1 10 2331 1 1 3 ARG C C 5.063 -6.208 -3.172 1.00 . A A . 3 ARG C 1 1 10 2332 1 1 3 ARG CA C 3.769 -5.431 -2.950 1.00 . A A . 3 ARG CA 1 1 10 2333 1 1 3 ARG CB C 3.123 -5.101 -4.297 1.00 . A A . 3 ARG CB 1 1 10 2334 1 1 3 ARG CD C 3.739 -6.395 -6.361 1.00 . A A . 3 ARG CD 1 1 10 2335 1 1 3 ARG CG C 2.827 -6.326 -5.147 1.00 . A A . 3 ARG CG 1 1 10 2336 1 1 3 ARG CZ C 3.550 -6.250 -8.808 1.00 . A A . 3 ARG CZ 1 1 10 2337 1 1 3 ARG H H 3.917 -3.342 -2.643 1.00 . A A . 3 ARG H 1 1 10 2338 1 1 3 ARG HA H 3.090 -6.041 -2.375 1.00 . A A . 3 ARG HA 1 1 10 2339 1 1 3 ARG HB2 H 2.193 -4.581 -4.119 1.00 . A A . 3 ARG HB2 1 1 10 2340 1 1 3 ARG HB3 H 3.787 -4.456 -4.853 1.00 . A A . 3 ARG HB3 1 1 10 2341 1 1 3 ARG HD2 H 4.544 -5.687 -6.231 1.00 . A A . 3 ARG HD2 1 1 10 2342 1 1 3 ARG HD3 H 4.146 -7.393 -6.433 1.00 . A A . 3 ARG HD3 1 1 10 2343 1 1 3 ARG HE H 2.118 -5.728 -7.522 1.00 . A A . 3 ARG HE 1 1 10 2344 1 1 3 ARG HG2 H 2.976 -7.213 -4.548 1.00 . A A . 3 ARG HG2 1 1 10 2345 1 1 3 ARG HG3 H 1.801 -6.282 -5.480 1.00 . A A . 3 ARG HG3 1 1 10 2346 1 1 3 ARG HH11 H 5.316 -6.961 -8.133 1.00 . A A . 3 ARG HH11 1 1 10 2347 1 1 3 ARG HH12 H 5.170 -6.854 -9.856 1.00 . A A . 3 ARG HH12 1 1 10 2348 1 1 3 ARG HH21 H 1.913 -5.583 -9.789 1.00 . A A . 3 ARG HH21 1 1 10 2349 1 1 3 ARG HH22 H 3.234 -6.070 -10.797 1.00 . A A . 3 ARG HH22 1 1 10 2350 1 1 3 ARG N N 4.021 -4.208 -2.197 1.00 . A A . 3 ARG N 1 1 10 2351 1 1 3 ARG NE N 3.029 -6.082 -7.598 1.00 . A A . 3 ARG NE 1 1 10 2352 1 1 3 ARG NH1 N 4.780 -6.727 -8.943 1.00 . A A . 3 ARG NH1 1 1 10 2353 1 1 3 ARG NH2 N 2.840 -5.943 -9.887 1.00 . A A . 3 ARG NH2 1 1 10 2354 1 1 3 ARG O O 5.041 -7.363 -3.596 1.00 . A A . 3 ARG O 1 1 10 2355 1 1 4 GLY C C 7.598 -7.493 -2.255 1.00 . A A . 4 GLY C 1 1 10 2356 1 1 4 GLY CA C 7.479 -6.213 -3.057 1.00 . A A . 4 GLY CA 1 1 10 2357 1 1 4 GLY H H 6.148 -4.646 -2.547 1.00 . A A . 4 GLY H 1 1 10 2358 1 1 4 GLY HA2 H 7.616 -6.441 -4.103 1.00 . A A . 4 GLY HA2 1 1 10 2359 1 1 4 GLY HA3 H 8.256 -5.531 -2.742 1.00 . A A . 4 GLY HA3 1 1 10 2360 1 1 4 GLY N N 6.191 -5.566 -2.882 1.00 . A A . 4 GLY N 1 1 10 2361 1 1 4 GLY O O 8.508 -8.291 -2.479 1.00 . A A . 4 GLY O 1 1 10 2362 1 1 5 TRP C C 6.273 -10.114 -1.279 1.00 . A A . 5 TRP C 1 1 10 2363 1 1 5 TRP CA C 6.685 -8.883 -0.479 1.00 . A A . 5 TRP CA 1 1 10 2364 1 1 5 TRP CB C 5.746 -8.698 0.715 1.00 . A A . 5 TRP CB 1 1 10 2365 1 1 5 TRP CD1 C 3.618 -8.045 -0.554 1.00 . A A . 5 TRP CD1 1 1 10 2366 1 1 5 TRP CD2 C 3.346 -9.734 0.891 1.00 . A A . 5 TRP CD2 1 1 10 2367 1 1 5 TRP CE2 C 2.111 -9.476 0.264 1.00 . A A . 5 TRP CE2 1 1 10 2368 1 1 5 TRP CE3 C 3.419 -10.758 1.839 1.00 . A A . 5 TRP CE3 1 1 10 2369 1 1 5 TRP CG C 4.296 -8.808 0.353 1.00 . A A . 5 TRP CG 1 1 10 2370 1 1 5 TRP CH2 C 1.061 -11.200 1.491 1.00 . A A . 5 TRP CH2 1 1 10 2371 1 1 5 TRP CZ2 C 0.961 -10.204 0.558 1.00 . A A . 5 TRP CZ2 1 1 10 2372 1 1 5 TRP CZ3 C 2.276 -11.479 2.130 1.00 . A A . 5 TRP CZ3 1 1 10 2373 1 1 5 TRP H H 5.976 -7.018 -1.187 1.00 . A A . 5 TRP H 1 1 10 2374 1 1 5 TRP HA H 7.692 -9.025 -0.114 1.00 . A A . 5 TRP HA 1 1 10 2375 1 1 5 TRP HB2 H 5.963 -9.453 1.456 1.00 . A A . 5 TRP HB2 1 1 10 2376 1 1 5 TRP HB3 H 5.910 -7.720 1.144 1.00 . A A . 5 TRP HB3 1 1 10 2377 1 1 5 TRP HD1 H 4.062 -7.249 -1.132 1.00 . A A . 5 TRP HD1 1 1 10 2378 1 1 5 TRP HE1 H 1.615 -8.046 -1.189 1.00 . A A . 5 TRP HE1 1 1 10 2379 1 1 5 TRP HE3 H 4.346 -10.988 2.343 1.00 . A A . 5 TRP HE3 1 1 10 2380 1 1 5 TRP HH2 H 0.194 -11.788 1.749 1.00 . A A . 5 TRP HH2 1 1 10 2381 1 1 5 TRP HZ2 H 0.017 -10.001 0.073 1.00 . A A . 5 TRP HZ2 1 1 10 2382 1 1 5 TRP HZ3 H 2.313 -12.273 2.861 1.00 . A A . 5 TRP HZ3 1 1 10 2383 1 1 5 TRP N N 6.678 -7.690 -1.318 1.00 . A A . 5 TRP N 1 1 10 2384 1 1 5 TRP NE1 N 2.303 -8.441 -0.612 1.00 . A A . 5 TRP NE1 1 1 10 2385 1 1 5 TRP O O 6.787 -11.211 -1.058 1.00 . A A . 5 TRP O 1 1 10 2386 1 1 6 LYS C C 5.901 -11.397 -4.097 1.00 . A A . 6 LYS C 1 1 10 2387 1 1 6 LYS CA C 4.863 -11.021 -3.044 1.00 . A A . 6 LYS CA 1 1 10 2388 1 1 6 LYS CB C 3.549 -10.632 -3.724 1.00 . A A . 6 LYS CB 1 1 10 2389 1 1 6 LYS CD C 3.653 -11.072 -6.195 1.00 . A A . 6 LYS CD 1 1 10 2390 1 1 6 LYS CE C 4.182 -12.214 -7.048 1.00 . A A . 6 LYS CE 1 1 10 2391 1 1 6 LYS CG C 3.147 -11.568 -4.851 1.00 . A A . 6 LYS CG 1 1 10 2392 1 1 6 LYS H H 4.972 -9.028 -2.338 1.00 . A A . 6 LYS H 1 1 10 2393 1 1 6 LYS HA H 4.690 -11.874 -2.405 1.00 . A A . 6 LYS HA 1 1 10 2394 1 1 6 LYS HB2 H 2.761 -10.633 -2.985 1.00 . A A . 6 LYS HB2 1 1 10 2395 1 1 6 LYS HB3 H 3.648 -9.636 -4.130 1.00 . A A . 6 LYS HB3 1 1 10 2396 1 1 6 LYS HD2 H 2.841 -10.591 -6.720 1.00 . A A . 6 LYS HD2 1 1 10 2397 1 1 6 LYS HD3 H 4.448 -10.359 -6.029 1.00 . A A . 6 LYS HD3 1 1 10 2398 1 1 6 LYS HE2 H 5.260 -12.207 -7.007 1.00 . A A . 6 LYS HE2 1 1 10 2399 1 1 6 LYS HE3 H 3.812 -13.146 -6.647 1.00 . A A . 6 LYS HE3 1 1 10 2400 1 1 6 LYS HG2 H 3.564 -12.546 -4.661 1.00 . A A . 6 LYS HG2 1 1 10 2401 1 1 6 LYS HG3 H 2.069 -11.634 -4.884 1.00 . A A . 6 LYS HG3 1 1 10 2402 1 1 6 LYS HZ1 H 3.634 -13.036 -8.889 1.00 . A A . 6 LYS HZ1 1 1 10 2403 1 1 6 LYS HZ2 H 4.461 -11.565 -9.014 1.00 . A A . 6 LYS HZ2 1 1 10 2404 1 1 6 LYS HZ3 H 2.842 -11.587 -8.523 1.00 . A A . 6 LYS HZ3 1 1 10 2405 1 1 6 LYS N N 5.344 -9.926 -2.209 1.00 . A A . 6 LYS N 1 1 10 2406 1 1 6 LYS NZ N 3.749 -12.093 -8.468 1.00 . A A . 6 LYS NZ 1 1 10 2407 1 1 6 LYS O O 5.839 -12.478 -4.685 1.00 . A A . 6 LYS O 1 1 10 2408 1 1 7 ARG C C 8.799 -11.899 -4.880 1.00 . A A . 7 ARG C 1 1 10 2409 1 1 7 ARG CA C 7.904 -10.740 -5.312 1.00 . A A . 7 ARG CA 1 1 10 2410 1 1 7 ARG CB C 8.746 -9.477 -5.507 1.00 . A A . 7 ARG CB 1 1 10 2411 1 1 7 ARG CD C 8.134 -9.293 -7.937 1.00 . A A . 7 ARG CD 1 1 10 2412 1 1 7 ARG CG C 8.228 -8.564 -6.606 1.00 . A A . 7 ARG CG 1 1 10 2413 1 1 7 ARG CZ C 9.820 -8.165 -9.326 1.00 . A A . 7 ARG CZ 1 1 10 2414 1 1 7 ARG H H 6.850 -9.658 -3.829 1.00 . A A . 7 ARG H 1 1 10 2415 1 1 7 ARG HA H 7.432 -10.995 -6.248 1.00 . A A . 7 ARG HA 1 1 10 2416 1 1 7 ARG HB2 H 8.758 -8.920 -4.582 1.00 . A A . 7 ARG HB2 1 1 10 2417 1 1 7 ARG HB3 H 9.756 -9.768 -5.756 1.00 . A A . 7 ARG HB3 1 1 10 2418 1 1 7 ARG HD2 H 8.768 -10.166 -7.901 1.00 . A A . 7 ARG HD2 1 1 10 2419 1 1 7 ARG HD3 H 7.110 -9.599 -8.092 1.00 . A A . 7 ARG HD3 1 1 10 2420 1 1 7 ARG HE H 7.851 -8.077 -9.628 1.00 . A A . 7 ARG HE 1 1 10 2421 1 1 7 ARG HG2 H 7.246 -8.208 -6.332 1.00 . A A . 7 ARG HG2 1 1 10 2422 1 1 7 ARG HG3 H 8.901 -7.726 -6.711 1.00 . A A . 7 ARG HG3 1 1 10 2423 1 1 7 ARG HH11 H 10.567 -9.240 -7.786 1.00 . A A . 7 ARG HH11 1 1 10 2424 1 1 7 ARG HH12 H 11.745 -8.441 -8.773 1.00 . A A . 7 ARG HH12 1 1 10 2425 1 1 7 ARG HH21 H 9.393 -7.019 -10.935 1.00 . A A . 7 ARG HH21 1 1 10 2426 1 1 7 ARG HH22 H 11.076 -7.177 -10.563 1.00 . A A . 7 ARG HH22 1 1 10 2427 1 1 7 ARG N N 6.854 -10.501 -4.330 1.00 . A A . 7 ARG N 1 1 10 2428 1 1 7 ARG NE N 8.552 -8.449 -9.054 1.00 . A A . 7 ARG NE 1 1 10 2429 1 1 7 ARG NH1 N 10.790 -8.655 -8.566 1.00 . A A . 7 ARG NH1 1 1 10 2430 1 1 7 ARG NH2 N 10.121 -7.390 -10.360 1.00 . A A . 7 ARG NH2 1 1 10 2431 1 1 7 ARG O O 8.612 -13.036 -5.314 1.00 . A A . 7 ARG O 1 1 10 2432 1 1 8 LYS C C 10.267 -13.121 -2.157 1.00 . A A . 8 LYS C 1 1 10 2433 1 1 8 LYS CA C 10.694 -12.618 -3.532 1.00 . A A . 8 LYS CA 1 1 10 2434 1 1 8 LYS CB C 12.115 -12.054 -3.462 1.00 . A A . 8 LYS CB 1 1 10 2435 1 1 8 LYS CD C 12.104 -9.821 -4.614 1.00 . A A . 8 LYS CD 1 1 10 2436 1 1 8 LYS CE C 13.427 -9.143 -4.937 1.00 . A A . 8 LYS CE 1 1 10 2437 1 1 8 LYS CG C 12.162 -10.546 -3.280 1.00 . A A . 8 LYS CG 1 1 10 2438 1 1 8 LYS H H 9.869 -10.677 -3.714 1.00 . A A . 8 LYS H 1 1 10 2439 1 1 8 LYS HA H 10.678 -13.444 -4.226 1.00 . A A . 8 LYS HA 1 1 10 2440 1 1 8 LYS HB2 H 12.631 -12.512 -2.631 1.00 . A A . 8 LYS HB2 1 1 10 2441 1 1 8 LYS HB3 H 12.633 -12.301 -4.377 1.00 . A A . 8 LYS HB3 1 1 10 2442 1 1 8 LYS HD2 H 11.880 -10.535 -5.393 1.00 . A A . 8 LYS HD2 1 1 10 2443 1 1 8 LYS HD3 H 11.326 -9.073 -4.574 1.00 . A A . 8 LYS HD3 1 1 10 2444 1 1 8 LYS HE2 H 14.231 -9.829 -4.721 1.00 . A A . 8 LYS HE2 1 1 10 2445 1 1 8 LYS HE3 H 13.440 -8.892 -5.988 1.00 . A A . 8 LYS HE3 1 1 10 2446 1 1 8 LYS HG2 H 11.320 -10.239 -2.679 1.00 . A A . 8 LYS HG2 1 1 10 2447 1 1 8 LYS HG3 H 13.082 -10.283 -2.777 1.00 . A A . 8 LYS HG3 1 1 10 2448 1 1 8 LYS HZ1 H 14.625 -7.629 -4.140 1.00 . A A . 8 LYS HZ1 1 1 10 2449 1 1 8 LYS HZ2 H 13.316 -8.055 -3.158 1.00 . A A . 8 LYS HZ2 1 1 10 2450 1 1 8 LYS HZ3 H 13.063 -7.123 -4.546 1.00 . A A . 8 LYS HZ3 1 1 10 2451 1 1 8 LYS N N 9.770 -11.602 -4.024 1.00 . A A . 8 LYS N 1 1 10 2452 1 1 8 LYS NZ N 13.622 -7.900 -4.140 1.00 . A A . 8 LYS NZ 1 1 10 2453 1 1 8 LYS O O 9.704 -14.210 -2.032 1.00 . A A . 8 LYS O 1 1 10 2454 1 1 9 CYS C C 8.972 -11.889 0.714 1.00 . A A . 9 CYS C 1 1 10 2455 1 1 9 CYS CA C 10.179 -12.688 0.236 1.00 . A A . 9 CYS CA 1 1 10 2456 1 1 9 CYS CB C 11.364 -12.456 1.175 1.00 . A A . 9 CYS CB 1 1 10 2457 1 1 9 CYS H H 10.987 -11.468 -1.294 1.00 . A A . 9 CYS H 1 1 10 2458 1 1 9 CYS HA H 9.926 -13.738 0.243 1.00 . A A . 9 CYS HA 1 1 10 2459 1 1 9 CYS HB2 H 11.578 -11.398 1.218 1.00 . A A . 9 CYS HB2 1 1 10 2460 1 1 9 CYS HB3 H 11.105 -12.804 2.163 1.00 . A A . 9 CYS HB3 1 1 10 2461 1 1 9 CYS HG H 12.549 -14.274 -0.164 1.00 . A A . 9 CYS HG 1 1 10 2462 1 1 9 CYS N N 10.537 -12.323 -1.130 1.00 . A A . 9 CYS N 1 1 10 2463 1 1 9 CYS O O 8.901 -10.670 0.556 1.00 . A A . 9 CYS O 1 1 10 2464 1 1 9 CYS SG S 12.881 -13.301 0.671 1.00 . A A . 9 CYS SG 1 1 10 2465 1 1 10 PRO C C 7.036 -11.096 3.051 1.00 . A A . 10 PRO C 1 1 10 2466 1 1 10 PRO CA C 6.774 -11.965 1.826 1.00 . A A . 10 PRO CA 1 1 10 2467 1 1 10 PRO CB C 5.894 -13.162 2.197 1.00 . A A . 10 PRO CB 1 1 10 2468 1 1 10 PRO CD C 8.015 -14.045 1.536 1.00 . A A . 10 PRO CD 1 1 10 2469 1 1 10 PRO CG C 6.854 -14.269 2.466 1.00 . A A . 10 PRO CG 1 1 10 2470 1 1 10 PRO HA H 6.281 -11.376 1.067 1.00 . A A . 10 PRO HA 1 1 10 2471 1 1 10 PRO HB2 H 5.310 -12.923 3.075 1.00 . A A . 10 PRO HB2 1 1 10 2472 1 1 10 PRO HB3 H 5.238 -13.400 1.374 1.00 . A A . 10 PRO HB3 1 1 10 2473 1 1 10 PRO HD2 H 8.938 -14.352 2.005 1.00 . A A . 10 PRO HD2 1 1 10 2474 1 1 10 PRO HD3 H 7.865 -14.578 0.609 1.00 . A A . 10 PRO HD3 1 1 10 2475 1 1 10 PRO HG2 H 7.183 -14.229 3.493 1.00 . A A . 10 PRO HG2 1 1 10 2476 1 1 10 PRO HG3 H 6.386 -15.219 2.257 1.00 . A A . 10 PRO HG3 1 1 10 2477 1 1 10 PRO N N 7.997 -12.590 1.313 1.00 . A A . 10 PRO N 1 1 10 2478 1 1 10 PRO O O 6.150 -10.378 3.516 1.00 . A A . 10 PRO O 1 1 10 2479 1 1 11 LEU C C 8.874 -8.924 4.369 1.00 . A A . 11 LEU C 1 1 10 2480 1 1 11 LEU CA C 8.637 -10.384 4.741 1.00 . A A . 11 LEU CA 1 1 10 2481 1 1 11 LEU CB C 9.895 -10.970 5.384 1.00 . A A . 11 LEU CB 1 1 10 2482 1 1 11 LEU CD1 C 11.821 -9.366 5.454 1.00 . A A . 11 LEU CD1 1 1 10 2483 1 1 11 LEU CD2 C 12.198 -11.740 4.761 1.00 . A A . 11 LEU CD2 1 1 10 2484 1 1 11 LEU CG C 11.224 -10.571 4.742 1.00 . A A . 11 LEU CG 1 1 10 2485 1 1 11 LEU H H 8.920 -11.756 3.155 1.00 . A A . 11 LEU H 1 1 10 2486 1 1 11 LEU HA H 7.824 -10.434 5.450 1.00 . A A . 11 LEU HA 1 1 10 2487 1 1 11 LEU HB2 H 9.918 -10.653 6.415 1.00 . A A . 11 LEU HB2 1 1 10 2488 1 1 11 LEU HB3 H 9.816 -12.047 5.342 1.00 . A A . 11 LEU HB3 1 1 10 2489 1 1 11 LEU HD11 H 11.547 -8.465 4.928 1.00 . A A . 11 LEU HD11 1 1 10 2490 1 1 11 LEU HD12 H 12.896 -9.457 5.477 1.00 . A A . 11 LEU HD12 1 1 10 2491 1 1 11 LEU HD13 H 11.442 -9.322 6.465 1.00 . A A . 11 LEU HD13 1 1 10 2492 1 1 11 LEU HD21 H 12.884 -11.651 3.932 1.00 . A A . 11 LEU HD21 1 1 10 2493 1 1 11 LEU HD22 H 11.649 -12.666 4.677 1.00 . A A . 11 LEU HD22 1 1 10 2494 1 1 11 LEU HD23 H 12.752 -11.732 5.689 1.00 . A A . 11 LEU HD23 1 1 10 2495 1 1 11 LEU HG H 11.051 -10.296 3.711 1.00 . A A . 11 LEU HG 1 1 10 2496 1 1 11 LEU N N 8.257 -11.166 3.570 1.00 . A A . 11 LEU N 1 1 10 2497 1 1 11 LEU O O 9.149 -8.089 5.231 1.00 . A A . 11 LEU O 1 1 10 2498 1 1 12 PHE C C 7.712 -6.420 2.796 1.00 . A A . 12 PHE C 1 1 10 2499 1 1 12 PHE CA C 8.967 -7.263 2.592 1.00 . A A . 12 PHE CA 1 1 10 2500 1 1 12 PHE CB C 9.347 -7.281 1.110 1.00 . A A . 12 PHE CB 1 1 10 2501 1 1 12 PHE CD1 C 11.681 -6.425 1.450 1.00 . A A . 12 PHE CD1 1 1 10 2502 1 1 12 PHE CD2 C 10.335 -5.405 -0.232 1.00 . A A . 12 PHE CD2 1 1 10 2503 1 1 12 PHE CE1 C 12.722 -5.571 1.139 1.00 . A A . 12 PHE CE1 1 1 10 2504 1 1 12 PHE CE2 C 11.372 -4.548 -0.548 1.00 . A A . 12 PHE CE2 1 1 10 2505 1 1 12 PHE CG C 10.477 -6.352 0.769 1.00 . A A . 12 PHE CG 1 1 10 2506 1 1 12 PHE CZ C 12.568 -4.632 0.138 1.00 . A A . 12 PHE CZ 1 1 10 2507 1 1 12 PHE H H 8.545 -9.332 2.439 1.00 . A A . 12 PHE H 1 1 10 2508 1 1 12 PHE HA H 9.776 -6.827 3.157 1.00 . A A . 12 PHE HA 1 1 10 2509 1 1 12 PHE HB2 H 9.647 -8.281 0.834 1.00 . A A . 12 PHE HB2 1 1 10 2510 1 1 12 PHE HB3 H 8.489 -6.992 0.522 1.00 . A A . 12 PHE HB3 1 1 10 2511 1 1 12 PHE HD1 H 11.804 -7.160 2.233 1.00 . A A . 12 PHE HD1 1 1 10 2512 1 1 12 PHE HD2 H 9.399 -5.339 -0.770 1.00 . A A . 12 PHE HD2 1 1 10 2513 1 1 12 PHE HE1 H 13.656 -5.638 1.677 1.00 . A A . 12 PHE HE1 1 1 10 2514 1 1 12 PHE HE2 H 11.248 -3.815 -1.332 1.00 . A A . 12 PHE HE2 1 1 10 2515 1 1 12 PHE HZ H 13.379 -3.963 -0.106 1.00 . A A . 12 PHE HZ 1 1 10 2516 1 1 12 PHE N N 8.765 -8.623 3.079 1.00 . A A . 12 PHE N 1 1 10 2517 1 1 12 PHE O O 7.657 -5.261 2.389 1.00 . A A . 12 PHE O 1 1 10 2518 1 1 13 GLY C C 5.690 -4.941 4.304 1.00 . A A . 13 GLY C 1 1 10 2519 1 1 13 GLY CA C 5.464 -6.303 3.678 1.00 . A A . 13 GLY CA 1 1 10 2520 1 1 13 GLY H H 6.806 -7.940 3.733 1.00 . A A . 13 GLY H 1 1 10 2521 1 1 13 GLY HA2 H 4.942 -6.175 2.742 1.00 . A A . 13 GLY HA2 1 1 10 2522 1 1 13 GLY HA3 H 4.851 -6.894 4.343 1.00 . A A . 13 GLY HA3 1 1 10 2523 1 1 13 GLY N N 6.705 -7.013 3.431 1.00 . A A . 13 GLY N 1 1 10 2524 1 1 13 GLY O O 4.895 -4.021 4.110 1.00 . A A . 13 GLY O 1 1 10 2525 1 1 14 LYS C C 7.896 -2.642 4.784 1.00 . A A . 14 LYS C 1 1 10 2526 1 1 14 LYS CA C 7.105 -3.553 5.717 1.00 . A A . 14 LYS CA 1 1 10 2527 1 1 14 LYS CB C 7.908 -3.815 6.993 1.00 . A A . 14 LYS CB 1 1 10 2528 1 1 14 LYS CD C 9.153 -5.918 7.574 1.00 . A A . 14 LYS CD 1 1 10 2529 1 1 14 LYS CE C 9.250 -5.636 9.065 1.00 . A A . 14 LYS CE 1 1 10 2530 1 1 14 LYS CG C 9.166 -4.633 6.762 1.00 . A A . 14 LYS CG 1 1 10 2531 1 1 14 LYS H H 7.371 -5.582 5.176 1.00 . A A . 14 LYS H 1 1 10 2532 1 1 14 LYS HA H 6.179 -3.063 5.979 1.00 . A A . 14 LYS HA 1 1 10 2533 1 1 14 LYS HB2 H 8.193 -2.867 7.425 1.00 . A A . 14 LYS HB2 1 1 10 2534 1 1 14 LYS HB3 H 7.281 -4.347 7.695 1.00 . A A . 14 LYS HB3 1 1 10 2535 1 1 14 LYS HD2 H 8.232 -6.447 7.378 1.00 . A A . 14 LYS HD2 1 1 10 2536 1 1 14 LYS HD3 H 9.992 -6.530 7.276 1.00 . A A . 14 LYS HD3 1 1 10 2537 1 1 14 LYS HE2 H 9.469 -4.589 9.207 1.00 . A A . 14 LYS HE2 1 1 10 2538 1 1 14 LYS HE3 H 8.302 -5.871 9.525 1.00 . A A . 14 LYS HE3 1 1 10 2539 1 1 14 LYS HG2 H 9.235 -4.883 5.714 1.00 . A A . 14 LYS HG2 1 1 10 2540 1 1 14 LYS HG3 H 10.025 -4.044 7.052 1.00 . A A . 14 LYS HG3 1 1 10 2541 1 1 14 LYS HZ1 H 11.250 -6.169 9.348 1.00 . A A . 14 LYS HZ1 1 1 10 2542 1 1 14 LYS HZ2 H 10.167 -7.458 9.518 1.00 . A A . 14 LYS HZ2 1 1 10 2543 1 1 14 LYS HZ3 H 10.303 -6.299 10.743 1.00 . A A . 14 LYS HZ3 1 1 10 2544 1 1 14 LYS N N 6.775 -4.812 5.059 1.00 . A A . 14 LYS N 1 1 10 2545 1 1 14 LYS NZ N 10.318 -6.447 9.714 1.00 . A A . 14 LYS NZ 1 1 10 2546 1 1 14 LYS O O 7.783 -1.419 4.852 1.00 . A A . 14 LYS O 1 1 10 2547 1 1 15 GLY C C 8.656 -1.852 1.877 1.00 . A A . 15 GLY C 1 1 10 2548 1 1 15 GLY CA C 9.493 -2.475 2.976 1.00 . A A . 15 GLY CA 1 1 10 2549 1 1 15 GLY H H 8.746 -4.226 3.903 1.00 . A A . 15 GLY H 1 1 10 2550 1 1 15 GLY HA2 H 10.002 -1.690 3.516 1.00 . A A . 15 GLY HA2 1 1 10 2551 1 1 15 GLY HA3 H 10.230 -3.125 2.527 1.00 . A A . 15 GLY HA3 1 1 10 2552 1 1 15 GLY N N 8.696 -3.247 3.911 1.00 . A A . 15 GLY N 1 1 10 2553 1 1 15 GLY O O 8.063 -0.790 2.065 1.00 . A A . 15 GLY O 1 1 10 2554 1 1 16 GLY C C 8.643 -1.076 -1.280 1.00 . A A . 16 GLY C 1 1 10 2555 1 1 16 GLY CA C 7.835 -2.002 -0.393 1.00 . A A . 16 GLY CA 1 1 10 2556 1 1 16 GLY H H 9.100 -3.356 0.632 1.00 . A A . 16 GLY H 1 1 10 2557 1 1 16 GLY HA2 H 7.483 -2.834 -0.984 1.00 . A A . 16 GLY HA2 1 1 10 2558 1 1 16 GLY HA3 H 6.983 -1.460 -0.008 1.00 . A A . 16 GLY HA3 1 1 10 2559 1 1 16 GLY N N 8.608 -2.514 0.725 1.00 . A A . 16 GLY N 1 1 10 2560 1 1 16 GLY O O 9.499 -1.526 -2.042 1.00 . A A . 16 GLY O 1 1 11 2561 1 1 1 VAL C C 2.132 -4.263 -0.077 1.00 . A A . 1 VAL C 1 1 11 2562 1 1 1 VAL CA C 0.663 -4.371 0.318 1.00 . A A . 1 VAL CA 1 1 11 2563 1 1 1 VAL CB C -0.183 -3.529 -0.655 1.00 . A A . 1 VAL CB 1 1 11 2564 1 1 1 VAL CG1 C 0.009 -4.012 -2.085 1.00 . A A . 1 VAL CG1 1 1 11 2565 1 1 1 VAL CG2 C -1.651 -3.575 -0.261 1.00 . A A . 1 VAL CG2 1 1 11 2566 1 1 1 VAL H1 H 0.938 -4.418 2.416 1.00 . A A . 1 VAL H1 1 1 11 2567 1 1 1 VAL HA H 0.353 -5.403 0.233 1.00 . A A . 1 VAL HA 1 1 11 2568 1 1 1 VAL HB H 0.152 -2.504 -0.597 1.00 . A A . 1 VAL HB 1 1 11 2569 1 1 1 VAL HG11 H 0.117 -5.087 -2.090 1.00 . A A . 1 VAL HG11 1 1 11 2570 1 1 1 VAL HG12 H -0.849 -3.732 -2.678 1.00 . A A . 1 VAL HG12 1 1 11 2571 1 1 1 VAL HG13 H 0.898 -3.561 -2.501 1.00 . A A . 1 VAL HG13 1 1 11 2572 1 1 1 VAL HG21 H -2.250 -3.149 -1.052 1.00 . A A . 1 VAL HG21 1 1 11 2573 1 1 1 VAL HG22 H -1.947 -4.600 -0.097 1.00 . A A . 1 VAL HG22 1 1 11 2574 1 1 1 VAL HG23 H -1.798 -3.008 0.647 1.00 . A A . 1 VAL HG23 1 1 11 2575 1 1 1 VAL N N 0.458 -3.952 1.700 1.00 . A A . 1 VAL N 1 1 11 2576 1 1 1 VAL O O 2.586 -3.214 -0.533 1.00 . A A . 1 VAL O 1 1 11 2577 1 1 2 ALA C C 4.518 -6.101 -1.564 1.00 . A A . 2 ALA C 1 1 11 2578 1 1 2 ALA CA C 4.286 -5.383 -0.239 1.00 . A A . 2 ALA CA 1 1 11 2579 1 1 2 ALA CB C 5.082 -6.051 0.872 1.00 . A A . 2 ALA CB 1 1 11 2580 1 1 2 ALA H H 2.449 -6.160 0.469 1.00 . A A . 2 ALA H 1 1 11 2581 1 1 2 ALA HA H 4.628 -4.362 -0.330 1.00 . A A . 2 ALA HA 1 1 11 2582 1 1 2 ALA HB1 H 5.238 -5.346 1.676 1.00 . A A . 2 ALA HB1 1 1 11 2583 1 1 2 ALA HB2 H 4.535 -6.905 1.243 1.00 . A A . 2 ALA HB2 1 1 11 2584 1 1 2 ALA HB3 H 6.037 -6.374 0.486 1.00 . A A . 2 ALA HB3 1 1 11 2585 1 1 2 ALA N N 2.869 -5.354 0.101 1.00 . A A . 2 ALA N 1 1 11 2586 1 1 2 ALA O O 5.086 -7.193 -1.598 1.00 . A A . 2 ALA O 1 1 11 2587 1 1 3 ARG C C 5.708 -6.244 -4.323 1.00 . A A . 3 ARG C 1 1 11 2588 1 1 3 ARG CA C 4.232 -6.064 -3.980 1.00 . A A . 3 ARG CA 1 1 11 2589 1 1 3 ARG CB C 3.556 -5.181 -5.031 1.00 . A A . 3 ARG CB 1 1 11 2590 1 1 3 ARG CD C 3.559 -4.380 -7.413 1.00 . A A . 3 ARG CD 1 1 11 2591 1 1 3 ARG CG C 4.382 -4.998 -6.294 1.00 . A A . 3 ARG CG 1 1 11 2592 1 1 3 ARG CZ C 3.978 -3.560 -9.693 1.00 . A A . 3 ARG CZ 1 1 11 2593 1 1 3 ARG H H 3.629 -4.614 -2.562 1.00 . A A . 3 ARG H 1 1 11 2594 1 1 3 ARG HA H 3.755 -7.033 -3.977 1.00 . A A . 3 ARG HA 1 1 11 2595 1 1 3 ARG HB2 H 2.612 -5.627 -5.307 1.00 . A A . 3 ARG HB2 1 1 11 2596 1 1 3 ARG HB3 H 3.374 -4.208 -4.602 1.00 . A A . 3 ARG HB3 1 1 11 2597 1 1 3 ARG HD2 H 2.937 -5.147 -7.851 1.00 . A A . 3 ARG HD2 1 1 11 2598 1 1 3 ARG HD3 H 2.933 -3.605 -6.996 1.00 . A A . 3 ARG HD3 1 1 11 2599 1 1 3 ARG HE H 5.326 -3.580 -8.222 1.00 . A A . 3 ARG HE 1 1 11 2600 1 1 3 ARG HG2 H 5.217 -4.348 -6.076 1.00 . A A . 3 ARG HG2 1 1 11 2601 1 1 3 ARG HG3 H 4.747 -5.961 -6.617 1.00 . A A . 3 ARG HG3 1 1 11 2602 1 1 3 ARG HH11 H 2.106 -4.246 -9.367 1.00 . A A . 3 ARG HH11 1 1 11 2603 1 1 3 ARG HH12 H 2.415 -3.664 -10.970 1.00 . A A . 3 ARG HH12 1 1 11 2604 1 1 3 ARG HH21 H 5.745 -2.811 -10.329 1.00 . A A . 3 ARG HH21 1 1 11 2605 1 1 3 ARG HH22 H 4.485 -2.849 -11.516 1.00 . A A . 3 ARG HH22 1 1 11 2606 1 1 3 ARG N N 4.074 -5.483 -2.653 1.00 . A A . 3 ARG N 1 1 11 2607 1 1 3 ARG NE N 4.400 -3.800 -8.456 1.00 . A A . 3 ARG NE 1 1 11 2608 1 1 3 ARG NH1 N 2.731 -3.847 -10.038 1.00 . A A . 3 ARG NH1 1 1 11 2609 1 1 3 ARG NH2 N 4.804 -3.030 -10.586 1.00 . A A . 3 ARG NH2 1 1 11 2610 1 1 3 ARG O O 6.153 -7.347 -4.636 1.00 . A A . 3 ARG O 1 1 11 2611 1 1 4 GLY C C 8.589 -6.320 -3.825 1.00 . A A . 4 GLY C 1 1 11 2612 1 1 4 GLY CA C 7.878 -5.208 -4.570 1.00 . A A . 4 GLY CA 1 1 11 2613 1 1 4 GLY H H 6.052 -4.297 -4.008 1.00 . A A . 4 GLY H 1 1 11 2614 1 1 4 GLY HA2 H 7.999 -5.365 -5.632 1.00 . A A . 4 GLY HA2 1 1 11 2615 1 1 4 GLY HA3 H 8.332 -4.264 -4.303 1.00 . A A . 4 GLY HA3 1 1 11 2616 1 1 4 GLY N N 6.461 -5.150 -4.263 1.00 . A A . 4 GLY N 1 1 11 2617 1 1 4 GLY O O 9.626 -6.811 -4.270 1.00 . A A . 4 GLY O 1 1 11 2618 1 1 5 TRP C C 7.960 -9.121 -2.177 1.00 . A A . 5 TRP C 1 1 11 2619 1 1 5 TRP CA C 8.618 -7.779 -1.878 1.00 . A A . 5 TRP CA 1 1 11 2620 1 1 5 TRP CB C 8.481 -7.449 -0.390 1.00 . A A . 5 TRP CB 1 1 11 2621 1 1 5 TRP CD1 C 7.992 -4.934 -0.439 1.00 . A A . 5 TRP CD1 1 1 11 2622 1 1 5 TRP CD2 C 9.856 -5.489 0.672 1.00 . A A . 5 TRP CD2 1 1 11 2623 1 1 5 TRP CE2 C 9.704 -4.089 0.719 1.00 . A A . 5 TRP CE2 1 1 11 2624 1 1 5 TRP CE3 C 10.959 -6.068 1.305 1.00 . A A . 5 TRP CE3 1 1 11 2625 1 1 5 TRP CG C 8.750 -6.009 -0.074 1.00 . A A . 5 TRP CG 1 1 11 2626 1 1 5 TRP CH2 C 11.685 -3.858 1.986 1.00 . A A . 5 TRP CH2 1 1 11 2627 1 1 5 TRP CZ2 C 10.614 -3.264 1.374 1.00 . A A . 5 TRP CZ2 1 1 11 2628 1 1 5 TRP CZ3 C 11.861 -5.248 1.955 1.00 . A A . 5 TRP CZ3 1 1 11 2629 1 1 5 TRP H H 7.203 -6.288 -2.385 1.00 . A A . 5 TRP H 1 1 11 2630 1 1 5 TRP HA H 9.667 -7.842 -2.127 1.00 . A A . 5 TRP HA 1 1 11 2631 1 1 5 TRP HB2 H 7.476 -7.679 -0.069 1.00 . A A . 5 TRP HB2 1 1 11 2632 1 1 5 TRP HB3 H 9.181 -8.052 0.170 1.00 . A A . 5 TRP HB3 1 1 11 2633 1 1 5 TRP HD1 H 7.083 -4.999 -1.018 1.00 . A A . 5 TRP HD1 1 1 11 2634 1 1 5 TRP HE1 H 8.203 -2.872 -0.097 1.00 . A A . 5 TRP HE1 1 1 11 2635 1 1 5 TRP HE3 H 11.112 -7.137 1.292 1.00 . A A . 5 TRP HE3 1 1 11 2636 1 1 5 TRP HH2 H 12.415 -3.256 2.505 1.00 . A A . 5 TRP HH2 1 1 11 2637 1 1 5 TRP HZ2 H 10.492 -2.191 1.408 1.00 . A A . 5 TRP HZ2 1 1 11 2638 1 1 5 TRP HZ3 H 12.720 -5.678 2.450 1.00 . A A . 5 TRP HZ3 1 1 11 2639 1 1 5 TRP N N 8.030 -6.718 -2.688 1.00 . A A . 5 TRP N 1 1 11 2640 1 1 5 TRP NE1 N 8.561 -3.776 0.034 1.00 . A A . 5 TRP NE1 1 1 11 2641 1 1 5 TRP O O 8.584 -10.174 -2.045 1.00 . A A . 5 TRP O 1 1 11 2642 1 1 6 LYS C C 6.750 -11.187 -3.839 1.00 . A A . 6 LYS C 1 1 11 2643 1 1 6 LYS CA C 5.950 -10.290 -2.900 1.00 . A A . 6 LYS CA 1 1 11 2644 1 1 6 LYS CB C 4.606 -9.934 -3.539 1.00 . A A . 6 LYS CB 1 1 11 2645 1 1 6 LYS CD C 3.526 -11.939 -2.478 1.00 . A A . 6 LYS CD 1 1 11 2646 1 1 6 LYS CE C 2.065 -12.278 -2.227 1.00 . A A . 6 LYS CE 1 1 11 2647 1 1 6 LYS CG C 3.699 -11.133 -3.755 1.00 . A A . 6 LYS CG 1 1 11 2648 1 1 6 LYS H H 6.250 -8.207 -2.666 1.00 . A A . 6 LYS H 1 1 11 2649 1 1 6 LYS HA H 5.772 -10.822 -1.978 1.00 . A A . 6 LYS HA 1 1 11 2650 1 1 6 LYS HB2 H 4.092 -9.231 -2.901 1.00 . A A . 6 LYS HB2 1 1 11 2651 1 1 6 LYS HB3 H 4.788 -9.470 -4.498 1.00 . A A . 6 LYS HB3 1 1 11 2652 1 1 6 LYS HD2 H 4.088 -12.857 -2.563 1.00 . A A . 6 LYS HD2 1 1 11 2653 1 1 6 LYS HD3 H 3.901 -11.361 -1.645 1.00 . A A . 6 LYS HD3 1 1 11 2654 1 1 6 LYS HE2 H 1.650 -12.709 -3.125 1.00 . A A . 6 LYS HE2 1 1 11 2655 1 1 6 LYS HE3 H 2.009 -12.997 -1.423 1.00 . A A . 6 LYS HE3 1 1 11 2656 1 1 6 LYS HG2 H 2.731 -10.786 -4.083 1.00 . A A . 6 LYS HG2 1 1 11 2657 1 1 6 LYS HG3 H 4.132 -11.769 -4.515 1.00 . A A . 6 LYS HG3 1 1 11 2658 1 1 6 LYS HZ1 H 1.883 -10.370 -1.395 1.00 . A A . 6 LYS HZ1 1 1 11 2659 1 1 6 LYS HZ2 H 0.508 -11.337 -1.200 1.00 . A A . 6 LYS HZ2 1 1 11 2660 1 1 6 LYS HZ3 H 0.850 -10.647 -2.706 1.00 . A A . 6 LYS HZ3 1 1 11 2661 1 1 6 LYS N N 6.694 -9.077 -2.580 1.00 . A A . 6 LYS N 1 1 11 2662 1 1 6 LYS NZ N 1.271 -11.074 -1.856 1.00 . A A . 6 LYS NZ 1 1 11 2663 1 1 6 LYS O O 6.732 -12.411 -3.709 1.00 . A A . 6 LYS O 1 1 11 2664 1 1 7 ARG C C 9.298 -12.174 -5.032 1.00 . A A . 7 ARG C 1 1 11 2665 1 1 7 ARG CA C 8.258 -11.314 -5.745 1.00 . A A . 7 ARG CA 1 1 11 2666 1 1 7 ARG CB C 8.952 -10.353 -6.712 1.00 . A A . 7 ARG CB 1 1 11 2667 1 1 7 ARG CD C 8.781 -8.179 -7.962 1.00 . A A . 7 ARG CD 1 1 11 2668 1 1 7 ARG CG C 8.014 -9.334 -7.338 1.00 . A A . 7 ARG CG 1 1 11 2669 1 1 7 ARG CZ C 7.098 -6.935 -9.251 1.00 . A A . 7 ARG CZ 1 1 11 2670 1 1 7 ARG H H 7.426 -9.592 -4.838 1.00 . A A . 7 ARG H 1 1 11 2671 1 1 7 ARG HA H 7.597 -11.959 -6.305 1.00 . A A . 7 ARG HA 1 1 11 2672 1 1 7 ARG HB2 H 9.724 -9.818 -6.179 1.00 . A A . 7 ARG HB2 1 1 11 2673 1 1 7 ARG HB3 H 9.406 -10.927 -7.506 1.00 . A A . 7 ARG HB3 1 1 11 2674 1 1 7 ARG HD2 H 9.573 -7.886 -7.290 1.00 . A A . 7 ARG HD2 1 1 11 2675 1 1 7 ARG HD3 H 9.206 -8.511 -8.897 1.00 . A A . 7 ARG HD3 1 1 11 2676 1 1 7 ARG HE H 7.964 -6.281 -7.578 1.00 . A A . 7 ARG HE 1 1 11 2677 1 1 7 ARG HG2 H 7.429 -9.820 -8.105 1.00 . A A . 7 ARG HG2 1 1 11 2678 1 1 7 ARG HG3 H 7.357 -8.948 -6.573 1.00 . A A . 7 ARG HG3 1 1 11 2679 1 1 7 ARG HH11 H 7.582 -8.744 -10.009 1.00 . A A . 7 ARG HH11 1 1 11 2680 1 1 7 ARG HH12 H 6.397 -7.857 -10.908 1.00 . A A . 7 ARG HH12 1 1 11 2681 1 1 7 ARG HH21 H 6.404 -5.103 -8.754 1.00 . A A . 7 ARG HH21 1 1 11 2682 1 1 7 ARG HH22 H 5.728 -5.785 -10.194 1.00 . A A . 7 ARG HH22 1 1 11 2683 1 1 7 ARG N N 7.452 -10.570 -4.785 1.00 . A A . 7 ARG N 1 1 11 2684 1 1 7 ARG NE N 7.922 -7.025 -8.214 1.00 . A A . 7 ARG NE 1 1 11 2685 1 1 7 ARG NH1 N 7.020 -7.926 -10.128 1.00 . A A . 7 ARG NH1 1 1 11 2686 1 1 7 ARG NH2 N 6.348 -5.852 -9.413 1.00 . A A . 7 ARG NH2 1 1 11 2687 1 1 7 ARG O O 9.356 -13.388 -5.229 1.00 . A A . 7 ARG O 1 1 11 2688 1 1 8 LYS C C 10.571 -12.926 -2.228 1.00 . A A . 8 LYS C 1 1 11 2689 1 1 8 LYS CA C 11.155 -12.241 -3.460 1.00 . A A . 8 LYS CA 1 1 11 2690 1 1 8 LYS CB C 12.260 -11.269 -3.040 1.00 . A A . 8 LYS CB 1 1 11 2691 1 1 8 LYS CD C 13.983 -9.580 -3.739 1.00 . A A . 8 LYS CD 1 1 11 2692 1 1 8 LYS CE C 15.167 -9.519 -4.693 1.00 . A A . 8 LYS CE 1 1 11 2693 1 1 8 LYS CG C 12.940 -10.579 -4.210 1.00 . A A . 8 LYS CG 1 1 11 2694 1 1 8 LYS H H 10.022 -10.567 -4.088 1.00 . A A . 8 LYS H 1 1 11 2695 1 1 8 LYS HA H 11.576 -12.993 -4.109 1.00 . A A . 8 LYS HA 1 1 11 2696 1 1 8 LYS HB2 H 11.833 -10.511 -2.401 1.00 . A A . 8 LYS HB2 1 1 11 2697 1 1 8 LYS HB3 H 13.011 -11.814 -2.486 1.00 . A A . 8 LYS HB3 1 1 11 2698 1 1 8 LYS HD2 H 13.532 -8.601 -3.681 1.00 . A A . 8 LYS HD2 1 1 11 2699 1 1 8 LYS HD3 H 14.335 -9.875 -2.761 1.00 . A A . 8 LYS HD3 1 1 11 2700 1 1 8 LYS HE2 H 16.049 -9.862 -4.174 1.00 . A A . 8 LYS HE2 1 1 11 2701 1 1 8 LYS HE3 H 14.969 -10.168 -5.533 1.00 . A A . 8 LYS HE3 1 1 11 2702 1 1 8 LYS HG2 H 13.422 -11.325 -4.825 1.00 . A A . 8 LYS HG2 1 1 11 2703 1 1 8 LYS HG3 H 12.193 -10.059 -4.792 1.00 . A A . 8 LYS HG3 1 1 11 2704 1 1 8 LYS HZ1 H 15.694 -8.163 -6.192 1.00 . A A . 8 LYS HZ1 1 1 11 2705 1 1 8 LYS HZ2 H 16.157 -7.681 -4.637 1.00 . A A . 8 LYS HZ2 1 1 11 2706 1 1 8 LYS HZ3 H 14.537 -7.572 -5.109 1.00 . A A . 8 LYS HZ3 1 1 11 2707 1 1 8 LYS N N 10.118 -11.536 -4.203 1.00 . A A . 8 LYS N 1 1 11 2708 1 1 8 LYS NZ N 15.405 -8.137 -5.193 1.00 . A A . 8 LYS NZ 1 1 11 2709 1 1 8 LYS O O 10.388 -14.144 -2.211 1.00 . A A . 8 LYS O 1 1 11 2710 1 1 9 CYS C C 8.362 -12.031 0.333 1.00 . A A . 9 CYS C 1 1 11 2711 1 1 9 CYS CA C 9.716 -12.667 0.036 1.00 . A A . 9 CYS CA 1 1 11 2712 1 1 9 CYS CB C 10.674 -12.424 1.203 1.00 . A A . 9 CYS CB 1 1 11 2713 1 1 9 CYS H H 10.449 -11.174 -1.273 1.00 . A A . 9 CYS H 1 1 11 2714 1 1 9 CYS HA H 9.580 -13.730 -0.092 1.00 . A A . 9 CYS HA 1 1 11 2715 1 1 9 CYS HB2 H 11.481 -11.787 0.871 1.00 . A A . 9 CYS HB2 1 1 11 2716 1 1 9 CYS HB3 H 10.140 -11.930 2.001 1.00 . A A . 9 CYS HB3 1 1 11 2717 1 1 9 CYS HG H 11.231 -14.904 1.000 1.00 . A A . 9 CYS HG 1 1 11 2718 1 1 9 CYS N N 10.280 -12.136 -1.200 1.00 . A A . 9 CYS N 1 1 11 2719 1 1 9 CYS O O 8.254 -10.830 0.580 1.00 . A A . 9 CYS O 1 1 11 2720 1 1 9 CYS SG S 11.409 -13.931 1.881 1.00 . A A . 9 CYS SG 1 1 11 2721 1 1 10 PRO C C 5.725 -12.008 2.030 1.00 . A A . 10 PRO C 1 1 11 2722 1 1 10 PRO CA C 5.937 -12.393 0.570 1.00 . A A . 10 PRO CA 1 1 11 2723 1 1 10 PRO CB C 5.077 -13.607 0.207 1.00 . A A . 10 PRO CB 1 1 11 2724 1 1 10 PRO CD C 7.359 -14.297 0.019 1.00 . A A . 10 PRO CD 1 1 11 2725 1 1 10 PRO CG C 5.982 -14.778 0.385 1.00 . A A . 10 PRO CG 1 1 11 2726 1 1 10 PRO HA H 5.670 -11.559 -0.063 1.00 . A A . 10 PRO HA 1 1 11 2727 1 1 10 PRO HB2 H 4.226 -13.660 0.871 1.00 . A A . 10 PRO HB2 1 1 11 2728 1 1 10 PRO HB3 H 4.740 -13.521 -0.815 1.00 . A A . 10 PRO HB3 1 1 11 2729 1 1 10 PRO HD2 H 8.103 -14.784 0.631 1.00 . A A . 10 PRO HD2 1 1 11 2730 1 1 10 PRO HD3 H 7.554 -14.473 -1.028 1.00 . A A . 10 PRO HD3 1 1 11 2731 1 1 10 PRO HG2 H 5.959 -15.106 1.412 1.00 . A A . 10 PRO HG2 1 1 11 2732 1 1 10 PRO HG3 H 5.678 -15.579 -0.273 1.00 . A A . 10 PRO HG3 1 1 11 2733 1 1 10 PRO N N 7.303 -12.853 0.307 1.00 . A A . 10 PRO N 1 1 11 2734 1 1 10 PRO O O 4.762 -11.319 2.368 1.00 . A A . 10 PRO O 1 1 11 2735 1 1 11 LEU C C 7.160 -10.799 4.628 1.00 . A A . 11 LEU C 1 1 11 2736 1 1 11 LEU CA C 6.544 -12.159 4.318 1.00 . A A . 11 LEU CA 1 1 11 2737 1 1 11 LEU CB C 7.248 -13.248 5.130 1.00 . A A . 11 LEU CB 1 1 11 2738 1 1 11 LEU CD1 C 9.105 -12.545 6.660 1.00 . A A . 11 LEU CD1 1 1 11 2739 1 1 11 LEU CD2 C 9.457 -14.431 5.054 1.00 . A A . 11 LEU CD2 1 1 11 2740 1 1 11 LEU CG C 8.761 -13.097 5.285 1.00 . A A . 11 LEU CG 1 1 11 2741 1 1 11 LEU H H 7.376 -13.002 2.564 1.00 . A A . 11 LEU H 1 1 11 2742 1 1 11 LEU HA H 5.499 -12.138 4.588 1.00 . A A . 11 LEU HA 1 1 11 2743 1 1 11 LEU HB2 H 6.813 -13.255 6.118 1.00 . A A . 11 LEU HB2 1 1 11 2744 1 1 11 LEU HB3 H 7.056 -14.195 4.647 1.00 . A A . 11 LEU HB3 1 1 11 2745 1 1 11 LEU HD11 H 9.788 -11.716 6.555 1.00 . A A . 11 LEU HD11 1 1 11 2746 1 1 11 LEU HD12 H 9.567 -13.320 7.253 1.00 . A A . 11 LEU HD12 1 1 11 2747 1 1 11 LEU HD13 H 8.202 -12.209 7.149 1.00 . A A . 11 LEU HD13 1 1 11 2748 1 1 11 LEU HD21 H 9.534 -14.963 5.991 1.00 . A A . 11 LEU HD21 1 1 11 2749 1 1 11 LEU HD22 H 10.445 -14.256 4.656 1.00 . A A . 11 LEU HD22 1 1 11 2750 1 1 11 LEU HD23 H 8.884 -15.018 4.351 1.00 . A A . 11 LEU HD23 1 1 11 2751 1 1 11 LEU HG H 9.124 -12.397 4.545 1.00 . A A . 11 LEU HG 1 1 11 2752 1 1 11 LEU N N 6.631 -12.457 2.892 1.00 . A A . 11 LEU N 1 1 11 2753 1 1 11 LEU O O 7.265 -10.404 5.789 1.00 . A A . 11 LEU O 1 1 11 2754 1 1 12 PHE C C 7.131 -7.666 3.541 1.00 . A A . 12 PHE C 1 1 11 2755 1 1 12 PHE CA C 8.167 -8.768 3.743 1.00 . A A . 12 PHE CA 1 1 11 2756 1 1 12 PHE CB C 9.319 -8.587 2.752 1.00 . A A . 12 PHE CB 1 1 11 2757 1 1 12 PHE CD1 C 10.962 -7.789 4.473 1.00 . A A . 12 PHE CD1 1 1 11 2758 1 1 12 PHE CD2 C 11.662 -9.467 2.931 1.00 . A A . 12 PHE CD2 1 1 11 2759 1 1 12 PHE CE1 C 12.209 -7.812 5.070 1.00 . A A . 12 PHE CE1 1 1 11 2760 1 1 12 PHE CE2 C 12.910 -9.496 3.524 1.00 . A A . 12 PHE CE2 1 1 11 2761 1 1 12 PHE CG C 10.675 -8.615 3.398 1.00 . A A . 12 PHE CG 1 1 11 2762 1 1 12 PHE CZ C 13.184 -8.666 4.594 1.00 . A A . 12 PHE CZ 1 1 11 2763 1 1 12 PHE H H 7.452 -10.454 2.680 1.00 . A A . 12 PHE H 1 1 11 2764 1 1 12 PHE HA H 8.554 -8.702 4.748 1.00 . A A . 12 PHE HA 1 1 11 2765 1 1 12 PHE HB2 H 9.284 -9.381 2.022 1.00 . A A . 12 PHE HB2 1 1 11 2766 1 1 12 PHE HB3 H 9.208 -7.638 2.251 1.00 . A A . 12 PHE HB3 1 1 11 2767 1 1 12 PHE HD1 H 10.199 -7.120 4.846 1.00 . A A . 12 PHE HD1 1 1 11 2768 1 1 12 PHE HD2 H 11.450 -10.116 2.093 1.00 . A A . 12 PHE HD2 1 1 11 2769 1 1 12 PHE HE1 H 12.419 -7.162 5.906 1.00 . A A . 12 PHE HE1 1 1 11 2770 1 1 12 PHE HE2 H 13.672 -10.164 3.150 1.00 . A A . 12 PHE HE2 1 1 11 2771 1 1 12 PHE HZ H 14.158 -8.687 5.059 1.00 . A A . 12 PHE HZ 1 1 11 2772 1 1 12 PHE N N 7.563 -10.085 3.582 1.00 . A A . 12 PHE N 1 1 11 2773 1 1 12 PHE O O 7.200 -6.903 2.578 1.00 . A A . 12 PHE O 1 1 11 2774 1 1 13 GLY C C 5.616 -5.210 4.794 1.00 . A A . 13 GLY C 1 1 11 2775 1 1 13 GLY CA C 5.132 -6.580 4.361 1.00 . A A . 13 GLY CA 1 1 11 2776 1 1 13 GLY H H 6.165 -8.226 5.203 1.00 . A A . 13 GLY H 1 1 11 2777 1 1 13 GLY HA2 H 4.792 -6.524 3.338 1.00 . A A . 13 GLY HA2 1 1 11 2778 1 1 13 GLY HA3 H 4.303 -6.871 4.990 1.00 . A A . 13 GLY HA3 1 1 11 2779 1 1 13 GLY N N 6.170 -7.590 4.457 1.00 . A A . 13 GLY N 1 1 11 2780 1 1 13 GLY O O 5.044 -4.598 5.696 1.00 . A A . 13 GLY O 1 1 11 2781 1 1 14 LYS C C 6.698 -2.350 3.530 1.00 . A A . 14 LYS C 1 1 11 2782 1 1 14 LYS CA C 7.235 -3.421 4.473 1.00 . A A . 14 LYS CA 1 1 11 2783 1 1 14 LYS CB C 8.762 -3.466 4.394 1.00 . A A . 14 LYS CB 1 1 11 2784 1 1 14 LYS CD C 8.900 -1.619 6.091 1.00 . A A . 14 LYS CD 1 1 11 2785 1 1 14 LYS CE C 10.026 -1.112 6.980 1.00 . A A . 14 LYS CE 1 1 11 2786 1 1 14 LYS CG C 9.430 -2.155 4.772 1.00 . A A . 14 LYS CG 1 1 11 2787 1 1 14 LYS H H 7.086 -5.263 3.440 1.00 . A A . 14 LYS H 1 1 11 2788 1 1 14 LYS HA H 6.942 -3.174 5.483 1.00 . A A . 14 LYS HA 1 1 11 2789 1 1 14 LYS HB2 H 9.123 -4.235 5.061 1.00 . A A . 14 LYS HB2 1 1 11 2790 1 1 14 LYS HB3 H 9.051 -3.714 3.383 1.00 . A A . 14 LYS HB3 1 1 11 2791 1 1 14 LYS HD2 H 8.220 -0.805 5.892 1.00 . A A . 14 LYS HD2 1 1 11 2792 1 1 14 LYS HD3 H 8.375 -2.411 6.607 1.00 . A A . 14 LYS HD3 1 1 11 2793 1 1 14 LYS HE2 H 10.810 -0.714 6.353 1.00 . A A . 14 LYS HE2 1 1 11 2794 1 1 14 LYS HE3 H 9.640 -0.329 7.615 1.00 . A A . 14 LYS HE3 1 1 11 2795 1 1 14 LYS HG2 H 10.494 -2.316 4.863 1.00 . A A . 14 LYS HG2 1 1 11 2796 1 1 14 LYS HG3 H 9.239 -1.428 3.996 1.00 . A A . 14 LYS HG3 1 1 11 2797 1 1 14 LYS HZ1 H 10.621 -3.089 7.302 1.00 . A A . 14 LYS HZ1 1 1 11 2798 1 1 14 LYS HZ2 H 9.999 -2.326 8.679 1.00 . A A . 14 LYS HZ2 1 1 11 2799 1 1 14 LYS HZ3 H 11.554 -1.948 8.132 1.00 . A A . 14 LYS HZ3 1 1 11 2800 1 1 14 LYS N N 6.673 -4.727 4.151 1.00 . A A . 14 LYS N 1 1 11 2801 1 1 14 LYS NZ N 10.590 -2.195 7.833 1.00 . A A . 14 LYS NZ 1 1 11 2802 1 1 14 LYS O O 5.838 -1.553 3.904 1.00 . A A . 14 LYS O 1 1 11 2803 1 1 15 GLY C C 5.812 -1.949 0.308 1.00 . A A . 15 GLY C 1 1 11 2804 1 1 15 GLY CA C 6.769 -1.360 1.324 1.00 . A A . 15 GLY CA 1 1 11 2805 1 1 15 GLY H H 7.894 -2.996 2.060 1.00 . A A . 15 GLY H 1 1 11 2806 1 1 15 GLY HA2 H 6.277 -0.548 1.839 1.00 . A A . 15 GLY HA2 1 1 11 2807 1 1 15 GLY HA3 H 7.633 -0.972 0.805 1.00 . A A . 15 GLY HA3 1 1 11 2808 1 1 15 GLY N N 7.210 -2.337 2.303 1.00 . A A . 15 GLY N 1 1 11 2809 1 1 15 GLY O O 4.682 -2.305 0.642 1.00 . A A . 15 GLY O 1 1 11 2810 1 1 16 GLY C C 5.698 -1.968 -3.339 1.00 . A A . 16 GLY C 1 1 11 2811 1 1 16 GLY CA C 5.425 -2.601 -1.988 1.00 . A A . 16 GLY CA 1 1 11 2812 1 1 16 GLY H H 7.173 -1.752 -1.147 1.00 . A A . 16 GLY H 1 1 11 2813 1 1 16 GLY HA2 H 5.603 -3.663 -2.058 1.00 . A A . 16 GLY HA2 1 1 11 2814 1 1 16 GLY HA3 H 4.389 -2.436 -1.729 1.00 . A A . 16 GLY HA3 1 1 11 2815 1 1 16 GLY N N 6.263 -2.052 -0.939 1.00 . A A . 16 GLY N 1 1 11 2816 1 1 16 GLY O O 5.531 -0.760 -3.511 1.00 . A A . 16 GLY O 1 1 12 2817 1 1 1 VAL C C 3.614 -1.467 -0.972 1.00 . A A . 1 VAL C 1 1 12 2818 1 1 1 VAL CA C 2.288 -0.769 -0.693 1.00 . A A . 1 VAL CA 1 1 12 2819 1 1 1 VAL CB C 2.453 0.742 -0.937 1.00 . A A . 1 VAL CB 1 1 12 2820 1 1 1 VAL CG1 C 1.122 1.459 -0.773 1.00 . A A . 1 VAL CG1 1 1 12 2821 1 1 1 VAL CG2 C 3.500 1.322 0.002 1.00 . A A . 1 VAL CG2 1 1 12 2822 1 1 1 VAL H1 H 0.864 -1.074 0.843 1.00 . A A . 1 VAL H1 1 1 12 2823 1 1 1 VAL HA H 1.543 -1.144 -1.380 1.00 . A A . 1 VAL HA 1 1 12 2824 1 1 1 VAL HB H 2.792 0.887 -1.953 1.00 . A A . 1 VAL HB 1 1 12 2825 1 1 1 VAL HG11 H 1.259 2.517 -0.945 1.00 . A A . 1 VAL HG11 1 1 12 2826 1 1 1 VAL HG12 H 0.411 1.066 -1.485 1.00 . A A . 1 VAL HG12 1 1 12 2827 1 1 1 VAL HG13 H 0.751 1.304 0.230 1.00 . A A . 1 VAL HG13 1 1 12 2828 1 1 1 VAL HG21 H 3.397 2.396 0.038 1.00 . A A . 1 VAL HG21 1 1 12 2829 1 1 1 VAL HG22 H 3.360 0.913 0.992 1.00 . A A . 1 VAL HG22 1 1 12 2830 1 1 1 VAL HG23 H 4.487 1.067 -0.356 1.00 . A A . 1 VAL HG23 1 1 12 2831 1 1 1 VAL N N 1.827 -1.041 0.663 1.00 . A A . 1 VAL N 1 1 12 2832 1 1 1 VAL O O 4.413 -1.001 -1.784 1.00 . A A . 1 VAL O 1 1 12 2833 1 1 2 ALA C C 4.810 -4.638 -1.247 1.00 . A A . 2 ALA C 1 1 12 2834 1 1 2 ALA CA C 5.070 -3.351 -0.472 1.00 . A A . 2 ALA CA 1 1 12 2835 1 1 2 ALA CB C 5.697 -3.664 0.879 1.00 . A A . 2 ALA CB 1 1 12 2836 1 1 2 ALA H H 3.166 -2.908 0.338 1.00 . A A . 2 ALA H 1 1 12 2837 1 1 2 ALA HA H 5.765 -2.741 -1.031 1.00 . A A . 2 ALA HA 1 1 12 2838 1 1 2 ALA HB1 H 6.459 -4.419 0.755 1.00 . A A . 2 ALA HB1 1 1 12 2839 1 1 2 ALA HB2 H 6.140 -2.767 1.286 1.00 . A A . 2 ALA HB2 1 1 12 2840 1 1 2 ALA HB3 H 4.936 -4.027 1.553 1.00 . A A . 2 ALA HB3 1 1 12 2841 1 1 2 ALA N N 3.842 -2.587 -0.295 1.00 . A A . 2 ALA N 1 1 12 2842 1 1 2 ALA O O 5.018 -5.737 -0.732 1.00 . A A . 2 ALA O 1 1 12 2843 1 1 3 ARG C C 5.329 -6.446 -3.616 1.00 . A A . 3 ARG C 1 1 12 2844 1 1 3 ARG CA C 4.061 -5.647 -3.331 1.00 . A A . 3 ARG CA 1 1 12 2845 1 1 3 ARG CB C 3.425 -5.194 -4.646 1.00 . A A . 3 ARG CB 1 1 12 2846 1 1 3 ARG CD C 3.763 -4.713 -7.090 1.00 . A A . 3 ARG CD 1 1 12 2847 1 1 3 ARG CG C 4.308 -5.425 -5.862 1.00 . A A . 3 ARG CG 1 1 12 2848 1 1 3 ARG CZ C 1.818 -4.864 -8.587 1.00 . A A . 3 ARG CZ 1 1 12 2849 1 1 3 ARG H H 4.206 -3.593 -2.841 1.00 . A A . 3 ARG H 1 1 12 2850 1 1 3 ARG HA H 3.363 -6.278 -2.802 1.00 . A A . 3 ARG HA 1 1 12 2851 1 1 3 ARG HB2 H 2.502 -5.735 -4.792 1.00 . A A . 3 ARG HB2 1 1 12 2852 1 1 3 ARG HB3 H 3.208 -4.138 -4.582 1.00 . A A . 3 ARG HB3 1 1 12 2853 1 1 3 ARG HD2 H 3.497 -3.703 -6.816 1.00 . A A . 3 ARG HD2 1 1 12 2854 1 1 3 ARG HD3 H 4.533 -4.690 -7.847 1.00 . A A . 3 ARG HD3 1 1 12 2855 1 1 3 ARG HE H 2.352 -6.261 -7.266 1.00 . A A . 3 ARG HE 1 1 12 2856 1 1 3 ARG HG2 H 5.299 -5.050 -5.652 1.00 . A A . 3 ARG HG2 1 1 12 2857 1 1 3 ARG HG3 H 4.357 -6.485 -6.063 1.00 . A A . 3 ARG HG3 1 1 12 2858 1 1 3 ARG HH11 H 2.904 -3.170 -8.771 1.00 . A A . 3 ARG HH11 1 1 12 2859 1 1 3 ARG HH12 H 1.530 -3.290 -9.821 1.00 . A A . 3 ARG HH12 1 1 12 2860 1 1 3 ARG HH21 H 0.541 -6.429 -8.643 1.00 . A A . 3 ARG HH21 1 1 12 2861 1 1 3 ARG HH22 H 0.186 -5.143 -9.746 1.00 . A A . 3 ARG HH22 1 1 12 2862 1 1 3 ARG N N 4.352 -4.495 -2.486 1.00 . A A . 3 ARG N 1 1 12 2863 1 1 3 ARG NE N 2.584 -5.382 -7.632 1.00 . A A . 3 ARG NE 1 1 12 2864 1 1 3 ARG NH1 N 2.108 -3.677 -9.101 1.00 . A A . 3 ARG NH1 1 1 12 2865 1 1 3 ARG NH2 N 0.762 -5.534 -9.028 1.00 . A A . 3 ARG NH2 1 1 12 2866 1 1 3 ARG O O 5.267 -7.590 -4.065 1.00 . A A . 3 ARG O 1 1 12 2867 1 1 4 GLY C C 7.884 -7.783 -2.786 1.00 . A A . 4 GLY C 1 1 12 2868 1 1 4 GLY CA C 7.747 -6.503 -3.588 1.00 . A A . 4 GLY CA 1 1 12 2869 1 1 4 GLY H H 6.469 -4.922 -2.996 1.00 . A A . 4 GLY H 1 1 12 2870 1 1 4 GLY HA2 H 7.828 -6.738 -4.638 1.00 . A A . 4 GLY HA2 1 1 12 2871 1 1 4 GLY HA3 H 8.550 -5.834 -3.316 1.00 . A A . 4 GLY HA3 1 1 12 2872 1 1 4 GLY N N 6.480 -5.835 -3.353 1.00 . A A . 4 GLY N 1 1 12 2873 1 1 4 GLY O O 8.769 -8.596 -3.051 1.00 . A A . 4 GLY O 1 1 12 2874 1 1 5 TRP C C 6.757 -10.405 -1.779 1.00 . A A . 5 TRP C 1 1 12 2875 1 1 5 TRP CA C 7.037 -9.150 -0.960 1.00 . A A . 5 TRP CA 1 1 12 2876 1 1 5 TRP CB C 6.014 -9.024 0.169 1.00 . A A . 5 TRP CB 1 1 12 2877 1 1 5 TRP CD1 C 3.912 -8.457 -1.184 1.00 . A A . 5 TRP CD1 1 1 12 2878 1 1 5 TRP CD2 C 3.700 -10.252 0.138 1.00 . A A . 5 TRP CD2 1 1 12 2879 1 1 5 TRP CE2 C 2.484 -10.051 -0.545 1.00 . A A . 5 TRP CE2 1 1 12 2880 1 1 5 TRP CE3 C 3.803 -11.327 1.026 1.00 . A A . 5 TRP CE3 1 1 12 2881 1 1 5 TRP CG C 4.599 -9.222 -0.285 1.00 . A A . 5 TRP CG 1 1 12 2882 1 1 5 TRP CH2 C 1.512 -11.927 0.510 1.00 . A A . 5 TRP CH2 1 1 12 2883 1 1 5 TRP CZ2 C 1.383 -10.883 -0.366 1.00 . A A . 5 TRP CZ2 1 1 12 2884 1 1 5 TRP CZ3 C 2.709 -12.152 1.203 1.00 . A A . 5 TRP CZ3 1 1 12 2885 1 1 5 TRP H H 6.326 -7.275 -1.642 1.00 . A A . 5 TRP H 1 1 12 2886 1 1 5 TRP HA H 8.025 -9.227 -0.531 1.00 . A A . 5 TRP HA 1 1 12 2887 1 1 5 TRP HB2 H 6.228 -9.764 0.925 1.00 . A A . 5 TRP HB2 1 1 12 2888 1 1 5 TRP HB3 H 6.089 -8.038 0.605 1.00 . A A . 5 TRP HB3 1 1 12 2889 1 1 5 TRP HD1 H 4.321 -7.593 -1.685 1.00 . A A . 5 TRP HD1 1 1 12 2890 1 1 5 TRP HE1 H 1.955 -8.573 -1.936 1.00 . A A . 5 TRP HE1 1 1 12 2891 1 1 5 TRP HE3 H 4.717 -11.516 1.569 1.00 . A A . 5 TRP HE3 1 1 12 2892 1 1 5 TRP HH2 H 0.683 -12.597 0.679 1.00 . A A . 5 TRP HH2 1 1 12 2893 1 1 5 TRP HZ2 H 0.454 -10.724 -0.893 1.00 . A A . 5 TRP HZ2 1 1 12 2894 1 1 5 TRP HZ3 H 2.770 -12.987 1.885 1.00 . A A . 5 TRP HZ3 1 1 12 2895 1 1 5 TRP N N 7.008 -7.960 -1.804 1.00 . A A . 5 TRP N 1 1 12 2896 1 1 5 TRP NE1 N 2.639 -8.949 -1.344 1.00 . A A . 5 TRP NE1 1 1 12 2897 1 1 5 TRP O O 7.353 -11.457 -1.546 1.00 . A A . 5 TRP O 1 1 12 2898 1 1 6 LYS C C 6.573 -11.675 -4.634 1.00 . A A . 6 LYS C 1 1 12 2899 1 1 6 LYS CA C 5.488 -11.413 -3.595 1.00 . A A . 6 LYS CA 1 1 12 2900 1 1 6 LYS CB C 4.153 -11.144 -4.294 1.00 . A A . 6 LYS CB 1 1 12 2901 1 1 6 LYS CD C 3.597 -13.590 -4.150 1.00 . A A . 6 LYS CD 1 1 12 2902 1 1 6 LYS CE C 2.307 -14.381 -4.304 1.00 . A A . 6 LYS CE 1 1 12 2903 1 1 6 LYS CG C 3.598 -12.351 -5.030 1.00 . A A . 6 LYS CG 1 1 12 2904 1 1 6 LYS H H 5.405 -9.424 -2.878 1.00 . A A . 6 LYS H 1 1 12 2905 1 1 6 LYS HA H 5.387 -12.287 -2.969 1.00 . A A . 6 LYS HA 1 1 12 2906 1 1 6 LYS HB2 H 3.429 -10.836 -3.554 1.00 . A A . 6 LYS HB2 1 1 12 2907 1 1 6 LYS HB3 H 4.289 -10.344 -5.007 1.00 . A A . 6 LYS HB3 1 1 12 2908 1 1 6 LYS HD2 H 4.428 -14.220 -4.430 1.00 . A A . 6 LYS HD2 1 1 12 2909 1 1 6 LYS HD3 H 3.703 -13.287 -3.118 1.00 . A A . 6 LYS HD3 1 1 12 2910 1 1 6 LYS HE2 H 2.071 -14.846 -3.359 1.00 . A A . 6 LYS HE2 1 1 12 2911 1 1 6 LYS HE3 H 1.514 -13.702 -4.580 1.00 . A A . 6 LYS HE3 1 1 12 2912 1 1 6 LYS HG2 H 2.584 -12.140 -5.337 1.00 . A A . 6 LYS HG2 1 1 12 2913 1 1 6 LYS HG3 H 4.207 -12.540 -5.903 1.00 . A A . 6 LYS HG3 1 1 12 2914 1 1 6 LYS HZ1 H 3.317 -15.959 -5.229 1.00 . A A . 6 LYS HZ1 1 1 12 2915 1 1 6 LYS HZ2 H 2.410 -15.007 -6.294 1.00 . A A . 6 LYS HZ2 1 1 12 2916 1 1 6 LYS HZ3 H 1.633 -16.106 -5.270 1.00 . A A . 6 LYS HZ3 1 1 12 2917 1 1 6 LYS N N 5.846 -10.288 -2.740 1.00 . A A . 6 LYS N 1 1 12 2918 1 1 6 LYS NZ N 2.425 -15.438 -5.347 1.00 . A A . 6 LYS NZ 1 1 12 2919 1 1 6 LYS O O 6.593 -12.727 -5.273 1.00 . A A . 6 LYS O 1 1 12 2920 1 1 7 ARG C C 9.612 -11.833 -5.263 1.00 . A A . 7 ARG C 1 1 12 2921 1 1 7 ARG CA C 8.564 -10.840 -5.757 1.00 . A A . 7 ARG CA 1 1 12 2922 1 1 7 ARG CB C 9.214 -9.477 -6.006 1.00 . A A . 7 ARG CB 1 1 12 2923 1 1 7 ARG CD C 8.974 -7.137 -6.890 1.00 . A A . 7 ARG CD 1 1 12 2924 1 1 7 ARG CG C 8.259 -8.442 -6.576 1.00 . A A . 7 ARG CG 1 1 12 2925 1 1 7 ARG CZ C 8.804 -7.022 -9.340 1.00 . A A . 7 ARG CZ 1 1 12 2926 1 1 7 ARG H H 7.407 -9.897 -4.257 1.00 . A A . 7 ARG H 1 1 12 2927 1 1 7 ARG HA H 8.148 -11.205 -6.684 1.00 . A A . 7 ARG HA 1 1 12 2928 1 1 7 ARG HB2 H 9.603 -9.100 -5.072 1.00 . A A . 7 ARG HB2 1 1 12 2929 1 1 7 ARG HB3 H 10.030 -9.604 -6.702 1.00 . A A . 7 ARG HB3 1 1 12 2930 1 1 7 ARG HD2 H 8.268 -6.325 -6.802 1.00 . A A . 7 ARG HD2 1 1 12 2931 1 1 7 ARG HD3 H 9.772 -6.999 -6.176 1.00 . A A . 7 ARG HD3 1 1 12 2932 1 1 7 ARG HE H 10.509 -7.216 -8.324 1.00 . A A . 7 ARG HE 1 1 12 2933 1 1 7 ARG HG2 H 7.824 -8.829 -7.486 1.00 . A A . 7 ARG HG2 1 1 12 2934 1 1 7 ARG HG3 H 7.479 -8.250 -5.854 1.00 . A A . 7 ARG HG3 1 1 12 2935 1 1 7 ARG HH11 H 7.042 -6.904 -8.359 1.00 . A A . 7 ARG HH11 1 1 12 2936 1 1 7 ARG HH12 H 6.936 -6.824 -10.086 1.00 . A A . 7 ARG HH12 1 1 12 2937 1 1 7 ARG HH21 H 10.383 -7.111 -10.599 1.00 . A A . 7 ARG HH21 1 1 12 2938 1 1 7 ARG HH22 H 8.837 -6.943 -11.359 1.00 . A A . 7 ARG HH22 1 1 12 2939 1 1 7 ARG N N 7.475 -10.712 -4.796 1.00 . A A . 7 ARG N 1 1 12 2940 1 1 7 ARG NE N 9.537 -7.132 -8.238 1.00 . A A . 7 ARG NE 1 1 12 2941 1 1 7 ARG NH1 N 7.486 -6.908 -9.255 1.00 . A A . 7 ARG NH1 1 1 12 2942 1 1 7 ARG NH2 N 9.390 -7.026 -10.531 1.00 . A A . 7 ARG NH2 1 1 12 2943 1 1 7 ARG O O 9.660 -12.978 -5.713 1.00 . A A . 7 ARG O 1 1 12 2944 1 1 8 LYS C C 11.056 -12.848 -2.454 1.00 . A A . 8 LYS C 1 1 12 2945 1 1 8 LYS CA C 11.499 -12.234 -3.778 1.00 . A A . 8 LYS CA 1 1 12 2946 1 1 8 LYS CB C 12.783 -11.426 -3.573 1.00 . A A . 8 LYS CB 1 1 12 2947 1 1 8 LYS CD C 12.465 -9.190 -4.672 1.00 . A A . 8 LYS CD 1 1 12 2948 1 1 8 LYS CE C 13.712 -8.352 -4.907 1.00 . A A . 8 LYS CE 1 1 12 2949 1 1 8 LYS CG C 12.539 -9.943 -3.354 1.00 . A A . 8 LYS CG 1 1 12 2950 1 1 8 LYS H H 10.364 -10.463 -4.015 1.00 . A A . 8 LYS H 1 1 12 2951 1 1 8 LYS HA H 11.692 -13.028 -4.482 1.00 . A A . 8 LYS HA 1 1 12 2952 1 1 8 LYS HB2 H 13.305 -11.815 -2.711 1.00 . A A . 8 LYS HB2 1 1 12 2953 1 1 8 LYS HB3 H 13.410 -11.542 -4.445 1.00 . A A . 8 LYS HB3 1 1 12 2954 1 1 8 LYS HD2 H 12.366 -9.901 -5.478 1.00 . A A . 8 LYS HD2 1 1 12 2955 1 1 8 LYS HD3 H 11.602 -8.539 -4.656 1.00 . A A . 8 LYS HD3 1 1 12 2956 1 1 8 LYS HE2 H 14.576 -8.921 -4.599 1.00 . A A . 8 LYS HE2 1 1 12 2957 1 1 8 LYS HE3 H 13.787 -8.129 -5.961 1.00 . A A . 8 LYS HE3 1 1 12 2958 1 1 8 LYS HG2 H 11.607 -9.814 -2.825 1.00 . A A . 8 LYS HG2 1 1 12 2959 1 1 8 LYS HG3 H 13.349 -9.538 -2.764 1.00 . A A . 8 LYS HG3 1 1 12 2960 1 1 8 LYS HZ1 H 14.290 -7.141 -3.306 1.00 . A A . 8 LYS HZ1 1 1 12 2961 1 1 8 LYS HZ2 H 12.703 -6.874 -3.830 1.00 . A A . 8 LYS HZ2 1 1 12 2962 1 1 8 LYS HZ3 H 14.004 -6.291 -4.740 1.00 . A A . 8 LYS HZ3 1 1 12 2963 1 1 8 LYS N N 10.452 -11.386 -4.335 1.00 . A A . 8 LYS N 1 1 12 2964 1 1 8 LYS NZ N 13.675 -7.075 -4.142 1.00 . A A . 8 LYS NZ 1 1 12 2965 1 1 8 LYS O O 10.638 -14.006 -2.405 1.00 . A A . 8 LYS O 1 1 12 2966 1 1 9 CYS C C 9.452 -11.875 0.385 1.00 . A A . 9 CYS C 1 1 12 2967 1 1 9 CYS CA C 10.755 -12.533 -0.059 1.00 . A A . 9 CYS CA 1 1 12 2968 1 1 9 CYS CB C 11.860 -12.241 0.956 1.00 . A A . 9 CYS CB 1 1 12 2969 1 1 9 CYS H H 11.488 -11.152 -1.487 1.00 . A A . 9 CYS H 1 1 12 2970 1 1 9 CYS HA H 10.603 -13.600 -0.117 1.00 . A A . 9 CYS HA 1 1 12 2971 1 1 9 CYS HB2 H 12.558 -11.538 0.525 1.00 . A A . 9 CYS HB2 1 1 12 2972 1 1 9 CYS HB3 H 11.420 -11.805 1.840 1.00 . A A . 9 CYS HB3 1 1 12 2973 1 1 9 CYS HG H 12.472 -14.698 0.660 1.00 . A A . 9 CYS HG 1 1 12 2974 1 1 9 CYS N N 11.147 -12.066 -1.384 1.00 . A A . 9 CYS N 1 1 12 2975 1 1 9 CYS O O 9.304 -10.653 0.355 1.00 . A A . 9 CYS O 1 1 12 2976 1 1 9 CYS SG S 12.798 -13.700 1.467 1.00 . A A . 9 CYS SG 1 1 12 2977 1 1 10 PRO C C 7.264 -11.487 2.598 1.00 . A A . 10 PRO C 1 1 12 2978 1 1 10 PRO CA C 7.177 -12.224 1.265 1.00 . A A . 10 PRO CA 1 1 12 2979 1 1 10 PRO CB C 6.362 -13.510 1.417 1.00 . A A . 10 PRO CB 1 1 12 2980 1 1 10 PRO CD C 8.593 -14.170 0.871 1.00 . A A . 10 PRO CD 1 1 12 2981 1 1 10 PRO CG C 7.375 -14.576 1.654 1.00 . A A . 10 PRO CG 1 1 12 2982 1 1 10 PRO HA H 6.710 -11.583 0.531 1.00 . A A . 10 PRO HA 1 1 12 2983 1 1 10 PRO HB2 H 5.686 -13.413 2.255 1.00 . A A . 10 PRO HB2 1 1 12 2984 1 1 10 PRO HB3 H 5.800 -13.693 0.514 1.00 . A A . 10 PRO HB3 1 1 12 2985 1 1 10 PRO HD2 H 9.492 -14.468 1.389 1.00 . A A . 10 PRO HD2 1 1 12 2986 1 1 10 PRO HD3 H 8.566 -14.601 -0.119 1.00 . A A . 10 PRO HD3 1 1 12 2987 1 1 10 PRO HG2 H 7.609 -14.634 2.706 1.00 . A A . 10 PRO HG2 1 1 12 2988 1 1 10 PRO HG3 H 7.000 -15.524 1.298 1.00 . A A . 10 PRO HG3 1 1 12 2989 1 1 10 PRO N N 8.485 -12.703 0.807 1.00 . A A . 10 PRO N 1 1 12 2990 1 1 10 PRO O O 6.294 -10.872 3.043 1.00 . A A . 10 PRO O 1 1 12 2991 1 1 11 LEU C C 8.608 -9.374 4.355 1.00 . A A . 11 LEU C 1 1 12 2992 1 1 11 LEU CA C 8.644 -10.891 4.512 1.00 . A A . 11 LEU CA 1 1 12 2993 1 1 11 LEU CB C 9.983 -11.321 5.114 1.00 . A A . 11 LEU CB 1 1 12 2994 1 1 11 LEU CD1 C 11.537 -9.375 5.400 1.00 . A A . 11 LEU CD1 1 1 12 2995 1 1 11 LEU CD2 C 12.414 -11.557 4.548 1.00 . A A . 11 LEU CD2 1 1 12 2996 1 1 11 LEU CG C 11.223 -10.611 4.570 1.00 . A A . 11 LEU CG 1 1 12 2997 1 1 11 LEU H H 9.166 -12.057 2.826 1.00 . A A . 11 LEU H 1 1 12 2998 1 1 11 LEU HA H 7.847 -11.191 5.176 1.00 . A A . 11 LEU HA 1 1 12 2999 1 1 11 LEU HB2 H 9.940 -11.143 6.177 1.00 . A A . 11 LEU HB2 1 1 12 3000 1 1 11 LEU HB3 H 10.101 -12.380 4.932 1.00 . A A . 11 LEU HB3 1 1 12 3001 1 1 11 LEU HD11 H 10.999 -8.528 5.002 1.00 . A A . 11 LEU HD11 1 1 12 3002 1 1 11 LEU HD12 H 12.598 -9.177 5.363 1.00 . A A . 11 LEU HD12 1 1 12 3003 1 1 11 LEU HD13 H 11.238 -9.544 6.424 1.00 . A A . 11 LEU HD13 1 1 12 3004 1 1 11 LEU HD21 H 13.043 -11.325 3.702 1.00 . A A . 11 LEU HD21 1 1 12 3005 1 1 11 LEU HD22 H 12.062 -12.575 4.466 1.00 . A A . 11 LEU HD22 1 1 12 3006 1 1 11 LEU HD23 H 12.980 -11.444 5.461 1.00 . A A . 11 LEU HD23 1 1 12 3007 1 1 11 LEU HG H 11.030 -10.290 3.555 1.00 . A A . 11 LEU HG 1 1 12 3008 1 1 11 LEU N N 8.430 -11.553 3.230 1.00 . A A . 11 LEU N 1 1 12 3009 1 1 11 LEU O O 8.572 -8.638 5.341 1.00 . A A . 11 LEU O 1 1 12 3010 1 1 12 PHE C C 7.170 -6.931 2.974 1.00 . A A . 12 PHE C 1 1 12 3011 1 1 12 PHE CA C 8.584 -7.484 2.822 1.00 . A A . 12 PHE CA 1 1 12 3012 1 1 12 PHE CB C 9.100 -7.214 1.407 1.00 . A A . 12 PHE CB 1 1 12 3013 1 1 12 PHE CD1 C 11.203 -8.580 1.511 1.00 . A A . 12 PHE CD1 1 1 12 3014 1 1 12 PHE CD2 C 11.375 -6.278 0.913 1.00 . A A . 12 PHE CD2 1 1 12 3015 1 1 12 PHE CE1 C 12.573 -8.718 1.389 1.00 . A A . 12 PHE CE1 1 1 12 3016 1 1 12 PHE CE2 C 12.745 -6.410 0.789 1.00 . A A . 12 PHE CE2 1 1 12 3017 1 1 12 PHE CG C 10.589 -7.360 1.274 1.00 . A A . 12 PHE CG 1 1 12 3018 1 1 12 PHE CZ C 13.345 -7.631 1.028 1.00 . A A . 12 PHE CZ 1 1 12 3019 1 1 12 PHE H H 8.647 -9.550 2.364 1.00 . A A . 12 PHE H 1 1 12 3020 1 1 12 PHE HA H 9.229 -6.990 3.532 1.00 . A A . 12 PHE HA 1 1 12 3021 1 1 12 PHE HB2 H 8.637 -7.910 0.724 1.00 . A A . 12 PHE HB2 1 1 12 3022 1 1 12 PHE HB3 H 8.837 -6.207 1.122 1.00 . A A . 12 PHE HB3 1 1 12 3023 1 1 12 PHE HD1 H 10.599 -9.431 1.794 1.00 . A A . 12 PHE HD1 1 1 12 3024 1 1 12 PHE HD2 H 10.908 -5.322 0.726 1.00 . A A . 12 PHE HD2 1 1 12 3025 1 1 12 PHE HE1 H 13.038 -9.674 1.577 1.00 . A A . 12 PHE HE1 1 1 12 3026 1 1 12 PHE HE2 H 13.347 -5.559 0.507 1.00 . A A . 12 PHE HE2 1 1 12 3027 1 1 12 PHE HZ H 14.415 -7.737 0.932 1.00 . A A . 12 PHE HZ 1 1 12 3028 1 1 12 PHE N N 8.617 -8.913 3.109 1.00 . A A . 12 PHE N 1 1 12 3029 1 1 12 PHE O O 6.616 -6.348 2.043 1.00 . A A . 12 PHE O 1 1 12 3030 1 1 13 GLY C C 5.165 -5.121 4.402 1.00 . A A . 13 GLY C 1 1 12 3031 1 1 13 GLY CA C 5.247 -6.634 4.409 1.00 . A A . 13 GLY CA 1 1 12 3032 1 1 13 GLY H H 7.081 -7.590 4.862 1.00 . A A . 13 GLY H 1 1 12 3033 1 1 13 GLY HA2 H 4.586 -7.024 3.649 1.00 . A A . 13 GLY HA2 1 1 12 3034 1 1 13 GLY HA3 H 4.922 -6.996 5.374 1.00 . A A . 13 GLY HA3 1 1 12 3035 1 1 13 GLY N N 6.591 -7.119 4.156 1.00 . A A . 13 GLY N 1 1 12 3036 1 1 13 GLY O O 4.111 -4.549 4.123 1.00 . A A . 13 GLY O 1 1 12 3037 1 1 14 LYS C C 7.334 -2.482 3.716 1.00 . A A . 14 LYS C 1 1 12 3038 1 1 14 LYS CA C 6.332 -3.011 4.738 1.00 . A A . 14 LYS CA 1 1 12 3039 1 1 14 LYS CB C 6.709 -2.521 6.138 1.00 . A A . 14 LYS CB 1 1 12 3040 1 1 14 LYS CD C 7.377 -4.307 7.773 1.00 . A A . 14 LYS CD 1 1 12 3041 1 1 14 LYS CE C 7.079 -3.660 9.117 1.00 . A A . 14 LYS CE 1 1 12 3042 1 1 14 LYS CG C 7.865 -3.285 6.760 1.00 . A A . 14 LYS CG 1 1 12 3043 1 1 14 LYS H H 7.090 -4.979 4.922 1.00 . A A . 14 LYS H 1 1 12 3044 1 1 14 LYS HA H 5.350 -2.639 4.488 1.00 . A A . 14 LYS HA 1 1 12 3045 1 1 14 LYS HB2 H 6.984 -1.478 6.079 1.00 . A A . 14 LYS HB2 1 1 12 3046 1 1 14 LYS HB3 H 5.849 -2.621 6.785 1.00 . A A . 14 LYS HB3 1 1 12 3047 1 1 14 LYS HD2 H 6.475 -4.768 7.400 1.00 . A A . 14 LYS HD2 1 1 12 3048 1 1 14 LYS HD3 H 8.140 -5.060 7.907 1.00 . A A . 14 LYS HD3 1 1 12 3049 1 1 14 LYS HE2 H 7.016 -2.591 8.981 1.00 . A A . 14 LYS HE2 1 1 12 3050 1 1 14 LYS HE3 H 6.132 -4.032 9.478 1.00 . A A . 14 LYS HE3 1 1 12 3051 1 1 14 LYS HG2 H 8.406 -3.799 5.979 1.00 . A A . 14 LYS HG2 1 1 12 3052 1 1 14 LYS HG3 H 8.522 -2.585 7.255 1.00 . A A . 14 LYS HG3 1 1 12 3053 1 1 14 LYS HZ1 H 7.700 -4.280 11.013 1.00 . A A . 14 LYS HZ1 1 1 12 3054 1 1 14 LYS HZ2 H 8.699 -3.108 10.314 1.00 . A A . 14 LYS HZ2 1 1 12 3055 1 1 14 LYS HZ3 H 8.764 -4.708 9.769 1.00 . A A . 14 LYS HZ3 1 1 12 3056 1 1 14 LYS N N 6.281 -4.468 4.710 1.00 . A A . 14 LYS N 1 1 12 3057 1 1 14 LYS NZ N 8.134 -3.960 10.124 1.00 . A A . 14 LYS NZ 1 1 12 3058 1 1 14 LYS O O 7.184 -1.375 3.202 1.00 . A A . 14 LYS O 1 1 12 3059 1 1 15 GLY C C 8.778 -2.571 1.102 1.00 . A A . 15 GLY C 1 1 12 3060 1 1 15 GLY CA C 9.365 -2.878 2.465 1.00 . A A . 15 GLY CA 1 1 12 3061 1 1 15 GLY H H 8.423 -4.155 3.867 1.00 . A A . 15 GLY H 1 1 12 3062 1 1 15 GLY HA2 H 9.867 -1.997 2.836 1.00 . A A . 15 GLY HA2 1 1 12 3063 1 1 15 GLY HA3 H 10.087 -3.675 2.362 1.00 . A A . 15 GLY HA3 1 1 12 3064 1 1 15 GLY N N 8.355 -3.283 3.425 1.00 . A A . 15 GLY N 1 1 12 3065 1 1 15 GLY O O 8.301 -1.463 0.858 1.00 . A A . 15 GLY O 1 1 12 3066 1 1 16 GLY C C 9.364 -3.346 -2.188 1.00 . A A . 16 GLY C 1 1 12 3067 1 1 16 GLY CA C 8.281 -3.363 -1.128 1.00 . A A . 16 GLY CA 1 1 12 3068 1 1 16 GLY H H 9.207 -4.417 0.458 1.00 . A A . 16 GLY H 1 1 12 3069 1 1 16 GLY HA2 H 7.590 -4.164 -1.346 1.00 . A A . 16 GLY HA2 1 1 12 3070 1 1 16 GLY HA3 H 7.748 -2.424 -1.159 1.00 . A A . 16 GLY HA3 1 1 12 3071 1 1 16 GLY N N 8.814 -3.555 0.208 1.00 . A A . 16 GLY N 1 1 12 3072 1 1 16 GLY O O 9.154 -2.843 -3.292 1.00 . A A . 16 GLY O 1 1 13 3073 1 1 1 VAL C C 3.121 -1.222 -0.075 1.00 . A A . 1 VAL C 1 1 13 3074 1 1 1 VAL CA C 1.867 -0.356 -0.114 1.00 . A A . 1 VAL CA 1 1 13 3075 1 1 1 VAL CB C 2.276 1.125 -0.016 1.00 . A A . 1 VAL CB 1 1 13 3076 1 1 1 VAL CG1 C 1.066 2.028 -0.201 1.00 . A A . 1 VAL CG1 1 1 13 3077 1 1 1 VAL CG2 C 2.959 1.402 1.315 1.00 . A A . 1 VAL CG2 1 1 13 3078 1 1 1 VAL H1 H 0.034 -0.354 0.945 1.00 . A A . 1 VAL H1 1 1 13 3079 1 1 1 VAL HA H 1.365 -0.508 -1.058 1.00 . A A . 1 VAL HA 1 1 13 3080 1 1 1 VAL HB H 2.979 1.337 -0.808 1.00 . A A . 1 VAL HB 1 1 13 3081 1 1 1 VAL HG11 H 0.453 1.646 -1.004 1.00 . A A . 1 VAL HG11 1 1 13 3082 1 1 1 VAL HG12 H 0.490 2.050 0.713 1.00 . A A . 1 VAL HG12 1 1 13 3083 1 1 1 VAL HG13 H 1.396 3.027 -0.444 1.00 . A A . 1 VAL HG13 1 1 13 3084 1 1 1 VAL HG21 H 2.332 1.052 2.122 1.00 . A A . 1 VAL HG21 1 1 13 3085 1 1 1 VAL HG22 H 3.908 0.887 1.346 1.00 . A A . 1 VAL HG22 1 1 13 3086 1 1 1 VAL HG23 H 3.123 2.465 1.422 1.00 . A A . 1 VAL HG23 1 1 13 3087 1 1 1 VAL N N 0.942 -0.723 0.952 1.00 . A A . 1 VAL N 1 1 13 3088 1 1 1 VAL O O 4.218 -0.757 -0.383 1.00 . A A . 1 VAL O 1 1 13 3089 1 1 2 ALA C C 3.852 -4.610 -0.545 1.00 . A A . 2 ALA C 1 1 13 3090 1 1 2 ALA CA C 4.068 -3.417 0.380 1.00 . A A . 2 ALA CA 1 1 13 3091 1 1 2 ALA CB C 4.266 -3.887 1.813 1.00 . A A . 2 ALA CB 1 1 13 3092 1 1 2 ALA H H 2.051 -2.796 0.537 1.00 . A A . 2 ALA H 1 1 13 3093 1 1 2 ALA HA H 4.962 -2.893 0.072 1.00 . A A . 2 ALA HA 1 1 13 3094 1 1 2 ALA HB1 H 5.046 -4.635 1.841 1.00 . A A . 2 ALA HB1 1 1 13 3095 1 1 2 ALA HB2 H 4.549 -3.049 2.432 1.00 . A A . 2 ALA HB2 1 1 13 3096 1 1 2 ALA HB3 H 3.345 -4.313 2.183 1.00 . A A . 2 ALA HB3 1 1 13 3097 1 1 2 ALA N N 2.951 -2.484 0.304 1.00 . A A . 2 ALA N 1 1 13 3098 1 1 2 ALA O O 3.570 -5.718 -0.089 1.00 . A A . 2 ALA O 1 1 13 3099 1 1 3 ARG C C 5.128 -6.122 -3.144 1.00 . A A . 3 ARG C 1 1 13 3100 1 1 3 ARG CA C 3.803 -5.430 -2.836 1.00 . A A . 3 ARG CA 1 1 13 3101 1 1 3 ARG CB C 3.205 -4.855 -4.121 1.00 . A A . 3 ARG CB 1 1 13 3102 1 1 3 ARG CD C 3.767 -5.653 -6.437 1.00 . A A . 3 ARG CD 1 1 13 3103 1 1 3 ARG CG C 2.935 -5.903 -5.189 1.00 . A A . 3 ARG CG 1 1 13 3104 1 1 3 ARG CZ C 3.673 -6.282 -8.812 1.00 . A A . 3 ARG CZ 1 1 13 3105 1 1 3 ARG H H 4.212 -3.470 -2.149 1.00 . A A . 3 ARG H 1 1 13 3106 1 1 3 ARG HA H 3.119 -6.156 -2.424 1.00 . A A . 3 ARG HA 1 1 13 3107 1 1 3 ARG HB2 H 2.271 -4.367 -3.883 1.00 . A A . 3 ARG HB2 1 1 13 3108 1 1 3 ARG HB3 H 3.889 -4.126 -4.528 1.00 . A A . 3 ARG HB3 1 1 13 3109 1 1 3 ARG HD2 H 3.996 -4.599 -6.496 1.00 . A A . 3 ARG HD2 1 1 13 3110 1 1 3 ARG HD3 H 4.685 -6.216 -6.359 1.00 . A A . 3 ARG HD3 1 1 13 3111 1 1 3 ARG HE H 2.092 -6.158 -7.602 1.00 . A A . 3 ARG HE 1 1 13 3112 1 1 3 ARG HG2 H 3.182 -6.877 -4.795 1.00 . A A . 3 ARG HG2 1 1 13 3113 1 1 3 ARG HG3 H 1.888 -5.873 -5.453 1.00 . A A . 3 ARG HG3 1 1 13 3114 1 1 3 ARG HH11 H 5.525 -5.878 -8.112 1.00 . A A . 3 ARG HH11 1 1 13 3115 1 1 3 ARG HH12 H 5.444 -6.323 -9.785 1.00 . A A . 3 ARG HH12 1 1 13 3116 1 1 3 ARG HH21 H 1.973 -6.746 -9.802 1.00 . A A . 3 ARG HH21 1 1 13 3117 1 1 3 ARG HH22 H 3.424 -6.815 -10.745 1.00 . A A . 3 ARG HH22 1 1 13 3118 1 1 3 ARG N N 3.986 -4.375 -1.847 1.00 . A A . 3 ARG N 1 1 13 3119 1 1 3 ARG NE N 3.065 -6.054 -7.653 1.00 . A A . 3 ARG NE 1 1 13 3120 1 1 3 ARG NH1 N 4.989 -6.149 -8.911 1.00 . A A . 3 ARG NH1 1 1 13 3121 1 1 3 ARG NH2 N 2.965 -6.644 -9.874 1.00 . A A . 3 ARG NH2 1 1 13 3122 1 1 3 ARG O O 5.157 -7.177 -3.775 1.00 . A A . 3 ARG O 1 1 13 3123 1 1 4 GLY C C 7.689 -7.466 -2.317 1.00 . A A . 4 GLY C 1 1 13 3124 1 1 4 GLY CA C 7.536 -6.089 -2.932 1.00 . A A . 4 GLY CA 1 1 13 3125 1 1 4 GLY H H 6.140 -4.677 -2.197 1.00 . A A . 4 GLY H 1 1 13 3126 1 1 4 GLY HA2 H 7.697 -6.162 -3.997 1.00 . A A . 4 GLY HA2 1 1 13 3127 1 1 4 GLY HA3 H 8.284 -5.434 -2.509 1.00 . A A . 4 GLY HA3 1 1 13 3128 1 1 4 GLY N N 6.224 -5.518 -2.694 1.00 . A A . 4 GLY N 1 1 13 3129 1 1 4 GLY O O 8.647 -8.181 -2.611 1.00 . A A . 4 GLY O 1 1 13 3130 1 1 5 TRP C C 6.527 -10.262 -1.798 1.00 . A A . 5 TRP C 1 1 13 3131 1 1 5 TRP CA C 6.781 -9.138 -0.800 1.00 . A A . 5 TRP CA 1 1 13 3132 1 1 5 TRP CB C 5.743 -9.192 0.322 1.00 . A A . 5 TRP CB 1 1 13 3133 1 1 5 TRP CD1 C 3.669 -8.408 -0.965 1.00 . A A . 5 TRP CD1 1 1 13 3134 1 1 5 TRP CD2 C 3.417 -10.373 0.081 1.00 . A A . 5 TRP CD2 1 1 13 3135 1 1 5 TRP CE2 C 2.214 -10.059 -0.583 1.00 . A A . 5 TRP CE2 1 1 13 3136 1 1 5 TRP CE3 C 3.494 -11.565 0.806 1.00 . A A . 5 TRP CE3 1 1 13 3137 1 1 5 TRP CG C 4.334 -9.304 -0.177 1.00 . A A . 5 TRP CG 1 1 13 3138 1 1 5 TRP CH2 C 1.205 -12.055 0.176 1.00 . A A . 5 TRP CH2 1 1 13 3139 1 1 5 TRP CZ2 C 1.101 -10.894 -0.541 1.00 . A A . 5 TRP CZ2 1 1 13 3140 1 1 5 TRP CZ3 C 2.388 -12.393 0.847 1.00 . A A . 5 TRP CZ3 1 1 13 3141 1 1 5 TRP H H 6.006 -7.223 -1.266 1.00 . A A . 5 TRP H 1 1 13 3142 1 1 5 TRP HA H 7.765 -9.266 -0.374 1.00 . A A . 5 TRP HA 1 1 13 3143 1 1 5 TRP HB2 H 5.944 -10.047 0.949 1.00 . A A . 5 TRP HB2 1 1 13 3144 1 1 5 TRP HB3 H 5.817 -8.291 0.914 1.00 . A A . 5 TRP HB3 1 1 13 3145 1 1 5 TRP HD1 H 4.096 -7.487 -1.330 1.00 . A A . 5 TRP HD1 1 1 13 3146 1 1 5 TRP HE1 H 1.723 -8.389 -1.754 1.00 . A A . 5 TRP HE1 1 1 13 3147 1 1 5 TRP HE3 H 4.397 -11.843 1.329 1.00 . A A . 5 TRP HE3 1 1 13 3148 1 1 5 TRP HH2 H 0.366 -12.731 0.236 1.00 . A A . 5 TRP HH2 1 1 13 3149 1 1 5 TRP HZ2 H 0.182 -10.648 -1.053 1.00 . A A . 5 TRP HZ2 1 1 13 3150 1 1 5 TRP HZ3 H 2.429 -13.318 1.403 1.00 . A A . 5 TRP HZ3 1 1 13 3151 1 1 5 TRP N N 6.745 -7.838 -1.460 1.00 . A A . 5 TRP N 1 1 13 3152 1 1 5 TRP NE1 N 2.394 -8.856 -1.213 1.00 . A A . 5 TRP NE1 1 1 13 3153 1 1 5 TRP O O 7.149 -11.322 -1.727 1.00 . A A . 5 TRP O 1 1 13 3154 1 1 6 LYS C C 6.409 -11.169 -4.753 1.00 . A A . 6 LYS C 1 1 13 3155 1 1 6 LYS CA C 5.274 -11.016 -3.745 1.00 . A A . 6 LYS CA 1 1 13 3156 1 1 6 LYS CB C 3.985 -10.620 -4.468 1.00 . A A . 6 LYS CB 1 1 13 3157 1 1 6 LYS CD C 3.288 -13.033 -4.524 1.00 . A A . 6 LYS CD 1 1 13 3158 1 1 6 LYS CE C 1.972 -13.746 -4.798 1.00 . A A . 6 LYS CE 1 1 13 3159 1 1 6 LYS CG C 3.392 -11.736 -5.310 1.00 . A A . 6 LYS CG 1 1 13 3160 1 1 6 LYS H H 5.147 -9.159 -2.736 1.00 . A A . 6 LYS H 1 1 13 3161 1 1 6 LYS HA H 5.121 -11.962 -3.247 1.00 . A A . 6 LYS HA 1 1 13 3162 1 1 6 LYS HB2 H 3.251 -10.323 -3.734 1.00 . A A . 6 LYS HB2 1 1 13 3163 1 1 6 LYS HB3 H 4.193 -9.781 -5.116 1.00 . A A . 6 LYS HB3 1 1 13 3164 1 1 6 LYS HD2 H 4.102 -13.682 -4.807 1.00 . A A . 6 LYS HD2 1 1 13 3165 1 1 6 LYS HD3 H 3.353 -12.809 -3.468 1.00 . A A . 6 LYS HD3 1 1 13 3166 1 1 6 LYS HE2 H 1.638 -14.218 -3.887 1.00 . A A . 6 LYS HE2 1 1 13 3167 1 1 6 LYS HE3 H 1.242 -13.016 -5.114 1.00 . A A . 6 LYS HE3 1 1 13 3168 1 1 6 LYS HG2 H 2.405 -11.445 -5.635 1.00 . A A . 6 LYS HG2 1 1 13 3169 1 1 6 LYS HG3 H 4.024 -11.899 -6.172 1.00 . A A . 6 LYS HG3 1 1 13 3170 1 1 6 LYS HZ1 H 2.416 -15.684 -5.439 1.00 . A A . 6 LYS HZ1 1 1 13 3171 1 1 6 LYS HZ2 H 2.822 -14.482 -6.558 1.00 . A A . 6 LYS HZ2 1 1 13 3172 1 1 6 LYS HZ3 H 1.204 -14.924 -6.342 1.00 . A A . 6 LYS HZ3 1 1 13 3173 1 1 6 LYS N N 5.610 -10.024 -2.730 1.00 . A A . 6 LYS N 1 1 13 3174 1 1 6 LYS NZ N 2.114 -14.782 -5.858 1.00 . A A . 6 LYS NZ 1 1 13 3175 1 1 6 LYS O O 6.522 -12.195 -5.423 1.00 . A A . 6 LYS O 1 1 13 3176 1 1 7 ARG C C 9.325 -11.309 -5.451 1.00 . A A . 7 ARG C 1 1 13 3177 1 1 7 ARG CA C 8.373 -10.163 -5.779 1.00 . A A . 7 ARG CA 1 1 13 3178 1 1 7 ARG CB C 9.125 -8.832 -5.731 1.00 . A A . 7 ARG CB 1 1 13 3179 1 1 7 ARG CD C 8.724 -8.370 -8.169 1.00 . A A . 7 ARG CD 1 1 13 3180 1 1 7 ARG CG C 8.636 -7.819 -6.754 1.00 . A A . 7 ARG CG 1 1 13 3181 1 1 7 ARG CZ C 9.383 -7.601 -10.409 1.00 . A A . 7 ARG CZ 1 1 13 3182 1 1 7 ARG H H 7.105 -9.352 -4.292 1.00 . A A . 7 ARG H 1 1 13 3183 1 1 7 ARG HA H 7.981 -10.309 -6.774 1.00 . A A . 7 ARG HA 1 1 13 3184 1 1 7 ARG HB2 H 9.009 -8.401 -4.747 1.00 . A A . 7 ARG HB2 1 1 13 3185 1 1 7 ARG HB3 H 10.173 -9.017 -5.912 1.00 . A A . 7 ARG HB3 1 1 13 3186 1 1 7 ARG HD2 H 9.446 -9.173 -8.184 1.00 . A A . 7 ARG HD2 1 1 13 3187 1 1 7 ARG HD3 H 7.755 -8.752 -8.452 1.00 . A A . 7 ARG HD3 1 1 13 3188 1 1 7 ARG HE H 9.222 -6.429 -8.803 1.00 . A A . 7 ARG HE 1 1 13 3189 1 1 7 ARG HG2 H 7.607 -7.572 -6.539 1.00 . A A . 7 ARG HG2 1 1 13 3190 1 1 7 ARG HG3 H 9.244 -6.929 -6.685 1.00 . A A . 7 ARG HG3 1 1 13 3191 1 1 7 ARG HH11 H 8.992 -9.578 -10.269 1.00 . A A . 7 ARG HH11 1 1 13 3192 1 1 7 ARG HH12 H 9.457 -9.023 -11.843 1.00 . A A . 7 ARG HH12 1 1 13 3193 1 1 7 ARG HH21 H 9.835 -5.686 -10.871 1.00 . A A . 7 ARG HH21 1 1 13 3194 1 1 7 ARG HH22 H 9.937 -6.809 -12.184 1.00 . A A . 7 ARG HH22 1 1 13 3195 1 1 7 ARG N N 7.247 -10.142 -4.853 1.00 . A A . 7 ARG N 1 1 13 3196 1 1 7 ARG NE N 9.131 -7.348 -9.129 1.00 . A A . 7 ARG NE 1 1 13 3197 1 1 7 ARG NH1 N 9.268 -8.836 -10.879 1.00 . A A . 7 ARG NH1 1 1 13 3198 1 1 7 ARG NH2 N 9.748 -6.618 -11.222 1.00 . A A . 7 ARG NH2 1 1 13 3199 1 1 7 ARG O O 9.249 -12.384 -6.047 1.00 . A A . 7 ARG O 1 1 13 3200 1 1 8 LYS C C 10.706 -12.830 -2.853 1.00 . A A . 8 LYS C 1 1 13 3201 1 1 8 LYS CA C 11.190 -12.084 -4.092 1.00 . A A . 8 LYS CA 1 1 13 3202 1 1 8 LYS CB C 12.548 -11.437 -3.812 1.00 . A A . 8 LYS CB 1 1 13 3203 1 1 8 LYS CD C 14.376 -9.924 -4.639 1.00 . A A . 8 LYS CD 1 1 13 3204 1 1 8 LYS CE C 15.565 -10.825 -4.339 1.00 . A A . 8 LYS CE 1 1 13 3205 1 1 8 LYS CG C 13.147 -10.733 -5.018 1.00 . A A . 8 LYS CG 1 1 13 3206 1 1 8 LYS H H 10.234 -10.195 -4.062 1.00 . A A . 8 LYS H 1 1 13 3207 1 1 8 LYS HA H 11.297 -12.788 -4.903 1.00 . A A . 8 LYS HA 1 1 13 3208 1 1 8 LYS HB2 H 12.432 -10.712 -3.020 1.00 . A A . 8 LYS HB2 1 1 13 3209 1 1 8 LYS HB3 H 13.239 -12.202 -3.489 1.00 . A A . 8 LYS HB3 1 1 13 3210 1 1 8 LYS HD2 H 14.633 -9.270 -5.459 1.00 . A A . 8 LYS HD2 1 1 13 3211 1 1 8 LYS HD3 H 14.151 -9.334 -3.762 1.00 . A A . 8 LYS HD3 1 1 13 3212 1 1 8 LYS HE2 H 15.298 -11.495 -3.536 1.00 . A A . 8 LYS HE2 1 1 13 3213 1 1 8 LYS HE3 H 15.798 -11.398 -5.224 1.00 . A A . 8 LYS HE3 1 1 13 3214 1 1 8 LYS HG2 H 13.429 -11.473 -5.752 1.00 . A A . 8 LYS HG2 1 1 13 3215 1 1 8 LYS HG3 H 12.406 -10.069 -5.440 1.00 . A A . 8 LYS HG3 1 1 13 3216 1 1 8 LYS HZ1 H 17.176 -9.567 -4.767 1.00 . A A . 8 LYS HZ1 1 1 13 3217 1 1 8 LYS HZ2 H 17.482 -10.673 -3.524 1.00 . A A . 8 LYS HZ2 1 1 13 3218 1 1 8 LYS HZ3 H 16.505 -9.323 -3.234 1.00 . A A . 8 LYS HZ3 1 1 13 3219 1 1 8 LYS N N 10.223 -11.072 -4.501 1.00 . A A . 8 LYS N 1 1 13 3220 1 1 8 LYS NZ N 16.766 -10.042 -3.938 1.00 . A A . 8 LYS NZ 1 1 13 3221 1 1 8 LYS O O 10.222 -13.959 -2.946 1.00 . A A . 8 LYS O 1 1 13 3222 1 1 9 CYS C C 9.122 -12.162 0.063 1.00 . A A . 9 CYS C 1 1 13 3223 1 1 9 CYS CA C 10.415 -12.798 -0.437 1.00 . A A . 9 CYS CA 1 1 13 3224 1 1 9 CYS CB C 11.511 -12.650 0.619 1.00 . A A . 9 CYS CB 1 1 13 3225 1 1 9 CYS H H 11.233 -11.296 -1.684 1.00 . A A . 9 CYS H 1 1 13 3226 1 1 9 CYS HA H 10.239 -13.847 -0.617 1.00 . A A . 9 CYS HA 1 1 13 3227 1 1 9 CYS HB2 H 11.684 -11.600 0.804 1.00 . A A . 9 CYS HB2 1 1 13 3228 1 1 9 CYS HB3 H 11.184 -13.120 1.535 1.00 . A A . 9 CYS HB3 1 1 13 3229 1 1 9 CYS HG H 12.894 -14.688 -0.039 1.00 . A A . 9 CYS HG 1 1 13 3230 1 1 9 CYS N N 10.839 -12.194 -1.695 1.00 . A A . 9 CYS N 1 1 13 3231 1 1 9 CYS O O 8.981 -10.940 0.113 1.00 . A A . 9 CYS O 1 1 13 3232 1 1 9 CYS SG S 13.092 -13.393 0.151 1.00 . A A . 9 CYS SG 1 1 13 3233 1 1 10 PRO C C 6.957 -11.904 2.317 1.00 . A A . 10 PRO C 1 1 13 3234 1 1 10 PRO CA C 6.853 -12.552 0.941 1.00 . A A . 10 PRO CA 1 1 13 3235 1 1 10 PRO CB C 6.030 -13.841 1.018 1.00 . A A . 10 PRO CB 1 1 13 3236 1 1 10 PRO CD C 8.251 -14.478 0.407 1.00 . A A . 10 PRO CD 1 1 13 3237 1 1 10 PRO CG C 7.038 -14.926 1.175 1.00 . A A . 10 PRO CG 1 1 13 3238 1 1 10 PRO HA H 6.383 -11.863 0.255 1.00 . A A . 10 PRO HA 1 1 13 3239 1 1 10 PRO HB2 H 5.363 -13.794 1.867 1.00 . A A . 10 PRO HB2 1 1 13 3240 1 1 10 PRO HB3 H 5.458 -13.962 0.110 1.00 . A A . 10 PRO HB3 1 1 13 3241 1 1 10 PRO HD2 H 9.153 -14.815 0.896 1.00 . A A . 10 PRO HD2 1 1 13 3242 1 1 10 PRO HD3 H 8.212 -14.843 -0.608 1.00 . A A . 10 PRO HD3 1 1 13 3243 1 1 10 PRO HG2 H 7.281 -15.053 2.219 1.00 . A A . 10 PRO HG2 1 1 13 3244 1 1 10 PRO HG3 H 6.653 -15.847 0.762 1.00 . A A . 10 PRO HG3 1 1 13 3245 1 1 10 PRO N N 8.153 -13.009 0.440 1.00 . A A . 10 PRO N 1 1 13 3246 1 1 10 PRO O O 5.991 -11.328 2.819 1.00 . A A . 10 PRO O 1 1 13 3247 1 1 11 LEU C C 8.533 -9.909 4.153 1.00 . A A . 11 LEU C 1 1 13 3248 1 1 11 LEU CA C 8.366 -11.423 4.243 1.00 . A A . 11 LEU CA 1 1 13 3249 1 1 11 LEU CB C 9.607 -12.047 4.885 1.00 . A A . 11 LEU CB 1 1 13 3250 1 1 11 LEU CD1 C 11.785 -10.865 4.507 1.00 . A A . 11 LEU CD1 1 1 13 3251 1 1 11 LEU CD2 C 11.624 -13.333 4.135 1.00 . A A . 11 LEU CD2 1 1 13 3252 1 1 11 LEU CG C 10.888 -12.004 4.050 1.00 . A A . 11 LEU CG 1 1 13 3253 1 1 11 LEU H H 8.868 -12.471 2.474 1.00 . A A . 11 LEU H 1 1 13 3254 1 1 11 LEU HA H 7.505 -11.642 4.856 1.00 . A A . 11 LEU HA 1 1 13 3255 1 1 11 LEU HB2 H 9.798 -11.525 5.810 1.00 . A A . 11 LEU HB2 1 1 13 3256 1 1 11 LEU HB3 H 9.383 -13.083 5.097 1.00 . A A . 11 LEU HB3 1 1 13 3257 1 1 11 LEU HD11 H 11.547 -9.972 3.949 1.00 . A A . 11 LEU HD11 1 1 13 3258 1 1 11 LEU HD12 H 12.818 -11.130 4.338 1.00 . A A . 11 LEU HD12 1 1 13 3259 1 1 11 LEU HD13 H 11.628 -10.684 5.561 1.00 . A A . 11 LEU HD13 1 1 13 3260 1 1 11 LEU HD21 H 11.703 -13.635 5.169 1.00 . A A . 11 LEU HD21 1 1 13 3261 1 1 11 LEU HD22 H 12.613 -13.223 3.715 1.00 . A A . 11 LEU HD22 1 1 13 3262 1 1 11 LEU HD23 H 11.079 -14.083 3.580 1.00 . A A . 11 LEU HD23 1 1 13 3263 1 1 11 LEU HG H 10.629 -11.829 3.015 1.00 . A A . 11 LEU HG 1 1 13 3264 1 1 11 LEU N N 8.135 -12.001 2.924 1.00 . A A . 11 LEU N 1 1 13 3265 1 1 11 LEU O O 8.657 -9.226 5.170 1.00 . A A . 11 LEU O 1 1 13 3266 1 1 12 PHE C C 7.357 -7.233 2.919 1.00 . A A . 12 PHE C 1 1 13 3267 1 1 12 PHE CA C 8.683 -7.958 2.706 1.00 . A A . 12 PHE CA 1 1 13 3268 1 1 12 PHE CB C 9.201 -7.692 1.292 1.00 . A A . 12 PHE CB 1 1 13 3269 1 1 12 PHE CD1 C 10.097 -5.449 1.973 1.00 . A A . 12 PHE CD1 1 1 13 3270 1 1 12 PHE CD2 C 11.358 -6.749 0.421 1.00 . A A . 12 PHE CD2 1 1 13 3271 1 1 12 PHE CE1 C 11.051 -4.450 1.917 1.00 . A A . 12 PHE CE1 1 1 13 3272 1 1 12 PHE CE2 C 12.315 -5.754 0.362 1.00 . A A . 12 PHE CE2 1 1 13 3273 1 1 12 PHE CG C 10.240 -6.608 1.228 1.00 . A A . 12 PHE CG 1 1 13 3274 1 1 12 PHE CZ C 12.161 -4.603 1.109 1.00 . A A . 12 PHE CZ 1 1 13 3275 1 1 12 PHE H H 8.430 -9.987 2.158 1.00 . A A . 12 PHE H 1 1 13 3276 1 1 12 PHE HA H 9.401 -7.585 3.420 1.00 . A A . 12 PHE HA 1 1 13 3277 1 1 12 PHE HB2 H 9.643 -8.597 0.902 1.00 . A A . 12 PHE HB2 1 1 13 3278 1 1 12 PHE HB3 H 8.375 -7.399 0.662 1.00 . A A . 12 PHE HB3 1 1 13 3279 1 1 12 PHE HD1 H 9.229 -5.329 2.606 1.00 . A A . 12 PHE HD1 1 1 13 3280 1 1 12 PHE HD2 H 11.479 -7.648 -0.165 1.00 . A A . 12 PHE HD2 1 1 13 3281 1 1 12 PHE HE1 H 10.927 -3.552 2.503 1.00 . A A . 12 PHE HE1 1 1 13 3282 1 1 12 PHE HE2 H 13.182 -5.875 -0.271 1.00 . A A . 12 PHE HE2 1 1 13 3283 1 1 12 PHE HZ H 12.908 -3.824 1.064 1.00 . A A . 12 PHE HZ 1 1 13 3284 1 1 12 PHE N N 8.533 -9.391 2.929 1.00 . A A . 12 PHE N 1 1 13 3285 1 1 12 PHE O O 6.876 -6.523 2.036 1.00 . A A . 12 PHE O 1 1 13 3286 1 1 13 GLY C C 5.676 -5.330 4.827 1.00 . A A . 13 GLY C 1 1 13 3287 1 1 13 GLY CA C 5.505 -6.776 4.405 1.00 . A A . 13 GLY CA 1 1 13 3288 1 1 13 GLY H H 7.200 -7.994 4.764 1.00 . A A . 13 GLY H 1 1 13 3289 1 1 13 GLY HA2 H 4.873 -6.813 3.531 1.00 . A A . 13 GLY HA2 1 1 13 3290 1 1 13 GLY HA3 H 5.026 -7.318 5.207 1.00 . A A . 13 GLY HA3 1 1 13 3291 1 1 13 GLY N N 6.770 -7.417 4.098 1.00 . A A . 13 GLY N 1 1 13 3292 1 1 13 GLY O O 4.800 -4.498 4.590 1.00 . A A . 13 GLY O 1 1 13 3293 1 1 14 LYS C C 7.192 -2.711 4.732 1.00 . A A . 14 LYS C 1 1 13 3294 1 1 14 LYS CA C 7.092 -3.673 5.911 1.00 . A A . 14 LYS CA 1 1 13 3295 1 1 14 LYS CB C 8.392 -3.646 6.717 1.00 . A A . 14 LYS CB 1 1 13 3296 1 1 14 LYS CD C 7.593 -1.638 7.998 1.00 . A A . 14 LYS CD 1 1 13 3297 1 1 14 LYS CE C 8.048 -1.036 9.319 1.00 . A A . 14 LYS CE 1 1 13 3298 1 1 14 LYS CG C 8.753 -2.268 7.245 1.00 . A A . 14 LYS CG 1 1 13 3299 1 1 14 LYS H H 7.468 -5.734 5.615 1.00 . A A . 14 LYS H 1 1 13 3300 1 1 14 LYS HA H 6.278 -3.359 6.547 1.00 . A A . 14 LYS HA 1 1 13 3301 1 1 14 LYS HB2 H 8.294 -4.316 7.558 1.00 . A A . 14 LYS HB2 1 1 13 3302 1 1 14 LYS HB3 H 9.200 -3.989 6.086 1.00 . A A . 14 LYS HB3 1 1 13 3303 1 1 14 LYS HD2 H 7.161 -0.858 7.390 1.00 . A A . 14 LYS HD2 1 1 13 3304 1 1 14 LYS HD3 H 6.849 -2.397 8.195 1.00 . A A . 14 LYS HD3 1 1 13 3305 1 1 14 LYS HE2 H 7.275 -1.192 10.056 1.00 . A A . 14 LYS HE2 1 1 13 3306 1 1 14 LYS HE3 H 8.951 -1.537 9.635 1.00 . A A . 14 LYS HE3 1 1 13 3307 1 1 14 LYS HG2 H 9.596 -2.358 7.913 1.00 . A A . 14 LYS HG2 1 1 13 3308 1 1 14 LYS HG3 H 9.017 -1.632 6.412 1.00 . A A . 14 LYS HG3 1 1 13 3309 1 1 14 LYS HZ1 H 7.915 0.929 10.014 1.00 . A A . 14 LYS HZ1 1 1 13 3310 1 1 14 LYS HZ2 H 7.890 0.795 8.328 1.00 . A A . 14 LYS HZ2 1 1 13 3311 1 1 14 LYS HZ3 H 9.343 0.596 9.170 1.00 . A A . 14 LYS HZ3 1 1 13 3312 1 1 14 LYS N N 6.807 -5.028 5.455 1.00 . A A . 14 LYS N 1 1 13 3313 1 1 14 LYS NZ N 8.318 0.423 9.200 1.00 . A A . 14 LYS NZ 1 1 13 3314 1 1 14 LYS O O 6.279 -1.927 4.477 1.00 . A A . 14 LYS O 1 1 13 3315 1 1 15 GLY C C 7.629 -2.289 1.692 1.00 . A A . 15 GLY C 1 1 13 3316 1 1 15 GLY CA C 8.507 -1.909 2.868 1.00 . A A . 15 GLY CA 1 1 13 3317 1 1 15 GLY H H 9.004 -3.422 4.263 1.00 . A A . 15 GLY H 1 1 13 3318 1 1 15 GLY HA2 H 8.284 -0.893 3.158 1.00 . A A . 15 GLY HA2 1 1 13 3319 1 1 15 GLY HA3 H 9.542 -1.965 2.562 1.00 . A A . 15 GLY HA3 1 1 13 3320 1 1 15 GLY N N 8.309 -2.778 4.013 1.00 . A A . 15 GLY N 1 1 13 3321 1 1 15 GLY O O 6.438 -1.981 1.674 1.00 . A A . 15 GLY O 1 1 13 3322 1 1 16 GLY C C 6.950 -2.189 -1.264 1.00 . A A . 16 GLY C 1 1 13 3323 1 1 16 GLY CA C 7.467 -3.369 -0.465 1.00 . A A . 16 GLY CA 1 1 13 3324 1 1 16 GLY H H 9.172 -3.177 0.776 1.00 . A A . 16 GLY H 1 1 13 3325 1 1 16 GLY HA2 H 8.106 -3.966 -1.098 1.00 . A A . 16 GLY HA2 1 1 13 3326 1 1 16 GLY HA3 H 6.628 -3.969 -0.148 1.00 . A A . 16 GLY HA3 1 1 13 3327 1 1 16 GLY N N 8.219 -2.959 0.707 1.00 . A A . 16 GLY N 1 1 13 3328 1 1 16 GLY O O 7.146 -2.119 -2.477 1.00 . A A . 16 GLY O 1 1 14 3329 1 1 1 VAL C C 1.814 -4.361 0.172 1.00 . A A . 1 VAL C 1 1 14 3330 1 1 1 VAL CA C 0.351 -4.574 0.545 1.00 . A A . 1 VAL CA 1 1 14 3331 1 1 1 VAL CB C -0.503 -4.553 -0.737 1.00 . A A . 1 VAL CB 1 1 14 3332 1 1 1 VAL CG1 C -0.110 -5.697 -1.659 1.00 . A A . 1 VAL CG1 1 1 14 3333 1 1 1 VAL CG2 C -1.983 -4.620 -0.392 1.00 . A A . 1 VAL CG2 1 1 14 3334 1 1 1 VAL H1 H -0.899 -3.746 2.040 1.00 . A A . 1 VAL H1 1 1 14 3335 1 1 1 VAL HA H 0.245 -5.545 1.007 1.00 . A A . 1 VAL HA 1 1 14 3336 1 1 1 VAL HB H -0.317 -3.623 -1.254 1.00 . A A . 1 VAL HB 1 1 14 3337 1 1 1 VAL HG11 H 0.335 -6.491 -1.078 1.00 . A A . 1 VAL HG11 1 1 14 3338 1 1 1 VAL HG12 H -0.988 -6.068 -2.167 1.00 . A A . 1 VAL HG12 1 1 14 3339 1 1 1 VAL HG13 H 0.604 -5.342 -2.388 1.00 . A A . 1 VAL HG13 1 1 14 3340 1 1 1 VAL HG21 H -2.558 -4.755 -1.296 1.00 . A A . 1 VAL HG21 1 1 14 3341 1 1 1 VAL HG22 H -2.159 -5.450 0.275 1.00 . A A . 1 VAL HG22 1 1 14 3342 1 1 1 VAL HG23 H -2.282 -3.701 0.091 1.00 . A A . 1 VAL HG23 1 1 14 3343 1 1 1 VAL N N -0.100 -3.569 1.500 1.00 . A A . 1 VAL N 1 1 14 3344 1 1 1 VAL O O 2.192 -3.295 -0.313 1.00 . A A . 1 VAL O 1 1 14 3345 1 1 2 ALA C C 4.343 -5.898 -1.289 1.00 . A A . 2 ALA C 1 1 14 3346 1 1 2 ALA CA C 4.053 -5.309 0.088 1.00 . A A . 2 ALA CA 1 1 14 3347 1 1 2 ALA CB C 4.867 -6.027 1.154 1.00 . A A . 2 ALA CB 1 1 14 3348 1 1 2 ALA H H 2.271 -6.206 0.791 1.00 . A A . 2 ALA H 1 1 14 3349 1 1 2 ALA HA H 4.342 -4.267 0.091 1.00 . A A . 2 ALA HA 1 1 14 3350 1 1 2 ALA HB1 H 5.762 -6.436 0.707 1.00 . A A . 2 ALA HB1 1 1 14 3351 1 1 2 ALA HB2 H 5.140 -5.329 1.930 1.00 . A A . 2 ALA HB2 1 1 14 3352 1 1 2 ALA HB3 H 4.279 -6.827 1.578 1.00 . A A . 2 ALA HB3 1 1 14 3353 1 1 2 ALA N N 2.632 -5.383 0.402 1.00 . A A . 2 ALA N 1 1 14 3354 1 1 2 ALA O O 5.053 -6.896 -1.410 1.00 . A A . 2 ALA O 1 1 14 3355 1 1 3 ARG C C 5.468 -5.746 -4.053 1.00 . A A . 3 ARG C 1 1 14 3356 1 1 3 ARG CA C 3.986 -5.738 -3.691 1.00 . A A . 3 ARG CA 1 1 14 3357 1 1 3 ARG CB C 3.216 -4.850 -4.669 1.00 . A A . 3 ARG CB 1 1 14 3358 1 1 3 ARG CD C 3.158 -3.772 -6.939 1.00 . A A . 3 ARG CD 1 1 14 3359 1 1 3 ARG CG C 4.031 -4.429 -5.881 1.00 . A A . 3 ARG CG 1 1 14 3360 1 1 3 ARG CZ C 2.556 -4.157 -9.291 1.00 . A A . 3 ARG CZ 1 1 14 3361 1 1 3 ARG H H 3.233 -4.483 -2.162 1.00 . A A . 3 ARG H 1 1 14 3362 1 1 3 ARG HA H 3.606 -6.746 -3.757 1.00 . A A . 3 ARG HA 1 1 14 3363 1 1 3 ARG HB2 H 2.346 -5.388 -5.018 1.00 . A A . 3 ARG HB2 1 1 14 3364 1 1 3 ARG HB3 H 2.894 -3.959 -4.152 1.00 . A A . 3 ARG HB3 1 1 14 3365 1 1 3 ARG HD2 H 2.178 -3.598 -6.521 1.00 . A A . 3 ARG HD2 1 1 14 3366 1 1 3 ARG HD3 H 3.602 -2.828 -7.218 1.00 . A A . 3 ARG HD3 1 1 14 3367 1 1 3 ARG HE H 3.295 -5.543 -8.062 1.00 . A A . 3 ARG HE 1 1 14 3368 1 1 3 ARG HG2 H 4.788 -3.725 -5.567 1.00 . A A . 3 ARG HG2 1 1 14 3369 1 1 3 ARG HG3 H 4.503 -5.302 -6.307 1.00 . A A . 3 ARG HG3 1 1 14 3370 1 1 3 ARG HH11 H 2.251 -2.271 -8.633 1.00 . A A . 3 ARG HH11 1 1 14 3371 1 1 3 ARG HH12 H 1.831 -2.556 -10.290 1.00 . A A . 3 ARG HH12 1 1 14 3372 1 1 3 ARG HH21 H 2.746 -5.930 -10.242 1.00 . A A . 3 ARG HH21 1 1 14 3373 1 1 3 ARG HH22 H 2.112 -4.638 -11.204 1.00 . A A . 3 ARG HH22 1 1 14 3374 1 1 3 ARG N N 3.788 -5.274 -2.323 1.00 . A A . 3 ARG N 1 1 14 3375 1 1 3 ARG NE N 3.023 -4.605 -8.131 1.00 . A A . 3 ARG NE 1 1 14 3376 1 1 3 ARG NH1 N 2.181 -2.891 -9.415 1.00 . A A . 3 ARG NH1 1 1 14 3377 1 1 3 ARG NH2 N 2.464 -4.976 -10.331 1.00 . A A . 3 ARG NH2 1 1 14 3378 1 1 3 ARG O O 6.005 -6.762 -4.493 1.00 . A A . 3 ARG O 1 1 14 3379 1 1 4 GLY C C 8.358 -5.597 -3.526 1.00 . A A . 4 GLY C 1 1 14 3380 1 1 4 GLY CA C 7.538 -4.502 -4.179 1.00 . A A . 4 GLY CA 1 1 14 3381 1 1 4 GLY H H 5.645 -3.826 -3.513 1.00 . A A . 4 GLY H 1 1 14 3382 1 1 4 GLY HA2 H 7.664 -4.562 -5.250 1.00 . A A . 4 GLY HA2 1 1 14 3383 1 1 4 GLY HA3 H 7.902 -3.544 -3.837 1.00 . A A . 4 GLY HA3 1 1 14 3384 1 1 4 GLY N N 6.125 -4.605 -3.866 1.00 . A A . 4 GLY N 1 1 14 3385 1 1 4 GLY O O 9.447 -5.928 -3.993 1.00 . A A . 4 GLY O 1 1 14 3386 1 1 5 TRP C C 8.035 -8.594 -2.173 1.00 . A A . 5 TRP C 1 1 14 3387 1 1 5 TRP CA C 8.526 -7.222 -1.723 1.00 . A A . 5 TRP CA 1 1 14 3388 1 1 5 TRP CB C 8.321 -7.063 -0.215 1.00 . A A . 5 TRP CB 1 1 14 3389 1 1 5 TRP CD1 C 7.488 -4.649 -0.003 1.00 . A A . 5 TRP CD1 1 1 14 3390 1 1 5 TRP CD2 C 9.431 -5.048 1.038 1.00 . A A . 5 TRP CD2 1 1 14 3391 1 1 5 TRP CE2 C 9.087 -3.695 1.230 1.00 . A A . 5 TRP CE2 1 1 14 3392 1 1 5 TRP CE3 C 10.614 -5.529 1.604 1.00 . A A . 5 TRP CE3 1 1 14 3393 1 1 5 TRP CG C 8.394 -5.640 0.247 1.00 . A A . 5 TRP CG 1 1 14 3394 1 1 5 TRP CH2 C 11.039 -3.319 2.506 1.00 . A A . 5 TRP CH2 1 1 14 3395 1 1 5 TRP CZ2 C 9.886 -2.821 1.963 1.00 . A A . 5 TRP CZ2 1 1 14 3396 1 1 5 TRP CZ3 C 11.406 -4.660 2.331 1.00 . A A . 5 TRP CZ3 1 1 14 3397 1 1 5 TRP H H 6.961 -5.852 -2.118 1.00 . A A . 5 TRP H 1 1 14 3398 1 1 5 TRP HA H 9.580 -7.140 -1.944 1.00 . A A . 5 TRP HA 1 1 14 3399 1 1 5 TRP HB2 H 7.350 -7.451 0.053 1.00 . A A . 5 TRP HB2 1 1 14 3400 1 1 5 TRP HB3 H 9.084 -7.623 0.305 1.00 . A A . 5 TRP HB3 1 1 14 3401 1 1 5 TRP HD1 H 6.586 -4.782 -0.581 1.00 . A A . 5 TRP HD1 1 1 14 3402 1 1 5 TRP HE1 H 7.417 -2.624 0.549 1.00 . A A . 5 TRP HE1 1 1 14 3403 1 1 5 TRP HE3 H 10.914 -6.559 1.480 1.00 . A A . 5 TRP HE3 1 1 14 3404 1 1 5 TRP HH2 H 11.688 -2.677 3.081 1.00 . A A . 5 TRP HH2 1 1 14 3405 1 1 5 TRP HZ2 H 9.616 -1.785 2.107 1.00 . A A . 5 TRP HZ2 1 1 14 3406 1 1 5 TRP HZ3 H 12.325 -5.014 2.775 1.00 . A A . 5 TRP HZ3 1 1 14 3407 1 1 5 TRP N N 7.834 -6.159 -2.442 1.00 . A A . 5 TRP N 1 1 14 3408 1 1 5 TRP NE1 N 7.899 -3.477 0.585 1.00 . A A . 5 TRP NE1 1 1 14 3409 1 1 5 TRP O O 8.793 -9.564 -2.183 1.00 . A A . 5 TRP O 1 1 14 3410 1 1 6 LYS C C 7.082 -10.625 -3.997 1.00 . A A . 6 LYS C 1 1 14 3411 1 1 6 LYS CA C 6.169 -9.921 -2.999 1.00 . A A . 6 LYS CA 1 1 14 3412 1 1 6 LYS CB C 4.803 -9.660 -3.638 1.00 . A A . 6 LYS CB 1 1 14 3413 1 1 6 LYS CD C 2.414 -8.977 -3.271 1.00 . A A . 6 LYS CD 1 1 14 3414 1 1 6 LYS CE C 1.280 -9.991 -3.244 1.00 . A A . 6 LYS CE 1 1 14 3415 1 1 6 LYS CG C 3.674 -9.533 -2.630 1.00 . A A . 6 LYS CG 1 1 14 3416 1 1 6 LYS H H 6.207 -7.860 -2.516 1.00 . A A . 6 LYS H 1 1 14 3417 1 1 6 LYS HA H 6.038 -10.557 -2.138 1.00 . A A . 6 LYS HA 1 1 14 3418 1 1 6 LYS HB2 H 4.854 -8.744 -4.208 1.00 . A A . 6 LYS HB2 1 1 14 3419 1 1 6 LYS HB3 H 4.570 -10.477 -4.307 1.00 . A A . 6 LYS HB3 1 1 14 3420 1 1 6 LYS HD2 H 2.105 -8.094 -2.732 1.00 . A A . 6 LYS HD2 1 1 14 3421 1 1 6 LYS HD3 H 2.628 -8.716 -4.299 1.00 . A A . 6 LYS HD3 1 1 14 3422 1 1 6 LYS HE2 H 0.667 -9.849 -4.121 1.00 . A A . 6 LYS HE2 1 1 14 3423 1 1 6 LYS HE3 H 1.704 -10.984 -3.257 1.00 . A A . 6 LYS HE3 1 1 14 3424 1 1 6 LYS HG2 H 3.457 -10.508 -2.221 1.00 . A A . 6 LYS HG2 1 1 14 3425 1 1 6 LYS HG3 H 3.986 -8.869 -1.836 1.00 . A A . 6 LYS HG3 1 1 14 3426 1 1 6 LYS HZ1 H -0.398 -9.253 -2.244 1.00 . A A . 6 LYS HZ1 1 1 14 3427 1 1 6 LYS HZ2 H 0.976 -9.390 -1.267 1.00 . A A . 6 LYS HZ2 1 1 14 3428 1 1 6 LYS HZ3 H 0.108 -10.774 -1.703 1.00 . A A . 6 LYS HZ3 1 1 14 3429 1 1 6 LYS N N 6.762 -8.668 -2.546 1.00 . A A . 6 LYS N 1 1 14 3430 1 1 6 LYS NZ N 0.432 -9.841 -2.029 1.00 . A A . 6 LYS NZ 1 1 14 3431 1 1 6 LYS O O 7.322 -11.828 -3.891 1.00 . A A . 6 LYS O 1 1 14 3432 1 1 7 ARG C C 9.535 -11.322 -5.347 1.00 . A A . 7 ARG C 1 1 14 3433 1 1 7 ARG CA C 8.478 -10.421 -5.980 1.00 . A A . 7 ARG CA 1 1 14 3434 1 1 7 ARG CB C 9.156 -9.295 -6.763 1.00 . A A . 7 ARG CB 1 1 14 3435 1 1 7 ARG CD C 9.619 -10.990 -8.559 1.00 . A A . 7 ARG CD 1 1 14 3436 1 1 7 ARG CG C 10.154 -9.787 -7.798 1.00 . A A . 7 ARG CG 1 1 14 3437 1 1 7 ARG CZ C 9.733 -11.945 -10.822 1.00 . A A . 7 ARG CZ 1 1 14 3438 1 1 7 ARG H H 7.363 -8.916 -4.996 1.00 . A A . 7 ARG H 1 1 14 3439 1 1 7 ARG HA H 7.880 -11.010 -6.659 1.00 . A A . 7 ARG HA 1 1 14 3440 1 1 7 ARG HB2 H 8.397 -8.719 -7.273 1.00 . A A . 7 ARG HB2 1 1 14 3441 1 1 7 ARG HB3 H 9.677 -8.653 -6.069 1.00 . A A . 7 ARG HB3 1 1 14 3442 1 1 7 ARG HD2 H 9.986 -11.890 -8.089 1.00 . A A . 7 ARG HD2 1 1 14 3443 1 1 7 ARG HD3 H 8.540 -10.976 -8.516 1.00 . A A . 7 ARG HD3 1 1 14 3444 1 1 7 ARG HE H 10.572 -10.223 -10.268 1.00 . A A . 7 ARG HE 1 1 14 3445 1 1 7 ARG HG2 H 10.353 -8.991 -8.500 1.00 . A A . 7 ARG HG2 1 1 14 3446 1 1 7 ARG HG3 H 11.069 -10.066 -7.298 1.00 . A A . 7 ARG HG3 1 1 14 3447 1 1 7 ARG HH11 H 8.694 -13.047 -9.485 1.00 . A A . 7 ARG HH11 1 1 14 3448 1 1 7 ARG HH12 H 8.782 -13.709 -11.084 1.00 . A A . 7 ARG HH12 1 1 14 3449 1 1 7 ARG HH21 H 10.695 -11.084 -12.377 1.00 . A A . 7 ARG HH21 1 1 14 3450 1 1 7 ARG HH22 H 9.921 -12.592 -12.728 1.00 . A A . 7 ARG HH22 1 1 14 3451 1 1 7 ARG N N 7.591 -9.868 -4.964 1.00 . A A . 7 ARG N 1 1 14 3452 1 1 7 ARG NE N 10.038 -10.983 -9.959 1.00 . A A . 7 ARG NE 1 1 14 3453 1 1 7 ARG NH1 N 9.011 -12.987 -10.431 1.00 . A A . 7 ARG NH1 1 1 14 3454 1 1 7 ARG NH2 N 10.151 -11.867 -12.079 1.00 . A A . 7 ARG NH2 1 1 14 3455 1 1 7 ARG O O 9.659 -12.495 -5.700 1.00 . A A . 7 ARG O 1 1 14 3456 1 1 8 LYS C C 10.797 -12.184 -2.468 1.00 . A A . 8 LYS C 1 1 14 3457 1 1 8 LYS CA C 11.341 -11.516 -3.727 1.00 . A A . 8 LYS CA 1 1 14 3458 1 1 8 LYS CB C 12.507 -10.593 -3.364 1.00 . A A . 8 LYS CB 1 1 14 3459 1 1 8 LYS CD C 14.198 -8.908 -4.145 1.00 . A A . 8 LYS CD 1 1 14 3460 1 1 8 LYS CE C 15.504 -9.589 -3.765 1.00 . A A . 8 LYS CE 1 1 14 3461 1 1 8 LYS CG C 13.145 -9.919 -4.566 1.00 . A A . 8 LYS CG 1 1 14 3462 1 1 8 LYS H H 10.149 -9.825 -4.172 1.00 . A A . 8 LYS H 1 1 14 3463 1 1 8 LYS HA H 11.695 -12.281 -4.402 1.00 . A A . 8 LYS HA 1 1 14 3464 1 1 8 LYS HB2 H 12.148 -9.825 -2.695 1.00 . A A . 8 LYS HB2 1 1 14 3465 1 1 8 LYS HB3 H 13.266 -11.173 -2.859 1.00 . A A . 8 LYS HB3 1 1 14 3466 1 1 8 LYS HD2 H 14.384 -8.231 -4.965 1.00 . A A . 8 LYS HD2 1 1 14 3467 1 1 8 LYS HD3 H 13.831 -8.353 -3.293 1.00 . A A . 8 LYS HD3 1 1 14 3468 1 1 8 LYS HE2 H 15.591 -9.597 -2.689 1.00 . A A . 8 LYS HE2 1 1 14 3469 1 1 8 LYS HE3 H 15.485 -10.604 -4.132 1.00 . A A . 8 LYS HE3 1 1 14 3470 1 1 8 LYS HG2 H 13.612 -10.671 -5.185 1.00 . A A . 8 LYS HG2 1 1 14 3471 1 1 8 LYS HG3 H 12.377 -9.410 -5.132 1.00 . A A . 8 LYS HG3 1 1 14 3472 1 1 8 LYS HZ1 H 16.390 -7.985 -4.767 1.00 . A A . 8 LYS HZ1 1 1 14 3473 1 1 8 LYS HZ2 H 17.127 -9.477 -5.074 1.00 . A A . 8 LYS HZ2 1 1 14 3474 1 1 8 LYS HZ3 H 17.384 -8.695 -3.597 1.00 . A A . 8 LYS HZ3 1 1 14 3475 1 1 8 LYS N N 10.295 -10.765 -4.411 1.00 . A A . 8 LYS N 1 1 14 3476 1 1 8 LYS NZ N 16.684 -8.887 -4.341 1.00 . A A . 8 LYS NZ 1 1 14 3477 1 1 8 LYS O O 10.561 -13.393 -2.448 1.00 . A A . 8 LYS O 1 1 14 3478 1 1 9 CYS C C 8.774 -11.216 0.215 1.00 . A A . 9 CYS C 1 1 14 3479 1 1 9 CYS CA C 10.082 -11.906 -0.159 1.00 . A A . 9 CYS CA 1 1 14 3480 1 1 9 CYS CB C 11.112 -11.710 0.956 1.00 . A A . 9 CYS CB 1 1 14 3481 1 1 9 CYS H H 10.806 -10.436 -1.499 1.00 . A A . 9 CYS H 1 1 14 3482 1 1 9 CYS HA H 9.895 -12.961 -0.284 1.00 . A A . 9 CYS HA 1 1 14 3483 1 1 9 CYS HB2 H 11.730 -10.857 0.719 1.00 . A A . 9 CYS HB2 1 1 14 3484 1 1 9 CYS HB3 H 10.594 -11.525 1.885 1.00 . A A . 9 CYS HB3 1 1 14 3485 1 1 9 CYS HG H 13.363 -12.675 1.665 1.00 . A A . 9 CYS HG 1 1 14 3486 1 1 9 CYS N N 10.600 -11.391 -1.422 1.00 . A A . 9 CYS N 1 1 14 3487 1 1 9 CYS O O 8.756 -10.081 0.691 1.00 . A A . 9 CYS O 1 1 14 3488 1 1 9 CYS SG S 12.206 -13.128 1.206 1.00 . A A . 9 CYS SG 1 1 14 3489 1 1 10 PRO C C 6.067 -11.278 1.797 1.00 . A A . 10 PRO C 1 1 14 3490 1 1 10 PRO CA C 6.318 -11.390 0.297 1.00 . A A . 10 PRO CA 1 1 14 3491 1 1 10 PRO CB C 5.378 -12.425 -0.326 1.00 . A A . 10 PRO CB 1 1 14 3492 1 1 10 PRO CD C 7.598 -13.274 -0.573 1.00 . A A . 10 PRO CD 1 1 14 3493 1 1 10 PRO CG C 6.169 -13.687 -0.354 1.00 . A A . 10 PRO CG 1 1 14 3494 1 1 10 PRO HA H 6.155 -10.428 -0.166 1.00 . A A . 10 PRO HA 1 1 14 3495 1 1 10 PRO HB2 H 4.493 -12.527 0.287 1.00 . A A . 10 PRO HB2 1 1 14 3496 1 1 10 PRO HB3 H 5.099 -12.111 -1.321 1.00 . A A . 10 PRO HB3 1 1 14 3497 1 1 10 PRO HD2 H 8.268 -13.938 -0.046 1.00 . A A . 10 PRO HD2 1 1 14 3498 1 1 10 PRO HD3 H 7.830 -13.262 -1.628 1.00 . A A . 10 PRO HD3 1 1 14 3499 1 1 10 PRO HG2 H 6.068 -14.205 0.587 1.00 . A A . 10 PRO HG2 1 1 14 3500 1 1 10 PRO HG3 H 5.832 -14.313 -1.167 1.00 . A A . 10 PRO HG3 1 1 14 3501 1 1 10 PRO N N 7.652 -11.916 -0.007 1.00 . A A . 10 PRO N 1 1 14 3502 1 1 10 PRO O O 5.116 -10.628 2.232 1.00 . A A . 10 PRO O 1 1 14 3503 1 1 11 LEU C C 7.176 -10.516 4.591 1.00 . A A . 11 LEU C 1 1 14 3504 1 1 11 LEU CA C 6.799 -11.887 4.038 1.00 . A A . 11 LEU CA 1 1 14 3505 1 1 11 LEU CB C 7.684 -12.964 4.668 1.00 . A A . 11 LEU CB 1 1 14 3506 1 1 11 LEU CD1 C 10.040 -12.580 5.434 1.00 . A A . 11 LEU CD1 1 1 14 3507 1 1 11 LEU CD2 C 9.561 -14.304 3.685 1.00 . A A . 11 LEU CD2 1 1 14 3508 1 1 11 LEU CG C 9.155 -12.951 4.253 1.00 . A A . 11 LEU CG 1 1 14 3509 1 1 11 LEU H H 7.665 -12.417 2.181 1.00 . A A . 11 LEU H 1 1 14 3510 1 1 11 LEU HA H 5.768 -12.090 4.284 1.00 . A A . 11 LEU HA 1 1 14 3511 1 1 11 LEU HB2 H 7.642 -12.841 5.740 1.00 . A A . 11 LEU HB2 1 1 14 3512 1 1 11 LEU HB3 H 7.272 -13.927 4.402 1.00 . A A . 11 LEU HB3 1 1 14 3513 1 1 11 LEU HD11 H 10.213 -13.455 6.043 1.00 . A A . 11 LEU HD11 1 1 14 3514 1 1 11 LEU HD12 H 9.551 -11.820 6.025 1.00 . A A . 11 LEU HD12 1 1 14 3515 1 1 11 LEU HD13 H 10.984 -12.201 5.071 1.00 . A A . 11 LEU HD13 1 1 14 3516 1 1 11 LEU HD21 H 10.624 -14.444 3.813 1.00 . A A . 11 LEU HD21 1 1 14 3517 1 1 11 LEU HD22 H 9.316 -14.340 2.634 1.00 . A A . 11 LEU HD22 1 1 14 3518 1 1 11 LEU HD23 H 9.029 -15.087 4.206 1.00 . A A . 11 LEU HD23 1 1 14 3519 1 1 11 LEU HG H 9.299 -12.207 3.482 1.00 . A A . 11 LEU HG 1 1 14 3520 1 1 11 LEU N N 6.927 -11.915 2.585 1.00 . A A . 11 LEU N 1 1 14 3521 1 1 11 LEU O O 7.029 -10.255 5.785 1.00 . A A . 11 LEU O 1 1 14 3522 1 1 12 PHE C C 6.907 -7.311 3.919 1.00 . A A . 12 PHE C 1 1 14 3523 1 1 12 PHE CA C 8.056 -8.297 4.113 1.00 . A A . 12 PHE CA 1 1 14 3524 1 1 12 PHE CB C 9.275 -7.841 3.309 1.00 . A A . 12 PHE CB 1 1 14 3525 1 1 12 PHE CD1 C 10.864 -8.827 4.983 1.00 . A A . 12 PHE CD1 1 1 14 3526 1 1 12 PHE CD2 C 11.390 -9.029 2.666 1.00 . A A . 12 PHE CD2 1 1 14 3527 1 1 12 PHE CE1 C 12.022 -9.508 5.309 1.00 . A A . 12 PHE CE1 1 1 14 3528 1 1 12 PHE CE2 C 12.549 -9.711 2.986 1.00 . A A . 12 PHE CE2 1 1 14 3529 1 1 12 PHE CG C 10.535 -8.581 3.660 1.00 . A A . 12 PHE CG 1 1 14 3530 1 1 12 PHE CZ C 12.866 -9.949 4.309 1.00 . A A . 12 PHE CZ 1 1 14 3531 1 1 12 PHE H H 7.753 -9.909 2.775 1.00 . A A . 12 PHE H 1 1 14 3532 1 1 12 PHE HA H 8.316 -8.326 5.160 1.00 . A A . 12 PHE HA 1 1 14 3533 1 1 12 PHE HB2 H 9.082 -7.995 2.258 1.00 . A A . 12 PHE HB2 1 1 14 3534 1 1 12 PHE HB3 H 9.444 -6.791 3.490 1.00 . A A . 12 PHE HB3 1 1 14 3535 1 1 12 PHE HD1 H 10.203 -8.482 5.767 1.00 . A A . 12 PHE HD1 1 1 14 3536 1 1 12 PHE HD2 H 11.144 -8.843 1.631 1.00 . A A . 12 PHE HD2 1 1 14 3537 1 1 12 PHE HE1 H 12.266 -9.693 6.345 1.00 . A A . 12 PHE HE1 1 1 14 3538 1 1 12 PHE HE2 H 13.207 -10.054 2.203 1.00 . A A . 12 PHE HE2 1 1 14 3539 1 1 12 PHE HZ H 13.771 -10.482 4.562 1.00 . A A . 12 PHE HZ 1 1 14 3540 1 1 12 PHE N N 7.659 -9.642 3.714 1.00 . A A . 12 PHE N 1 1 14 3541 1 1 12 PHE O O 6.956 -6.449 3.043 1.00 . A A . 12 PHE O 1 1 14 3542 1 1 13 GLY C C 5.013 -5.178 5.190 1.00 . A A . 13 GLY C 1 1 14 3543 1 1 13 GLY CA C 4.726 -6.563 4.646 1.00 . A A . 13 GLY CA 1 1 14 3544 1 1 13 GLY H H 5.888 -8.153 5.423 1.00 . A A . 13 GLY H 1 1 14 3545 1 1 13 GLY HA2 H 4.437 -6.478 3.609 1.00 . A A . 13 GLY HA2 1 1 14 3546 1 1 13 GLY HA3 H 3.906 -6.993 5.203 1.00 . A A . 13 GLY HA3 1 1 14 3547 1 1 13 GLY N N 5.873 -7.447 4.743 1.00 . A A . 13 GLY N 1 1 14 3548 1 1 13 GLY O O 4.348 -4.716 6.118 1.00 . A A . 13 GLY O 1 1 14 3549 1 1 14 LYS C C 5.839 -2.118 4.087 1.00 . A A . 14 LYS C 1 1 14 3550 1 1 14 LYS CA C 6.384 -3.172 5.046 1.00 . A A . 14 LYS CA 1 1 14 3551 1 1 14 LYS CB C 7.907 -3.052 5.140 1.00 . A A . 14 LYS CB 1 1 14 3552 1 1 14 LYS CD C 10.050 -3.908 6.132 1.00 . A A . 14 LYS CD 1 1 14 3553 1 1 14 LYS CE C 10.513 -3.328 7.460 1.00 . A A . 14 LYS CE 1 1 14 3554 1 1 14 LYS CG C 8.539 -4.058 6.086 1.00 . A A . 14 LYS CG 1 1 14 3555 1 1 14 LYS H H 6.502 -4.934 3.879 1.00 . A A . 14 LYS H 1 1 14 3556 1 1 14 LYS HA H 5.958 -3.006 6.024 1.00 . A A . 14 LYS HA 1 1 14 3557 1 1 14 LYS HB2 H 8.329 -3.199 4.157 1.00 . A A . 14 LYS HB2 1 1 14 3558 1 1 14 LYS HB3 H 8.157 -2.059 5.485 1.00 . A A . 14 LYS HB3 1 1 14 3559 1 1 14 LYS HD2 H 10.505 -4.878 5.998 1.00 . A A . 14 LYS HD2 1 1 14 3560 1 1 14 LYS HD3 H 10.362 -3.249 5.333 1.00 . A A . 14 LYS HD3 1 1 14 3561 1 1 14 LYS HE2 H 10.000 -3.840 8.259 1.00 . A A . 14 LYS HE2 1 1 14 3562 1 1 14 LYS HE3 H 11.577 -3.486 7.555 1.00 . A A . 14 LYS HE3 1 1 14 3563 1 1 14 LYS HG2 H 8.143 -3.904 7.079 1.00 . A A . 14 LYS HG2 1 1 14 3564 1 1 14 LYS HG3 H 8.296 -5.056 5.750 1.00 . A A . 14 LYS HG3 1 1 14 3565 1 1 14 LYS HZ1 H 10.524 -1.388 6.683 1.00 . A A . 14 LYS HZ1 1 1 14 3566 1 1 14 LYS HZ2 H 10.748 -1.457 8.359 1.00 . A A . 14 LYS HZ2 1 1 14 3567 1 1 14 LYS HZ3 H 9.211 -1.712 7.699 1.00 . A A . 14 LYS HZ3 1 1 14 3568 1 1 14 LYS N N 6.009 -4.512 4.614 1.00 . A A . 14 LYS N 1 1 14 3569 1 1 14 LYS NZ N 10.229 -1.869 7.557 1.00 . A A . 14 LYS NZ 1 1 14 3570 1 1 14 LYS O O 4.890 -1.404 4.408 1.00 . A A . 14 LYS O 1 1 14 3571 1 1 15 GLY C C 5.186 -1.692 0.813 1.00 . A A . 15 GLY C 1 1 14 3572 1 1 15 GLY CA C 6.006 -1.059 1.920 1.00 . A A . 15 GLY CA 1 1 14 3573 1 1 15 GLY H H 7.198 -2.623 2.706 1.00 . A A . 15 GLY H 1 1 14 3574 1 1 15 GLY HA2 H 5.409 -0.306 2.411 1.00 . A A . 15 GLY HA2 1 1 14 3575 1 1 15 GLY HA3 H 6.875 -0.588 1.483 1.00 . A A . 15 GLY HA3 1 1 14 3576 1 1 15 GLY N N 6.446 -2.027 2.907 1.00 . A A . 15 GLY N 1 1 14 3577 1 1 15 GLY O O 4.070 -2.154 1.045 1.00 . A A . 15 GLY O 1 1 14 3578 1 1 16 GLY C C 5.273 -1.526 -2.811 1.00 . A A . 16 GLY C 1 1 14 3579 1 1 16 GLY CA C 5.037 -2.292 -1.525 1.00 . A A . 16 GLY CA 1 1 14 3580 1 1 16 GLY H H 6.633 -1.328 -0.522 1.00 . A A . 16 GLY H 1 1 14 3581 1 1 16 GLY HA2 H 5.372 -3.310 -1.658 1.00 . A A . 16 GLY HA2 1 1 14 3582 1 1 16 GLY HA3 H 3.978 -2.297 -1.311 1.00 . A A . 16 GLY HA3 1 1 14 3583 1 1 16 GLY N N 5.740 -1.711 -0.396 1.00 . A A . 16 GLY N 1 1 14 3584 1 1 16 GLY O O 4.341 -0.962 -3.385 1.00 . A A . 16 GLY O 1 1 15 3585 1 1 1 VAL C C 3.934 -1.323 -1.050 1.00 . A A . 1 VAL C 1 1 15 3586 1 1 1 VAL CA C 2.956 -0.194 -1.353 1.00 . A A . 1 VAL CA 1 1 15 3587 1 1 1 VAL CB C 2.555 -0.263 -2.839 1.00 . A A . 1 VAL CB 1 1 15 3588 1 1 1 VAL CG1 C 1.485 0.772 -3.152 1.00 . A A . 1 VAL CG1 1 1 15 3589 1 1 1 VAL CG2 C 3.773 -0.069 -3.729 1.00 . A A . 1 VAL CG2 1 1 15 3590 1 1 1 VAL H1 H 4.421 1.141 -0.613 1.00 . A A . 1 VAL H1 1 1 15 3591 1 1 1 VAL HA H 2.066 -0.331 -0.755 1.00 . A A . 1 VAL HA 1 1 15 3592 1 1 1 VAL HB H 2.144 -1.243 -3.035 1.00 . A A . 1 VAL HB 1 1 15 3593 1 1 1 VAL HG11 H 1.930 1.598 -3.688 1.00 . A A . 1 VAL HG11 1 1 15 3594 1 1 1 VAL HG12 H 0.714 0.321 -3.759 1.00 . A A . 1 VAL HG12 1 1 15 3595 1 1 1 VAL HG13 H 1.053 1.133 -2.230 1.00 . A A . 1 VAL HG13 1 1 15 3596 1 1 1 VAL HG21 H 3.457 0.269 -4.704 1.00 . A A . 1 VAL HG21 1 1 15 3597 1 1 1 VAL HG22 H 4.427 0.667 -3.287 1.00 . A A . 1 VAL HG22 1 1 15 3598 1 1 1 VAL HG23 H 4.301 -1.007 -3.827 1.00 . A A . 1 VAL HG23 1 1 15 3599 1 1 1 VAL N N 3.530 1.104 -1.018 1.00 . A A . 1 VAL N 1 1 15 3600 1 1 1 VAL O O 5.147 -1.157 -1.173 1.00 . A A . 1 VAL O 1 1 15 3601 1 1 2 ALA C C 3.866 -4.820 -1.216 1.00 . A A . 2 ALA C 1 1 15 3602 1 1 2 ALA CA C 4.224 -3.630 -0.332 1.00 . A A . 2 ALA CA 1 1 15 3603 1 1 2 ALA CB C 4.073 -3.997 1.137 1.00 . A A . 2 ALA CB 1 1 15 3604 1 1 2 ALA H H 2.424 -2.543 -0.572 1.00 . A A . 2 ALA H 1 1 15 3605 1 1 2 ALA HA H 5.256 -3.362 -0.507 1.00 . A A . 2 ALA HA 1 1 15 3606 1 1 2 ALA HB1 H 3.026 -4.126 1.369 1.00 . A A . 2 ALA HB1 1 1 15 3607 1 1 2 ALA HB2 H 4.602 -4.917 1.334 1.00 . A A . 2 ALA HB2 1 1 15 3608 1 1 2 ALA HB3 H 4.483 -3.207 1.749 1.00 . A A . 2 ALA HB3 1 1 15 3609 1 1 2 ALA N N 3.398 -2.472 -0.651 1.00 . A A . 2 ALA N 1 1 15 3610 1 1 2 ALA O O 3.205 -5.759 -0.772 1.00 . A A . 2 ALA O 1 1 15 3611 1 1 3 ARG C C 5.226 -6.786 -3.537 1.00 . A A . 3 ARG C 1 1 15 3612 1 1 3 ARG CA C 4.030 -5.848 -3.416 1.00 . A A . 3 ARG CA 1 1 15 3613 1 1 3 ARG CB C 3.681 -5.269 -4.789 1.00 . A A . 3 ARG CB 1 1 15 3614 1 1 3 ARG CD C 4.204 -6.316 -7.013 1.00 . A A . 3 ARG CD 1 1 15 3615 1 1 3 ARG CG C 3.276 -6.321 -5.808 1.00 . A A . 3 ARG CG 1 1 15 3616 1 1 3 ARG CZ C 4.056 -6.869 -9.403 1.00 . A A . 3 ARG CZ 1 1 15 3617 1 1 3 ARG H H 4.828 -3.999 -2.765 1.00 . A A . 3 ARG H 1 1 15 3618 1 1 3 ARG HA H 3.184 -6.407 -3.046 1.00 . A A . 3 ARG HA 1 1 15 3619 1 1 3 ARG HB2 H 2.861 -4.575 -4.676 1.00 . A A . 3 ARG HB2 1 1 15 3620 1 1 3 ARG HB3 H 4.540 -4.740 -5.172 1.00 . A A . 3 ARG HB3 1 1 15 3621 1 1 3 ARG HD2 H 4.721 -5.369 -7.048 1.00 . A A . 3 ARG HD2 1 1 15 3622 1 1 3 ARG HD3 H 4.923 -7.114 -6.900 1.00 . A A . 3 ARG HD3 1 1 15 3623 1 1 3 ARG HE H 2.509 -6.354 -8.255 1.00 . A A . 3 ARG HE 1 1 15 3624 1 1 3 ARG HG2 H 3.315 -7.295 -5.342 1.00 . A A . 3 ARG HG2 1 1 15 3625 1 1 3 ARG HG3 H 2.269 -6.119 -6.139 1.00 . A A . 3 ARG HG3 1 1 15 3626 1 1 3 ARG HH11 H 5.916 -6.968 -8.621 1.00 . A A . 3 ARG HH11 1 1 15 3627 1 1 3 ARG HH12 H 5.798 -7.356 -10.306 1.00 . A A . 3 ARG HH12 1 1 15 3628 1 1 3 ARG HH21 H 2.340 -6.862 -10.472 1.00 . A A . 3 ARG HH21 1 1 15 3629 1 1 3 ARG HH22 H 3.764 -7.294 -11.358 1.00 . A A . 3 ARG HH22 1 1 15 3630 1 1 3 ARG N N 4.306 -4.774 -2.469 1.00 . A A . 3 ARG N 1 1 15 3631 1 1 3 ARG NE N 3.477 -6.505 -8.265 1.00 . A A . 3 ARG NE 1 1 15 3632 1 1 3 ARG NH1 N 5.364 -7.081 -9.447 1.00 . A A . 3 ARG NH1 1 1 15 3633 1 1 3 ARG NH2 N 3.327 -7.021 -10.501 1.00 . A A . 3 ARG NH2 1 1 15 3634 1 1 3 ARG O O 5.132 -7.854 -4.141 1.00 . A A . 3 ARG O 1 1 15 3635 1 1 4 GLY C C 7.326 -8.595 -2.476 1.00 . A A . 4 GLY C 1 1 15 3636 1 1 4 GLY CA C 7.551 -7.195 -3.014 1.00 . A A . 4 GLY CA 1 1 15 3637 1 1 4 GLY H H 6.369 -5.518 -2.491 1.00 . A A . 4 GLY H 1 1 15 3638 1 1 4 GLY HA2 H 7.880 -7.264 -4.040 1.00 . A A . 4 GLY HA2 1 1 15 3639 1 1 4 GLY HA3 H 8.325 -6.718 -2.430 1.00 . A A . 4 GLY HA3 1 1 15 3640 1 1 4 GLY N N 6.353 -6.380 -2.959 1.00 . A A . 4 GLY N 1 1 15 3641 1 1 4 GLY O O 8.169 -9.475 -2.646 1.00 . A A . 4 GLY O 1 1 15 3642 1 1 5 TRP C C 6.333 -11.229 -2.167 1.00 . A A . 5 TRP C 1 1 15 3643 1 1 5 TRP CA C 5.854 -10.102 -1.258 1.00 . A A . 5 TRP CA 1 1 15 3644 1 1 5 TRP CB C 4.345 -10.214 -1.038 1.00 . A A . 5 TRP CB 1 1 15 3645 1 1 5 TRP CD1 C 4.030 -8.086 0.354 1.00 . A A . 5 TRP CD1 1 1 15 3646 1 1 5 TRP CD2 C 3.114 -9.920 1.257 1.00 . A A . 5 TRP CD2 1 1 15 3647 1 1 5 TRP CE2 C 2.872 -8.828 2.114 1.00 . A A . 5 TRP CE2 1 1 15 3648 1 1 5 TRP CE3 C 2.630 -11.180 1.618 1.00 . A A . 5 TRP CE3 1 1 15 3649 1 1 5 TRP CG C 3.856 -9.423 0.137 1.00 . A A . 5 TRP CG 1 1 15 3650 1 1 5 TRP CH2 C 1.705 -10.206 3.636 1.00 . A A . 5 TRP CH2 1 1 15 3651 1 1 5 TRP CZ2 C 2.168 -8.961 3.307 1.00 . A A . 5 TRP CZ2 1 1 15 3652 1 1 5 TRP CZ3 C 1.931 -11.310 2.803 1.00 . A A . 5 TRP CZ3 1 1 15 3653 1 1 5 TRP H H 5.554 -8.058 -1.722 1.00 . A A . 5 TRP H 1 1 15 3654 1 1 5 TRP HA H 6.356 -10.186 -0.305 1.00 . A A . 5 TRP HA 1 1 15 3655 1 1 5 TRP HB2 H 3.831 -9.857 -1.917 1.00 . A A . 5 TRP HB2 1 1 15 3656 1 1 5 TRP HB3 H 4.089 -11.251 -0.872 1.00 . A A . 5 TRP HB3 1 1 15 3657 1 1 5 TRP HD1 H 4.557 -7.424 -0.316 1.00 . A A . 5 TRP HD1 1 1 15 3658 1 1 5 TRP HE1 H 3.430 -6.815 1.916 1.00 . A A . 5 TRP HE1 1 1 15 3659 1 1 5 TRP HE3 H 2.794 -12.042 0.989 1.00 . A A . 5 TRP HE3 1 1 15 3660 1 1 5 TRP HH2 H 1.155 -10.355 4.552 1.00 . A A . 5 TRP HH2 1 1 15 3661 1 1 5 TRP HZ2 H 1.985 -8.120 3.960 1.00 . A A . 5 TRP HZ2 1 1 15 3662 1 1 5 TRP HZ3 H 1.550 -12.276 3.099 1.00 . A A . 5 TRP HZ3 1 1 15 3663 1 1 5 TRP N N 6.187 -8.799 -1.825 1.00 . A A . 5 TRP N 1 1 15 3664 1 1 5 TRP NE1 N 3.441 -7.721 1.541 1.00 . A A . 5 TRP NE1 1 1 15 3665 1 1 5 TRP O O 7.353 -11.865 -1.899 1.00 . A A . 5 TRP O 1 1 15 3666 1 1 6 LYS C C 7.244 -12.191 -4.913 1.00 . A A . 6 LYS C 1 1 15 3667 1 1 6 LYS CA C 5.941 -12.521 -4.192 1.00 . A A . 6 LYS CA 1 1 15 3668 1 1 6 LYS CB C 4.815 -12.711 -5.211 1.00 . A A . 6 LYS CB 1 1 15 3669 1 1 6 LYS CD C 2.318 -12.473 -5.343 1.00 . A A . 6 LYS CD 1 1 15 3670 1 1 6 LYS CE C 1.029 -12.548 -4.539 1.00 . A A . 6 LYS CE 1 1 15 3671 1 1 6 LYS CG C 3.484 -13.085 -4.584 1.00 . A A . 6 LYS CG 1 1 15 3672 1 1 6 LYS H H 4.790 -10.930 -3.402 1.00 . A A . 6 LYS H 1 1 15 3673 1 1 6 LYS HA H 6.072 -13.439 -3.639 1.00 . A A . 6 LYS HA 1 1 15 3674 1 1 6 LYS HB2 H 4.685 -11.790 -5.761 1.00 . A A . 6 LYS HB2 1 1 15 3675 1 1 6 LYS HB3 H 5.098 -13.494 -5.900 1.00 . A A . 6 LYS HB3 1 1 15 3676 1 1 6 LYS HD2 H 2.539 -11.436 -5.550 1.00 . A A . 6 LYS HD2 1 1 15 3677 1 1 6 LYS HD3 H 2.184 -13.007 -6.273 1.00 . A A . 6 LYS HD3 1 1 15 3678 1 1 6 LYS HE2 H 0.705 -13.576 -4.498 1.00 . A A . 6 LYS HE2 1 1 15 3679 1 1 6 LYS HE3 H 1.223 -12.192 -3.538 1.00 . A A . 6 LYS HE3 1 1 15 3680 1 1 6 LYS HG2 H 3.381 -14.160 -4.595 1.00 . A A . 6 LYS HG2 1 1 15 3681 1 1 6 LYS HG3 H 3.464 -12.730 -3.564 1.00 . A A . 6 LYS HG3 1 1 15 3682 1 1 6 LYS HZ1 H -0.965 -12.213 -5.064 1.00 . A A . 6 LYS HZ1 1 1 15 3683 1 1 6 LYS HZ2 H 0.150 -11.554 -6.152 1.00 . A A . 6 LYS HZ2 1 1 15 3684 1 1 6 LYS HZ3 H -0.118 -10.806 -4.659 1.00 . A A . 6 LYS HZ3 1 1 15 3685 1 1 6 LYS N N 5.592 -11.472 -3.242 1.00 . A A . 6 LYS N 1 1 15 3686 1 1 6 LYS NZ N -0.052 -11.723 -5.146 1.00 . A A . 6 LYS NZ 1 1 15 3687 1 1 6 LYS O O 7.996 -13.087 -5.298 1.00 . A A . 6 LYS O 1 1 15 3688 1 1 7 ARG C C 9.960 -11.023 -5.088 1.00 . A A . 7 ARG C 1 1 15 3689 1 1 7 ARG CA C 8.718 -10.452 -5.766 1.00 . A A . 7 ARG CA 1 1 15 3690 1 1 7 ARG CB C 8.786 -8.924 -5.777 1.00 . A A . 7 ARG CB 1 1 15 3691 1 1 7 ARG CD C 7.764 -6.772 -6.576 1.00 . A A . 7 ARG CD 1 1 15 3692 1 1 7 ARG CG C 7.552 -8.263 -6.368 1.00 . A A . 7 ARG CG 1 1 15 3693 1 1 7 ARG CZ C 8.037 -5.195 -8.442 1.00 . A A . 7 ARG CZ 1 1 15 3694 1 1 7 ARG H H 6.867 -10.233 -4.762 1.00 . A A . 7 ARG H 1 1 15 3695 1 1 7 ARG HA H 8.682 -10.809 -6.785 1.00 . A A . 7 ARG HA 1 1 15 3696 1 1 7 ARG HB2 H 8.904 -8.573 -4.762 1.00 . A A . 7 ARG HB2 1 1 15 3697 1 1 7 ARG HB3 H 9.644 -8.618 -6.356 1.00 . A A . 7 ARG HB3 1 1 15 3698 1 1 7 ARG HD2 H 6.891 -6.245 -6.220 1.00 . A A . 7 ARG HD2 1 1 15 3699 1 1 7 ARG HD3 H 8.628 -6.462 -6.007 1.00 . A A . 7 ARG HD3 1 1 15 3700 1 1 7 ARG HE H 8.081 -7.182 -8.613 1.00 . A A . 7 ARG HE 1 1 15 3701 1 1 7 ARG HG2 H 7.332 -8.720 -7.322 1.00 . A A . 7 ARG HG2 1 1 15 3702 1 1 7 ARG HG3 H 6.720 -8.410 -5.696 1.00 . A A . 7 ARG HG3 1 1 15 3703 1 1 7 ARG HH11 H 7.753 -4.334 -6.637 1.00 . A A . 7 ARG HH11 1 1 15 3704 1 1 7 ARG HH12 H 7.947 -3.234 -7.961 1.00 . A A . 7 ARG HH12 1 1 15 3705 1 1 7 ARG HH21 H 8.337 -5.743 -10.365 1.00 . A A . 7 ARG HH21 1 1 15 3706 1 1 7 ARG HH22 H 8.278 -4.037 -10.081 1.00 . A A . 7 ARG HH22 1 1 15 3707 1 1 7 ARG N N 7.505 -10.900 -5.092 1.00 . A A . 7 ARG N 1 1 15 3708 1 1 7 ARG NE N 7.977 -6.440 -7.982 1.00 . A A . 7 ARG NE 1 1 15 3709 1 1 7 ARG NH1 N 7.900 -4.170 -7.612 1.00 . A A . 7 ARG NH1 1 1 15 3710 1 1 7 ARG NH2 N 8.234 -4.973 -9.736 1.00 . A A . 7 ARG NH2 1 1 15 3711 1 1 7 ARG O O 10.554 -11.989 -5.568 1.00 . A A . 7 ARG O 1 1 15 3712 1 1 8 LYS C C 11.113 -11.790 -2.080 1.00 . A A . 8 LYS C 1 1 15 3713 1 1 8 LYS CA C 11.518 -10.866 -3.224 1.00 . A A . 8 LYS CA 1 1 15 3714 1 1 8 LYS CB C 12.288 -9.664 -2.675 1.00 . A A . 8 LYS CB 1 1 15 3715 1 1 8 LYS CD C 13.369 -7.449 -3.161 1.00 . A A . 8 LYS CD 1 1 15 3716 1 1 8 LYS CE C 14.313 -6.752 -4.129 1.00 . A A . 8 LYS CE 1 1 15 3717 1 1 8 LYS CG C 12.811 -8.732 -3.754 1.00 . A A . 8 LYS CG 1 1 15 3718 1 1 8 LYS H H 9.832 -9.654 -3.637 1.00 . A A . 8 LYS H 1 1 15 3719 1 1 8 LYS HA H 12.155 -11.412 -3.903 1.00 . A A . 8 LYS HA 1 1 15 3720 1 1 8 LYS HB2 H 11.635 -9.099 -2.026 1.00 . A A . 8 LYS HB2 1 1 15 3721 1 1 8 LYS HB3 H 13.130 -10.023 -2.100 1.00 . A A . 8 LYS HB3 1 1 15 3722 1 1 8 LYS HD2 H 12.551 -6.783 -2.932 1.00 . A A . 8 LYS HD2 1 1 15 3723 1 1 8 LYS HD3 H 13.908 -7.686 -2.254 1.00 . A A . 8 LYS HD3 1 1 15 3724 1 1 8 LYS HE2 H 14.272 -7.260 -5.080 1.00 . A A . 8 LYS HE2 1 1 15 3725 1 1 8 LYS HE3 H 13.988 -5.729 -4.254 1.00 . A A . 8 LYS HE3 1 1 15 3726 1 1 8 LYS HG2 H 13.595 -9.233 -4.301 1.00 . A A . 8 LYS HG2 1 1 15 3727 1 1 8 LYS HG3 H 12.002 -8.485 -4.427 1.00 . A A . 8 LYS HG3 1 1 15 3728 1 1 8 LYS HZ1 H 15.732 -6.723 -2.596 1.00 . A A . 8 LYS HZ1 1 1 15 3729 1 1 8 LYS HZ2 H 16.230 -5.933 -4.006 1.00 . A A . 8 LYS HZ2 1 1 15 3730 1 1 8 LYS HZ3 H 16.203 -7.623 -3.949 1.00 . A A . 8 LYS HZ3 1 1 15 3731 1 1 8 LYS N N 10.347 -10.419 -3.970 1.00 . A A . 8 LYS N 1 1 15 3732 1 1 8 LYS NZ N 15.718 -6.758 -3.635 1.00 . A A . 8 LYS NZ 1 1 15 3733 1 1 8 LYS O O 11.239 -13.011 -2.181 1.00 . A A . 8 LYS O 1 1 15 3734 1 1 9 CYS C C 8.739 -11.700 0.499 1.00 . A A . 9 CYS C 1 1 15 3735 1 1 9 CYS CA C 10.203 -11.971 0.170 1.00 . A A . 9 CYS CA 1 1 15 3736 1 1 9 CYS CB C 11.080 -11.635 1.378 1.00 . A A . 9 CYS CB 1 1 15 3737 1 1 9 CYS H H 10.551 -10.224 -0.972 1.00 . A A . 9 CYS H 1 1 15 3738 1 1 9 CYS HA H 10.318 -13.018 -0.067 1.00 . A A . 9 CYS HA 1 1 15 3739 1 1 9 CYS HB2 H 11.654 -10.746 1.160 1.00 . A A . 9 CYS HB2 1 1 15 3740 1 1 9 CYS HB3 H 10.446 -11.446 2.231 1.00 . A A . 9 CYS HB3 1 1 15 3741 1 1 9 CYS HG H 12.894 -13.308 0.737 1.00 . A A . 9 CYS HG 1 1 15 3742 1 1 9 CYS N N 10.627 -11.201 -0.993 1.00 . A A . 9 CYS N 1 1 15 3743 1 1 9 CYS O O 8.300 -10.553 0.593 1.00 . A A . 9 CYS O 1 1 15 3744 1 1 9 CYS SG S 12.244 -12.942 1.831 1.00 . A A . 9 CYS SG 1 1 15 3745 1 1 10 PRO C C 6.289 -12.154 2.404 1.00 . A A . 10 PRO C 1 1 15 3746 1 1 10 PRO CA C 6.534 -12.683 0.994 1.00 . A A . 10 PRO CA 1 1 15 3747 1 1 10 PRO CB C 6.045 -14.128 0.873 1.00 . A A . 10 PRO CB 1 1 15 3748 1 1 10 PRO CD C 8.417 -14.176 0.578 1.00 . A A . 10 PRO CD 1 1 15 3749 1 1 10 PRO CG C 7.256 -14.960 1.124 1.00 . A A . 10 PRO CG 1 1 15 3750 1 1 10 PRO HA H 6.009 -12.063 0.283 1.00 . A A . 10 PRO HA 1 1 15 3751 1 1 10 PRO HB2 H 5.277 -14.314 1.611 1.00 . A A . 10 PRO HB2 1 1 15 3752 1 1 10 PRO HB3 H 5.650 -14.296 -0.117 1.00 . A A . 10 PRO HB3 1 1 15 3753 1 1 10 PRO HD2 H 9.298 -14.337 1.181 1.00 . A A . 10 PRO HD2 1 1 15 3754 1 1 10 PRO HD3 H 8.606 -14.448 -0.450 1.00 . A A . 10 PRO HD3 1 1 15 3755 1 1 10 PRO HG2 H 7.377 -15.121 2.184 1.00 . A A . 10 PRO HG2 1 1 15 3756 1 1 10 PRO HG3 H 7.166 -15.904 0.607 1.00 . A A . 10 PRO HG3 1 1 15 3757 1 1 10 PRO N N 7.962 -12.779 0.675 1.00 . A A . 10 PRO N 1 1 15 3758 1 1 10 PRO O O 5.147 -11.926 2.802 1.00 . A A . 10 PRO O 1 1 15 3759 1 1 11 LEU C C 7.808 -10.034 4.615 1.00 . A A . 11 LEU C 1 1 15 3760 1 1 11 LEU CA C 7.271 -11.459 4.520 1.00 . A A . 11 LEU CA 1 1 15 3761 1 1 11 LEU CB C 8.041 -12.371 5.476 1.00 . A A . 11 LEU CB 1 1 15 3762 1 1 11 LEU CD1 C 10.399 -11.817 4.830 1.00 . A A . 11 LEU CD1 1 1 15 3763 1 1 11 LEU CD2 C 9.877 -14.034 5.863 1.00 . A A . 11 LEU CD2 1 1 15 3764 1 1 11 LEU CG C 9.367 -12.926 4.953 1.00 . A A . 11 LEU CG 1 1 15 3765 1 1 11 LEU H H 8.252 -12.162 2.781 1.00 . A A . 11 LEU H 1 1 15 3766 1 1 11 LEU HA H 6.228 -11.457 4.799 1.00 . A A . 11 LEU HA 1 1 15 3767 1 1 11 LEU HB2 H 8.250 -11.809 6.373 1.00 . A A . 11 LEU HB2 1 1 15 3768 1 1 11 LEU HB3 H 7.403 -13.209 5.719 1.00 . A A . 11 LEU HB3 1 1 15 3769 1 1 11 LEU HD11 H 10.036 -11.061 4.150 1.00 . A A . 11 LEU HD11 1 1 15 3770 1 1 11 LEU HD12 H 11.324 -12.226 4.453 1.00 . A A . 11 LEU HD12 1 1 15 3771 1 1 11 LEU HD13 H 10.570 -11.375 5.801 1.00 . A A . 11 LEU HD13 1 1 15 3772 1 1 11 LEU HD21 H 10.456 -14.737 5.283 1.00 . A A . 11 LEU HD21 1 1 15 3773 1 1 11 LEU HD22 H 9.039 -14.543 6.315 1.00 . A A . 11 LEU HD22 1 1 15 3774 1 1 11 LEU HD23 H 10.498 -13.606 6.637 1.00 . A A . 11 LEU HD23 1 1 15 3775 1 1 11 LEU HG H 9.210 -13.346 3.969 1.00 . A A . 11 LEU HG 1 1 15 3776 1 1 11 LEU N N 7.369 -11.962 3.154 1.00 . A A . 11 LEU N 1 1 15 3777 1 1 11 LEU O O 7.982 -9.497 5.710 1.00 . A A . 11 LEU O 1 1 15 3778 1 1 12 PHE C C 7.440 -7.052 3.350 1.00 . A A . 12 PHE C 1 1 15 3779 1 1 12 PHE CA C 8.581 -8.063 3.416 1.00 . A A . 12 PHE CA 1 1 15 3780 1 1 12 PHE CB C 9.505 -7.885 2.209 1.00 . A A . 12 PHE CB 1 1 15 3781 1 1 12 PHE CD1 C 10.713 -5.905 3.166 1.00 . A A . 12 PHE CD1 1 1 15 3782 1 1 12 PHE CD2 C 12.004 -7.652 2.182 1.00 . A A . 12 PHE CD2 1 1 15 3783 1 1 12 PHE CE1 C 11.872 -5.210 3.457 1.00 . A A . 12 PHE CE1 1 1 15 3784 1 1 12 PHE CE2 C 13.166 -6.962 2.471 1.00 . A A . 12 PHE CE2 1 1 15 3785 1 1 12 PHE CG C 10.766 -7.132 2.525 1.00 . A A . 12 PHE CG 1 1 15 3786 1 1 12 PHE CZ C 13.099 -5.739 3.110 1.00 . A A . 12 PHE CZ 1 1 15 3787 1 1 12 PHE H H 7.907 -9.906 2.623 1.00 . A A . 12 PHE H 1 1 15 3788 1 1 12 PHE HA H 9.146 -7.892 4.319 1.00 . A A . 12 PHE HA 1 1 15 3789 1 1 12 PHE HB2 H 9.786 -8.858 1.833 1.00 . A A . 12 PHE HB2 1 1 15 3790 1 1 12 PHE HB3 H 8.978 -7.344 1.438 1.00 . A A . 12 PHE HB3 1 1 15 3791 1 1 12 PHE HD1 H 9.754 -5.490 3.438 1.00 . A A . 12 PHE HD1 1 1 15 3792 1 1 12 PHE HD2 H 12.056 -8.609 1.683 1.00 . A A . 12 PHE HD2 1 1 15 3793 1 1 12 PHE HE1 H 11.817 -4.254 3.957 1.00 . A A . 12 PHE HE1 1 1 15 3794 1 1 12 PHE HE2 H 14.124 -7.379 2.199 1.00 . A A . 12 PHE HE2 1 1 15 3795 1 1 12 PHE HZ H 14.006 -5.198 3.337 1.00 . A A . 12 PHE HZ 1 1 15 3796 1 1 12 PHE N N 8.066 -9.426 3.462 1.00 . A A . 12 PHE N 1 1 15 3797 1 1 12 PHE O O 7.520 -6.055 2.633 1.00 . A A . 12 PHE O 1 1 15 3798 1 1 13 GLY C C 5.594 -5.030 4.589 1.00 . A A . 13 GLY C 1 1 15 3799 1 1 13 GLY CA C 5.234 -6.424 4.115 1.00 . A A . 13 GLY CA 1 1 15 3800 1 1 13 GLY H H 6.369 -8.129 4.654 1.00 . A A . 13 GLY H 1 1 15 3801 1 1 13 GLY HA2 H 4.830 -6.361 3.116 1.00 . A A . 13 GLY HA2 1 1 15 3802 1 1 13 GLY HA3 H 4.480 -6.832 4.773 1.00 . A A . 13 GLY HA3 1 1 15 3803 1 1 13 GLY N N 6.377 -7.318 4.103 1.00 . A A . 13 GLY N 1 1 15 3804 1 1 13 GLY O O 4.885 -4.066 4.300 1.00 . A A . 13 GLY O 1 1 15 3805 1 1 14 LYS C C 7.608 -2.725 4.702 1.00 . A A . 14 LYS C 1 1 15 3806 1 1 14 LYS CA C 7.151 -3.636 5.837 1.00 . A A . 14 LYS CA 1 1 15 3807 1 1 14 LYS CB C 8.294 -3.838 6.834 1.00 . A A . 14 LYS CB 1 1 15 3808 1 1 14 LYS CD C 10.473 -3.048 5.866 1.00 . A A . 14 LYS CD 1 1 15 3809 1 1 14 LYS CE C 11.884 -3.221 6.408 1.00 . A A . 14 LYS CE 1 1 15 3810 1 1 14 LYS CG C 9.603 -4.252 6.184 1.00 . A A . 14 LYS CG 1 1 15 3811 1 1 14 LYS H H 7.221 -5.727 5.517 1.00 . A A . 14 LYS H 1 1 15 3812 1 1 14 LYS HA H 6.320 -3.170 6.344 1.00 . A A . 14 LYS HA 1 1 15 3813 1 1 14 LYS HB2 H 8.458 -2.913 7.368 1.00 . A A . 14 LYS HB2 1 1 15 3814 1 1 14 LYS HB3 H 8.008 -4.604 7.540 1.00 . A A . 14 LYS HB3 1 1 15 3815 1 1 14 LYS HD2 H 10.524 -2.925 4.794 1.00 . A A . 14 LYS HD2 1 1 15 3816 1 1 14 LYS HD3 H 10.031 -2.168 6.311 1.00 . A A . 14 LYS HD3 1 1 15 3817 1 1 14 LYS HE2 H 11.890 -2.948 7.452 1.00 . A A . 14 LYS HE2 1 1 15 3818 1 1 14 LYS HE3 H 12.170 -4.257 6.305 1.00 . A A . 14 LYS HE3 1 1 15 3819 1 1 14 LYS HG2 H 10.140 -4.902 6.859 1.00 . A A . 14 LYS HG2 1 1 15 3820 1 1 14 LYS HG3 H 9.387 -4.782 5.267 1.00 . A A . 14 LYS HG3 1 1 15 3821 1 1 14 LYS HZ1 H 13.754 -2.311 6.216 1.00 . A A . 14 LYS HZ1 1 1 15 3822 1 1 14 LYS HZ2 H 12.484 -1.413 5.552 1.00 . A A . 14 LYS HZ2 1 1 15 3823 1 1 14 LYS HZ3 H 13.066 -2.779 4.744 1.00 . A A . 14 LYS HZ3 1 1 15 3824 1 1 14 LYS N N 6.698 -4.922 5.320 1.00 . A A . 14 LYS N 1 1 15 3825 1 1 14 LYS NZ N 12.866 -2.372 5.679 1.00 . A A . 14 LYS NZ 1 1 15 3826 1 1 14 LYS O O 7.472 -1.505 4.779 1.00 . A A . 14 LYS O 1 1 15 3827 1 1 15 GLY C C 7.851 -2.868 1.242 1.00 . A A . 15 GLY C 1 1 15 3828 1 1 15 GLY CA C 8.617 -2.554 2.511 1.00 . A A . 15 GLY CA 1 1 15 3829 1 1 15 GLY H H 8.233 -4.303 3.640 1.00 . A A . 15 GLY H 1 1 15 3830 1 1 15 GLY HA2 H 8.508 -1.503 2.735 1.00 . A A . 15 GLY HA2 1 1 15 3831 1 1 15 GLY HA3 H 9.663 -2.771 2.349 1.00 . A A . 15 GLY HA3 1 1 15 3832 1 1 15 GLY N N 8.150 -3.327 3.647 1.00 . A A . 15 GLY N 1 1 15 3833 1 1 15 GLY O O 6.816 -2.262 0.967 1.00 . A A . 15 GLY O 1 1 15 3834 1 1 16 GLY C C 7.437 -3.001 -1.674 1.00 . A A . 16 GLY C 1 1 15 3835 1 1 16 GLY CA C 7.705 -4.193 -0.776 1.00 . A A . 16 GLY CA 1 1 15 3836 1 1 16 GLY H H 9.189 -4.267 0.732 1.00 . A A . 16 GLY H 1 1 15 3837 1 1 16 GLY HA2 H 8.333 -4.895 -1.304 1.00 . A A . 16 GLY HA2 1 1 15 3838 1 1 16 GLY HA3 H 6.765 -4.671 -0.542 1.00 . A A . 16 GLY HA3 1 1 15 3839 1 1 16 GLY N N 8.361 -3.818 0.463 1.00 . A A . 16 GLY N 1 1 15 3840 1 1 16 GLY O O 6.917 -3.153 -2.779 1.00 . A A . 16 GLY O 1 1 16 3841 1 1 1 VAL C C 3.462 -1.826 -1.607 1.00 . A A . 1 VAL C 1 1 16 3842 1 1 1 VAL CA C 2.557 -0.703 -2.102 1.00 . A A . 1 VAL CA 1 1 16 3843 1 1 1 VAL CB C 3.298 0.639 -1.958 1.00 . A A . 1 VAL CB 1 1 16 3844 1 1 1 VAL CG1 C 2.508 1.759 -2.618 1.00 . A A . 1 VAL CG1 1 1 16 3845 1 1 1 VAL CG2 C 3.558 0.951 -0.492 1.00 . A A . 1 VAL CG2 1 1 16 3846 1 1 1 VAL H1 H 0.647 -1.413 -1.530 1.00 . A A . 1 VAL H1 1 1 16 3847 1 1 1 VAL HA H 2.342 -0.862 -3.148 1.00 . A A . 1 VAL HA 1 1 16 3848 1 1 1 VAL HB H 4.251 0.557 -2.461 1.00 . A A . 1 VAL HB 1 1 16 3849 1 1 1 VAL HG11 H 2.015 2.347 -1.858 1.00 . A A . 1 VAL HG11 1 1 16 3850 1 1 1 VAL HG12 H 3.178 2.388 -3.184 1.00 . A A . 1 VAL HG12 1 1 16 3851 1 1 1 VAL HG13 H 1.767 1.335 -3.280 1.00 . A A . 1 VAL HG13 1 1 16 3852 1 1 1 VAL HG21 H 4.094 1.884 -0.411 1.00 . A A . 1 VAL HG21 1 1 16 3853 1 1 1 VAL HG22 H 2.616 1.030 0.030 1.00 . A A . 1 VAL HG22 1 1 16 3854 1 1 1 VAL HG23 H 4.147 0.158 -0.054 1.00 . A A . 1 VAL HG23 1 1 16 3855 1 1 1 VAL N N 1.291 -0.691 -1.378 1.00 . A A . 1 VAL N 1 1 16 3856 1 1 1 VAL O O 4.671 -1.647 -1.468 1.00 . A A . 1 VAL O 1 1 16 3857 1 1 2 ALA C C 3.475 -5.320 -1.818 1.00 . A A . 2 ALA C 1 1 16 3858 1 1 2 ALA CA C 3.619 -4.138 -0.865 1.00 . A A . 2 ALA CA 1 1 16 3859 1 1 2 ALA CB C 3.161 -4.526 0.533 1.00 . A A . 2 ALA CB 1 1 16 3860 1 1 2 ALA H H 1.899 -3.066 -1.473 1.00 . A A . 2 ALA H 1 1 16 3861 1 1 2 ALA HA H 4.662 -3.858 -0.811 1.00 . A A . 2 ALA HA 1 1 16 3862 1 1 2 ALA HB1 H 2.274 -5.139 0.463 1.00 . A A . 2 ALA HB1 1 1 16 3863 1 1 2 ALA HB2 H 3.944 -5.081 1.027 1.00 . A A . 2 ALA HB2 1 1 16 3864 1 1 2 ALA HB3 H 2.938 -3.634 1.099 1.00 . A A . 2 ALA HB3 1 1 16 3865 1 1 2 ALA N N 2.867 -2.985 -1.342 1.00 . A A . 2 ALA N 1 1 16 3866 1 1 2 ALA O O 2.760 -6.280 -1.528 1.00 . A A . 2 ALA O 1 1 16 3867 1 1 3 ARG C C 5.332 -7.207 -3.853 1.00 . A A . 3 ARG C 1 1 16 3868 1 1 3 ARG CA C 4.104 -6.307 -3.952 1.00 . A A . 3 ARG CA 1 1 16 3869 1 1 3 ARG CB C 4.006 -5.712 -5.358 1.00 . A A . 3 ARG CB 1 1 16 3870 1 1 3 ARG CD C 5.316 -4.201 -6.880 1.00 . A A . 3 ARG CD 1 1 16 3871 1 1 3 ARG CG C 5.357 -5.440 -6.000 1.00 . A A . 3 ARG CG 1 1 16 3872 1 1 3 ARG CZ C 7.472 -3.111 -6.425 1.00 . A A . 3 ARG CZ 1 1 16 3873 1 1 3 ARG H H 4.711 -4.453 -3.130 1.00 . A A . 3 ARG H 1 1 16 3874 1 1 3 ARG HA H 3.222 -6.898 -3.759 1.00 . A A . 3 ARG HA 1 1 16 3875 1 1 3 ARG HB2 H 3.464 -6.400 -5.990 1.00 . A A . 3 ARG HB2 1 1 16 3876 1 1 3 ARG HB3 H 3.463 -4.781 -5.305 1.00 . A A . 3 ARG HB3 1 1 16 3877 1 1 3 ARG HD2 H 4.760 -4.430 -7.777 1.00 . A A . 3 ARG HD2 1 1 16 3878 1 1 3 ARG HD3 H 4.817 -3.409 -6.340 1.00 . A A . 3 ARG HD3 1 1 16 3879 1 1 3 ARG HE H 6.956 -3.934 -8.167 1.00 . A A . 3 ARG HE 1 1 16 3880 1 1 3 ARG HG2 H 6.091 -5.292 -5.222 1.00 . A A . 3 ARG HG2 1 1 16 3881 1 1 3 ARG HG3 H 5.635 -6.291 -6.604 1.00 . A A . 3 ARG HG3 1 1 16 3882 1 1 3 ARG HH11 H 6.186 -3.133 -4.868 1.00 . A A . 3 ARG HH11 1 1 16 3883 1 1 3 ARG HH12 H 7.709 -2.368 -4.560 1.00 . A A . 3 ARG HH12 1 1 16 3884 1 1 3 ARG HH21 H 8.966 -2.929 -7.774 1.00 . A A . 3 ARG HH21 1 1 16 3885 1 1 3 ARG HH22 H 9.290 -2.252 -6.215 1.00 . A A . 3 ARG HH22 1 1 16 3886 1 1 3 ARG N N 4.158 -5.244 -2.956 1.00 . A A . 3 ARG N 1 1 16 3887 1 1 3 ARG NE N 6.654 -3.750 -7.253 1.00 . A A . 3 ARG NE 1 1 16 3888 1 1 3 ARG NH1 N 7.091 -2.849 -5.182 1.00 . A A . 3 ARG NH1 1 1 16 3889 1 1 3 ARG NH2 N 8.675 -2.733 -6.839 1.00 . A A . 3 ARG NH2 1 1 16 3890 1 1 3 ARG O O 5.342 -8.320 -4.378 1.00 . A A . 3 ARG O 1 1 16 3891 1 1 4 GLY C C 7.330 -8.862 -2.432 1.00 . A A . 4 GLY C 1 1 16 3892 1 1 4 GLY CA C 7.585 -7.490 -3.022 1.00 . A A . 4 GLY CA 1 1 16 3893 1 1 4 GLY H H 6.302 -5.823 -2.780 1.00 . A A . 4 GLY H 1 1 16 3894 1 1 4 GLY HA2 H 8.050 -7.606 -3.990 1.00 . A A . 4 GLY HA2 1 1 16 3895 1 1 4 GLY HA3 H 8.259 -6.951 -2.373 1.00 . A A . 4 GLY HA3 1 1 16 3896 1 1 4 GLY N N 6.367 -6.717 -3.177 1.00 . A A . 4 GLY N 1 1 16 3897 1 1 4 GLY O O 8.205 -9.728 -2.458 1.00 . A A . 4 GLY O 1 1 16 3898 1 1 5 TRP C C 6.265 -11.503 -2.145 1.00 . A A . 5 TRP C 1 1 16 3899 1 1 5 TRP CA C 5.765 -10.339 -1.297 1.00 . A A . 5 TRP CA 1 1 16 3900 1 1 5 TRP CB C 4.247 -10.429 -1.128 1.00 . A A . 5 TRP CB 1 1 16 3901 1 1 5 TRP CD1 C 3.844 -8.195 0.062 1.00 . A A . 5 TRP CD1 1 1 16 3902 1 1 5 TRP CD2 C 2.980 -9.970 1.119 1.00 . A A . 5 TRP CD2 1 1 16 3903 1 1 5 TRP CE2 C 2.691 -8.815 1.871 1.00 . A A . 5 TRP CE2 1 1 16 3904 1 1 5 TRP CE3 C 2.534 -11.208 1.589 1.00 . A A . 5 TRP CE3 1 1 16 3905 1 1 5 TRP CG C 3.718 -9.552 -0.034 1.00 . A A . 5 TRP CG 1 1 16 3906 1 1 5 TRP CH2 C 1.553 -10.089 3.502 1.00 . A A . 5 TRP CH2 1 1 16 3907 1 1 5 TRP CZ2 C 1.978 -8.863 3.066 1.00 . A A . 5 TRP CZ2 1 1 16 3908 1 1 5 TRP CZ3 C 1.826 -11.255 2.775 1.00 . A A . 5 TRP CZ3 1 1 16 3909 1 1 5 TRP H H 5.476 -8.332 -1.907 1.00 . A A . 5 TRP H 1 1 16 3910 1 1 5 TRP HA H 6.230 -10.391 -0.323 1.00 . A A . 5 TRP HA 1 1 16 3911 1 1 5 TRP HB2 H 3.770 -10.136 -2.051 1.00 . A A . 5 TRP HB2 1 1 16 3912 1 1 5 TRP HB3 H 3.979 -11.450 -0.896 1.00 . A A . 5 TRP HB3 1 1 16 3913 1 1 5 TRP HD1 H 4.357 -7.580 -0.662 1.00 . A A . 5 TRP HD1 1 1 16 3914 1 1 5 TRP HE1 H 3.183 -6.810 1.496 1.00 . A A . 5 TRP HE1 1 1 16 3915 1 1 5 TRP HE3 H 2.734 -12.118 1.043 1.00 . A A . 5 TRP HE3 1 1 16 3916 1 1 5 TRP HH2 H 0.997 -10.172 4.423 1.00 . A A . 5 TRP HH2 1 1 16 3917 1 1 5 TRP HZ2 H 1.758 -7.973 3.637 1.00 . A A . 5 TRP HZ2 1 1 16 3918 1 1 5 TRP HZ3 H 1.473 -12.203 3.154 1.00 . A A . 5 TRP HZ3 1 1 16 3919 1 1 5 TRP N N 6.131 -9.061 -1.898 1.00 . A A . 5 TRP N 1 1 16 3920 1 1 5 TRP NE1 N 3.229 -7.745 1.205 1.00 . A A . 5 TRP NE1 1 1 16 3921 1 1 5 TRP O O 7.253 -12.154 -1.803 1.00 . A A . 5 TRP O 1 1 16 3922 1 1 6 LYS C C 7.163 -12.460 -4.994 1.00 . A A . 6 LYS C 1 1 16 3923 1 1 6 LYS CA C 5.952 -12.846 -4.151 1.00 . A A . 6 LYS CA 1 1 16 3924 1 1 6 LYS CB C 4.778 -13.210 -5.062 1.00 . A A . 6 LYS CB 1 1 16 3925 1 1 6 LYS CD C 3.504 -14.203 -3.138 1.00 . A A . 6 LYS CD 1 1 16 3926 1 1 6 LYS CE C 2.166 -14.272 -2.419 1.00 . A A . 6 LYS CE 1 1 16 3927 1 1 6 LYS CG C 3.444 -13.274 -4.339 1.00 . A A . 6 LYS CG 1 1 16 3928 1 1 6 LYS H H 4.798 -11.206 -3.471 1.00 . A A . 6 LYS H 1 1 16 3929 1 1 6 LYS HA H 6.207 -13.703 -3.547 1.00 . A A . 6 LYS HA 1 1 16 3930 1 1 6 LYS HB2 H 4.704 -12.470 -5.846 1.00 . A A . 6 LYS HB2 1 1 16 3931 1 1 6 LYS HB3 H 4.969 -14.176 -5.507 1.00 . A A . 6 LYS HB3 1 1 16 3932 1 1 6 LYS HD2 H 3.771 -15.194 -3.474 1.00 . A A . 6 LYS HD2 1 1 16 3933 1 1 6 LYS HD3 H 4.255 -13.839 -2.450 1.00 . A A . 6 LYS HD3 1 1 16 3934 1 1 6 LYS HE2 H 2.234 -13.705 -1.504 1.00 . A A . 6 LYS HE2 1 1 16 3935 1 1 6 LYS HE3 H 1.408 -13.840 -3.055 1.00 . A A . 6 LYS HE3 1 1 16 3936 1 1 6 LYS HG2 H 3.180 -12.283 -4.001 1.00 . A A . 6 LYS HG2 1 1 16 3937 1 1 6 LYS HG3 H 2.690 -13.634 -5.025 1.00 . A A . 6 LYS HG3 1 1 16 3938 1 1 6 LYS HZ1 H 1.788 -15.816 -1.063 1.00 . A A . 6 LYS HZ1 1 1 16 3939 1 1 6 LYS HZ2 H 2.457 -16.338 -2.527 1.00 . A A . 6 LYS HZ2 1 1 16 3940 1 1 6 LYS HZ3 H 0.831 -15.878 -2.456 1.00 . A A . 6 LYS HZ3 1 1 16 3941 1 1 6 LYS N N 5.577 -11.761 -3.252 1.00 . A A . 6 LYS N 1 1 16 3942 1 1 6 LYS NZ N 1.783 -15.674 -2.093 1.00 . A A . 6 LYS NZ 1 1 16 3943 1 1 6 LYS O O 7.801 -13.315 -5.609 1.00 . A A . 6 LYS O 1 1 16 3944 1 1 7 ARG C C 9.926 -11.008 -5.091 1.00 . A A . 7 ARG C 1 1 16 3945 1 1 7 ARG CA C 8.610 -10.670 -5.785 1.00 . A A . 7 ARG CA 1 1 16 3946 1 1 7 ARG CB C 8.497 -9.157 -5.979 1.00 . A A . 7 ARG CB 1 1 16 3947 1 1 7 ARG CD C 7.711 -7.403 -7.598 1.00 . A A . 7 ARG CD 1 1 16 3948 1 1 7 ARG CG C 8.430 -8.733 -7.437 1.00 . A A . 7 ARG CG 1 1 16 3949 1 1 7 ARG CZ C 7.925 -6.950 -10.005 1.00 . A A . 7 ARG CZ 1 1 16 3950 1 1 7 ARG H H 6.928 -10.535 -4.507 1.00 . A A . 7 ARG H 1 1 16 3951 1 1 7 ARG HA H 8.593 -11.150 -6.752 1.00 . A A . 7 ARG HA 1 1 16 3952 1 1 7 ARG HB2 H 7.603 -8.808 -5.484 1.00 . A A . 7 ARG HB2 1 1 16 3953 1 1 7 ARG HB3 H 9.356 -8.684 -5.528 1.00 . A A . 7 ARG HB3 1 1 16 3954 1 1 7 ARG HD2 H 6.657 -7.594 -7.736 1.00 . A A . 7 ARG HD2 1 1 16 3955 1 1 7 ARG HD3 H 7.857 -6.820 -6.701 1.00 . A A . 7 ARG HD3 1 1 16 3956 1 1 7 ARG HE H 8.784 -5.874 -8.562 1.00 . A A . 7 ARG HE 1 1 16 3957 1 1 7 ARG HG2 H 9.435 -8.634 -7.820 1.00 . A A . 7 ARG HG2 1 1 16 3958 1 1 7 ARG HG3 H 7.902 -9.489 -7.998 1.00 . A A . 7 ARG HG3 1 1 16 3959 1 1 7 ARG HH11 H 6.776 -8.545 -9.539 1.00 . A A . 7 ARG HH11 1 1 16 3960 1 1 7 ARG HH12 H 6.935 -8.214 -11.232 1.00 . A A . 7 ARG HH12 1 1 16 3961 1 1 7 ARG HH21 H 9.001 -5.429 -10.788 1.00 . A A . 7 ARG HH21 1 1 16 3962 1 1 7 ARG HH22 H 8.202 -6.442 -11.942 1.00 . A A . 7 ARG HH22 1 1 16 3963 1 1 7 ARG N N 7.475 -11.168 -5.017 1.00 . A A . 7 ARG N 1 1 16 3964 1 1 7 ARG NE N 8.209 -6.646 -8.743 1.00 . A A . 7 ARG NE 1 1 16 3965 1 1 7 ARG NH1 N 7.149 -7.989 -10.281 1.00 . A A . 7 ARG NH1 1 1 16 3966 1 1 7 ARG NH2 N 8.416 -6.213 -10.993 1.00 . A A . 7 ARG NH2 1 1 16 3967 1 1 7 ARG O O 10.614 -11.957 -5.467 1.00 . A A . 7 ARG O 1 1 16 3968 1 1 8 LYS C C 11.253 -11.317 -2.105 1.00 . A A . 8 LYS C 1 1 16 3969 1 1 8 LYS CA C 11.504 -10.439 -3.327 1.00 . A A . 8 LYS CA 1 1 16 3970 1 1 8 LYS CB C 12.101 -9.099 -2.891 1.00 . A A . 8 LYS CB 1 1 16 3971 1 1 8 LYS CD C 12.854 -6.799 -3.562 1.00 . A A . 8 LYS CD 1 1 16 3972 1 1 8 LYS CE C 13.732 -6.093 -4.584 1.00 . A A . 8 LYS CE 1 1 16 3973 1 1 8 LYS CG C 12.426 -8.173 -4.050 1.00 . A A . 8 LYS CG 1 1 16 3974 1 1 8 LYS H H 9.682 -9.483 -3.822 1.00 . A A . 8 LYS H 1 1 16 3975 1 1 8 LYS HA H 12.204 -10.941 -3.978 1.00 . A A . 8 LYS HA 1 1 16 3976 1 1 8 LYS HB2 H 11.396 -8.599 -2.243 1.00 . A A . 8 LYS HB2 1 1 16 3977 1 1 8 LYS HB3 H 13.012 -9.286 -2.341 1.00 . A A . 8 LYS HB3 1 1 16 3978 1 1 8 LYS HD2 H 11.974 -6.198 -3.385 1.00 . A A . 8 LYS HD2 1 1 16 3979 1 1 8 LYS HD3 H 13.407 -6.910 -2.640 1.00 . A A . 8 LYS HD3 1 1 16 3980 1 1 8 LYS HE2 H 14.426 -5.452 -4.062 1.00 . A A . 8 LYS HE2 1 1 16 3981 1 1 8 LYS HE3 H 14.281 -6.837 -5.142 1.00 . A A . 8 LYS HE3 1 1 16 3982 1 1 8 LYS HG2 H 13.229 -8.603 -4.629 1.00 . A A . 8 LYS HG2 1 1 16 3983 1 1 8 LYS HG3 H 11.548 -8.067 -4.671 1.00 . A A . 8 LYS HG3 1 1 16 3984 1 1 8 LYS HZ1 H 12.170 -4.777 -5.020 1.00 . A A . 8 LYS HZ1 1 1 16 3985 1 1 8 LYS HZ2 H 12.506 -5.877 -6.261 1.00 . A A . 8 LYS HZ2 1 1 16 3986 1 1 8 LYS HZ3 H 13.537 -4.564 -5.993 1.00 . A A . 8 LYS HZ3 1 1 16 3987 1 1 8 LYS N N 10.272 -10.224 -4.075 1.00 . A A . 8 LYS N 1 1 16 3988 1 1 8 LYS NZ N 12.930 -5.270 -5.531 1.00 . A A . 8 LYS NZ 1 1 16 3989 1 1 8 LYS O O 11.591 -12.501 -2.100 1.00 . A A . 8 LYS O 1 1 16 3990 1 1 9 CYS C C 8.865 -11.430 0.457 1.00 . A A . 9 CYS C 1 1 16 3991 1 1 9 CYS CA C 10.360 -11.460 0.155 1.00 . A A . 9 CYS CA 1 1 16 3992 1 1 9 CYS CB C 11.142 -10.866 1.327 1.00 . A A . 9 CYS CB 1 1 16 3993 1 1 9 CYS H H 10.412 -9.784 -1.137 1.00 . A A . 9 CYS H 1 1 16 3994 1 1 9 CYS HA H 10.665 -12.485 0.012 1.00 . A A . 9 CYS HA 1 1 16 3995 1 1 9 CYS HB2 H 11.467 -9.870 1.066 1.00 . A A . 9 CYS HB2 1 1 16 3996 1 1 9 CYS HB3 H 10.494 -10.811 2.190 1.00 . A A . 9 CYS HB3 1 1 16 3997 1 1 9 CYS HG H 13.674 -11.152 1.383 1.00 . A A . 9 CYS HG 1 1 16 3998 1 1 9 CYS N N 10.657 -10.730 -1.073 1.00 . A A . 9 CYS N 1 1 16 3999 1 1 9 CYS O O 8.231 -10.374 0.473 1.00 . A A . 9 CYS O 1 1 16 4000 1 1 9 CYS SG S 12.606 -11.817 1.795 1.00 . A A . 9 CYS SG 1 1 16 4001 1 1 10 PRO C C 6.502 -12.186 2.374 1.00 . A A . 10 PRO C 1 1 16 4002 1 1 10 PRO CA C 6.859 -12.751 1.004 1.00 . A A . 10 PRO CA 1 1 16 4003 1 1 10 PRO CB C 6.633 -14.265 0.974 1.00 . A A . 10 PRO CB 1 1 16 4004 1 1 10 PRO CD C 8.981 -13.914 0.696 1.00 . A A . 10 PRO CD 1 1 16 4005 1 1 10 PRO CG C 7.966 -14.853 1.286 1.00 . A A . 10 PRO CG 1 1 16 4006 1 1 10 PRO HA H 6.246 -12.279 0.250 1.00 . A A . 10 PRO HA 1 1 16 4007 1 1 10 PRO HB2 H 5.897 -14.536 1.718 1.00 . A A . 10 PRO HB2 1 1 16 4008 1 1 10 PRO HB3 H 6.289 -14.562 -0.005 1.00 . A A . 10 PRO HB3 1 1 16 4009 1 1 10 PRO HD2 H 9.866 -13.879 1.313 1.00 . A A . 10 PRO HD2 1 1 16 4010 1 1 10 PRO HD3 H 9.232 -14.213 -0.311 1.00 . A A . 10 PRO HD3 1 1 16 4011 1 1 10 PRO HG2 H 8.096 -14.923 2.355 1.00 . A A . 10 PRO HG2 1 1 16 4012 1 1 10 PRO HG3 H 8.051 -15.829 0.831 1.00 . A A . 10 PRO HG3 1 1 16 4013 1 1 10 PRO N N 8.286 -12.615 0.699 1.00 . A A . 10 PRO N 1 1 16 4014 1 1 10 PRO O O 5.330 -12.130 2.748 1.00 . A A . 10 PRO O 1 1 16 4015 1 1 11 LEU C C 7.626 -9.712 4.464 1.00 . A A . 11 LEU C 1 1 16 4016 1 1 11 LEU CA C 7.312 -11.204 4.449 1.00 . A A . 11 LEU CA 1 1 16 4017 1 1 11 LEU CB C 8.186 -11.931 5.473 1.00 . A A . 11 LEU CB 1 1 16 4018 1 1 11 LEU CD1 C 10.587 -12.327 6.073 1.00 . A A . 11 LEU CD1 1 1 16 4019 1 1 11 LEU CD2 C 9.440 -13.845 4.450 1.00 . A A . 11 LEU CD2 1 1 16 4020 1 1 11 LEU CG C 9.545 -12.419 4.970 1.00 . A A . 11 LEU CG 1 1 16 4021 1 1 11 LEU H H 8.430 -11.836 2.767 1.00 . A A . 11 LEU H 1 1 16 4022 1 1 11 LEU HA H 6.274 -11.344 4.710 1.00 . A A . 11 LEU HA 1 1 16 4023 1 1 11 LEU HB2 H 8.362 -11.256 6.296 1.00 . A A . 11 LEU HB2 1 1 16 4024 1 1 11 LEU HB3 H 7.635 -12.791 5.826 1.00 . A A . 11 LEU HB3 1 1 16 4025 1 1 11 LEU HD11 H 10.174 -12.715 6.992 1.00 . A A . 11 LEU HD11 1 1 16 4026 1 1 11 LEU HD12 H 10.872 -11.295 6.214 1.00 . A A . 11 LEU HD12 1 1 16 4027 1 1 11 LEU HD13 H 11.456 -12.906 5.796 1.00 . A A . 11 LEU HD13 1 1 16 4028 1 1 11 LEU HD21 H 8.407 -14.159 4.465 1.00 . A A . 11 LEU HD21 1 1 16 4029 1 1 11 LEU HD22 H 10.026 -14.500 5.077 1.00 . A A . 11 LEU HD22 1 1 16 4030 1 1 11 LEU HD23 H 9.815 -13.887 3.437 1.00 . A A . 11 LEU HD23 1 1 16 4031 1 1 11 LEU HG H 9.867 -11.787 4.154 1.00 . A A . 11 LEU HG 1 1 16 4032 1 1 11 LEU N N 7.519 -11.767 3.119 1.00 . A A . 11 LEU N 1 1 16 4033 1 1 11 LEU O O 7.697 -9.092 5.526 1.00 . A A . 11 LEU O 1 1 16 4034 1 1 12 PHE C C 6.844 -6.908 2.923 1.00 . A A . 12 PHE C 1 1 16 4035 1 1 12 PHE CA C 8.116 -7.719 3.155 1.00 . A A . 12 PHE CA 1 1 16 4036 1 1 12 PHE CB C 9.101 -7.485 2.008 1.00 . A A . 12 PHE CB 1 1 16 4037 1 1 12 PHE CD1 C 10.982 -8.428 3.374 1.00 . A A . 12 PHE CD1 1 1 16 4038 1 1 12 PHE CD2 C 11.448 -6.605 1.910 1.00 . A A . 12 PHE CD2 1 1 16 4039 1 1 12 PHE CE1 C 12.305 -8.451 3.773 1.00 . A A . 12 PHE CE1 1 1 16 4040 1 1 12 PHE CE2 C 12.773 -6.623 2.304 1.00 . A A . 12 PHE CE2 1 1 16 4041 1 1 12 PHE CG C 10.539 -7.506 2.439 1.00 . A A . 12 PHE CG 1 1 16 4042 1 1 12 PHE CZ C 13.202 -7.547 3.238 1.00 . A A . 12 PHE CZ 1 1 16 4043 1 1 12 PHE H H 7.741 -9.686 2.468 1.00 . A A . 12 PHE H 1 1 16 4044 1 1 12 PHE HA H 8.570 -7.396 4.080 1.00 . A A . 12 PHE HA 1 1 16 4045 1 1 12 PHE HB2 H 8.966 -8.256 1.265 1.00 . A A . 12 PHE HB2 1 1 16 4046 1 1 12 PHE HB3 H 8.901 -6.522 1.563 1.00 . A A . 12 PHE HB3 1 1 16 4047 1 1 12 PHE HD1 H 10.281 -9.136 3.794 1.00 . A A . 12 PHE HD1 1 1 16 4048 1 1 12 PHE HD2 H 11.115 -5.881 1.181 1.00 . A A . 12 PHE HD2 1 1 16 4049 1 1 12 PHE HE1 H 12.637 -9.175 4.503 1.00 . A A . 12 PHE HE1 1 1 16 4050 1 1 12 PHE HE2 H 13.472 -5.915 1.885 1.00 . A A . 12 PHE HE2 1 1 16 4051 1 1 12 PHE HZ H 14.236 -7.564 3.547 1.00 . A A . 12 PHE HZ 1 1 16 4052 1 1 12 PHE N N 7.811 -9.139 3.279 1.00 . A A . 12 PHE N 1 1 16 4053 1 1 12 PHE O O 6.677 -6.281 1.877 1.00 . A A . 12 PHE O 1 1 16 4054 1 1 13 GLY C C 4.804 -4.788 4.354 1.00 . A A . 13 GLY C 1 1 16 4055 1 1 13 GLY CA C 4.703 -6.191 3.789 1.00 . A A . 13 GLY CA 1 1 16 4056 1 1 13 GLY H H 6.136 -7.444 4.717 1.00 . A A . 13 GLY H 1 1 16 4057 1 1 13 GLY HA2 H 4.431 -6.129 2.746 1.00 . A A . 13 GLY HA2 1 1 16 4058 1 1 13 GLY HA3 H 3.931 -6.726 4.321 1.00 . A A . 13 GLY HA3 1 1 16 4059 1 1 13 GLY N N 5.949 -6.927 3.906 1.00 . A A . 13 GLY N 1 1 16 4060 1 1 13 GLY O O 3.792 -4.168 4.682 1.00 . A A . 13 GLY O 1 1 16 4061 1 1 14 LYS C C 6.921 -2.054 3.956 1.00 . A A . 14 LYS C 1 1 16 4062 1 1 14 LYS CA C 6.258 -2.946 5.001 1.00 . A A . 14 LYS CA 1 1 16 4063 1 1 14 LYS CB C 7.131 -3.016 6.256 1.00 . A A . 14 LYS CB 1 1 16 4064 1 1 14 LYS CD C 9.082 -4.109 5.112 1.00 . A A . 14 LYS CD 1 1 16 4065 1 1 14 LYS CE C 10.472 -4.559 5.538 1.00 . A A . 14 LYS CE 1 1 16 4066 1 1 14 LYS CG C 8.094 -4.191 6.263 1.00 . A A . 14 LYS CG 1 1 16 4067 1 1 14 LYS H H 6.796 -4.827 4.192 1.00 . A A . 14 LYS H 1 1 16 4068 1 1 14 LYS HA H 5.300 -2.523 5.262 1.00 . A A . 14 LYS HA 1 1 16 4069 1 1 14 LYS HB2 H 7.707 -2.105 6.330 1.00 . A A . 14 LYS HB2 1 1 16 4070 1 1 14 LYS HB3 H 6.490 -3.097 7.122 1.00 . A A . 14 LYS HB3 1 1 16 4071 1 1 14 LYS HD2 H 8.741 -4.746 4.310 1.00 . A A . 14 LYS HD2 1 1 16 4072 1 1 14 LYS HD3 H 9.134 -3.087 4.766 1.00 . A A . 14 LYS HD3 1 1 16 4073 1 1 14 LYS HE2 H 10.563 -4.439 6.606 1.00 . A A . 14 LYS HE2 1 1 16 4074 1 1 14 LYS HE3 H 10.593 -5.601 5.281 1.00 . A A . 14 LYS HE3 1 1 16 4075 1 1 14 LYS HG2 H 8.641 -4.191 7.194 1.00 . A A . 14 LYS HG2 1 1 16 4076 1 1 14 LYS HG3 H 7.528 -5.108 6.176 1.00 . A A . 14 LYS HG3 1 1 16 4077 1 1 14 LYS HZ1 H 11.340 -2.750 4.956 1.00 . A A . 14 LYS HZ1 1 1 16 4078 1 1 14 LYS HZ2 H 11.588 -4.013 3.859 1.00 . A A . 14 LYS HZ2 1 1 16 4079 1 1 14 LYS HZ3 H 12.462 -3.967 5.307 1.00 . A A . 14 LYS HZ3 1 1 16 4080 1 1 14 LYS N N 6.028 -4.285 4.471 1.00 . A A . 14 LYS N 1 1 16 4081 1 1 14 LYS NZ N 11.540 -3.766 4.868 1.00 . A A . 14 LYS NZ 1 1 16 4082 1 1 14 LYS O O 6.877 -0.828 4.055 1.00 . A A . 14 LYS O 1 1 16 4083 1 1 15 GLY C C 7.573 -2.156 0.544 1.00 . A A . 15 GLY C 1 1 16 4084 1 1 15 GLY CA C 8.197 -1.924 1.906 1.00 . A A . 15 GLY CA 1 1 16 4085 1 1 15 GLY H H 7.538 -3.658 2.928 1.00 . A A . 15 GLY H 1 1 16 4086 1 1 15 GLY HA2 H 8.139 -0.872 2.143 1.00 . A A . 15 GLY HA2 1 1 16 4087 1 1 15 GLY HA3 H 9.235 -2.218 1.868 1.00 . A A . 15 GLY HA3 1 1 16 4088 1 1 15 GLY N N 7.535 -2.678 2.955 1.00 . A A . 15 GLY N 1 1 16 4089 1 1 15 GLY O O 6.839 -1.309 0.038 1.00 . A A . 15 GLY O 1 1 16 4090 1 1 16 GLY C C 8.396 -3.714 -2.427 1.00 . A A . 16 GLY C 1 1 16 4091 1 1 16 GLY CA C 7.324 -3.626 -1.359 1.00 . A A . 16 GLY CA 1 1 16 4092 1 1 16 GLY H H 8.460 -3.945 0.399 1.00 . A A . 16 GLY H 1 1 16 4093 1 1 16 GLY HA2 H 6.809 -4.574 -1.302 1.00 . A A . 16 GLY HA2 1 1 16 4094 1 1 16 GLY HA3 H 6.617 -2.860 -1.639 1.00 . A A . 16 GLY HA3 1 1 16 4095 1 1 16 GLY N N 7.868 -3.307 -0.052 1.00 . A A . 16 GLY N 1 1 16 4096 1 1 16 GLY O O 8.498 -4.718 -3.132 1.00 . A A . 16 GLY O 1 1 17 4097 1 1 1 VAL C C 3.804 -1.157 -0.891 1.00 . A A . 1 VAL C 1 1 17 4098 1 1 1 VAL CA C 2.814 -0.022 -1.124 1.00 . A A . 1 VAL CA 1 1 17 4099 1 1 1 VAL CB C 2.926 0.451 -2.585 1.00 . A A . 1 VAL CB 1 1 17 4100 1 1 1 VAL CG1 C 2.589 -0.683 -3.541 1.00 . A A . 1 VAL CG1 1 1 17 4101 1 1 1 VAL CG2 C 2.021 1.650 -2.828 1.00 . A A . 1 VAL CG2 1 1 17 4102 1 1 1 VAL H1 H 3.942 1.211 0.175 1.00 . A A . 1 VAL H1 1 1 17 4103 1 1 1 VAL HA H 1.811 -0.392 -0.963 1.00 . A A . 1 VAL HA 1 1 17 4104 1 1 1 VAL HB H 3.946 0.754 -2.767 1.00 . A A . 1 VAL HB 1 1 17 4105 1 1 1 VAL HG11 H 1.890 -1.357 -3.067 1.00 . A A . 1 VAL HG11 1 1 17 4106 1 1 1 VAL HG12 H 2.146 -0.278 -4.440 1.00 . A A . 1 VAL HG12 1 1 17 4107 1 1 1 VAL HG13 H 3.491 -1.220 -3.794 1.00 . A A . 1 VAL HG13 1 1 17 4108 1 1 1 VAL HG21 H 2.493 2.541 -2.443 1.00 . A A . 1 VAL HG21 1 1 17 4109 1 1 1 VAL HG22 H 1.850 1.762 -3.888 1.00 . A A . 1 VAL HG22 1 1 17 4110 1 1 1 VAL HG23 H 1.077 1.497 -2.325 1.00 . A A . 1 VAL HG23 1 1 17 4111 1 1 1 VAL N N 3.044 1.075 -0.191 1.00 . A A . 1 VAL N 1 1 17 4112 1 1 1 VAL O O 4.995 -1.022 -1.168 1.00 . A A . 1 VAL O 1 1 17 4113 1 1 2 ALA C C 3.660 -4.656 -0.895 1.00 . A A . 2 ALA C 1 1 17 4114 1 1 2 ALA CA C 4.142 -3.438 -0.114 1.00 . A A . 2 ALA CA 1 1 17 4115 1 1 2 ALA CB C 4.165 -3.740 1.377 1.00 . A A . 2 ALA CB 1 1 17 4116 1 1 2 ALA H H 2.344 -2.325 -0.182 1.00 . A A . 2 ALA H 1 1 17 4117 1 1 2 ALA HA H 5.149 -3.200 -0.424 1.00 . A A . 2 ALA HA 1 1 17 4118 1 1 2 ALA HB1 H 4.694 -4.667 1.547 1.00 . A A . 2 ALA HB1 1 1 17 4119 1 1 2 ALA HB2 H 4.666 -2.939 1.899 1.00 . A A . 2 ALA HB2 1 1 17 4120 1 1 2 ALA HB3 H 3.153 -3.831 1.741 1.00 . A A . 2 ALA HB3 1 1 17 4121 1 1 2 ALA N N 3.302 -2.277 -0.382 1.00 . A A . 2 ALA N 1 1 17 4122 1 1 2 ALA O O 3.044 -5.562 -0.333 1.00 . A A . 2 ALA O 1 1 17 4123 1 1 3 ARG C C 4.696 -6.745 -3.276 1.00 . A A . 3 ARG C 1 1 17 4124 1 1 3 ARG CA C 3.538 -5.777 -3.052 1.00 . A A . 3 ARG CA 1 1 17 4125 1 1 3 ARG CB C 3.033 -5.249 -4.396 1.00 . A A . 3 ARG CB 1 1 17 4126 1 1 3 ARG CD C 3.277 -6.403 -6.615 1.00 . A A . 3 ARG CD 1 1 17 4127 1 1 3 ARG CG C 2.494 -6.334 -5.313 1.00 . A A . 3 ARG CG 1 1 17 4128 1 1 3 ARG CZ C 2.785 -6.457 -9.023 1.00 . A A . 3 ARG CZ 1 1 17 4129 1 1 3 ARG H H 4.438 -3.920 -2.584 1.00 . A A . 3 ARG H 1 1 17 4130 1 1 3 ARG HA H 2.735 -6.303 -2.557 1.00 . A A . 3 ARG HA 1 1 17 4131 1 1 3 ARG HB2 H 2.243 -4.536 -4.215 1.00 . A A . 3 ARG HB2 1 1 17 4132 1 1 3 ARG HB3 H 3.847 -4.752 -4.902 1.00 . A A . 3 ARG HB3 1 1 17 4133 1 1 3 ARG HD2 H 3.793 -5.466 -6.759 1.00 . A A . 3 ARG HD2 1 1 17 4134 1 1 3 ARG HD3 H 3.998 -7.204 -6.543 1.00 . A A . 3 ARG HD3 1 1 17 4135 1 1 3 ARG HE H 1.501 -6.971 -7.586 1.00 . A A . 3 ARG HE 1 1 17 4136 1 1 3 ARG HG2 H 2.568 -7.287 -4.810 1.00 . A A . 3 ARG HG2 1 1 17 4137 1 1 3 ARG HG3 H 1.459 -6.122 -5.536 1.00 . A A . 3 ARG HG3 1 1 17 4138 1 1 3 ARG HH11 H 4.648 -5.837 -8.550 1.00 . A A . 3 ARG HH11 1 1 17 4139 1 1 3 ARG HH12 H 4.288 -5.880 -10.244 1.00 . A A . 3 ARG HH12 1 1 17 4140 1 1 3 ARG HH21 H 1.015 -7.032 -9.813 1.00 . A A . 3 ARG HH21 1 1 17 4141 1 1 3 ARG HH22 H 2.221 -6.559 -10.962 1.00 . A A . 3 ARG HH22 1 1 17 4142 1 1 3 ARG N N 3.944 -4.671 -2.193 1.00 . A A . 3 ARG N 1 1 17 4143 1 1 3 ARG NE N 2.409 -6.648 -7.763 1.00 . A A . 3 ARG NE 1 1 17 4144 1 1 3 ARG NH1 N 4.007 -6.022 -9.295 1.00 . A A . 3 ARG NH1 1 1 17 4145 1 1 3 ARG NH2 N 1.938 -6.703 -10.014 1.00 . A A . 3 ARG NH2 1 1 17 4146 1 1 3 ARG O O 4.513 -7.833 -3.821 1.00 . A A . 3 ARG O 1 1 17 4147 1 1 4 GLY C C 6.875 -8.558 -2.401 1.00 . A A . 4 GLY C 1 1 17 4148 1 1 4 GLY CA C 7.059 -7.184 -3.014 1.00 . A A . 4 GLY CA 1 1 17 4149 1 1 4 GLY H H 5.976 -5.464 -2.423 1.00 . A A . 4 GLY H 1 1 17 4150 1 1 4 GLY HA2 H 7.264 -7.296 -4.069 1.00 . A A . 4 GLY HA2 1 1 17 4151 1 1 4 GLY HA3 H 7.904 -6.703 -2.543 1.00 . A A . 4 GLY HA3 1 1 17 4152 1 1 4 GLY N N 5.889 -6.341 -2.851 1.00 . A A . 4 GLY N 1 1 17 4153 1 1 4 GLY O O 7.675 -9.463 -2.638 1.00 . A A . 4 GLY O 1 1 17 4154 1 1 5 TRP C C 5.890 -11.156 -1.871 1.00 . A A . 5 TRP C 1 1 17 4155 1 1 5 TRP CA C 5.534 -9.987 -0.960 1.00 . A A . 5 TRP CA 1 1 17 4156 1 1 5 TRP CB C 4.058 -10.063 -0.566 1.00 . A A . 5 TRP CB 1 1 17 4157 1 1 5 TRP CD1 C 3.927 -7.885 0.779 1.00 . A A . 5 TRP CD1 1 1 17 4158 1 1 5 TRP CD2 C 3.112 -9.677 1.846 1.00 . A A . 5 TRP CD2 1 1 17 4159 1 1 5 TRP CE2 C 2.982 -8.555 2.688 1.00 . A A . 5 TRP CE2 1 1 17 4160 1 1 5 TRP CE3 C 2.664 -10.919 2.306 1.00 . A A . 5 TRP CE3 1 1 17 4161 1 1 5 TRP CG C 3.718 -9.227 0.630 1.00 . A A . 5 TRP CG 1 1 17 4162 1 1 5 TRP CH2 C 1.994 -9.868 4.385 1.00 . A A . 5 TRP CH2 1 1 17 4163 1 1 5 TRP CZ2 C 2.424 -8.640 3.961 1.00 . A A . 5 TRP CZ2 1 1 17 4164 1 1 5 TRP CZ3 C 2.111 -11.001 3.569 1.00 . A A . 5 TRP CZ3 1 1 17 4165 1 1 5 TRP H H 5.218 -7.954 -1.460 1.00 . A A . 5 TRP H 1 1 17 4166 1 1 5 TRP HA H 6.138 -10.045 -0.066 1.00 . A A . 5 TRP HA 1 1 17 4167 1 1 5 TRP HB2 H 3.453 -9.722 -1.393 1.00 . A A . 5 TRP HB2 1 1 17 4168 1 1 5 TRP HB3 H 3.805 -11.089 -0.340 1.00 . A A . 5 TRP HB3 1 1 17 4169 1 1 5 TRP HD1 H 4.375 -7.253 0.028 1.00 . A A . 5 TRP HD1 1 1 17 4170 1 1 5 TRP HE1 H 3.527 -6.557 2.356 1.00 . A A . 5 TRP HE1 1 1 17 4171 1 1 5 TRP HE3 H 2.745 -11.804 1.692 1.00 . A A . 5 TRP HE3 1 1 17 4172 1 1 5 TRP HH2 H 1.556 -9.979 5.365 1.00 . A A . 5 TRP HH2 1 1 17 4173 1 1 5 TRP HZ2 H 2.326 -7.775 4.601 1.00 . A A . 5 TRP HZ2 1 1 17 4174 1 1 5 TRP HZ3 H 1.760 -11.953 3.942 1.00 . A A . 5 TRP HZ3 1 1 17 4175 1 1 5 TRP N N 5.820 -8.714 -1.610 1.00 . A A . 5 TRP N 1 1 17 4176 1 1 5 TRP NE1 N 3.487 -7.475 2.014 1.00 . A A . 5 TRP NE1 1 1 17 4177 1 1 5 TRP O O 6.924 -11.801 -1.695 1.00 . A A . 5 TRP O 1 1 17 4178 1 1 6 LYS C C 6.467 -12.235 -4.667 1.00 . A A . 6 LYS C 1 1 17 4179 1 1 6 LYS CA C 5.253 -12.516 -3.787 1.00 . A A . 6 LYS CA 1 1 17 4180 1 1 6 LYS CB C 4.015 -12.725 -4.662 1.00 . A A . 6 LYS CB 1 1 17 4181 1 1 6 LYS CD C 4.603 -12.663 -7.103 1.00 . A A . 6 LYS CD 1 1 17 4182 1 1 6 LYS CE C 5.816 -13.173 -7.866 1.00 . A A . 6 LYS CE 1 1 17 4183 1 1 6 LYS CG C 4.283 -13.548 -5.910 1.00 . A A . 6 LYS CG 1 1 17 4184 1 1 6 LYS H H 4.222 -10.875 -2.936 1.00 . A A . 6 LYS H 1 1 17 4185 1 1 6 LYS HA H 5.437 -13.413 -3.217 1.00 . A A . 6 LYS HA 1 1 17 4186 1 1 6 LYS HB2 H 3.259 -13.230 -4.079 1.00 . A A . 6 LYS HB2 1 1 17 4187 1 1 6 LYS HB3 H 3.637 -11.760 -4.967 1.00 . A A . 6 LYS HB3 1 1 17 4188 1 1 6 LYS HD2 H 3.753 -12.649 -7.769 1.00 . A A . 6 LYS HD2 1 1 17 4189 1 1 6 LYS HD3 H 4.805 -11.660 -6.752 1.00 . A A . 6 LYS HD3 1 1 17 4190 1 1 6 LYS HE2 H 6.636 -12.487 -7.713 1.00 . A A . 6 LYS HE2 1 1 17 4191 1 1 6 LYS HE3 H 6.084 -14.146 -7.480 1.00 . A A . 6 LYS HE3 1 1 17 4192 1 1 6 LYS HG2 H 5.123 -14.202 -5.725 1.00 . A A . 6 LYS HG2 1 1 17 4193 1 1 6 LYS HG3 H 3.407 -14.139 -6.136 1.00 . A A . 6 LYS HG3 1 1 17 4194 1 1 6 LYS HZ1 H 4.531 -13.156 -9.512 1.00 . A A . 6 LYS HZ1 1 1 17 4195 1 1 6 LYS HZ2 H 5.832 -14.226 -9.669 1.00 . A A . 6 LYS HZ2 1 1 17 4196 1 1 6 LYS HZ3 H 6.080 -12.562 -9.846 1.00 . A A . 6 LYS HZ3 1 1 17 4197 1 1 6 LYS N N 5.029 -11.425 -2.846 1.00 . A A . 6 LYS N 1 1 17 4198 1 1 6 LYS NZ N 5.546 -13.287 -9.325 1.00 . A A . 6 LYS NZ 1 1 17 4199 1 1 6 LYS O O 7.163 -13.156 -5.094 1.00 . A A . 6 LYS O 1 1 17 4200 1 1 7 ARG C C 9.154 -11.121 -5.208 1.00 . A A . 7 ARG C 1 1 17 4201 1 1 7 ARG CA C 7.848 -10.555 -5.759 1.00 . A A . 7 ARG CA 1 1 17 4202 1 1 7 ARG CB C 7.934 -9.030 -5.838 1.00 . A A . 7 ARG CB 1 1 17 4203 1 1 7 ARG CD C 6.849 -6.891 -6.589 1.00 . A A . 7 ARG CD 1 1 17 4204 1 1 7 ARG CG C 6.646 -8.370 -6.302 1.00 . A A . 7 ARG CG 1 1 17 4205 1 1 7 ARG CZ C 7.279 -5.464 -8.544 1.00 . A A . 7 ARG CZ 1 1 17 4206 1 1 7 ARG H H 6.127 -10.267 -4.562 1.00 . A A . 7 ARG H 1 1 17 4207 1 1 7 ARG HA H 7.690 -10.949 -6.752 1.00 . A A . 7 ARG HA 1 1 17 4208 1 1 7 ARG HB2 H 8.178 -8.643 -4.859 1.00 . A A . 7 ARG HB2 1 1 17 4209 1 1 7 ARG HB3 H 8.720 -8.760 -6.528 1.00 . A A . 7 ARG HB3 1 1 17 4210 1 1 7 ARG HD2 H 6.052 -6.334 -6.120 1.00 . A A . 7 ARG HD2 1 1 17 4211 1 1 7 ARG HD3 H 7.797 -6.584 -6.172 1.00 . A A . 7 ARG HD3 1 1 17 4212 1 1 7 ARG HE H 6.505 -7.300 -8.622 1.00 . A A . 7 ARG HE 1 1 17 4213 1 1 7 ARG HG2 H 6.308 -8.857 -7.205 1.00 . A A . 7 ARG HG2 1 1 17 4214 1 1 7 ARG HG3 H 5.898 -8.479 -5.530 1.00 . A A . 7 ARG HG3 1 1 17 4215 1 1 7 ARG HH11 H 7.775 -4.642 -6.766 1.00 . A A . 7 ARG HH11 1 1 17 4216 1 1 7 ARG HH12 H 8.073 -3.647 -8.153 1.00 . A A . 7 ARG HH12 1 1 17 4217 1 1 7 ARG HH21 H 6.893 -5.999 -10.455 1.00 . A A . 7 ARG HH21 1 1 17 4218 1 1 7 ARG HH22 H 7.570 -4.420 -10.250 1.00 . A A . 7 ARG HH22 1 1 17 4219 1 1 7 ARG N N 6.718 -10.956 -4.931 1.00 . A A . 7 ARG N 1 1 17 4220 1 1 7 ARG NE N 6.847 -6.606 -8.021 1.00 . A A . 7 ARG NE 1 1 17 4221 1 1 7 ARG NH1 N 7.747 -4.505 -7.756 1.00 . A A . 7 ARG NH1 1 1 17 4222 1 1 7 ARG NH2 N 7.245 -5.279 -9.858 1.00 . A A . 7 ARG NH2 1 1 17 4223 1 1 7 ARG O O 9.677 -12.112 -5.717 1.00 . A A . 7 ARG O 1 1 17 4224 1 1 8 LYS C C 10.639 -11.799 -2.327 1.00 . A A . 8 LYS C 1 1 17 4225 1 1 8 LYS CA C 10.919 -10.922 -3.544 1.00 . A A . 8 LYS CA 1 1 17 4226 1 1 8 LYS CB C 11.761 -9.713 -3.131 1.00 . A A . 8 LYS CB 1 1 17 4227 1 1 8 LYS CD C 12.807 -7.536 -3.821 1.00 . A A . 8 LYS CD 1 1 17 4228 1 1 8 LYS CE C 14.193 -7.774 -3.242 1.00 . A A . 8 LYS CE 1 1 17 4229 1 1 8 LYS CG C 12.173 -8.832 -4.298 1.00 . A A . 8 LYS CG 1 1 17 4230 1 1 8 LYS H H 9.211 -9.698 -3.804 1.00 . A A . 8 LYS H 1 1 17 4231 1 1 8 LYS HA H 11.468 -11.501 -4.271 1.00 . A A . 8 LYS HA 1 1 17 4232 1 1 8 LYS HB2 H 11.192 -9.113 -2.436 1.00 . A A . 8 LYS HB2 1 1 17 4233 1 1 8 LYS HB3 H 12.657 -10.064 -2.639 1.00 . A A . 8 LYS HB3 1 1 17 4234 1 1 8 LYS HD2 H 12.891 -6.857 -4.657 1.00 . A A . 8 LYS HD2 1 1 17 4235 1 1 8 LYS HD3 H 12.179 -7.096 -3.059 1.00 . A A . 8 LYS HD3 1 1 17 4236 1 1 8 LYS HE2 H 14.206 -8.738 -2.757 1.00 . A A . 8 LYS HE2 1 1 17 4237 1 1 8 LYS HE3 H 14.912 -7.768 -4.048 1.00 . A A . 8 LYS HE3 1 1 17 4238 1 1 8 LYS HG2 H 12.886 -9.366 -4.907 1.00 . A A . 8 LYS HG2 1 1 17 4239 1 1 8 LYS HG3 H 11.297 -8.598 -4.886 1.00 . A A . 8 LYS HG3 1 1 17 4240 1 1 8 LYS HZ1 H 14.695 -7.154 -1.311 1.00 . A A . 8 LYS HZ1 1 1 17 4241 1 1 8 LYS HZ2 H 13.821 -6.006 -2.195 1.00 . A A . 8 LYS HZ2 1 1 17 4242 1 1 8 LYS HZ3 H 15.457 -6.268 -2.535 1.00 . A A . 8 LYS HZ3 1 1 17 4243 1 1 8 LYS N N 9.675 -10.483 -4.165 1.00 . A A . 8 LYS N 1 1 17 4244 1 1 8 LYS NZ N 14.568 -6.727 -2.251 1.00 . A A . 8 LYS NZ 1 1 17 4245 1 1 8 LYS O O 10.736 -13.025 -2.399 1.00 . A A . 8 LYS O 1 1 17 4246 1 1 9 CYS C C 8.586 -11.577 0.507 1.00 . A A . 9 CYS C 1 1 17 4247 1 1 9 CYS CA C 9.997 -11.887 0.019 1.00 . A A . 9 CYS CA 1 1 17 4248 1 1 9 CYS CB C 11.015 -11.527 1.102 1.00 . A A . 9 CYS CB 1 1 17 4249 1 1 9 CYS H H 10.232 -10.186 -1.219 1.00 . A A . 9 CYS H 1 1 17 4250 1 1 9 CYS HA H 10.068 -12.943 -0.193 1.00 . A A . 9 CYS HA 1 1 17 4251 1 1 9 CYS HB2 H 11.491 -10.593 0.841 1.00 . A A . 9 CYS HB2 1 1 17 4252 1 1 9 CYS HB3 H 10.500 -11.410 2.044 1.00 . A A . 9 CYS HB3 1 1 17 4253 1 1 9 CYS HG H 11.738 -13.913 1.637 1.00 . A A . 9 CYS HG 1 1 17 4254 1 1 9 CYS N N 10.292 -11.164 -1.214 1.00 . A A . 9 CYS N 1 1 17 4255 1 1 9 CYS O O 8.179 -10.420 0.612 1.00 . A A . 9 CYS O 1 1 17 4256 1 1 9 CYS SG S 12.316 -12.761 1.331 1.00 . A A . 9 CYS SG 1 1 17 4257 1 1 10 PRO C C 6.372 -11.923 2.700 1.00 . A A . 10 PRO C 1 1 17 4258 1 1 10 PRO CA C 6.440 -12.501 1.291 1.00 . A A . 10 PRO CA 1 1 17 4259 1 1 10 PRO CB C 5.919 -13.941 1.278 1.00 . A A . 10 PRO CB 1 1 17 4260 1 1 10 PRO CD C 8.238 -14.043 0.709 1.00 . A A . 10 PRO CD 1 1 17 4261 1 1 10 PRO CG C 7.138 -14.786 1.414 1.00 . A A . 10 PRO CG 1 1 17 4262 1 1 10 PRO HA H 5.845 -11.895 0.625 1.00 . A A . 10 PRO HA 1 1 17 4263 1 1 10 PRO HB2 H 5.240 -14.088 2.107 1.00 . A A . 10 PRO HB2 1 1 17 4264 1 1 10 PRO HB3 H 5.407 -14.133 0.347 1.00 . A A . 10 PRO HB3 1 1 17 4265 1 1 10 PRO HD2 H 9.182 -14.201 1.210 1.00 . A A . 10 PRO HD2 1 1 17 4266 1 1 10 PRO HD3 H 8.301 -14.352 -0.324 1.00 . A A . 10 PRO HD3 1 1 17 4267 1 1 10 PRO HG2 H 7.381 -14.915 2.457 1.00 . A A . 10 PRO HG2 1 1 17 4268 1 1 10 PRO HG3 H 6.973 -15.745 0.944 1.00 . A A . 10 PRO HG3 1 1 17 4269 1 1 10 PRO N N 7.819 -12.635 0.811 1.00 . A A . 10 PRO N 1 1 17 4270 1 1 10 PRO O O 5.287 -11.666 3.225 1.00 . A A . 10 PRO O 1 1 17 4271 1 1 11 LEU C C 8.044 -9.709 4.629 1.00 . A A . 11 LEU C 1 1 17 4272 1 1 11 LEU CA C 7.607 -11.169 4.658 1.00 . A A . 11 LEU CA 1 1 17 4273 1 1 11 LEU CB C 8.577 -11.987 5.512 1.00 . A A . 11 LEU CB 1 1 17 4274 1 1 11 LEU CD1 C 10.575 -10.673 6.264 1.00 . A A . 11 LEU CD1 1 1 17 4275 1 1 11 LEU CD2 C 10.866 -13.005 5.407 1.00 . A A . 11 LEU CD2 1 1 17 4276 1 1 11 LEU CG C 10.065 -11.717 5.283 1.00 . A A . 11 LEU CG 1 1 17 4277 1 1 11 LEU H H 8.366 -11.943 2.840 1.00 . A A . 11 LEU H 1 1 17 4278 1 1 11 LEU HA H 6.620 -11.228 5.093 1.00 . A A . 11 LEU HA 1 1 17 4279 1 1 11 LEU HB2 H 8.360 -11.781 6.549 1.00 . A A . 11 LEU HB2 1 1 17 4280 1 1 11 LEU HB3 H 8.395 -13.033 5.309 1.00 . A A . 11 LEU HB3 1 1 17 4281 1 1 11 LEU HD11 H 9.765 -10.352 6.901 1.00 . A A . 11 LEU HD11 1 1 17 4282 1 1 11 LEU HD12 H 10.961 -9.825 5.718 1.00 . A A . 11 LEU HD12 1 1 17 4283 1 1 11 LEU HD13 H 11.362 -11.100 6.867 1.00 . A A . 11 LEU HD13 1 1 17 4284 1 1 11 LEU HD21 H 10.840 -13.347 6.431 1.00 . A A . 11 LEU HD21 1 1 17 4285 1 1 11 LEU HD22 H 11.889 -12.821 5.115 1.00 . A A . 11 LEU HD22 1 1 17 4286 1 1 11 LEU HD23 H 10.438 -13.759 4.763 1.00 . A A . 11 LEU HD23 1 1 17 4287 1 1 11 LEU HG H 10.204 -11.331 4.282 1.00 . A A . 11 LEU HG 1 1 17 4288 1 1 11 LEU N N 7.535 -11.719 3.309 1.00 . A A . 11 LEU N 1 1 17 4289 1 1 11 LEU O O 8.226 -9.083 5.673 1.00 . A A . 11 LEU O 1 1 17 4290 1 1 12 PHE C C 7.415 -6.853 3.220 1.00 . A A . 12 PHE C 1 1 17 4291 1 1 12 PHE CA C 8.625 -7.782 3.259 1.00 . A A . 12 PHE CA 1 1 17 4292 1 1 12 PHE CB C 9.446 -7.623 1.978 1.00 . A A . 12 PHE CB 1 1 17 4293 1 1 12 PHE CD1 C 11.355 -8.937 2.939 1.00 . A A . 12 PHE CD1 1 1 17 4294 1 1 12 PHE CD2 C 11.854 -7.037 1.588 1.00 . A A . 12 PHE CD2 1 1 17 4295 1 1 12 PHE CE1 C 12.706 -9.166 3.120 1.00 . A A . 12 PHE CE1 1 1 17 4296 1 1 12 PHE CE2 C 13.207 -7.262 1.765 1.00 . A A . 12 PHE CE2 1 1 17 4297 1 1 12 PHE CG C 10.914 -7.870 2.172 1.00 . A A . 12 PHE CG 1 1 17 4298 1 1 12 PHE CZ C 13.633 -8.329 2.532 1.00 . A A . 12 PHE CZ 1 1 17 4299 1 1 12 PHE H H 8.049 -9.720 2.629 1.00 . A A . 12 PHE H 1 1 17 4300 1 1 12 PHE HA H 9.239 -7.517 4.106 1.00 . A A . 12 PHE HA 1 1 17 4301 1 1 12 PHE HB2 H 9.087 -8.323 1.239 1.00 . A A . 12 PHE HB2 1 1 17 4302 1 1 12 PHE HB3 H 9.324 -6.617 1.604 1.00 . A A . 12 PHE HB3 1 1 17 4303 1 1 12 PHE HD1 H 10.631 -9.594 3.400 1.00 . A A . 12 PHE HD1 1 1 17 4304 1 1 12 PHE HD2 H 11.522 -6.202 0.987 1.00 . A A . 12 PHE HD2 1 1 17 4305 1 1 12 PHE HE1 H 13.036 -10.001 3.720 1.00 . A A . 12 PHE HE1 1 1 17 4306 1 1 12 PHE HE2 H 13.928 -6.605 1.303 1.00 . A A . 12 PHE HE2 1 1 17 4307 1 1 12 PHE HZ H 14.689 -8.506 2.672 1.00 . A A . 12 PHE HZ 1 1 17 4308 1 1 12 PHE N N 8.210 -9.170 3.425 1.00 . A A . 12 PHE N 1 1 17 4309 1 1 12 PHE O O 7.181 -6.162 2.230 1.00 . A A . 12 PHE O 1 1 17 4310 1 1 13 GLY C C 5.798 -4.582 4.805 1.00 . A A . 13 GLY C 1 1 17 4311 1 1 13 GLY CA C 5.470 -5.998 4.376 1.00 . A A . 13 GLY CA 1 1 17 4312 1 1 13 GLY H H 6.883 -7.417 5.066 1.00 . A A . 13 GLY H 1 1 17 4313 1 1 13 GLY HA2 H 5.003 -5.969 3.403 1.00 . A A . 13 GLY HA2 1 1 17 4314 1 1 13 GLY HA3 H 4.776 -6.425 5.084 1.00 . A A . 13 GLY HA3 1 1 17 4315 1 1 13 GLY N N 6.647 -6.844 4.306 1.00 . A A . 13 GLY N 1 1 17 4316 1 1 13 GLY O O 4.901 -3.768 5.024 1.00 . A A . 13 GLY O 1 1 17 4317 1 1 14 LYS C C 8.048 -2.168 4.138 1.00 . A A . 14 LYS C 1 1 17 4318 1 1 14 LYS CA C 7.534 -2.960 5.336 1.00 . A A . 14 LYS CA 1 1 17 4319 1 1 14 LYS CB C 8.632 -3.071 6.396 1.00 . A A . 14 LYS CB 1 1 17 4320 1 1 14 LYS CD C 11.115 -3.406 6.222 1.00 . A A . 14 LYS CD 1 1 17 4321 1 1 14 LYS CE C 11.496 -3.361 7.694 1.00 . A A . 14 LYS CE 1 1 17 4322 1 1 14 LYS CG C 9.746 -4.033 6.020 1.00 . A A . 14 LYS CG 1 1 17 4323 1 1 14 LYS H H 7.757 -4.979 4.741 1.00 . A A . 14 LYS H 1 1 17 4324 1 1 14 LYS HA H 6.688 -2.441 5.759 1.00 . A A . 14 LYS HA 1 1 17 4325 1 1 14 LYS HB2 H 9.065 -2.094 6.552 1.00 . A A . 14 LYS HB2 1 1 17 4326 1 1 14 LYS HB3 H 8.189 -3.411 7.321 1.00 . A A . 14 LYS HB3 1 1 17 4327 1 1 14 LYS HD2 H 11.851 -3.990 5.689 1.00 . A A . 14 LYS HD2 1 1 17 4328 1 1 14 LYS HD3 H 11.101 -2.398 5.832 1.00 . A A . 14 LYS HD3 1 1 17 4329 1 1 14 LYS HE2 H 11.561 -2.330 8.004 1.00 . A A . 14 LYS HE2 1 1 17 4330 1 1 14 LYS HE3 H 10.729 -3.862 8.266 1.00 . A A . 14 LYS HE3 1 1 17 4331 1 1 14 LYS HG2 H 9.671 -4.915 6.637 1.00 . A A . 14 LYS HG2 1 1 17 4332 1 1 14 LYS HG3 H 9.636 -4.308 4.981 1.00 . A A . 14 LYS HG3 1 1 17 4333 1 1 14 LYS HZ1 H 12.806 -4.460 8.895 1.00 . A A . 14 LYS HZ1 1 1 17 4334 1 1 14 LYS HZ2 H 13.575 -3.332 7.895 1.00 . A A . 14 LYS HZ2 1 1 17 4335 1 1 14 LYS HZ3 H 12.971 -4.769 7.240 1.00 . A A . 14 LYS HZ3 1 1 17 4336 1 1 14 LYS N N 7.088 -4.287 4.929 1.00 . A A . 14 LYS N 1 1 17 4337 1 1 14 LYS NZ N 12.803 -4.027 7.949 1.00 . A A . 14 LYS NZ 1 1 17 4338 1 1 14 LYS O O 7.959 -0.941 4.108 1.00 . A A . 14 LYS O 1 1 17 4339 1 1 15 GLY C C 8.253 -2.487 0.738 1.00 . A A . 15 GLY C 1 1 17 4340 1 1 15 GLY CA C 9.105 -2.224 1.964 1.00 . A A . 15 GLY CA 1 1 17 4341 1 1 15 GLY H H 8.631 -3.854 3.229 1.00 . A A . 15 GLY H 1 1 17 4342 1 1 15 GLY HA2 H 9.144 -1.160 2.141 1.00 . A A . 15 GLY HA2 1 1 17 4343 1 1 15 GLY HA3 H 10.106 -2.585 1.776 1.00 . A A . 15 GLY HA3 1 1 17 4344 1 1 15 GLY N N 8.586 -2.878 3.151 1.00 . A A . 15 GLY N 1 1 17 4345 1 1 15 GLY O O 7.332 -1.728 0.439 1.00 . A A . 15 GLY O 1 1 17 4346 1 1 16 GLY C C 7.706 -2.746 -2.140 1.00 . A A . 16 GLY C 1 1 17 4347 1 1 16 GLY CA C 7.810 -3.906 -1.170 1.00 . A A . 16 GLY CA 1 1 17 4348 1 1 16 GLY H H 9.308 -4.134 0.310 1.00 . A A . 16 GLY H 1 1 17 4349 1 1 16 GLY HA2 H 8.296 -4.733 -1.664 1.00 . A A . 16 GLY HA2 1 1 17 4350 1 1 16 GLY HA3 H 6.814 -4.207 -0.879 1.00 . A A . 16 GLY HA3 1 1 17 4351 1 1 16 GLY N N 8.562 -3.565 0.024 1.00 . A A . 16 GLY N 1 1 17 4352 1 1 16 GLY O O 8.633 -2.486 -2.908 1.00 . A A . 16 GLY O 1 1 18 4353 1 1 1 VAL C C 3.327 -1.179 -0.652 1.00 . A A . 1 VAL C 1 1 18 4354 1 1 1 VAL CA C 1.991 -0.448 -0.602 1.00 . A A . 1 VAL CA 1 1 18 4355 1 1 1 VAL CB C 1.031 -1.084 -1.626 1.00 . A A . 1 VAL CB 1 1 18 4356 1 1 1 VAL CG1 C -0.330 -0.408 -1.573 1.00 . A A . 1 VAL CG1 1 1 18 4357 1 1 1 VAL CG2 C 1.620 -1.007 -3.027 1.00 . A A . 1 VAL CG2 1 1 18 4358 1 1 1 VAL H1 H 3.034 1.392 -0.677 1.00 . A A . 1 VAL H1 1 1 18 4359 1 1 1 VAL HA H 1.563 -0.566 0.383 1.00 . A A . 1 VAL HA 1 1 18 4360 1 1 1 VAL HB H 0.902 -2.125 -1.369 1.00 . A A . 1 VAL HB 1 1 18 4361 1 1 1 VAL HG11 H -0.650 -0.165 -2.576 1.00 . A A . 1 VAL HG11 1 1 18 4362 1 1 1 VAL HG12 H -1.047 -1.076 -1.117 1.00 . A A . 1 VAL HG12 1 1 18 4363 1 1 1 VAL HG13 H -0.260 0.498 -0.989 1.00 . A A . 1 VAL HG13 1 1 18 4364 1 1 1 VAL HG21 H 2.153 -0.075 -3.143 1.00 . A A . 1 VAL HG21 1 1 18 4365 1 1 1 VAL HG22 H 2.300 -1.832 -3.176 1.00 . A A . 1 VAL HG22 1 1 18 4366 1 1 1 VAL HG23 H 0.824 -1.059 -3.755 1.00 . A A . 1 VAL HG23 1 1 18 4367 1 1 1 VAL N N 2.163 0.979 -0.850 1.00 . A A . 1 VAL N 1 1 18 4368 1 1 1 VAL O O 4.265 -0.735 -1.314 1.00 . A A . 1 VAL O 1 1 18 4369 1 1 2 ALA C C 4.462 -4.394 -0.702 1.00 . A A . 2 ALA C 1 1 18 4370 1 1 2 ALA CA C 4.628 -3.099 0.086 1.00 . A A . 2 ALA CA 1 1 18 4371 1 1 2 ALA CB C 5.022 -3.400 1.524 1.00 . A A . 2 ALA CB 1 1 18 4372 1 1 2 ALA H H 2.625 -2.606 0.559 1.00 . A A . 2 ALA H 1 1 18 4373 1 1 2 ALA HA H 5.419 -2.515 -0.363 1.00 . A A . 2 ALA HA 1 1 18 4374 1 1 2 ALA HB1 H 4.206 -3.906 2.021 1.00 . A A . 2 ALA HB1 1 1 18 4375 1 1 2 ALA HB2 H 5.897 -4.033 1.533 1.00 . A A . 2 ALA HB2 1 1 18 4376 1 1 2 ALA HB3 H 5.240 -2.477 2.039 1.00 . A A . 2 ALA HB3 1 1 18 4377 1 1 2 ALA N N 3.407 -2.304 0.052 1.00 . A A . 2 ALA N 1 1 18 4378 1 1 2 ALA O O 4.600 -5.487 -0.153 1.00 . A A . 2 ALA O 1 1 18 4379 1 1 3 ARG C C 5.287 -6.189 -3.026 1.00 . A A . 3 ARG C 1 1 18 4380 1 1 3 ARG CA C 3.978 -5.424 -2.853 1.00 . A A . 3 ARG CA 1 1 18 4381 1 1 3 ARG CB C 3.444 -4.990 -4.220 1.00 . A A . 3 ARG CB 1 1 18 4382 1 1 3 ARG CD C 4.284 -6.092 -6.316 1.00 . A A . 3 ARG CD 1 1 18 4383 1 1 3 ARG CG C 3.258 -6.141 -5.194 1.00 . A A . 3 ARG CG 1 1 18 4384 1 1 3 ARG CZ C 2.830 -6.067 -8.298 1.00 . A A . 3 ARG CZ 1 1 18 4385 1 1 3 ARG H H 4.068 -3.365 -2.371 1.00 . A A . 3 ARG H 1 1 18 4386 1 1 3 ARG HA H 3.254 -6.073 -2.384 1.00 . A A . 3 ARG HA 1 1 18 4387 1 1 3 ARG HB2 H 2.489 -4.505 -4.083 1.00 . A A . 3 ARG HB2 1 1 18 4388 1 1 3 ARG HB3 H 4.137 -4.286 -4.656 1.00 . A A . 3 ARG HB3 1 1 18 4389 1 1 3 ARG HD2 H 5.134 -5.515 -5.984 1.00 . A A . 3 ARG HD2 1 1 18 4390 1 1 3 ARG HD3 H 4.600 -7.100 -6.540 1.00 . A A . 3 ARG HD3 1 1 18 4391 1 1 3 ARG HE H 4.075 -4.597 -7.778 1.00 . A A . 3 ARG HE 1 1 18 4392 1 1 3 ARG HG2 H 3.368 -7.074 -4.661 1.00 . A A . 3 ARG HG2 1 1 18 4393 1 1 3 ARG HG3 H 2.268 -6.082 -5.621 1.00 . A A . 3 ARG HG3 1 1 18 4394 1 1 3 ARG HH11 H 2.694 -7.734 -7.165 1.00 . A A . 3 ARG HH11 1 1 18 4395 1 1 3 ARG HH12 H 1.674 -7.703 -8.566 1.00 . A A . 3 ARG HH12 1 1 18 4396 1 1 3 ARG HH21 H 2.737 -4.545 -9.625 1.00 . A A . 3 ARG HH21 1 1 18 4397 1 1 3 ARG HH22 H 1.700 -5.889 -9.965 1.00 . A A . 3 ARG HH22 1 1 18 4398 1 1 3 ARG N N 4.165 -4.263 -1.991 1.00 . A A . 3 ARG N 1 1 18 4399 1 1 3 ARG NE N 3.742 -5.484 -7.528 1.00 . A A . 3 ARG NE 1 1 18 4400 1 1 3 ARG NH1 N 2.361 -7.266 -7.984 1.00 . A A . 3 ARG NH1 1 1 18 4401 1 1 3 ARG NH2 N 2.386 -5.449 -9.385 1.00 . A A . 3 ARG NH2 1 1 18 4402 1 1 3 ARG O O 5.299 -7.315 -3.522 1.00 . A A . 3 ARG O 1 1 18 4403 1 1 4 GLY C C 7.757 -7.522 -1.984 1.00 . A A . 4 GLY C 1 1 18 4404 1 1 4 GLY CA C 7.687 -6.205 -2.732 1.00 . A A . 4 GLY CA 1 1 18 4405 1 1 4 GLY H H 6.318 -4.671 -2.226 1.00 . A A . 4 GLY H 1 1 18 4406 1 1 4 GLY HA2 H 7.894 -6.385 -3.777 1.00 . A A . 4 GLY HA2 1 1 18 4407 1 1 4 GLY HA3 H 8.439 -5.539 -2.336 1.00 . A A . 4 GLY HA3 1 1 18 4408 1 1 4 GLY N N 6.388 -5.569 -2.614 1.00 . A A . 4 GLY N 1 1 18 4409 1 1 4 GLY O O 8.693 -8.300 -2.170 1.00 . A A . 4 GLY O 1 1 18 4410 1 1 5 TRP C C 6.426 -10.203 -1.249 1.00 . A A . 5 TRP C 1 1 18 4411 1 1 5 TRP CA C 6.721 -9.004 -0.356 1.00 . A A . 5 TRP CA 1 1 18 4412 1 1 5 TRP CB C 5.662 -8.897 0.743 1.00 . A A . 5 TRP CB 1 1 18 4413 1 1 5 TRP CD1 C 3.649 -8.203 -0.683 1.00 . A A . 5 TRP CD1 1 1 18 4414 1 1 5 TRP CD2 C 3.292 -10.004 0.599 1.00 . A A . 5 TRP CD2 1 1 18 4415 1 1 5 TRP CE2 C 2.117 -9.730 -0.128 1.00 . A A . 5 TRP CE2 1 1 18 4416 1 1 5 TRP CE3 C 3.304 -11.095 1.472 1.00 . A A . 5 TRP CE3 1 1 18 4417 1 1 5 TRP CG C 4.259 -9.016 0.229 1.00 . A A . 5 TRP CG 1 1 18 4418 1 1 5 TRP CH2 C 1.008 -11.569 0.856 1.00 . A A . 5 TRP CH2 1 1 18 4419 1 1 5 TRP CZ2 C 0.968 -10.508 -0.007 1.00 . A A . 5 TRP CZ2 1 1 18 4420 1 1 5 TRP CZ3 C 2.163 -11.865 1.592 1.00 . A A . 5 TRP CZ3 1 1 18 4421 1 1 5 TRP H H 6.048 -7.113 -1.031 1.00 . A A . 5 TRP H 1 1 18 4422 1 1 5 TRP HA H 7.690 -9.140 0.103 1.00 . A A . 5 TRP HA 1 1 18 4423 1 1 5 TRP HB2 H 5.820 -9.684 1.465 1.00 . A A . 5 TRP HB2 1 1 18 4424 1 1 5 TRP HB3 H 5.758 -7.939 1.233 1.00 . A A . 5 TRP HB3 1 1 18 4425 1 1 5 TRP HD1 H 4.122 -7.354 -1.153 1.00 . A A . 5 TRP HD1 1 1 18 4426 1 1 5 TRP HE1 H 1.720 -8.207 -1.515 1.00 . A A . 5 TRP HE1 1 1 18 4427 1 1 5 TRP HE3 H 4.185 -11.339 2.048 1.00 . A A . 5 TRP HE3 1 1 18 4428 1 1 5 TRP HH2 H 0.140 -12.198 0.981 1.00 . A A . 5 TRP HH2 1 1 18 4429 1 1 5 TRP HZ2 H 0.071 -10.293 -0.568 1.00 . A A . 5 TRP HZ2 1 1 18 4430 1 1 5 TRP HZ3 H 2.154 -12.712 2.263 1.00 . A A . 5 TRP HZ3 1 1 18 4431 1 1 5 TRP N N 6.767 -7.772 -1.136 1.00 . A A . 5 TRP N 1 1 18 4432 1 1 5 TRP NE1 N 2.360 -8.627 -0.902 1.00 . A A . 5 TRP NE1 1 1 18 4433 1 1 5 TRP O O 6.968 -11.290 -1.047 1.00 . A A . 5 TRP O 1 1 18 4434 1 1 6 LYS C C 6.335 -11.357 -4.137 1.00 . A A . 6 LYS C 1 1 18 4435 1 1 6 LYS CA C 5.196 -11.065 -3.165 1.00 . A A . 6 LYS CA 1 1 18 4436 1 1 6 LYS CB C 3.934 -10.681 -3.941 1.00 . A A . 6 LYS CB 1 1 18 4437 1 1 6 LYS CD C 4.276 -10.984 -6.411 1.00 . A A . 6 LYS CD 1 1 18 4438 1 1 6 LYS CE C 3.212 -10.693 -7.458 1.00 . A A . 6 LYS CE 1 1 18 4439 1 1 6 LYS CG C 3.669 -11.567 -5.146 1.00 . A A . 6 LYS CG 1 1 18 4440 1 1 6 LYS H H 5.163 -9.112 -2.349 1.00 . A A . 6 LYS H 1 1 18 4441 1 1 6 LYS HA H 4.996 -11.954 -2.586 1.00 . A A . 6 LYS HA 1 1 18 4442 1 1 6 LYS HB2 H 3.084 -10.746 -3.278 1.00 . A A . 6 LYS HB2 1 1 18 4443 1 1 6 LYS HB3 H 4.034 -9.662 -4.285 1.00 . A A . 6 LYS HB3 1 1 18 4444 1 1 6 LYS HD2 H 4.785 -10.064 -6.166 1.00 . A A . 6 LYS HD2 1 1 18 4445 1 1 6 LYS HD3 H 4.985 -11.692 -6.818 1.00 . A A . 6 LYS HD3 1 1 18 4446 1 1 6 LYS HE2 H 2.416 -11.414 -7.354 1.00 . A A . 6 LYS HE2 1 1 18 4447 1 1 6 LYS HE3 H 2.823 -9.700 -7.289 1.00 . A A . 6 LYS HE3 1 1 18 4448 1 1 6 LYS HG2 H 4.100 -12.541 -4.968 1.00 . A A . 6 LYS HG2 1 1 18 4449 1 1 6 LYS HG3 H 2.601 -11.663 -5.282 1.00 . A A . 6 LYS HG3 1 1 18 4450 1 1 6 LYS HZ1 H 3.135 -11.349 -9.440 1.00 . A A . 6 LYS HZ1 1 1 18 4451 1 1 6 LYS HZ2 H 4.705 -11.201 -8.827 1.00 . A A . 6 LYS HZ2 1 1 18 4452 1 1 6 LYS HZ3 H 3.829 -9.818 -9.252 1.00 . A A . 6 LYS HZ3 1 1 18 4453 1 1 6 LYS N N 5.563 -10.000 -2.239 1.00 . A A . 6 LYS N 1 1 18 4454 1 1 6 LYS NZ N 3.758 -10.771 -8.841 1.00 . A A . 6 LYS NZ 1 1 18 4455 1 1 6 LYS O O 6.370 -12.414 -4.767 1.00 . A A . 6 LYS O 1 1 18 4456 1 1 7 ARG C C 9.303 -11.714 -4.688 1.00 . A A . 7 ARG C 1 1 18 4457 1 1 7 ARG CA C 8.404 -10.571 -5.148 1.00 . A A . 7 ARG CA 1 1 18 4458 1 1 7 ARG CB C 9.208 -9.271 -5.216 1.00 . A A . 7 ARG CB 1 1 18 4459 1 1 7 ARG CD C 8.832 -9.034 -7.690 1.00 . A A . 7 ARG CD 1 1 18 4460 1 1 7 ARG CG C 8.770 -8.342 -6.337 1.00 . A A . 7 ARG CG 1 1 18 4461 1 1 7 ARG CZ C 9.325 -8.462 -10.029 1.00 . A A . 7 ARG CZ 1 1 18 4462 1 1 7 ARG H H 7.181 -9.593 -3.724 1.00 . A A . 7 ARG H 1 1 18 4463 1 1 7 ARG HA H 8.024 -10.801 -6.132 1.00 . A A . 7 ARG HA 1 1 18 4464 1 1 7 ARG HB2 H 9.101 -8.745 -4.279 1.00 . A A . 7 ARG HB2 1 1 18 4465 1 1 7 ARG HB3 H 10.250 -9.514 -5.366 1.00 . A A . 7 ARG HB3 1 1 18 4466 1 1 7 ARG HD2 H 9.503 -9.876 -7.619 1.00 . A A . 7 ARG HD2 1 1 18 4467 1 1 7 ARG HD3 H 7.842 -9.383 -7.946 1.00 . A A . 7 ARG HD3 1 1 18 4468 1 1 7 ARG HE H 9.625 -7.252 -8.473 1.00 . A A . 7 ARG HE 1 1 18 4469 1 1 7 ARG HG2 H 7.754 -8.025 -6.153 1.00 . A A . 7 ARG HG2 1 1 18 4470 1 1 7 ARG HG3 H 9.421 -7.481 -6.352 1.00 . A A . 7 ARG HG3 1 1 18 4471 1 1 7 ARG HH11 H 8.561 -10.311 -9.749 1.00 . A A . 7 ARG HH11 1 1 18 4472 1 1 7 ARG HH12 H 8.914 -9.895 -11.394 1.00 . A A . 7 ARG HH12 1 1 18 4473 1 1 7 ARG HH21 H 10.093 -6.692 -10.634 1.00 . A A . 7 ARG HH21 1 1 18 4474 1 1 7 ARG HH22 H 9.785 -7.837 -11.896 1.00 . A A . 7 ARG HH22 1 1 18 4475 1 1 7 ARG N N 7.264 -10.414 -4.253 1.00 . A A . 7 ARG N 1 1 18 4476 1 1 7 ARG NE N 9.306 -8.138 -8.741 1.00 . A A . 7 ARG NE 1 1 18 4477 1 1 7 ARG NH1 N 8.899 -9.654 -10.423 1.00 . A A . 7 ARG NH1 1 1 18 4478 1 1 7 ARG NH2 N 9.771 -7.592 -10.927 1.00 . A A . 7 ARG NH2 1 1 18 4479 1 1 7 ARG O O 9.205 -12.836 -5.186 1.00 . A A . 7 ARG O 1 1 18 4480 1 1 8 LYS C C 10.570 -13.010 -1.897 1.00 . A A . 8 LYS C 1 1 18 4481 1 1 8 LYS CA C 11.098 -12.426 -3.204 1.00 . A A . 8 LYS CA 1 1 18 4482 1 1 8 LYS CB C 12.482 -11.812 -2.979 1.00 . A A . 8 LYS CB 1 1 18 4483 1 1 8 LYS CD C 12.482 -9.529 -4.026 1.00 . A A . 8 LYS CD 1 1 18 4484 1 1 8 LYS CE C 13.849 -8.909 -4.270 1.00 . A A . 8 LYS CE 1 1 18 4485 1 1 8 LYS CG C 12.450 -10.315 -2.726 1.00 . A A . 8 LYS CG 1 1 18 4486 1 1 8 LYS H H 10.212 -10.511 -3.375 1.00 . A A . 8 LYS H 1 1 18 4487 1 1 8 LYS HA H 11.179 -13.218 -3.932 1.00 . A A . 8 LYS HA 1 1 18 4488 1 1 8 LYS HB2 H 12.940 -12.291 -2.126 1.00 . A A . 8 LYS HB2 1 1 18 4489 1 1 8 LYS HB3 H 13.090 -11.996 -3.854 1.00 . A A . 8 LYS HB3 1 1 18 4490 1 1 8 LYS HD2 H 12.250 -10.194 -4.845 1.00 . A A . 8 LYS HD2 1 1 18 4491 1 1 8 LYS HD3 H 11.742 -8.742 -3.979 1.00 . A A . 8 LYS HD3 1 1 18 4492 1 1 8 LYS HE2 H 14.036 -8.170 -3.506 1.00 . A A . 8 LYS HE2 1 1 18 4493 1 1 8 LYS HE3 H 14.597 -9.686 -4.210 1.00 . A A . 8 LYS HE3 1 1 18 4494 1 1 8 LYS HG2 H 11.545 -10.069 -2.191 1.00 . A A . 8 LYS HG2 1 1 18 4495 1 1 8 LYS HG3 H 13.309 -10.042 -2.130 1.00 . A A . 8 LYS HG3 1 1 18 4496 1 1 8 LYS HZ1 H 12.978 -8.109 -5.992 1.00 . A A . 8 LYS HZ1 1 1 18 4497 1 1 8 LYS HZ2 H 14.472 -8.858 -6.263 1.00 . A A . 8 LYS HZ2 1 1 18 4498 1 1 8 LYS HZ3 H 14.409 -7.337 -5.525 1.00 . A A . 8 LYS HZ3 1 1 18 4499 1 1 8 LYS N N 10.181 -11.423 -3.733 1.00 . A A . 8 LYS N 1 1 18 4500 1 1 8 LYS NZ N 13.933 -8.258 -5.606 1.00 . A A . 8 LYS NZ 1 1 18 4501 1 1 8 LYS O O 10.035 -14.119 -1.874 1.00 . A A . 8 LYS O 1 1 18 4502 1 1 9 CYS C C 8.979 -11.976 0.894 1.00 . A A . 9 CYS C 1 1 18 4503 1 1 9 CYS CA C 10.261 -12.700 0.497 1.00 . A A . 9 CYS CA 1 1 18 4504 1 1 9 CYS CB C 11.344 -12.460 1.550 1.00 . A A . 9 CYS CB 1 1 18 4505 1 1 9 CYS H H 11.157 -11.382 -0.897 1.00 . A A . 9 CYS H 1 1 18 4506 1 1 9 CYS HA H 10.059 -13.758 0.435 1.00 . A A . 9 CYS HA 1 1 18 4507 1 1 9 CYS HB2 H 10.949 -12.709 2.524 1.00 . A A . 9 CYS HB2 1 1 18 4508 1 1 9 CYS HB3 H 12.189 -13.097 1.338 1.00 . A A . 9 CYS HB3 1 1 18 4509 1 1 9 CYS HG H 12.593 -10.596 2.761 1.00 . A A . 9 CYS HG 1 1 18 4510 1 1 9 CYS N N 10.723 -12.256 -0.814 1.00 . A A . 9 CYS N 1 1 18 4511 1 1 9 CYS O O 8.878 -10.752 0.817 1.00 . A A . 9 CYS O 1 1 18 4512 1 1 9 CYS SG S 11.941 -10.754 1.620 1.00 . A A . 9 CYS SG 1 1 18 4513 1 1 10 PRO C C 6.772 -11.424 3.052 1.00 . A A . 10 PRO C 1 1 18 4514 1 1 10 PRO CA C 6.678 -12.205 1.746 1.00 . A A . 10 PRO CA 1 1 18 4515 1 1 10 PRO CB C 5.811 -13.453 1.931 1.00 . A A . 10 PRO CB 1 1 18 4516 1 1 10 PRO CD C 8.024 -14.217 1.448 1.00 . A A . 10 PRO CD 1 1 18 4517 1 1 10 PRO CG C 6.779 -14.547 2.224 1.00 . A A . 10 PRO CG 1 1 18 4518 1 1 10 PRO HA H 6.248 -11.576 0.982 1.00 . A A . 10 PRO HA 1 1 18 4519 1 1 10 PRO HB2 H 5.126 -13.300 2.753 1.00 . A A . 10 PRO HB2 1 1 18 4520 1 1 10 PRO HB3 H 5.257 -13.648 1.025 1.00 . A A . 10 PRO HB3 1 1 18 4521 1 1 10 PRO HD2 H 8.902 -14.530 1.993 1.00 . A A . 10 PRO HD2 1 1 18 4522 1 1 10 PRO HD3 H 7.996 -14.683 0.474 1.00 . A A . 10 PRO HD3 1 1 18 4523 1 1 10 PRO HG2 H 6.992 -14.575 3.281 1.00 . A A . 10 PRO HG2 1 1 18 4524 1 1 10 PRO HG3 H 6.373 -15.493 1.896 1.00 . A A . 10 PRO HG3 1 1 18 4525 1 1 10 PRO N N 7.973 -12.750 1.329 1.00 . A A . 10 PRO N 1 1 18 4526 1 1 10 PRO O O 5.823 -10.748 3.453 1.00 . A A . 10 PRO O 1 1 18 4527 1 1 11 LEU C C 8.368 -9.331 4.739 1.00 . A A . 11 LEU C 1 1 18 4528 1 1 11 LEU CA C 8.138 -10.820 4.974 1.00 . A A . 11 LEU CA 1 1 18 4529 1 1 11 LEU CB C 9.335 -11.422 5.713 1.00 . A A . 11 LEU CB 1 1 18 4530 1 1 11 LEU CD1 C 11.515 -10.236 5.361 1.00 . A A . 11 LEU CD1 1 1 18 4531 1 1 11 LEU CD2 C 11.410 -12.729 5.191 1.00 . A A . 11 LEU CD2 1 1 18 4532 1 1 11 LEU CG C 10.661 -11.426 4.952 1.00 . A A . 11 LEU CG 1 1 18 4533 1 1 11 LEU H H 8.640 -12.072 3.344 1.00 . A A . 11 LEU H 1 1 18 4534 1 1 11 LEU HA H 7.252 -10.944 5.579 1.00 . A A . 11 LEU HA 1 1 18 4535 1 1 11 LEU HB2 H 9.478 -10.860 6.623 1.00 . A A . 11 LEU HB2 1 1 18 4536 1 1 11 LEU HB3 H 9.090 -12.445 5.959 1.00 . A A . 11 LEU HB3 1 1 18 4537 1 1 11 LEU HD11 H 12.471 -10.291 4.864 1.00 . A A . 11 LEU HD11 1 1 18 4538 1 1 11 LEU HD12 H 11.664 -10.250 6.431 1.00 . A A . 11 LEU HD12 1 1 18 4539 1 1 11 LEU HD13 H 11.015 -9.320 5.081 1.00 . A A . 11 LEU HD13 1 1 18 4540 1 1 11 LEU HD21 H 11.687 -12.799 6.233 1.00 . A A . 11 LEU HD21 1 1 18 4541 1 1 11 LEU HD22 H 12.299 -12.750 4.579 1.00 . A A . 11 LEU HD22 1 1 18 4542 1 1 11 LEU HD23 H 10.774 -13.562 4.930 1.00 . A A . 11 LEU HD23 1 1 18 4543 1 1 11 LEU HG H 10.461 -11.343 3.892 1.00 . A A . 11 LEU HG 1 1 18 4544 1 1 11 LEU N N 7.920 -11.519 3.713 1.00 . A A . 11 LEU N 1 1 18 4545 1 1 11 LEU O O 8.496 -8.554 5.686 1.00 . A A . 11 LEU O 1 1 18 4546 1 1 12 PHE C C 7.342 -6.737 3.267 1.00 . A A . 12 PHE C 1 1 18 4547 1 1 12 PHE CA C 8.629 -7.541 3.110 1.00 . A A . 12 PHE CA 1 1 18 4548 1 1 12 PHE CB C 9.138 -7.435 1.671 1.00 . A A . 12 PHE CB 1 1 18 4549 1 1 12 PHE CD1 C 10.029 -5.090 1.630 1.00 . A A . 12 PHE CD1 1 1 18 4550 1 1 12 PHE CD2 C 11.544 -6.884 1.217 1.00 . A A . 12 PHE CD2 1 1 18 4551 1 1 12 PHE CE1 C 11.059 -4.181 1.475 1.00 . A A . 12 PHE CE1 1 1 18 4552 1 1 12 PHE CE2 C 12.578 -5.981 1.061 1.00 . A A . 12 PHE CE2 1 1 18 4553 1 1 12 PHE CG C 10.260 -6.450 1.503 1.00 . A A . 12 PHE CG 1 1 18 4554 1 1 12 PHE CZ C 12.335 -4.627 1.191 1.00 . A A . 12 PHE CZ 1 1 18 4555 1 1 12 PHE H H 8.308 -9.604 2.759 1.00 . A A . 12 PHE H 1 1 18 4556 1 1 12 PHE HA H 9.375 -7.137 3.777 1.00 . A A . 12 PHE HA 1 1 18 4557 1 1 12 PHE HB2 H 9.496 -8.402 1.351 1.00 . A A . 12 PHE HB2 1 1 18 4558 1 1 12 PHE HB3 H 8.325 -7.127 1.031 1.00 . A A . 12 PHE HB3 1 1 18 4559 1 1 12 PHE HD1 H 9.032 -4.739 1.853 1.00 . A A . 12 PHE HD1 1 1 18 4560 1 1 12 PHE HD2 H 11.735 -7.944 1.115 1.00 . A A . 12 PHE HD2 1 1 18 4561 1 1 12 PHE HE1 H 10.867 -3.124 1.577 1.00 . A A . 12 PHE HE1 1 1 18 4562 1 1 12 PHE HE2 H 13.574 -6.333 0.839 1.00 . A A . 12 PHE HE2 1 1 18 4563 1 1 12 PHE HZ H 13.142 -3.920 1.069 1.00 . A A . 12 PHE HZ 1 1 18 4564 1 1 12 PHE N N 8.417 -8.938 3.470 1.00 . A A . 12 PHE N 1 1 18 4565 1 1 12 PHE O O 6.874 -6.104 2.322 1.00 . A A . 12 PHE O 1 1 18 4566 1 1 13 GLY C C 5.802 -4.644 5.264 1.00 . A A . 13 GLY C 1 1 18 4567 1 1 13 GLY CA C 5.547 -6.039 4.729 1.00 . A A . 13 GLY CA 1 1 18 4568 1 1 13 GLY H H 7.193 -7.290 5.185 1.00 . A A . 13 GLY H 1 1 18 4569 1 1 13 GLY HA2 H 4.985 -5.964 3.810 1.00 . A A . 13 GLY HA2 1 1 18 4570 1 1 13 GLY HA3 H 4.962 -6.588 5.453 1.00 . A A . 13 GLY HA3 1 1 18 4571 1 1 13 GLY N N 6.775 -6.768 4.469 1.00 . A A . 13 GLY N 1 1 18 4572 1 1 13 GLY O O 4.973 -4.084 5.981 1.00 . A A . 13 GLY O 1 1 18 4573 1 1 14 LYS C C 7.536 -1.810 4.178 1.00 . A A . 14 LYS C 1 1 18 4574 1 1 14 LYS CA C 7.319 -2.742 5.366 1.00 . A A . 14 LYS CA 1 1 18 4575 1 1 14 LYS CB C 8.585 -2.797 6.223 1.00 . A A . 14 LYS CB 1 1 18 4576 1 1 14 LYS CD C 9.613 -5.065 6.555 1.00 . A A . 14 LYS CD 1 1 18 4577 1 1 14 LYS CE C 9.971 -6.113 7.598 1.00 . A A . 14 LYS CE 1 1 18 4578 1 1 14 LYS CG C 8.661 -4.023 7.118 1.00 . A A . 14 LYS CG 1 1 18 4579 1 1 14 LYS H H 7.575 -4.577 4.342 1.00 . A A . 14 LYS H 1 1 18 4580 1 1 14 LYS HA H 6.506 -2.361 5.964 1.00 . A A . 14 LYS HA 1 1 18 4581 1 1 14 LYS HB2 H 9.447 -2.799 5.572 1.00 . A A . 14 LYS HB2 1 1 18 4582 1 1 14 LYS HB3 H 8.620 -1.918 6.850 1.00 . A A . 14 LYS HB3 1 1 18 4583 1 1 14 LYS HD2 H 9.141 -5.556 5.716 1.00 . A A . 14 LYS HD2 1 1 18 4584 1 1 14 LYS HD3 H 10.517 -4.574 6.225 1.00 . A A . 14 LYS HD3 1 1 18 4585 1 1 14 LYS HE2 H 9.533 -5.827 8.542 1.00 . A A . 14 LYS HE2 1 1 18 4586 1 1 14 LYS HE3 H 9.566 -7.065 7.287 1.00 . A A . 14 LYS HE3 1 1 18 4587 1 1 14 LYS HG2 H 9.010 -3.723 8.095 1.00 . A A . 14 LYS HG2 1 1 18 4588 1 1 14 LYS HG3 H 7.675 -4.457 7.203 1.00 . A A . 14 LYS HG3 1 1 18 4589 1 1 14 LYS HZ1 H 11.832 -5.388 8.209 1.00 . A A . 14 LYS HZ1 1 1 18 4590 1 1 14 LYS HZ2 H 11.899 -6.383 6.842 1.00 . A A . 14 LYS HZ2 1 1 18 4591 1 1 14 LYS HZ3 H 11.662 -7.063 8.372 1.00 . A A . 14 LYS HZ3 1 1 18 4592 1 1 14 LYS N N 6.955 -4.081 4.916 1.00 . A A . 14 LYS N 1 1 18 4593 1 1 14 LYS NZ N 11.444 -6.246 7.767 1.00 . A A . 14 LYS NZ 1 1 18 4594 1 1 14 LYS O O 6.758 -0.885 3.953 1.00 . A A . 14 LYS O 1 1 18 4595 1 1 15 GLY C C 8.044 -1.587 1.065 1.00 . A A . 15 GLY C 1 1 18 4596 1 1 15 GLY CA C 8.900 -1.236 2.266 1.00 . A A . 15 GLY CA 1 1 18 4597 1 1 15 GLY H H 9.186 -2.813 3.649 1.00 . A A . 15 GLY H 1 1 18 4598 1 1 15 GLY HA2 H 8.733 -0.201 2.523 1.00 . A A . 15 GLY HA2 1 1 18 4599 1 1 15 GLY HA3 H 9.939 -1.368 2.003 1.00 . A A . 15 GLY HA3 1 1 18 4600 1 1 15 GLY N N 8.600 -2.061 3.421 1.00 . A A . 15 GLY N 1 1 18 4601 1 1 15 GLY O O 6.869 -1.229 1.005 1.00 . A A . 15 GLY O 1 1 18 4602 1 1 16 GLY C C 7.226 -1.500 -1.760 1.00 . A A . 16 GLY C 1 1 18 4603 1 1 16 GLY CA C 7.905 -2.678 -1.089 1.00 . A A . 16 GLY CA 1 1 18 4604 1 1 16 GLY H H 9.575 -2.550 0.206 1.00 . A A . 16 GLY H 1 1 18 4605 1 1 16 GLY HA2 H 8.592 -3.130 -1.788 1.00 . A A . 16 GLY HA2 1 1 18 4606 1 1 16 GLY HA3 H 7.153 -3.404 -0.817 1.00 . A A . 16 GLY HA3 1 1 18 4607 1 1 16 GLY N N 8.635 -2.291 0.104 1.00 . A A . 16 GLY N 1 1 18 4608 1 1 16 GLY O O 7.842 -0.791 -2.556 1.00 . A A . 16 GLY O 1 1 19 4609 1 1 1 VAL C C 2.564 -1.738 -1.587 1.00 . A A . 1 VAL C 1 1 19 4610 1 1 1 VAL CA C 1.179 -1.101 -1.617 1.00 . A A . 1 VAL CA 1 1 19 4611 1 1 1 VAL CB C 1.258 0.237 -2.376 1.00 . A A . 1 VAL CB 1 1 19 4612 1 1 1 VAL CG1 C -0.137 0.774 -2.657 1.00 . A A . 1 VAL CG1 1 1 19 4613 1 1 1 VAL CG2 C 2.079 1.248 -1.589 1.00 . A A . 1 VAL CG2 1 1 19 4614 1 1 1 VAL H1 H 0.398 -0.019 0.026 1.00 . A A . 1 VAL H1 1 1 19 4615 1 1 1 VAL HA H 0.505 -1.755 -2.151 1.00 . A A . 1 VAL HA 1 1 19 4616 1 1 1 VAL HB H 1.750 0.063 -3.321 1.00 . A A . 1 VAL HB 1 1 19 4617 1 1 1 VAL HG11 H -0.781 -0.038 -2.961 1.00 . A A . 1 VAL HG11 1 1 19 4618 1 1 1 VAL HG12 H -0.533 1.234 -1.763 1.00 . A A . 1 VAL HG12 1 1 19 4619 1 1 1 VAL HG13 H -0.088 1.508 -3.448 1.00 . A A . 1 VAL HG13 1 1 19 4620 1 1 1 VAL HG21 H 1.418 1.958 -1.115 1.00 . A A . 1 VAL HG21 1 1 19 4621 1 1 1 VAL HG22 H 2.655 0.733 -0.835 1.00 . A A . 1 VAL HG22 1 1 19 4622 1 1 1 VAL HG23 H 2.747 1.769 -2.259 1.00 . A A . 1 VAL HG23 1 1 19 4623 1 1 1 VAL N N 0.656 -0.918 -0.268 1.00 . A A . 1 VAL N 1 1 19 4624 1 1 1 VAL O O 3.424 -1.416 -2.407 1.00 . A A . 1 VAL O 1 1 19 4625 1 1 2 ALA C C 4.082 -4.606 -1.331 1.00 . A A . 2 ALA C 1 1 19 4626 1 1 2 ALA CA C 4.053 -3.327 -0.501 1.00 . A A . 2 ALA CA 1 1 19 4627 1 1 2 ALA CB C 4.334 -3.637 0.961 1.00 . A A . 2 ALA CB 1 1 19 4628 1 1 2 ALA H H 2.049 -2.856 -0.013 1.00 . A A . 2 ALA H 1 1 19 4629 1 1 2 ALA HA H 4.827 -2.661 -0.858 1.00 . A A . 2 ALA HA 1 1 19 4630 1 1 2 ALA HB1 H 4.019 -4.647 1.181 1.00 . A A . 2 ALA HB1 1 1 19 4631 1 1 2 ALA HB2 H 5.392 -3.540 1.153 1.00 . A A . 2 ALA HB2 1 1 19 4632 1 1 2 ALA HB3 H 3.789 -2.946 1.587 1.00 . A A . 2 ALA HB3 1 1 19 4633 1 1 2 ALA N N 2.773 -2.643 -0.637 1.00 . A A . 2 ALA N 1 1 19 4634 1 1 2 ALA O O 4.416 -5.678 -0.825 1.00 . A A . 2 ALA O 1 1 19 4635 1 1 3 ARG C C 5.117 -6.209 -3.679 1.00 . A A . 3 ARG C 1 1 19 4636 1 1 3 ARG CA C 3.714 -5.635 -3.505 1.00 . A A . 3 ARG CA 1 1 19 4637 1 1 3 ARG CB C 3.141 -5.236 -4.866 1.00 . A A . 3 ARG CB 1 1 19 4638 1 1 3 ARG CD C 4.163 -6.102 -6.993 1.00 . A A . 3 ARG CD 1 1 19 4639 1 1 3 ARG CG C 3.154 -6.363 -5.886 1.00 . A A . 3 ARG CG 1 1 19 4640 1 1 3 ARG CZ C 2.817 -6.092 -9.051 1.00 . A A . 3 ARG CZ 1 1 19 4641 1 1 3 ARG H H 3.473 -3.606 -2.952 1.00 . A A . 3 ARG H 1 1 19 4642 1 1 3 ARG HA H 3.080 -6.391 -3.066 1.00 . A A . 3 ARG HA 1 1 19 4643 1 1 3 ARG HB2 H 2.120 -4.912 -4.734 1.00 . A A . 3 ARG HB2 1 1 19 4644 1 1 3 ARG HB3 H 3.722 -4.416 -5.261 1.00 . A A . 3 ARG HB3 1 1 19 4645 1 1 3 ARG HD2 H 4.290 -5.035 -7.102 1.00 . A A . 3 ARG HD2 1 1 19 4646 1 1 3 ARG HD3 H 5.105 -6.549 -6.715 1.00 . A A . 3 ARG HD3 1 1 19 4647 1 1 3 ARG HE H 4.142 -7.501 -8.562 1.00 . A A . 3 ARG HE 1 1 19 4648 1 1 3 ARG HG2 H 3.414 -7.285 -5.387 1.00 . A A . 3 ARG HG2 1 1 19 4649 1 1 3 ARG HG3 H 2.170 -6.452 -6.322 1.00 . A A . 3 ARG HG3 1 1 19 4650 1 1 3 ARG HH11 H 2.499 -4.522 -7.819 1.00 . A A . 3 ARG HH11 1 1 19 4651 1 1 3 ARG HH12 H 1.557 -4.527 -9.274 1.00 . A A . 3 ARG HH12 1 1 19 4652 1 1 3 ARG HH21 H 2.907 -7.519 -10.480 1.00 . A A . 3 ARG HH21 1 1 19 4653 1 1 3 ARG HH22 H 1.790 -6.233 -10.785 1.00 . A A . 3 ARG HH22 1 1 19 4654 1 1 3 ARG N N 3.730 -4.487 -2.606 1.00 . A A . 3 ARG N 1 1 19 4655 1 1 3 ARG NE N 3.731 -6.661 -8.271 1.00 . A A . 3 ARG NE 1 1 19 4656 1 1 3 ARG NH1 N 2.244 -4.954 -8.684 1.00 . A A . 3 ARG NH1 1 1 19 4657 1 1 3 ARG NH2 N 2.477 -6.661 -10.200 1.00 . A A . 3 ARG NH2 1 1 19 4658 1 1 3 ARG O O 5.287 -7.314 -4.192 1.00 . A A . 3 ARG O 1 1 19 4659 1 1 4 GLY C C 7.724 -7.242 -2.708 1.00 . A A . 4 GLY C 1 1 19 4660 1 1 4 GLY CA C 7.494 -5.897 -3.368 1.00 . A A . 4 GLY CA 1 1 19 4661 1 1 4 GLY H H 5.924 -4.575 -2.850 1.00 . A A . 4 GLY H 1 1 19 4662 1 1 4 GLY HA2 H 7.748 -5.973 -4.415 1.00 . A A . 4 GLY HA2 1 1 19 4663 1 1 4 GLY HA3 H 8.141 -5.166 -2.904 1.00 . A A . 4 GLY HA3 1 1 19 4664 1 1 4 GLY N N 6.119 -5.448 -3.250 1.00 . A A . 4 GLY N 1 1 19 4665 1 1 4 GLY O O 8.707 -7.924 -3.000 1.00 . A A . 4 GLY O 1 1 19 4666 1 1 5 TRP C C 6.439 -10.046 -1.985 1.00 . A A . 5 TRP C 1 1 19 4667 1 1 5 TRP CA C 6.927 -8.896 -1.112 1.00 . A A . 5 TRP CA 1 1 19 4668 1 1 5 TRP CB C 6.125 -8.852 0.190 1.00 . A A . 5 TRP CB 1 1 19 4669 1 1 5 TRP CD1 C 3.901 -8.408 -1.004 1.00 . A A . 5 TRP CD1 1 1 19 4670 1 1 5 TRP CD2 C 3.736 -9.751 0.781 1.00 . A A . 5 TRP CD2 1 1 19 4671 1 1 5 TRP CE2 C 2.454 -9.589 0.220 1.00 . A A . 5 TRP CE2 1 1 19 4672 1 1 5 TRP CE3 C 3.879 -10.558 1.913 1.00 . A A . 5 TRP CE3 1 1 19 4673 1 1 5 TRP CG C 4.647 -8.988 -0.018 1.00 . A A . 5 TRP CG 1 1 19 4674 1 1 5 TRP CH2 C 1.493 -10.986 1.864 1.00 . A A . 5 TRP CH2 1 1 19 4675 1 1 5 TRP CZ2 C 1.325 -10.203 0.755 1.00 . A A . 5 TRP CZ2 1 1 19 4676 1 1 5 TRP CZ3 C 2.757 -11.166 2.443 1.00 . A A . 5 TRP CZ3 1 1 19 4677 1 1 5 TRP H H 6.056 -7.036 -1.627 1.00 . A A . 5 TRP H 1 1 19 4678 1 1 5 TRP HA H 7.969 -9.055 -0.877 1.00 . A A . 5 TRP HA 1 1 19 4679 1 1 5 TRP HB2 H 6.447 -9.659 0.831 1.00 . A A . 5 TRP HB2 1 1 19 4680 1 1 5 TRP HB3 H 6.308 -7.909 0.685 1.00 . A A . 5 TRP HB3 1 1 19 4681 1 1 5 TRP HD1 H 4.303 -7.764 -1.771 1.00 . A A . 5 TRP HD1 1 1 19 4682 1 1 5 TRP HE1 H 1.851 -8.477 -1.453 1.00 . A A . 5 TRP HE1 1 1 19 4683 1 1 5 TRP HE3 H 4.844 -10.708 2.374 1.00 . A A . 5 TRP HE3 1 1 19 4684 1 1 5 TRP HH2 H 0.645 -11.480 2.312 1.00 . A A . 5 TRP HH2 1 1 19 4685 1 1 5 TRP HZ2 H 0.344 -10.075 0.320 1.00 . A A . 5 TRP HZ2 1 1 19 4686 1 1 5 TRP HZ3 H 2.848 -11.792 3.319 1.00 . A A . 5 TRP HZ3 1 1 19 4687 1 1 5 TRP N N 6.817 -7.623 -1.816 1.00 . A A . 5 TRP N 1 1 19 4688 1 1 5 TRP NE1 N 2.581 -8.765 -0.867 1.00 . A A . 5 TRP NE1 1 1 19 4689 1 1 5 TRP O O 6.738 -11.210 -1.721 1.00 . A A . 5 TRP O 1 1 19 4690 1 1 6 LYS C C 6.230 -11.181 -4.922 1.00 . A A . 6 LYS C 1 1 19 4691 1 1 6 LYS CA C 5.156 -10.717 -3.943 1.00 . A A . 6 LYS CA 1 1 19 4692 1 1 6 LYS CB C 3.957 -10.157 -4.711 1.00 . A A . 6 LYS CB 1 1 19 4693 1 1 6 LYS CD C 2.446 -10.966 -2.875 1.00 . A A . 6 LYS CD 1 1 19 4694 1 1 6 LYS CE C 0.982 -10.950 -2.462 1.00 . A A . 6 LYS CE 1 1 19 4695 1 1 6 LYS CG C 2.768 -9.825 -3.825 1.00 . A A . 6 LYS CG 1 1 19 4696 1 1 6 LYS H H 5.480 -8.767 -3.187 1.00 . A A . 6 LYS H 1 1 19 4697 1 1 6 LYS HA H 4.833 -11.563 -3.355 1.00 . A A . 6 LYS HA 1 1 19 4698 1 1 6 LYS HB2 H 4.262 -9.255 -5.221 1.00 . A A . 6 LYS HB2 1 1 19 4699 1 1 6 LYS HB3 H 3.641 -10.886 -5.443 1.00 . A A . 6 LYS HB3 1 1 19 4700 1 1 6 LYS HD2 H 2.660 -11.903 -3.365 1.00 . A A . 6 LYS HD2 1 1 19 4701 1 1 6 LYS HD3 H 3.061 -10.871 -1.991 1.00 . A A . 6 LYS HD3 1 1 19 4702 1 1 6 LYS HE2 H 0.783 -10.037 -1.923 1.00 . A A . 6 LYS HE2 1 1 19 4703 1 1 6 LYS HE3 H 0.371 -10.984 -3.351 1.00 . A A . 6 LYS HE3 1 1 19 4704 1 1 6 LYS HG2 H 2.997 -8.942 -3.247 1.00 . A A . 6 LYS HG2 1 1 19 4705 1 1 6 LYS HG3 H 1.907 -9.635 -4.451 1.00 . A A . 6 LYS HG3 1 1 19 4706 1 1 6 LYS HZ1 H -0.244 -11.921 -1.076 1.00 . A A . 6 LYS HZ1 1 1 19 4707 1 1 6 LYS HZ2 H 1.401 -12.280 -0.906 1.00 . A A . 6 LYS HZ2 1 1 19 4708 1 1 6 LYS HZ3 H 0.513 -12.965 -2.172 1.00 . A A . 6 LYS HZ3 1 1 19 4709 1 1 6 LYS N N 5.685 -9.713 -3.028 1.00 . A A . 6 LYS N 1 1 19 4710 1 1 6 LYS NZ N 0.639 -12.110 -1.593 1.00 . A A . 6 LYS NZ 1 1 19 4711 1 1 6 LYS O O 6.074 -12.202 -5.591 1.00 . A A . 6 LYS O 1 1 19 4712 1 1 7 ARG C C 9.308 -11.838 -5.290 1.00 . A A . 7 ARG C 1 1 19 4713 1 1 7 ARG CA C 8.418 -10.757 -5.898 1.00 . A A . 7 ARG CA 1 1 19 4714 1 1 7 ARG CB C 9.250 -9.511 -6.205 1.00 . A A . 7 ARG CB 1 1 19 4715 1 1 7 ARG CD C 9.027 -7.399 -7.550 1.00 . A A . 7 ARG CD 1 1 19 4716 1 1 7 ARG CG C 8.976 -8.918 -7.578 1.00 . A A . 7 ARG CG 1 1 19 4717 1 1 7 ARG CZ C 10.952 -6.912 -9.000 1.00 . A A . 7 ARG CZ 1 1 19 4718 1 1 7 ARG H H 7.385 -9.621 -4.442 1.00 . A A . 7 ARG H 1 1 19 4719 1 1 7 ARG HA H 7.994 -11.132 -6.818 1.00 . A A . 7 ARG HA 1 1 19 4720 1 1 7 ARG HB2 H 9.035 -8.756 -5.463 1.00 . A A . 7 ARG HB2 1 1 19 4721 1 1 7 ARG HB3 H 10.297 -9.769 -6.151 1.00 . A A . 7 ARG HB3 1 1 19 4722 1 1 7 ARG HD2 H 8.020 -7.019 -7.471 1.00 . A A . 7 ARG HD2 1 1 19 4723 1 1 7 ARG HD3 H 9.597 -7.088 -6.687 1.00 . A A . 7 ARG HD3 1 1 19 4724 1 1 7 ARG HE H 9.064 -6.413 -9.406 1.00 . A A . 7 ARG HE 1 1 19 4725 1 1 7 ARG HG2 H 9.721 -9.280 -8.271 1.00 . A A . 7 ARG HG2 1 1 19 4726 1 1 7 ARG HG3 H 7.995 -9.231 -7.905 1.00 . A A . 7 ARG HG3 1 1 19 4727 1 1 7 ARG HH11 H 11.401 -7.892 -7.292 1.00 . A A . 7 ARG HH11 1 1 19 4728 1 1 7 ARG HH12 H 12.749 -7.543 -8.323 1.00 . A A . 7 ARG HH12 1 1 19 4729 1 1 7 ARG HH21 H 10.830 -5.948 -10.772 1.00 . A A . 7 ARG HH21 1 1 19 4730 1 1 7 ARG HH22 H 12.423 -6.436 -10.302 1.00 . A A . 7 ARG HH22 1 1 19 4731 1 1 7 ARG N N 7.319 -10.424 -5.000 1.00 . A A . 7 ARG N 1 1 19 4732 1 1 7 ARG NE N 9.648 -6.850 -8.752 1.00 . A A . 7 ARG NE 1 1 19 4733 1 1 7 ARG NH1 N 11.768 -7.496 -8.134 1.00 . A A . 7 ARG NH1 1 1 19 4734 1 1 7 ARG NH2 N 11.442 -6.389 -10.117 1.00 . A A . 7 ARG NH2 1 1 19 4735 1 1 7 ARG O O 9.130 -13.027 -5.558 1.00 . A A . 7 ARG O 1 1 19 4736 1 1 8 LYS C C 10.802 -12.561 -2.363 1.00 . A A . 8 LYS C 1 1 19 4737 1 1 8 LYS CA C 11.183 -12.348 -3.825 1.00 . A A . 8 LYS CA 1 1 19 4738 1 1 8 LYS CB C 12.620 -11.828 -3.918 1.00 . A A . 8 LYS CB 1 1 19 4739 1 1 8 LYS CD C 14.097 -9.802 -3.765 1.00 . A A . 8 LYS CD 1 1 19 4740 1 1 8 LYS CE C 14.736 -9.102 -4.954 1.00 . A A . 8 LYS CE 1 1 19 4741 1 1 8 LYS CG C 12.711 -10.323 -4.105 1.00 . A A . 8 LYS CG 1 1 19 4742 1 1 8 LYS H H 10.358 -10.457 -4.298 1.00 . A A . 8 LYS H 1 1 19 4743 1 1 8 LYS HA H 11.117 -13.293 -4.343 1.00 . A A . 8 LYS HA 1 1 19 4744 1 1 8 LYS HB2 H 13.144 -12.090 -3.011 1.00 . A A . 8 LYS HB2 1 1 19 4745 1 1 8 LYS HB3 H 13.108 -12.304 -4.756 1.00 . A A . 8 LYS HB3 1 1 19 4746 1 1 8 LYS HD2 H 14.018 -9.100 -2.949 1.00 . A A . 8 LYS HD2 1 1 19 4747 1 1 8 LYS HD3 H 14.722 -10.633 -3.469 1.00 . A A . 8 LYS HD3 1 1 19 4748 1 1 8 LYS HE2 H 14.736 -9.778 -5.796 1.00 . A A . 8 LYS HE2 1 1 19 4749 1 1 8 LYS HE3 H 14.153 -8.227 -5.196 1.00 . A A . 8 LYS HE3 1 1 19 4750 1 1 8 LYS HG2 H 12.490 -10.083 -5.134 1.00 . A A . 8 LYS HG2 1 1 19 4751 1 1 8 LYS HG3 H 11.988 -9.845 -3.459 1.00 . A A . 8 LYS HG3 1 1 19 4752 1 1 8 LYS HZ1 H 16.801 -9.253 -5.232 1.00 . A A . 8 LYS HZ1 1 1 19 4753 1 1 8 LYS HZ2 H 16.350 -8.826 -3.658 1.00 . A A . 8 LYS HZ2 1 1 19 4754 1 1 8 LYS HZ3 H 16.267 -7.682 -4.901 1.00 . A A . 8 LYS HZ3 1 1 19 4755 1 1 8 LYS N N 10.266 -11.417 -4.472 1.00 . A A . 8 LYS N 1 1 19 4756 1 1 8 LYS NZ N 16.137 -8.687 -4.666 1.00 . A A . 8 LYS NZ 1 1 19 4757 1 1 8 LYS O O 10.168 -13.558 -2.016 1.00 . A A . 8 LYS O 1 1 19 4758 1 1 9 CYS C C 9.394 -11.905 0.140 1.00 . A A . 9 CYS C 1 1 19 4759 1 1 9 CYS CA C 10.888 -11.702 -0.088 1.00 . A A . 9 CYS CA 1 1 19 4760 1 1 9 CYS CB C 11.359 -10.436 0.630 1.00 . A A . 9 CYS CB 1 1 19 4761 1 1 9 CYS H H 11.693 -10.847 -1.849 1.00 . A A . 9 CYS H 1 1 19 4762 1 1 9 CYS HA H 11.420 -12.551 0.313 1.00 . A A . 9 CYS HA 1 1 19 4763 1 1 9 CYS HB2 H 11.292 -9.600 -0.050 1.00 . A A . 9 CYS HB2 1 1 19 4764 1 1 9 CYS HB3 H 10.717 -10.253 1.479 1.00 . A A . 9 CYS HB3 1 1 19 4765 1 1 9 CYS HG H 13.024 -10.790 2.528 1.00 . A A . 9 CYS HG 1 1 19 4766 1 1 9 CYS N N 11.191 -11.618 -1.512 1.00 . A A . 9 CYS N 1 1 19 4767 1 1 9 CYS O O 8.581 -11.005 -0.074 1.00 . A A . 9 CYS O 1 1 19 4768 1 1 9 CYS SG S 13.062 -10.518 1.232 1.00 . A A . 9 CYS SG 1 1 19 4769 1 1 10 PRO C C 7.065 -12.739 2.067 1.00 . A A . 10 PRO C 1 1 19 4770 1 1 10 PRO CA C 7.623 -13.465 0.848 1.00 . A A . 10 PRO CA 1 1 19 4771 1 1 10 PRO CB C 7.677 -14.973 1.102 1.00 . A A . 10 PRO CB 1 1 19 4772 1 1 10 PRO CD C 9.937 -14.235 0.859 1.00 . A A . 10 PRO CD 1 1 19 4773 1 1 10 PRO CG C 9.066 -15.228 1.576 1.00 . A A . 10 PRO CG 1 1 19 4774 1 1 10 PRO HA H 6.995 -13.264 -0.008 1.00 . A A . 10 PRO HA 1 1 19 4775 1 1 10 PRO HB2 H 6.947 -15.241 1.853 1.00 . A A . 10 PRO HB2 1 1 19 4776 1 1 10 PRO HB3 H 7.470 -15.504 0.185 1.00 . A A . 10 PRO HB3 1 1 19 4777 1 1 10 PRO HD2 H 10.752 -13.919 1.494 1.00 . A A . 10 PRO HD2 1 1 19 4778 1 1 10 PRO HD3 H 10.315 -14.658 -0.060 1.00 . A A . 10 PRO HD3 1 1 19 4779 1 1 10 PRO HG2 H 9.124 -15.076 2.643 1.00 . A A . 10 PRO HG2 1 1 19 4780 1 1 10 PRO HG3 H 9.361 -16.236 1.323 1.00 . A A . 10 PRO HG3 1 1 19 4781 1 1 10 PRO N N 9.022 -13.115 0.583 1.00 . A A . 10 PRO N 1 1 19 4782 1 1 10 PRO O O 5.855 -12.731 2.298 1.00 . A A . 10 PRO O 1 1 19 4783 1 1 11 LEU C C 7.983 -9.940 3.962 1.00 . A A . 11 LEU C 1 1 19 4784 1 1 11 LEU CA C 7.549 -11.400 4.042 1.00 . A A . 11 LEU CA 1 1 19 4785 1 1 11 LEU CB C 8.147 -12.054 5.288 1.00 . A A . 11 LEU CB 1 1 19 4786 1 1 11 LEU CD1 C 10.439 -12.200 6.293 1.00 . A A . 11 LEU CD1 1 1 19 4787 1 1 11 LEU CD2 C 9.500 -14.150 5.039 1.00 . A A . 11 LEU CD2 1 1 19 4788 1 1 11 LEU CG C 9.554 -12.632 5.134 1.00 . A A . 11 LEU CG 1 1 19 4789 1 1 11 LEU H H 8.903 -12.172 2.610 1.00 . A A . 11 LEU H 1 1 19 4790 1 1 11 LEU HA H 6.472 -11.440 4.106 1.00 . A A . 11 LEU HA 1 1 19 4791 1 1 11 LEU HB2 H 8.180 -11.310 6.069 1.00 . A A . 11 LEU HB2 1 1 19 4792 1 1 11 LEU HB3 H 7.489 -12.858 5.587 1.00 . A A . 11 LEU HB3 1 1 19 4793 1 1 11 LEU HD11 H 11.366 -12.753 6.263 1.00 . A A . 11 LEU HD11 1 1 19 4794 1 1 11 LEU HD12 H 9.932 -12.396 7.225 1.00 . A A . 11 LEU HD12 1 1 19 4795 1 1 11 LEU HD13 H 10.647 -11.143 6.212 1.00 . A A . 11 LEU HD13 1 1 19 4796 1 1 11 LEU HD21 H 8.629 -14.444 4.473 1.00 . A A . 11 LEU HD21 1 1 19 4797 1 1 11 LEU HD22 H 9.445 -14.570 6.032 1.00 . A A . 11 LEU HD22 1 1 19 4798 1 1 11 LEU HD23 H 10.390 -14.512 4.544 1.00 . A A . 11 LEU HD23 1 1 19 4799 1 1 11 LEU HG H 9.993 -12.254 4.220 1.00 . A A . 11 LEU HG 1 1 19 4800 1 1 11 LEU N N 7.953 -12.130 2.845 1.00 . A A . 11 LEU N 1 1 19 4801 1 1 11 LEU O O 8.171 -9.281 4.984 1.00 . A A . 11 LEU O 1 1 19 4802 1 1 12 PHE C C 7.371 -7.106 2.706 1.00 . A A . 12 PHE C 1 1 19 4803 1 1 12 PHE CA C 8.550 -8.058 2.526 1.00 . A A . 12 PHE CA 1 1 19 4804 1 1 12 PHE CB C 9.145 -7.891 1.127 1.00 . A A . 12 PHE CB 1 1 19 4805 1 1 12 PHE CD1 C 11.497 -7.522 1.920 1.00 . A A . 12 PHE CD1 1 1 19 4806 1 1 12 PHE CD2 C 10.602 -6.026 0.293 1.00 . A A . 12 PHE CD2 1 1 19 4807 1 1 12 PHE CE1 C 12.691 -6.825 1.910 1.00 . A A . 12 PHE CE1 1 1 19 4808 1 1 12 PHE CE2 C 11.793 -5.325 0.278 1.00 . A A . 12 PHE CE2 1 1 19 4809 1 1 12 PHE CG C 10.441 -7.131 1.113 1.00 . A A . 12 PHE CG 1 1 19 4810 1 1 12 PHE CZ C 12.838 -5.724 1.088 1.00 . A A . 12 PHE CZ 1 1 19 4811 1 1 12 PHE H H 7.974 -10.016 1.964 1.00 . A A . 12 PHE H 1 1 19 4812 1 1 12 PHE HA H 9.304 -7.820 3.260 1.00 . A A . 12 PHE HA 1 1 19 4813 1 1 12 PHE HB2 H 9.330 -8.867 0.703 1.00 . A A . 12 PHE HB2 1 1 19 4814 1 1 12 PHE HB3 H 8.441 -7.360 0.505 1.00 . A A . 12 PHE HB3 1 1 19 4815 1 1 12 PHE HD1 H 11.382 -8.383 2.563 1.00 . A A . 12 PHE HD1 1 1 19 4816 1 1 12 PHE HD2 H 9.785 -5.711 -0.340 1.00 . A A . 12 PHE HD2 1 1 19 4817 1 1 12 PHE HE1 H 13.506 -7.140 2.544 1.00 . A A . 12 PHE HE1 1 1 19 4818 1 1 12 PHE HE2 H 11.906 -4.465 -0.364 1.00 . A A . 12 PHE HE2 1 1 19 4819 1 1 12 PHE HZ H 13.770 -5.179 1.078 1.00 . A A . 12 PHE HZ 1 1 19 4820 1 1 12 PHE N N 8.139 -9.441 2.740 1.00 . A A . 12 PHE N 1 1 19 4821 1 1 12 PHE O O 7.492 -5.902 2.486 1.00 . A A . 12 PHE O 1 1 19 4822 1 1 13 GLY C C 5.327 -5.600 4.129 1.00 . A A . 13 GLY C 1 1 19 4823 1 1 13 GLY CA C 5.044 -6.844 3.310 1.00 . A A . 13 GLY CA 1 1 19 4824 1 1 13 GLY H H 6.191 -8.623 3.268 1.00 . A A . 13 GLY H 1 1 19 4825 1 1 13 GLY HA2 H 4.656 -6.548 2.347 1.00 . A A . 13 GLY HA2 1 1 19 4826 1 1 13 GLY HA3 H 4.299 -7.436 3.822 1.00 . A A . 13 GLY HA3 1 1 19 4827 1 1 13 GLY N N 6.229 -7.657 3.108 1.00 . A A . 13 GLY N 1 1 19 4828 1 1 13 GLY O O 4.672 -4.572 3.958 1.00 . A A . 13 GLY O 1 1 19 4829 1 1 14 LYS C C 7.234 -3.418 5.042 1.00 . A A . 14 LYS C 1 1 19 4830 1 1 14 LYS CA C 6.674 -4.567 5.874 1.00 . A A . 14 LYS CA 1 1 19 4831 1 1 14 LYS CB C 7.706 -5.005 6.916 1.00 . A A . 14 LYS CB 1 1 19 4832 1 1 14 LYS CD C 9.806 -3.676 7.279 1.00 . A A . 14 LYS CD 1 1 19 4833 1 1 14 LYS CE C 10.161 -2.211 7.076 1.00 . A A . 14 LYS CE 1 1 19 4834 1 1 14 LYS CG C 8.346 -3.847 7.662 1.00 . A A . 14 LYS CG 1 1 19 4835 1 1 14 LYS H H 6.792 -6.539 5.114 1.00 . A A . 14 LYS H 1 1 19 4836 1 1 14 LYS HA H 5.784 -4.228 6.381 1.00 . A A . 14 LYS HA 1 1 19 4837 1 1 14 LYS HB2 H 7.221 -5.647 7.637 1.00 . A A . 14 LYS HB2 1 1 19 4838 1 1 14 LYS HB3 H 8.487 -5.562 6.420 1.00 . A A . 14 LYS HB3 1 1 19 4839 1 1 14 LYS HD2 H 10.426 -4.079 8.066 1.00 . A A . 14 LYS HD2 1 1 19 4840 1 1 14 LYS HD3 H 9.993 -4.214 6.360 1.00 . A A . 14 LYS HD3 1 1 19 4841 1 1 14 LYS HE2 H 10.135 -1.991 6.020 1.00 . A A . 14 LYS HE2 1 1 19 4842 1 1 14 LYS HE3 H 9.430 -1.603 7.588 1.00 . A A . 14 LYS HE3 1 1 19 4843 1 1 14 LYS HG2 H 7.813 -2.939 7.424 1.00 . A A . 14 LYS HG2 1 1 19 4844 1 1 14 LYS HG3 H 8.282 -4.036 8.725 1.00 . A A . 14 LYS HG3 1 1 19 4845 1 1 14 LYS HZ1 H 11.777 -0.916 7.351 1.00 . A A . 14 LYS HZ1 1 1 19 4846 1 1 14 LYS HZ2 H 12.219 -2.543 7.204 1.00 . A A . 14 LYS HZ2 1 1 19 4847 1 1 14 LYS HZ3 H 11.526 -1.982 8.641 1.00 . A A . 14 LYS HZ3 1 1 19 4848 1 1 14 LYS N N 6.305 -5.693 5.024 1.00 . A A . 14 LYS N 1 1 19 4849 1 1 14 LYS NZ N 11.516 -1.890 7.605 1.00 . A A . 14 LYS NZ 1 1 19 4850 1 1 14 LYS O O 6.933 -2.252 5.294 1.00 . A A . 14 LYS O 1 1 19 4851 1 1 15 GLY C C 7.785 -2.443 1.975 1.00 . A A . 15 GLY C 1 1 19 4852 1 1 15 GLY CA C 8.637 -2.739 3.193 1.00 . A A . 15 GLY CA 1 1 19 4853 1 1 15 GLY H H 8.255 -4.701 3.893 1.00 . A A . 15 GLY H 1 1 19 4854 1 1 15 GLY HA2 H 8.760 -1.831 3.763 1.00 . A A . 15 GLY HA2 1 1 19 4855 1 1 15 GLY HA3 H 9.608 -3.080 2.864 1.00 . A A . 15 GLY HA3 1 1 19 4856 1 1 15 GLY N N 8.050 -3.755 4.047 1.00 . A A . 15 GLY N 1 1 19 4857 1 1 15 GLY O O 6.838 -1.661 2.046 1.00 . A A . 15 GLY O 1 1 19 4858 1 1 16 GLY C C 8.272 -2.641 -1.574 1.00 . A A . 16 GLY C 1 1 19 4859 1 1 16 GLY CA C 7.373 -2.854 -0.372 1.00 . A A . 16 GLY CA 1 1 19 4860 1 1 16 GLY H H 8.888 -3.683 0.854 1.00 . A A . 16 GLY H 1 1 19 4861 1 1 16 GLY HA2 H 6.745 -3.714 -0.553 1.00 . A A . 16 GLY HA2 1 1 19 4862 1 1 16 GLY HA3 H 6.746 -1.983 -0.248 1.00 . A A . 16 GLY HA3 1 1 19 4863 1 1 16 GLY N N 8.123 -3.069 0.851 1.00 . A A . 16 GLY N 1 1 19 4864 1 1 16 GLY O O 9.402 -2.173 -1.436 1.00 . A A . 16 GLY O 1 1 20 4865 1 1 1 VAL C C 2.955 -0.983 -1.629 1.00 . A A . 1 VAL C 1 1 20 4866 1 1 1 VAL CA C 1.603 -0.279 -1.582 1.00 . A A . 1 VAL CA 1 1 20 4867 1 1 1 VAL CB C 0.675 -0.903 -2.641 1.00 . A A . 1 VAL CB 1 1 20 4868 1 1 1 VAL CG1 C -0.724 -0.316 -2.537 1.00 . A A . 1 VAL CG1 1 1 20 4869 1 1 1 VAL CG2 C 1.246 -0.698 -4.036 1.00 . A A . 1 VAL CG2 1 1 20 4870 1 1 1 VAL H1 H 2.553 1.607 -1.445 1.00 . A A . 1 VAL H1 1 1 20 4871 1 1 1 VAL HA H 1.161 -0.436 -0.609 1.00 . A A . 1 VAL HA 1 1 20 4872 1 1 1 VAL HB H 0.610 -1.965 -2.454 1.00 . A A . 1 VAL HB 1 1 20 4873 1 1 1 VAL HG11 H -1.445 -1.038 -2.891 1.00 . A A . 1 VAL HG11 1 1 20 4874 1 1 1 VAL HG12 H -0.936 -0.069 -1.507 1.00 . A A . 1 VAL HG12 1 1 20 4875 1 1 1 VAL HG13 H -0.785 0.578 -3.141 1.00 . A A . 1 VAL HG13 1 1 20 4876 1 1 1 VAL HG21 H 0.496 -0.247 -4.669 1.00 . A A . 1 VAL HG21 1 1 20 4877 1 1 1 VAL HG22 H 2.107 -0.050 -3.980 1.00 . A A . 1 VAL HG22 1 1 20 4878 1 1 1 VAL HG23 H 1.540 -1.652 -4.449 1.00 . A A . 1 VAL HG23 1 1 20 4879 1 1 1 VAL N N 1.751 1.157 -1.784 1.00 . A A . 1 VAL N 1 1 20 4880 1 1 1 VAL O O 3.792 -0.684 -2.480 1.00 . A A . 1 VAL O 1 1 20 4881 1 1 2 ALA C C 4.290 -3.999 -1.382 1.00 . A A . 2 ALA C 1 1 20 4882 1 1 2 ALA CA C 4.410 -2.668 -0.648 1.00 . A A . 2 ALA CA 1 1 20 4883 1 1 2 ALA CB C 4.817 -2.897 0.801 1.00 . A A . 2 ALA CB 1 1 20 4884 1 1 2 ALA H H 2.455 -2.113 -0.058 1.00 . A A . 2 ALA H 1 1 20 4885 1 1 2 ALA HA H 5.179 -2.075 -1.122 1.00 . A A . 2 ALA HA 1 1 20 4886 1 1 2 ALA HB1 H 5.373 -2.042 1.157 1.00 . A A . 2 ALA HB1 1 1 20 4887 1 1 2 ALA HB2 H 3.933 -3.030 1.406 1.00 . A A . 2 ALA HB2 1 1 20 4888 1 1 2 ALA HB3 H 5.434 -3.781 0.865 1.00 . A A . 2 ALA HB3 1 1 20 4889 1 1 2 ALA N N 3.161 -1.920 -0.709 1.00 . A A . 2 ALA N 1 1 20 4890 1 1 2 ALA O O 4.553 -5.059 -0.814 1.00 . A A . 2 ALA O 1 1 20 4891 1 1 3 ARG C C 5.070 -5.849 -3.642 1.00 . A A . 3 ARG C 1 1 20 4892 1 1 3 ARG CA C 3.732 -5.137 -3.460 1.00 . A A . 3 ARG CA 1 1 20 4893 1 1 3 ARG CB C 3.142 -4.782 -4.826 1.00 . A A . 3 ARG CB 1 1 20 4894 1 1 3 ARG CD C 4.048 -5.847 -6.914 1.00 . A A . 3 ARG CD 1 1 20 4895 1 1 3 ARG CG C 3.047 -5.965 -5.775 1.00 . A A . 3 ARG CG 1 1 20 4896 1 1 3 ARG CZ C 3.666 -7.963 -8.104 1.00 . A A . 3 ARG CZ 1 1 20 4897 1 1 3 ARG H H 3.695 -3.062 -3.046 1.00 . A A . 3 ARG H 1 1 20 4898 1 1 3 ARG HA H 3.053 -5.799 -2.945 1.00 . A A . 3 ARG HA 1 1 20 4899 1 1 3 ARG HB2 H 2.148 -4.383 -4.683 1.00 . A A . 3 ARG HB2 1 1 20 4900 1 1 3 ARG HB3 H 3.761 -4.027 -5.286 1.00 . A A . 3 ARG HB3 1 1 20 4901 1 1 3 ARG HD2 H 3.593 -5.290 -7.719 1.00 . A A . 3 ARG HD2 1 1 20 4902 1 1 3 ARG HD3 H 4.918 -5.316 -6.557 1.00 . A A . 3 ARG HD3 1 1 20 4903 1 1 3 ARG HE H 5.381 -7.441 -7.230 1.00 . A A . 3 ARG HE 1 1 20 4904 1 1 3 ARG HG2 H 3.250 -6.873 -5.226 1.00 . A A . 3 ARG HG2 1 1 20 4905 1 1 3 ARG HG3 H 2.050 -6.005 -6.186 1.00 . A A . 3 ARG HG3 1 1 20 4906 1 1 3 ARG HH11 H 2.077 -6.717 -8.054 1.00 . A A . 3 ARG HH11 1 1 20 4907 1 1 3 ARG HH12 H 1.820 -8.212 -8.890 1.00 . A A . 3 ARG HH12 1 1 20 4908 1 1 3 ARG HH21 H 5.056 -9.414 -8.329 1.00 . A A . 3 ARG HH21 1 1 20 4909 1 1 3 ARG HH22 H 3.515 -9.746 -9.045 1.00 . A A . 3 ARG HH22 1 1 20 4910 1 1 3 ARG N N 3.890 -3.936 -2.648 1.00 . A A . 3 ARG N 1 1 20 4911 1 1 3 ARG NE N 4.463 -7.154 -7.416 1.00 . A A . 3 ARG NE 1 1 20 4912 1 1 3 ARG NH1 N 2.418 -7.601 -8.371 1.00 . A A . 3 ARG NH1 1 1 20 4913 1 1 3 ARG NH2 N 4.116 -9.137 -8.528 1.00 . A A . 3 ARG NH2 1 1 20 4914 1 1 3 ARG O O 5.118 -7.001 -4.073 1.00 . A A . 3 ARG O 1 1 20 4915 1 1 4 GLY C C 7.614 -7.045 -2.694 1.00 . A A . 4 GLY C 1 1 20 4916 1 1 4 GLY CA C 7.477 -5.736 -3.445 1.00 . A A . 4 GLY CA 1 1 20 4917 1 1 4 GLY H H 6.055 -4.240 -2.972 1.00 . A A . 4 GLY H 1 1 20 4918 1 1 4 GLY HA2 H 7.677 -5.911 -4.492 1.00 . A A . 4 GLY HA2 1 1 20 4919 1 1 4 GLY HA3 H 8.206 -5.037 -3.062 1.00 . A A . 4 GLY HA3 1 1 20 4920 1 1 4 GLY N N 6.154 -5.155 -3.311 1.00 . A A . 4 GLY N 1 1 20 4921 1 1 4 GLY O O 8.514 -7.838 -2.973 1.00 . A A . 4 GLY O 1 1 20 4922 1 1 5 TRP C C 6.188 -9.672 -1.733 1.00 . A A . 5 TRP C 1 1 20 4923 1 1 5 TRP CA C 6.748 -8.495 -0.942 1.00 . A A . 5 TRP CA 1 1 20 4924 1 1 5 TRP CB C 5.949 -8.305 0.349 1.00 . A A . 5 TRP CB 1 1 20 4925 1 1 5 TRP CD1 C 3.782 -7.719 -0.888 1.00 . A A . 5 TRP CD1 1 1 20 4926 1 1 5 TRP CD2 C 3.483 -8.940 0.966 1.00 . A A . 5 TRP CD2 1 1 20 4927 1 1 5 TRP CE2 C 2.224 -8.688 0.386 1.00 . A A . 5 TRP CE2 1 1 20 4928 1 1 5 TRP CE3 C 3.544 -9.692 2.143 1.00 . A A . 5 TRP CE3 1 1 20 4929 1 1 5 TRP CG C 4.466 -8.312 0.136 1.00 . A A . 5 TRP CG 1 1 20 4930 1 1 5 TRP CH2 C 1.129 -9.894 2.096 1.00 . A A . 5 TRP CH2 1 1 20 4931 1 1 5 TRP CZ2 C 1.040 -9.161 0.944 1.00 . A A . 5 TRP CZ2 1 1 20 4932 1 1 5 TRP CZ3 C 2.367 -10.160 2.695 1.00 . A A . 5 TRP CZ3 1 1 20 4933 1 1 5 TRP H H 6.027 -6.603 -1.561 1.00 . A A . 5 TRP H 1 1 20 4934 1 1 5 TRP HA H 7.777 -8.703 -0.690 1.00 . A A . 5 TRP HA 1 1 20 4935 1 1 5 TRP HB2 H 6.191 -9.103 1.035 1.00 . A A . 5 TRP HB2 1 1 20 4936 1 1 5 TRP HB3 H 6.218 -7.358 0.794 1.00 . A A . 5 TRP HB3 1 1 20 4937 1 1 5 TRP HD1 H 4.246 -7.160 -1.685 1.00 . A A . 5 TRP HD1 1 1 20 4938 1 1 5 TRP HE1 H 1.736 -7.618 -1.351 1.00 . A A . 5 TRP HE1 1 1 20 4939 1 1 5 TRP HE3 H 4.489 -9.907 2.619 1.00 . A A . 5 TRP HE3 1 1 20 4940 1 1 5 TRP HH2 H 0.236 -10.280 2.563 1.00 . A A . 5 TRP HH2 1 1 20 4941 1 1 5 TRP HZ2 H 0.078 -8.965 0.494 1.00 . A A . 5 TRP HZ2 1 1 20 4942 1 1 5 TRP HZ3 H 2.395 -10.743 3.605 1.00 . A A . 5 TRP HZ3 1 1 20 4943 1 1 5 TRP N N 6.721 -7.273 -1.737 1.00 . A A . 5 TRP N 1 1 20 4944 1 1 5 TRP NE1 N 2.434 -7.941 -0.743 1.00 . A A . 5 TRP NE1 1 1 20 4945 1 1 5 TRP O O 6.356 -10.829 -1.347 1.00 . A A . 5 TRP O 1 1 20 4946 1 1 6 LYS C C 5.957 -10.919 -4.698 1.00 . A A . 6 LYS C 1 1 20 4947 1 1 6 LYS CA C 4.937 -10.402 -3.689 1.00 . A A . 6 LYS CA 1 1 20 4948 1 1 6 LYS CB C 3.710 -9.856 -4.422 1.00 . A A . 6 LYS CB 1 1 20 4949 1 1 6 LYS CD C 2.341 -10.390 -2.384 1.00 . A A . 6 LYS CD 1 1 20 4950 1 1 6 LYS CE C 1.904 -11.734 -2.945 1.00 . A A . 6 LYS CE 1 1 20 4951 1 1 6 LYS CG C 2.606 -9.384 -3.492 1.00 . A A . 6 LYS CG 1 1 20 4952 1 1 6 LYS H H 5.420 -8.428 -3.097 1.00 . A A . 6 LYS H 1 1 20 4953 1 1 6 LYS HA H 4.631 -11.220 -3.053 1.00 . A A . 6 LYS HA 1 1 20 4954 1 1 6 LYS HB2 H 4.014 -9.022 -5.037 1.00 . A A . 6 LYS HB2 1 1 20 4955 1 1 6 LYS HB3 H 3.309 -10.633 -5.056 1.00 . A A . 6 LYS HB3 1 1 20 4956 1 1 6 LYS HD2 H 3.246 -10.528 -1.812 1.00 . A A . 6 LYS HD2 1 1 20 4957 1 1 6 LYS HD3 H 1.561 -10.007 -1.741 1.00 . A A . 6 LYS HD3 1 1 20 4958 1 1 6 LYS HE2 H 0.903 -11.945 -2.602 1.00 . A A . 6 LYS HE2 1 1 20 4959 1 1 6 LYS HE3 H 1.911 -11.678 -4.024 1.00 . A A . 6 LYS HE3 1 1 20 4960 1 1 6 LYS HG2 H 2.899 -8.444 -3.047 1.00 . A A . 6 LYS HG2 1 1 20 4961 1 1 6 LYS HG3 H 1.699 -9.245 -4.064 1.00 . A A . 6 LYS HG3 1 1 20 4962 1 1 6 LYS HZ1 H 3.398 -13.149 -3.308 1.00 . A A . 6 LYS HZ1 1 1 20 4963 1 1 6 LYS HZ2 H 2.247 -13.644 -2.172 1.00 . A A . 6 LYS HZ2 1 1 20 4964 1 1 6 LYS HZ3 H 3.425 -12.509 -1.742 1.00 . A A . 6 LYS HZ3 1 1 20 4965 1 1 6 LYS N N 5.521 -9.370 -2.842 1.00 . A A . 6 LYS N 1 1 20 4966 1 1 6 LYS NZ N 2.807 -12.836 -2.512 1.00 . A A . 6 LYS NZ 1 1 20 4967 1 1 6 LYS O O 5.751 -11.958 -5.326 1.00 . A A . 6 LYS O 1 1 20 4968 1 1 7 ARG C C 8.983 -11.677 -5.190 1.00 . A A . 7 ARG C 1 1 20 4969 1 1 7 ARG CA C 8.108 -10.574 -5.781 1.00 . A A . 7 ARG CA 1 1 20 4970 1 1 7 ARG CB C 8.970 -9.363 -6.140 1.00 . A A . 7 ARG CB 1 1 20 4971 1 1 7 ARG CD C 9.093 -7.057 -7.134 1.00 . A A . 7 ARG CD 1 1 20 4972 1 1 7 ARG CG C 8.194 -8.239 -6.808 1.00 . A A . 7 ARG CG 1 1 20 4973 1 1 7 ARG CZ C 10.743 -6.407 -8.837 1.00 . A A . 7 ARG CZ 1 1 20 4974 1 1 7 ARG H H 7.163 -9.371 -4.319 1.00 . A A . 7 ARG H 1 1 20 4975 1 1 7 ARG HA H 7.636 -10.948 -6.678 1.00 . A A . 7 ARG HA 1 1 20 4976 1 1 7 ARG HB2 H 9.418 -8.974 -5.238 1.00 . A A . 7 ARG HB2 1 1 20 4977 1 1 7 ARG HB3 H 9.753 -9.680 -6.813 1.00 . A A . 7 ARG HB3 1 1 20 4978 1 1 7 ARG HD2 H 8.475 -6.194 -7.326 1.00 . A A . 7 ARG HD2 1 1 20 4979 1 1 7 ARG HD3 H 9.730 -6.862 -6.284 1.00 . A A . 7 ARG HD3 1 1 20 4980 1 1 7 ARG HE H 9.880 -8.201 -8.712 1.00 . A A . 7 ARG HE 1 1 20 4981 1 1 7 ARG HG2 H 7.759 -8.610 -7.724 1.00 . A A . 7 ARG HG2 1 1 20 4982 1 1 7 ARG HG3 H 7.410 -7.911 -6.142 1.00 . A A . 7 ARG HG3 1 1 20 4983 1 1 7 ARG HH11 H 10.284 -4.962 -7.502 1.00 . A A . 7 ARG HH11 1 1 20 4984 1 1 7 ARG HH12 H 11.446 -4.517 -8.708 1.00 . A A . 7 ARG HH12 1 1 20 4985 1 1 7 ARG HH21 H 11.408 -7.627 -10.305 1.00 . A A . 7 ARG HH21 1 1 20 4986 1 1 7 ARG HH22 H 12.084 -6.033 -10.302 1.00 . A A . 7 ARG HH22 1 1 20 4987 1 1 7 ARG N N 7.057 -10.189 -4.848 1.00 . A A . 7 ARG N 1 1 20 4988 1 1 7 ARG NE N 9.929 -7.312 -8.304 1.00 . A A . 7 ARG NE 1 1 20 4989 1 1 7 ARG NH1 N 10.831 -5.196 -8.306 1.00 . A A . 7 ARG NH1 1 1 20 4990 1 1 7 ARG NH2 N 11.472 -6.715 -9.902 1.00 . A A . 7 ARG NH2 1 1 20 4991 1 1 7 ARG O O 8.790 -12.858 -5.477 1.00 . A A . 7 ARG O 1 1 20 4992 1 1 8 LYS C C 10.451 -12.480 -2.278 1.00 . A A . 8 LYS C 1 1 20 4993 1 1 8 LYS CA C 10.849 -12.235 -3.730 1.00 . A A . 8 LYS CA 1 1 20 4994 1 1 8 LYS CB C 12.289 -11.723 -3.795 1.00 . A A . 8 LYS CB 1 1 20 4995 1 1 8 LYS CD C 13.780 -9.713 -3.577 1.00 . A A . 8 LYS CD 1 1 20 4996 1 1 8 LYS CE C 14.759 -9.895 -4.727 1.00 . A A . 8 LYS CE 1 1 20 4997 1 1 8 LYS CG C 12.393 -10.214 -3.942 1.00 . A A . 8 LYS CG 1 1 20 4998 1 1 8 LYS H H 10.049 -10.325 -4.173 1.00 . A A . 8 LYS H 1 1 20 4999 1 1 8 LYS HA H 10.782 -13.166 -4.272 1.00 . A A . 8 LYS HA 1 1 20 5000 1 1 8 LYS HB2 H 12.803 -12.011 -2.890 1.00 . A A . 8 LYS HB2 1 1 20 5001 1 1 8 LYS HB3 H 12.783 -12.180 -4.640 1.00 . A A . 8 LYS HB3 1 1 20 5002 1 1 8 LYS HD2 H 13.721 -8.662 -3.333 1.00 . A A . 8 LYS HD2 1 1 20 5003 1 1 8 LYS HD3 H 14.139 -10.264 -2.719 1.00 . A A . 8 LYS HD3 1 1 20 5004 1 1 8 LYS HE2 H 14.968 -10.948 -4.841 1.00 . A A . 8 LYS HE2 1 1 20 5005 1 1 8 LYS HE3 H 14.306 -9.518 -5.632 1.00 . A A . 8 LYS HE3 1 1 20 5006 1 1 8 LYS HG2 H 12.183 -9.946 -4.967 1.00 . A A . 8 LYS HG2 1 1 20 5007 1 1 8 LYS HG3 H 11.668 -9.748 -3.290 1.00 . A A . 8 LYS HG3 1 1 20 5008 1 1 8 LYS HZ1 H 15.851 -8.261 -4.018 1.00 . A A . 8 LYS HZ1 1 1 20 5009 1 1 8 LYS HZ2 H 16.521 -8.990 -5.390 1.00 . A A . 8 LYS HZ2 1 1 20 5010 1 1 8 LYS HZ3 H 16.662 -9.739 -3.881 1.00 . A A . 8 LYS HZ3 1 1 20 5011 1 1 8 LYS N N 9.945 -11.282 -4.363 1.00 . A A . 8 LYS N 1 1 20 5012 1 1 8 LYS NZ N 16.038 -9.170 -4.487 1.00 . A A . 8 LYS NZ 1 1 20 5013 1 1 8 LYS O O 9.803 -13.479 -1.963 1.00 . A A . 8 LYS O 1 1 20 5014 1 1 9 CYS C C 9.015 -11.656 0.243 1.00 . A A . 9 CYS C 1 1 20 5015 1 1 9 CYS CA C 10.523 -11.681 0.019 1.00 . A A . 9 CYS CA 1 1 20 5016 1 1 9 CYS CB C 11.187 -10.550 0.807 1.00 . A A . 9 CYS CB 1 1 20 5017 1 1 9 CYS H H 11.354 -10.789 -1.711 1.00 . A A . 9 CYS H 1 1 20 5018 1 1 9 CYS HA H 10.911 -12.626 0.368 1.00 . A A . 9 CYS HA 1 1 20 5019 1 1 9 CYS HB2 H 11.117 -9.635 0.236 1.00 . A A . 9 CYS HB2 1 1 20 5020 1 1 9 CYS HB3 H 10.667 -10.421 1.745 1.00 . A A . 9 CYS HB3 1 1 20 5021 1 1 9 CYS HG H 13.211 -12.097 0.891 1.00 . A A . 9 CYS HG 1 1 20 5022 1 1 9 CYS N N 10.840 -11.563 -1.399 1.00 . A A . 9 CYS N 1 1 20 5023 1 1 9 CYS O O 8.348 -10.642 0.033 1.00 . A A . 9 CYS O 1 1 20 5024 1 1 9 CYS SG S 12.934 -10.834 1.177 1.00 . A A . 9 CYS SG 1 1 20 5025 1 1 10 PRO C C 6.581 -12.137 2.161 1.00 . A A . 10 PRO C 1 1 20 5026 1 1 10 PRO CA C 7.026 -12.933 0.939 1.00 . A A . 10 PRO CA 1 1 20 5027 1 1 10 PRO CB C 6.850 -14.434 1.184 1.00 . A A . 10 PRO CB 1 1 20 5028 1 1 10 PRO CD C 9.197 -14.045 0.950 1.00 . A A . 10 PRO CD 1 1 20 5029 1 1 10 PRO CG C 8.183 -14.899 1.660 1.00 . A A . 10 PRO CG 1 1 20 5030 1 1 10 PRO HA H 6.438 -12.635 0.083 1.00 . A A . 10 PRO HA 1 1 20 5031 1 1 10 PRO HB2 H 6.085 -14.591 1.932 1.00 . A A . 10 PRO HB2 1 1 20 5032 1 1 10 PRO HB3 H 6.566 -14.922 0.264 1.00 . A A . 10 PRO HB3 1 1 20 5033 1 1 10 PRO HD2 H 10.048 -13.860 1.588 1.00 . A A . 10 PRO HD2 1 1 20 5034 1 1 10 PRO HD3 H 9.508 -14.516 0.029 1.00 . A A . 10 PRO HD3 1 1 20 5035 1 1 10 PRO HG2 H 8.260 -14.763 2.728 1.00 . A A . 10 PRO HG2 1 1 20 5036 1 1 10 PRO HG3 H 8.322 -15.938 1.401 1.00 . A A . 10 PRO HG3 1 1 20 5037 1 1 10 PRO N N 8.462 -12.798 0.678 1.00 . A A . 10 PRO N 1 1 20 5038 1 1 10 PRO O O 5.385 -11.982 2.413 1.00 . A A . 10 PRO O 1 1 20 5039 1 1 11 LEU C C 7.851 -9.453 4.010 1.00 . A A . 11 LEU C 1 1 20 5040 1 1 11 LEU CA C 7.258 -10.854 4.116 1.00 . A A . 11 LEU CA 1 1 20 5041 1 1 11 LEU CB C 7.807 -11.560 5.356 1.00 . A A . 11 LEU CB 1 1 20 5042 1 1 11 LEU CD1 C 10.118 -11.830 6.290 1.00 . A A . 11 LEU CD1 1 1 20 5043 1 1 11 LEU CD2 C 8.985 -13.767 5.187 1.00 . A A . 11 LEU CD2 1 1 20 5044 1 1 11 LEU CG C 9.159 -12.256 5.189 1.00 . A A . 11 LEU CG 1 1 20 5045 1 1 11 LEU H H 8.484 -11.792 2.668 1.00 . A A . 11 LEU H 1 1 20 5046 1 1 11 LEU HA H 6.185 -10.772 4.204 1.00 . A A . 11 LEU HA 1 1 20 5047 1 1 11 LEU HB2 H 7.909 -10.824 6.138 1.00 . A A . 11 LEU HB2 1 1 20 5048 1 1 11 LEU HB3 H 7.086 -12.306 5.658 1.00 . A A . 11 LEU HB3 1 1 20 5049 1 1 11 LEU HD11 H 9.634 -11.933 7.249 1.00 . A A . 11 LEU HD11 1 1 20 5050 1 1 11 LEU HD12 H 10.404 -10.799 6.139 1.00 . A A . 11 LEU HD12 1 1 20 5051 1 1 11 LEU HD13 H 10.999 -12.455 6.262 1.00 . A A . 11 LEU HD13 1 1 20 5052 1 1 11 LEU HD21 H 8.827 -14.113 6.197 1.00 . A A . 11 LEU HD21 1 1 20 5053 1 1 11 LEU HD22 H 9.872 -14.231 4.782 1.00 . A A . 11 LEU HD22 1 1 20 5054 1 1 11 LEU HD23 H 8.132 -14.030 4.578 1.00 . A A . 11 LEU HD23 1 1 20 5055 1 1 11 LEU HG H 9.591 -11.966 4.241 1.00 . A A . 11 LEU HG 1 1 20 5056 1 1 11 LEU N N 7.550 -11.635 2.919 1.00 . A A . 11 LEU N 1 1 20 5057 1 1 11 LEU O O 8.126 -8.805 5.021 1.00 . A A . 11 LEU O 1 1 20 5058 1 1 12 PHE C C 7.535 -6.586 2.699 1.00 . A A . 12 PHE C 1 1 20 5059 1 1 12 PHE CA C 8.604 -7.663 2.542 1.00 . A A . 12 PHE CA 1 1 20 5060 1 1 12 PHE CB C 9.217 -7.589 1.142 1.00 . A A . 12 PHE CB 1 1 20 5061 1 1 12 PHE CD1 C 11.552 -7.011 1.854 1.00 . A A . 12 PHE CD1 1 1 20 5062 1 1 12 PHE CD2 C 10.494 -5.637 0.218 1.00 . A A . 12 PHE CD2 1 1 20 5063 1 1 12 PHE CE1 C 12.684 -6.220 1.790 1.00 . A A . 12 PHE CE1 1 1 20 5064 1 1 12 PHE CE2 C 11.623 -4.842 0.150 1.00 . A A . 12 PHE CE2 1 1 20 5065 1 1 12 PHE CG C 10.446 -6.729 1.070 1.00 . A A . 12 PHE CG 1 1 20 5066 1 1 12 PHE CZ C 12.720 -5.135 0.936 1.00 . A A . 12 PHE CZ 1 1 20 5067 1 1 12 PHE H H 7.806 -9.552 2.014 1.00 . A A . 12 PHE H 1 1 20 5068 1 1 12 PHE HA H 9.379 -7.495 3.274 1.00 . A A . 12 PHE HA 1 1 20 5069 1 1 12 PHE HB2 H 9.490 -8.584 0.823 1.00 . A A . 12 PHE HB2 1 1 20 5070 1 1 12 PHE HB3 H 8.486 -7.185 0.458 1.00 . A A . 12 PHE HB3 1 1 20 5071 1 1 12 PHE HD1 H 11.527 -7.860 2.521 1.00 . A A . 12 PHE HD1 1 1 20 5072 1 1 12 PHE HD2 H 9.636 -5.407 -0.398 1.00 . A A . 12 PHE HD2 1 1 20 5073 1 1 12 PHE HE1 H 13.540 -6.452 2.406 1.00 . A A . 12 PHE HE1 1 1 20 5074 1 1 12 PHE HE2 H 11.647 -3.995 -0.519 1.00 . A A . 12 PHE HE2 1 1 20 5075 1 1 12 PHE HZ H 13.603 -4.516 0.885 1.00 . A A . 12 PHE HZ 1 1 20 5076 1 1 12 PHE N N 8.044 -8.989 2.780 1.00 . A A . 12 PHE N 1 1 20 5077 1 1 12 PHE O O 7.767 -5.417 2.393 1.00 . A A . 12 PHE O 1 1 20 5078 1 1 13 GLY C C 5.710 -4.801 4.114 1.00 . A A . 13 GLY C 1 1 20 5079 1 1 13 GLY CA C 5.275 -6.047 3.367 1.00 . A A . 13 GLY CA 1 1 20 5080 1 1 13 GLY H H 6.235 -7.934 3.405 1.00 . A A . 13 GLY H 1 1 20 5081 1 1 13 GLY HA2 H 4.890 -5.759 2.400 1.00 . A A . 13 GLY HA2 1 1 20 5082 1 1 13 GLY HA3 H 4.488 -6.531 3.926 1.00 . A A . 13 GLY HA3 1 1 20 5083 1 1 13 GLY N N 6.362 -6.989 3.178 1.00 . A A . 13 GLY N 1 1 20 5084 1 1 13 GLY O O 5.151 -3.722 3.915 1.00 . A A . 13 GLY O 1 1 20 5085 1 1 14 LYS C C 7.830 -2.766 4.848 1.00 . A A . 14 LYS C 1 1 20 5086 1 1 14 LYS CA C 7.220 -3.829 5.757 1.00 . A A . 14 LYS CA 1 1 20 5087 1 1 14 LYS CB C 8.264 -4.315 6.764 1.00 . A A . 14 LYS CB 1 1 20 5088 1 1 14 LYS CD C 9.944 -6.171 6.970 1.00 . A A . 14 LYS CD 1 1 20 5089 1 1 14 LYS CE C 11.460 -6.291 6.923 1.00 . A A . 14 LYS CE 1 1 20 5090 1 1 14 LYS CG C 9.451 -5.012 6.121 1.00 . A A . 14 LYS CG 1 1 20 5091 1 1 14 LYS H H 7.114 -5.835 5.091 1.00 . A A . 14 LYS H 1 1 20 5092 1 1 14 LYS HA H 6.390 -3.393 6.293 1.00 . A A . 14 LYS HA 1 1 20 5093 1 1 14 LYS HB2 H 8.631 -3.467 7.323 1.00 . A A . 14 LYS HB2 1 1 20 5094 1 1 14 LYS HB3 H 7.793 -5.008 7.446 1.00 . A A . 14 LYS HB3 1 1 20 5095 1 1 14 LYS HD2 H 9.639 -6.012 7.994 1.00 . A A . 14 LYS HD2 1 1 20 5096 1 1 14 LYS HD3 H 9.508 -7.088 6.600 1.00 . A A . 14 LYS HD3 1 1 20 5097 1 1 14 LYS HE2 H 11.719 -7.257 6.519 1.00 . A A . 14 LYS HE2 1 1 20 5098 1 1 14 LYS HE3 H 11.849 -5.516 6.279 1.00 . A A . 14 LYS HE3 1 1 20 5099 1 1 14 LYS HG2 H 9.154 -5.389 5.153 1.00 . A A . 14 LYS HG2 1 1 20 5100 1 1 14 LYS HG3 H 10.254 -4.298 6.000 1.00 . A A . 14 LYS HG3 1 1 20 5101 1 1 14 LYS HZ1 H 11.364 -5.794 8.950 1.00 . A A . 14 LYS HZ1 1 1 20 5102 1 1 14 LYS HZ2 H 12.867 -5.484 8.239 1.00 . A A . 14 LYS HZ2 1 1 20 5103 1 1 14 LYS HZ3 H 12.418 -7.072 8.607 1.00 . A A . 14 LYS HZ3 1 1 20 5104 1 1 14 LYS N N 6.709 -4.950 4.977 1.00 . A A . 14 LYS N 1 1 20 5105 1 1 14 LYS NZ N 12.069 -6.150 8.274 1.00 . A A . 14 LYS NZ 1 1 20 5106 1 1 14 LYS O O 7.696 -1.570 5.099 1.00 . A A . 14 LYS O 1 1 20 5107 1 1 15 GLY C C 8.249 -2.011 1.651 1.00 . A A . 15 GLY C 1 1 20 5108 1 1 15 GLY CA C 9.120 -2.288 2.860 1.00 . A A . 15 GLY CA 1 1 20 5109 1 1 15 GLY H H 8.575 -4.179 3.641 1.00 . A A . 15 GLY H 1 1 20 5110 1 1 15 GLY HA2 H 9.315 -1.357 3.371 1.00 . A A . 15 GLY HA2 1 1 20 5111 1 1 15 GLY HA3 H 10.058 -2.706 2.525 1.00 . A A . 15 GLY HA3 1 1 20 5112 1 1 15 GLY N N 8.500 -3.213 3.790 1.00 . A A . 15 GLY N 1 1 20 5113 1 1 15 GLY O O 7.410 -1.111 1.674 1.00 . A A . 15 GLY O 1 1 20 5114 1 1 16 GLY C C 8.528 -2.579 -1.868 1.00 . A A . 16 GLY C 1 1 20 5115 1 1 16 GLY CA C 7.668 -2.602 -0.621 1.00 . A A . 16 GLY CA 1 1 20 5116 1 1 16 GLY H H 9.131 -3.488 0.627 1.00 . A A . 16 GLY H 1 1 20 5117 1 1 16 GLY HA2 H 6.955 -3.409 -0.702 1.00 . A A . 16 GLY HA2 1 1 20 5118 1 1 16 GLY HA3 H 7.131 -1.667 -0.550 1.00 . A A . 16 GLY HA3 1 1 20 5119 1 1 16 GLY N N 8.448 -2.786 0.589 1.00 . A A . 16 GLY N 1 1 20 5120 1 1 16 GLY O O 9.615 -3.156 -1.891 1.00 . A A . 16 GLY O 1 1 stop_ save_
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