NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
640222 | 6rsm | 34406 | cing | 4-filtered-FRED | STAR | entry | full | 112 |
data_FRED_restraints_with_modified_coordinates_PDB_code_6rsm # This FRED archive file contains, for PDB entry <6rsm>: # # - 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_6rsm _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 6rsm _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 1409.80 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 $peptide_12530 A . 1 1 stop_ save_ save_peptide_12530 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "peptide 12530" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code KFKKVIWKSFL _Entity.Number_of_monomers 11 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 LYS . 1 1 2 PHE . 1 1 3 LYS . 1 1 4 LYS . 1 1 5 VAL . 1 1 6 ILE . 1 1 7 TRP . 1 1 8 LYS . 1 1 9 SER . 1 1 10 PHE . 1 1 11 LEU . 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 LYS 1 1 1 1 PHE 2 2 1 1 LYS 3 3 1 1 LYS 4 4 1 1 VAL 5 5 1 1 ILE 6 6 1 1 TRP 7 7 1 1 LYS 8 8 1 1 SER 9 9 1 1 PHE 10 10 1 1 LEU 11 11 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 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 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 6 ILE HG13 . 6 ILE HG13 1 1 1 1 2 1 1 6 ILE MG . 6 ILE QG2 1 1 2 1 1 1 1 6 ILE H . 6 ILE H 1 1 2 1 2 1 1 6 ILE MG . 6 ILE QG2 1 1 3 1 1 1 1 6 ILE HG12 . 6 ILE HG12 1 1 3 1 2 1 1 6 ILE MG . 6 ILE QG2 1 1 4 1 1 1 1 6 ILE HA . 6 ILE HA 1 1 4 1 2 1 1 6 ILE MG . 6 ILE QG2 1 1 5 1 1 1 1 6 ILE MG . 6 ILE QG2 1 1 5 1 2 1 1 9 SER H . 9 SER H 1 1 6 1 1 1 1 8 LYS QD . 8 LYS QD 1 1 6 1 2 1 1 9 SER H . 9 SER H 1 1 7 1 1 1 1 9 SER H . 9 SER H 1 1 7 1 2 1 1 10 PHE H . 10 PHE H 1 1 8 1 1 1 1 8 LYS QB . 8 LYS QB 1 1 8 1 2 1 1 9 SER H . 9 SER H 1 1 9 1 1 1 1 9 SER H . 9 SER H 1 1 9 1 2 1 1 9 SER QB . 9 SER QB 1 1 10 1 1 1 1 8 LYS HA . 8 LYS HA 1 1 10 1 2 1 1 9 SER H . 9 SER H 1 1 11 1 1 1 1 8 LYS QG . 8 LYS QG 1 1 11 1 2 1 1 9 SER H . 9 SER H 1 1 12 1 1 1 1 5 VAL HA . 5 VAL HA 1 1 12 1 2 1 1 5 VAL QG . 5 VAL QG1 1 1 13 1 1 1 1 6 ILE HA . 6 ILE HA 1 1 13 1 2 1 1 6 ILE HG13 . 6 ILE HG13 1 1 14 1 1 1 1 3 LYS QD . 3 LYS QD 1 1 14 1 2 1 1 3 LYS HG3 . 3 LYS HG3 1 1 15 1 1 1 1 3 LYS HB3 . 3 LYS HB3 1 1 15 1 2 1 1 3 LYS HG3 . 3 LYS HG3 1 1 16 1 1 1 1 1 LYS QB . 1 LYS QB 1 1 16 1 2 1 1 2 PHE H . 2 PHE H 1 1 17 1 1 1 1 1 LYS HA . 1 LYS HA 1 1 17 1 2 1 1 2 PHE H . 2 PHE H 1 1 18 1 1 1 1 2 PHE H . 2 PHE H 1 1 18 1 2 1 1 2 PHE HB2 . 2 PHE HB2 1 1 19 1 1 1 1 2 PHE H . 2 PHE H 1 1 19 1 2 1 1 2 PHE QD . 2 PHE QD 1 1 20 1 1 1 1 11 LEU HA . 11 LEU HA 1 1 20 1 2 1 1 11 LEU MD1 . 11 LEU QD1 1 1 21 1 1 1 1 11 LEU HB3 . 11 LEU HB3 1 1 21 1 2 1 1 11 LEU MD1 . 11 LEU QD1 1 1 22 1 1 1 1 5 VAL H . 5 VAL H 1 1 22 1 2 1 1 5 VAL QG . 5 VAL QG1 1 1 23 1 1 1 1 4 LYS HG2 . 4 LYS HG2 1 1 23 1 2 1 1 5 VAL H . 5 VAL H 1 1 24 1 1 1 1 5 VAL H . 5 VAL H 1 1 24 1 2 1 1 5 VAL HB . 5 VAL HB 1 1 25 1 1 1 1 4 LYS HG3 . 4 LYS HG3 1 1 25 1 2 1 1 5 VAL H . 5 VAL H 1 1 26 1 1 1 1 4 LYS QB . 4 LYS QB 1 1 26 1 2 1 1 5 VAL H . 5 VAL H 1 1 27 1 1 1 1 4 LYS HA . 4 LYS HA 1 1 27 1 2 1 1 5 VAL H . 5 VAL H 1 1 28 1 1 1 1 10 PHE H . 10 PHE H 1 1 28 1 2 1 1 11 LEU H . 11 LEU H 1 1 29 1 1 1 1 9 SER QB . 9 SER QB 1 1 29 1 2 1 1 10 PHE H . 10 PHE H 1 1 30 1 1 1 1 10 PHE H . 10 PHE H 1 1 30 1 2 1 1 10 PHE QB . 10 PHE QB 1 1 31 1 1 1 1 9 SER HA . 9 SER HA 1 1 31 1 2 1 1 10 PHE H . 10 PHE H 1 1 32 1 1 1 1 8 LYS QB . 8 LYS QB 1 1 32 1 2 1 1 8 LYS QZ . 8 LYS QZ 1 1 33 1 1 1 1 5 VAL QG . 5 VAL QG1 1 1 33 1 2 1 1 6 ILE H . 6 ILE H 1 1 34 1 1 1 1 6 ILE H . 6 ILE H 1 1 34 1 2 1 1 6 ILE HG13 . 6 ILE HG13 1 1 35 1 1 1 1 5 VAL HB . 5 VAL HB 1 1 35 1 2 1 1 6 ILE H . 6 ILE H 1 1 36 1 1 1 1 5 VAL HA . 5 VAL HA 1 1 36 1 2 1 1 6 ILE H . 6 ILE H 1 1 37 1 1 1 1 6 ILE H . 6 ILE H 1 1 37 1 2 1 1 6 ILE HG12 . 6 ILE HG12 1 1 38 1 1 1 1 6 ILE H . 6 ILE H 1 1 38 1 2 1 1 6 ILE HB . 6 ILE HB 1 1 39 1 1 1 1 6 ILE H . 6 ILE H 1 1 39 1 2 1 1 6 ILE MD . 6 ILE QD1 1 1 40 1 1 1 1 10 PHE H . 10 PHE H 1 1 40 1 2 1 1 10 PHE QD . 10 PHE QD 1 1 41 1 1 1 1 10 PHE HA . 10 PHE HA 1 1 41 1 2 1 1 10 PHE QD . 10 PHE QD 1 1 42 1 1 1 1 11 LEU H . 11 LEU H 1 1 42 1 2 1 1 11 LEU MD1 . 11 LEU QD1 1 1 43 1 1 1 1 10 PHE QB . 10 PHE QB 1 1 43 1 2 1 1 11 LEU H . 11 LEU H 1 1 44 1 1 1 1 11 LEU H . 11 LEU H 1 1 44 1 2 1 1 11 LEU HB2 . 11 LEU HB2 1 1 45 1 1 1 1 4 LYS QD . 4 LYS QD 1 1 45 1 2 1 1 4 LYS HG3 . 4 LYS HG3 1 1 46 1 1 1 1 4 LYS HA . 4 LYS HA 1 1 46 1 2 1 1 4 LYS QD . 4 LYS QD 1 1 47 1 1 1 1 2 PHE HB2 . 2 PHE HB2 1 1 47 1 2 1 1 3 LYS H . 3 LYS H 1 1 48 1 1 1 1 4 LYS H . 4 LYS H 1 1 48 1 2 1 1 4 LYS HG2 . 4 LYS HG2 1 1 49 1 1 1 1 4 LYS H . 4 LYS H 1 1 49 1 2 1 1 4 LYS HG3 . 4 LYS HG3 1 1 50 1 1 1 1 4 LYS H . 4 LYS H 1 1 50 1 2 1 1 4 LYS QZ . 4 LYS QZ 1 1 51 1 1 1 1 4 LYS H . 4 LYS H 1 1 51 1 2 1 1 4 LYS QB . 4 LYS QB 1 1 52 1 1 1 1 3 LYS HA . 3 LYS HA 1 1 52 1 2 1 1 4 LYS H . 4 LYS H 1 1 53 1 1 1 1 4 LYS H . 4 LYS H 1 1 53 1 2 1 1 4 LYS QD . 4 LYS QD 1 1 54 1 1 1 1 2 PHE HA . 2 PHE HA 1 1 54 1 2 1 1 2 PHE QD . 2 PHE QD 1 1 55 1 1 1 1 7 TRP HH2 . 7 TRP HH2 1 1 55 1 2 1 1 11 LEU HA . 11 LEU HA 1 1 56 1 1 1 1 1 LYS HA . 1 LYS HA 1 1 56 1 2 1 1 1 LYS QD . 1 LYS QD 1 1 57 1 1 1 1 3 LYS HA . 3 LYS HA 1 1 57 1 2 1 1 3 LYS QE . 3 LYS QE 1 1 58 1 1 1 1 10 PHE H . 10 PHE H 1 1 58 1 2 1 1 10 PHE QE . 10 PHE QE 1 1 59 1 1 1 1 4 LYS QB . 4 LYS QB 1 1 59 1 2 1 1 4 LYS QE . 4 LYS QE 1 1 60 1 1 1 1 4 LYS H . 4 LYS H 1 1 60 1 2 1 1 4 LYS QE . 4 LYS QE 1 1 61 1 1 1 1 8 LYS HA . 8 LYS HA 1 1 61 1 2 1 1 8 LYS QZ . 8 LYS QZ 1 1 62 1 1 1 1 11 LEU HB2 . 11 LEU HB2 1 1 62 1 2 1 1 11 LEU MD1 . 11 LEU QD1 1 1 63 1 1 1 1 8 LYS H . 8 LYS H 1 1 63 1 2 1 1 8 LYS QD . 8 LYS QD 1 1 64 1 1 1 1 8 LYS H . 8 LYS H 1 1 64 1 2 1 1 8 LYS QB . 8 LYS QB 1 1 65 1 1 1 1 7 TRP QB . 7 TRP QB 1 1 65 1 2 1 1 8 LYS H . 8 LYS H 1 1 66 1 1 1 1 8 LYS H . 8 LYS H 1 1 66 1 2 1 1 8 LYS QZ . 8 LYS QZ 1 1 67 1 1 1 1 8 LYS H . 8 LYS H 1 1 67 1 2 1 1 8 LYS QG . 8 LYS QG 1 1 68 1 1 1 1 7 TRP HA . 7 TRP HA 1 1 68 1 2 1 1 8 LYS H . 8 LYS H 1 1 69 1 1 1 1 1 LYS HA . 1 LYS HA 1 1 69 1 2 1 1 1 LYS QE . 1 LYS QE 1 1 70 1 1 1 1 3 LYS H . 3 LYS H 1 1 70 1 2 1 1 3 LYS HG3 . 3 LYS HG3 1 1 71 1 1 1 1 3 LYS H . 3 LYS H 1 1 71 1 2 1 1 3 LYS HG2 . 3 LYS HG2 1 1 72 1 1 1 1 2 PHE HB3 . 2 PHE HB3 1 1 72 1 2 1 1 3 LYS H . 3 LYS H 1 1 73 1 1 1 1 3 LYS H . 3 LYS H 1 1 73 1 2 1 1 3 LYS QD . 3 LYS QD 1 1 74 1 1 1 1 3 LYS H . 3 LYS H 1 1 74 1 2 1 1 4 LYS H . 4 LYS H 1 1 75 1 1 1 1 3 LYS H . 3 LYS H 1 1 75 1 2 1 1 3 LYS QE . 3 LYS QE 1 1 76 1 1 1 1 2 PHE HA . 2 PHE HA 1 1 76 1 2 1 1 3 LYS H . 3 LYS H 1 1 77 1 1 1 1 3 LYS H . 3 LYS H 1 1 77 1 2 1 1 3 LYS HB3 . 3 LYS HB3 1 1 78 1 1 1 1 3 LYS H . 3 LYS H 1 1 78 1 2 1 1 3 LYS HB2 . 3 LYS HB2 1 1 79 1 1 1 1 6 ILE HA . 6 ILE HA 1 1 79 1 2 1 1 6 ILE MD . 6 ILE QD1 1 1 80 1 1 1 1 6 ILE HB . 6 ILE HB 1 1 80 1 2 1 1 6 ILE MD . 6 ILE QD1 1 1 81 1 1 1 1 8 LYS HA . 8 LYS HA 1 1 81 1 2 1 1 8 LYS QG . 8 LYS QG 1 1 82 1 1 1 1 11 LEU H . 11 LEU H 1 1 82 1 2 1 1 11 LEU HB3 . 11 LEU HB3 1 1 83 1 1 1 1 11 LEU HA . 11 LEU HA 1 1 83 1 2 1 1 11 LEU MD2 . 11 LEU QD2 1 1 84 1 1 1 1 11 LEU H . 11 LEU H 1 1 84 1 2 1 1 11 LEU MD2 . 11 LEU QD2 1 1 85 1 1 1 1 11 LEU HB3 . 11 LEU HB3 1 1 85 1 2 1 1 11 LEU MD2 . 11 LEU QD2 1 1 86 1 1 1 1 7 TRP QB . 7 TRP QB 1 1 86 1 2 1 1 7 TRP HD1 . 7 TRP HD1 1 1 87 1 1 1 1 11 LEU HA . 11 LEU HA 1 1 87 1 2 1 1 11 LEU HG . 11 LEU HG 1 1 88 1 1 1 1 11 LEU H . 11 LEU H 1 1 88 1 2 1 1 11 LEU HG . 11 LEU HG 1 1 89 1 1 1 1 6 ILE MG . 6 ILE QG2 1 1 89 1 2 1 1 7 TRP H . 7 TRP H 1 1 90 1 1 1 1 6 ILE H . 6 ILE H 1 1 90 1 2 1 1 7 TRP H . 7 TRP H 1 1 91 1 1 1 1 7 TRP H . 7 TRP H 1 1 91 1 2 1 1 7 TRP QB . 7 TRP QB 1 1 92 1 1 1 1 6 ILE HA . 6 ILE HA 1 1 92 1 2 1 1 7 TRP H . 7 TRP H 1 1 93 1 1 1 1 6 ILE HB . 6 ILE HB 1 1 93 1 2 1 1 7 TRP H . 7 TRP 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 . . . . . . . 3.14 1 1 2 1 . . . . . . . 3.89 1 1 3 1 . . . . . . . 3.31 1 1 4 1 . . . . . . . 3.16 1 1 5 1 . . . . . . . 3.63 1 1 6 1 . . . . . . . 4.04 1 1 7 1 . . . . . . . 3.19 1 1 8 1 . . . . . . . 3.97 1 1 9 1 . . . . . . . 3.38 1 1 10 1 . . . . . . . 3.48 1 1 11 1 . . . . . . . 4.33 1 1 12 1 . . . . . . . 3.24 1 1 13 1 . . . . . . . 4.16 1 1 14 1 . . . . . . . 2.65 1 1 15 1 . . . . . . . 2.71 1 1 16 1 . . . . . . . 4.26 1 1 17 1 . . . . . . . 3.53 1 1 18 1 . . . . . . . 3.94 1 1 19 1 . . . . . . . 4.96 1 1 20 1 . . . . . . . 4.54 1 1 21 1 . . . . . . . 3.16 1 1 22 1 . . . . . . . 3.21 1 1 23 1 . . . . . . . 4.78 1 1 24 1 . . . . . . . 3.24 1 1 25 1 . . . . . . . 4.54 1 1 26 1 . . . . . . . 3.83 1 1 27 1 . . . . . . . 2.9 1 1 28 1 . . . . . . . 3.25 1 1 29 1 . . . . . . . 3.97 1 1 30 1 . . . . . . . 3.13 1 1 31 1 . . . . . . . 3.5 1 1 32 1 . . . . . . . 4.35 1 1 33 1 . . . . . . . 3.33 1 1 34 1 . . . . . . . 3.75 1 1 35 1 . . . . . . . 4.23 1 1 36 1 . . . . . . . 2.93 1 1 37 1 . . . . . . . 3.74 1 1 38 1 . . . . . . . 3.33 1 1 39 1 . . . . . . . 4.06 1 1 40 1 . . . . . . . 5.38 1 1 41 1 . . . . . . . 3.99 1 1 42 1 . . . . . . . 4.69 1 1 43 1 . . . . . . . 3.96 1 1 44 1 . . . . . . . 3.24 1 1 45 1 . . . . . . . 2.61 1 1 46 1 . . . . . . . 4.37 1 1 47 1 . . . . . . . 4.4 1 1 48 1 . . . . . . . 4.1 1 1 49 1 . . . . . . . 3.91 1 1 50 1 . . . . . . . 5.5 1 1 51 1 . . . . . . . 3.09 1 1 52 1 . . . . . . . 2.92 1 1 53 1 . . . . . . . 4.03 1 1 54 1 . . . . . . . 3.5 1 1 55 1 . . . . . . . 3.92 1 1 56 1 . . . . . . . 3.93 1 1 57 1 . . . . . . . 5.5 1 1 58 1 . . . . . . . 4.69 1 1 59 1 . . . . . . . 4.4 1 1 60 1 . . . . . . . 5.5 1 1 61 1 . . . . . . . 5.34 1 1 62 1 . . . . . . . 3.47 1 1 63 1 . . . . . . . 3.32 1 1 64 1 . . . . . . . 3.64 1 1 65 1 . . . . . . . 3.58 1 1 66 1 . . . . . . . 5.17 1 1 67 1 . . . . . . . 3.58 1 1 68 1 . . . . . . . 3.54 1 1 69 1 . . . . . . . 5.42 1 1 70 1 . . . . . . . 3.95 1 1 71 1 . . . . . . . 4.28 1 1 72 1 . . . . . . . 3.87 1 1 73 1 . . . . . . . 4.0 1 1 74 1 . . . . . . . 3.76 1 1 75 1 . . . . . . . 3.56 1 1 76 1 . . . . . . . 2.98 1 1 77 1 . . . . . . . 3.74 1 1 78 1 . . . . . . . 3.93 1 1 79 1 . . . . . . . 3.75 1 1 80 1 . . . . . . . 3.52 1 1 81 1 . . . . . . . 3.84 1 1 82 1 . . . . . . . 3.75 1 1 83 1 . . . . . . . 3.08 1 1 84 1 . . . . . . . 4.27 1 1 85 1 . . . . . . . 2.89 1 1 86 1 . . . . . . . 3.17 1 1 87 1 . . . . . . . 4.0 1 1 88 1 . . . . . . . 3.89 1 1 89 1 . . . . . . . 3.7 1 1 90 1 . . . . . . . 3.67 1 1 91 1 . . . . . . . 3.13 1 1 92 1 . . . . . . . 2.94 1 1 93 1 . . . . . . . 3.81 1 1 stop_ save_ save_DYANA/DIANA_distance_constraints_4_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 2 2 1 . . . 1 2 3 1 . . . 1 2 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 7 TRP O . 7 TRP O 1 2 1 1 2 1 1 11 LEU H . 11 LEU H 1 2 2 1 1 1 1 7 TRP C . 7 TRP C 1 2 2 1 2 1 1 11 LEU H . 11 LEU H 1 2 3 1 1 1 1 7 TRP O . 7 TRP O 1 2 3 1 2 1 1 11 LEU N . 11 LEU N 1 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . . . 1.7 1 2 2 1 . . . . . . . 2.6 1 2 3 1 . . . . . . . 2.6 1 2 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 6 ILE C 1 1 7 TRP N 1 1 7 TRP CA 1 1 7 TRP C -80.8 -40.8 . 7 TRP . . 7 TRP . . 7 TRP . . 7 TRP . 1 1 2 PSI 1 1 7 TRP N 1 1 7 TRP CA 1 1 7 TRP C 1 1 8 LYS N -51.6 -11.6 . 7 TRP . . 7 TRP . . 7 TRP . . 7 TRP . 1 1 3 PHI 1 1 7 TRP C 1 1 8 LYS N 1 1 8 LYS CA 1 1 8 LYS C -84.2 -44.2 . 8 LYS . . 8 LYS . . 8 LYS . . 8 LYS . 1 1 4 PSI 1 1 8 LYS N 1 1 8 LYS CA 1 1 8 LYS C 1 1 9 SER N -52.899998 -12.9 . 8 LYS . . 8 LYS . . 8 LYS . . 8 LYS . 1 1 5 PHI 1 1 8 LYS C 1 1 9 SER N 1 1 9 SER CA 1 1 9 SER C -91.6 -51.6 . 9 SER . . 9 SER . . 9 SER . . 9 SER . 1 1 6 PSI 1 1 9 SER N 1 1 9 SER CA 1 1 9 SER C 1 1 10 PHE N -42.2 -2.2 . 9 SER . . 9 SER . . 9 SER . . 9 SER . 1 1 7 PHI 1 1 9 SER C 1 1 10 PHE N 1 1 10 PHE CA 1 1 10 PHE C -107.3 -56.5 . 10 PHE . . 10 PHE . . 10 PHE . . 10 PHE . 1 1 8 PSI 1 1 10 PHE N 1 1 10 PHE CA 1 1 10 PHE C 1 1 11 LEU N -44.5 4.0 . 10 PHE . . 10 PHE . . 10 PHE . . 10 PHE . 1 1 stop_ save_ save_DYANA/DIANA_dihedral_5 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 2 _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 6 ILE C 1 1 7 TRP N 1 1 7 TRP CA 1 1 7 TRP C -80.8 -40.8 . 7 TRP . . 7 TRP . . 7 TRP . . 7 TRP . 1 2 2 PSI 1 1 7 TRP N 1 1 7 TRP CA 1 1 7 TRP C 1 1 8 LYS N -51.6 -11.6 . 7 TRP . . 7 TRP . . 7 TRP . . 7 TRP . 1 2 3 PHI 1 1 7 TRP C 1 1 8 LYS N 1 1 8 LYS CA 1 1 8 LYS C -84.2 -44.2 . 8 LYS . . 8 LYS . . 8 LYS . . 8 LYS . 1 2 4 PSI 1 1 8 LYS N 1 1 8 LYS CA 1 1 8 LYS C 1 1 9 SER N -52.899998 -12.9 . 8 LYS . . 8 LYS . . 8 LYS . . 8 LYS . 1 2 5 PHI 1 1 8 LYS C 1 1 9 SER N 1 1 9 SER CA 1 1 9 SER C -91.6 -51.6 . 9 SER . . 9 SER . . 9 SER . . 9 SER . 1 2 6 PSI 1 1 9 SER N 1 1 9 SER CA 1 1 9 SER C 1 1 10 PHE N -42.2 -2.2 . 9 SER . . 9 SER . . 9 SER . . 9 SER . 1 2 7 PHI 1 1 9 SER C 1 1 10 PHE N 1 1 10 PHE CA 1 1 10 PHE C -107.3 -56.5 . 10 PHE . . 10 PHE . . 10 PHE . . 10 PHE . 1 2 8 PSI 1 1 10 PHE N 1 1 10 PHE CA 1 1 10 PHE C 1 1 11 LEU N -44.5 4.0 . 10 PHE . . 10 PHE . . 10 PHE . . 10 PHE . 1 2 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 LYS C C 2.634 1.392 -1.549 1.00 . A A . 1 LYS C 1 1 1 2 1 1 1 LYS CA C 2.094 -0.002 -1.241 1.00 . A A . 1 LYS CA 1 1 1 3 1 1 1 LYS CB C 1.224 -0.491 -2.401 1.00 . A A . 1 LYS CB 1 1 1 4 1 1 1 LYS CD C 0.642 -2.502 -3.789 1.00 . A A . 1 LYS CD 1 1 1 5 1 1 1 LYS CE C 0.545 -2.076 -5.246 1.00 . A A . 1 LYS CE 1 1 1 6 1 1 1 LYS CG C 1.747 -1.754 -3.063 1.00 . A A . 1 LYS CG 1 1 1 7 1 1 1 LYS H1 H 1.806 0.000 0.856 1.00 . A A . 1 LYS H1 1 1 1 8 1 1 1 LYS HA H 2.927 -0.677 -1.116 1.00 . A A . 1 LYS HA 1 1 1 9 1 1 1 LYS HB2 H 0.229 -0.690 -2.030 1.00 . A A . 1 LYS HB2 1 1 1 10 1 1 1 LYS HB3 H 1.171 0.287 -3.149 1.00 . A A . 1 LYS HB3 1 1 1 11 1 1 1 LYS HD2 H 0.849 -3.561 -3.749 1.00 . A A . 1 LYS HD2 1 1 1 12 1 1 1 LYS HD3 H -0.300 -2.299 -3.300 1.00 . A A . 1 LYS HD3 1 1 1 13 1 1 1 LYS HE2 H -0.128 -1.235 -5.317 1.00 . A A . 1 LYS HE2 1 1 1 14 1 1 1 LYS HE3 H 1.527 -1.781 -5.587 1.00 . A A . 1 LYS HE3 1 1 1 15 1 1 1 LYS HG2 H 2.514 -1.486 -3.774 1.00 . A A . 1 LYS HG2 1 1 1 16 1 1 1 LYS HG3 H 2.168 -2.399 -2.304 1.00 . A A . 1 LYS HG3 1 1 1 17 1 1 1 LYS HZ1 H -0.947 -3.396 -5.874 1.00 . A A . 1 LYS HZ1 1 1 1 18 1 1 1 LYS HZ2 H 0.089 -2.893 -7.113 1.00 . A A . 1 LYS HZ2 1 1 1 19 1 1 1 LYS HZ3 H 0.617 -4.031 -5.978 1.00 . A A . 1 LYS HZ3 1 1 1 20 1 1 1 LYS N N 1.329 0.000 0.000 1.00 . A A . 1 LYS N 1 1 1 21 1 1 1 LYS NZ N 0.041 -3.176 -6.114 1.00 . A A . 1 LYS NZ 1 1 1 22 1 1 1 LYS O O 2.042 2.398 -1.157 1.00 . A A . 1 LYS O 1 1 1 23 1 1 2 PHE C C 3.943 3.152 -4.012 1.00 . A A . 2 PHE C 1 1 1 24 1 1 2 PHE CA C 4.377 2.713 -2.617 1.00 . A A . 2 PHE CA 1 1 1 25 1 1 2 PHE CB C 5.901 2.598 -2.557 1.00 . A A . 2 PHE CB 1 1 1 26 1 1 2 PHE CD1 C 6.731 3.114 -0.246 1.00 . A A . 2 PHE CD1 1 1 1 27 1 1 2 PHE CD2 C 6.591 0.830 -0.916 1.00 . A A . 2 PHE CD2 1 1 1 28 1 1 2 PHE CE1 C 7.206 2.725 0.993 1.00 . A A . 2 PHE CE1 1 1 1 29 1 1 2 PHE CE2 C 7.066 0.435 0.321 1.00 . A A . 2 PHE CE2 1 1 1 30 1 1 2 PHE CG C 6.418 2.172 -1.212 1.00 . A A . 2 PHE CG 1 1 1 31 1 1 2 PHE CZ C 7.375 1.384 1.276 1.00 . A A . 2 PHE CZ 1 1 1 32 1 1 2 PHE H H 4.183 0.606 -2.539 1.00 . A A . 2 PHE H 1 1 1 33 1 1 2 PHE HA H 4.052 3.454 -1.903 1.00 . A A . 2 PHE HA 1 1 1 34 1 1 2 PHE HB2 H 6.229 1.869 -3.283 1.00 . A A . 2 PHE HB2 1 1 1 35 1 1 2 PHE HB3 H 6.337 3.557 -2.793 1.00 . A A . 2 PHE HB3 1 1 1 36 1 1 2 PHE HD1 H 6.599 4.164 -0.466 1.00 . A A . 2 PHE HD1 1 1 1 37 1 1 2 PHE HD2 H 6.351 0.086 -1.662 1.00 . A A . 2 PHE HD2 1 1 1 38 1 1 2 PHE HE1 H 7.446 3.470 1.737 1.00 . A A . 2 PHE HE1 1 1 1 39 1 1 2 PHE HE2 H 7.197 -0.614 0.540 1.00 . A A . 2 PHE HE2 1 1 1 40 1 1 2 PHE HZ H 7.745 1.078 2.243 1.00 . A A . 2 PHE HZ 1 1 1 41 1 1 2 PHE N N 3.758 1.443 -2.255 1.00 . A A . 2 PHE N 1 1 1 42 1 1 2 PHE O O 3.972 2.366 -4.960 1.00 . A A . 2 PHE O 1 1 1 43 1 1 3 LYS C C 4.259 5.625 -6.144 1.00 . A A . 3 LYS C 1 1 1 44 1 1 3 LYS CA C 3.101 4.958 -5.410 1.00 . A A . 3 LYS CA 1 1 1 45 1 1 3 LYS CB C 1.970 5.967 -5.196 1.00 . A A . 3 LYS CB 1 1 1 46 1 1 3 LYS CD C 1.930 7.147 -2.979 1.00 . A A . 3 LYS CD 1 1 1 47 1 1 3 LYS CE C 0.415 7.223 -2.879 1.00 . A A . 3 LYS CE 1 1 1 48 1 1 3 LYS CG C 2.397 7.203 -4.424 1.00 . A A . 3 LYS CG 1 1 1 49 1 1 3 LYS H H 3.540 4.991 -3.340 1.00 . A A . 3 LYS H 1 1 1 50 1 1 3 LYS HA H 2.732 4.140 -6.011 1.00 . A A . 3 LYS HA 1 1 1 51 1 1 3 LYS HB2 H 1.596 6.281 -6.159 1.00 . A A . 3 LYS HB2 1 1 1 52 1 1 3 LYS HB3 H 1.172 5.485 -4.649 1.00 . A A . 3 LYS HB3 1 1 1 53 1 1 3 LYS HD2 H 2.263 6.219 -2.538 1.00 . A A . 3 LYS HD2 1 1 1 54 1 1 3 LYS HD3 H 2.360 7.979 -2.438 1.00 . A A . 3 LYS HD3 1 1 1 55 1 1 3 LYS HE2 H 0.022 7.569 -3.823 1.00 . A A . 3 LYS HE2 1 1 1 56 1 1 3 LYS HE3 H 0.031 6.235 -2.670 1.00 . A A . 3 LYS HE3 1 1 1 57 1 1 3 LYS HG2 H 3.474 7.273 -4.440 1.00 . A A . 3 LYS HG2 1 1 1 58 1 1 3 LYS HG3 H 1.970 8.077 -4.897 1.00 . A A . 3 LYS HG3 1 1 1 59 1 1 3 LYS HZ1 H -0.583 7.636 -1.091 1.00 . A A . 3 LYS HZ1 1 1 1 60 1 1 3 LYS HZ2 H 0.803 8.576 -1.335 1.00 . A A . 3 LYS HZ2 1 1 1 61 1 1 3 LYS HZ3 H -0.611 8.912 -2.202 1.00 . A A . 3 LYS HZ3 1 1 1 62 1 1 3 LYS N N 3.540 4.412 -4.132 1.00 . A A . 3 LYS N 1 1 1 63 1 1 3 LYS NZ N -0.025 8.152 -1.801 1.00 . A A . 3 LYS NZ 1 1 1 64 1 1 3 LYS O O 4.108 6.708 -6.711 1.00 . A A . 3 LYS O 1 1 1 65 1 1 4 LYS C C 6.359 5.652 -8.297 1.00 . A A . 4 LYS C 1 1 1 66 1 1 4 LYS CA C 6.601 5.500 -6.799 1.00 . A A . 4 LYS CA 1 1 1 67 1 1 4 LYS CB C 7.800 4.581 -6.556 1.00 . A A . 4 LYS CB 1 1 1 68 1 1 4 LYS CD C 9.108 3.306 -4.831 1.00 . A A . 4 LYS CD 1 1 1 69 1 1 4 LYS CE C 10.491 3.712 -4.345 1.00 . A A . 4 LYS CE 1 1 1 70 1 1 4 LYS CG C 8.234 4.519 -5.101 1.00 . A A . 4 LYS CG 1 1 1 71 1 1 4 LYS H H 5.475 4.113 -5.663 1.00 . A A . 4 LYS H 1 1 1 72 1 1 4 LYS HA H 6.812 6.472 -6.380 1.00 . A A . 4 LYS HA 1 1 1 73 1 1 4 LYS HB2 H 7.543 3.582 -6.876 1.00 . A A . 4 LYS HB2 1 1 1 74 1 1 4 LYS HB3 H 8.634 4.935 -7.144 1.00 . A A . 4 LYS HB3 1 1 1 75 1 1 4 LYS HD2 H 8.638 2.695 -4.075 1.00 . A A . 4 LYS HD2 1 1 1 76 1 1 4 LYS HD3 H 9.210 2.736 -5.744 1.00 . A A . 4 LYS HD3 1 1 1 77 1 1 4 LYS HE2 H 10.736 4.676 -4.762 1.00 . A A . 4 LYS HE2 1 1 1 78 1 1 4 LYS HE3 H 10.473 3.781 -3.267 1.00 . A A . 4 LYS HE3 1 1 1 79 1 1 4 LYS HG2 H 8.793 5.412 -4.864 1.00 . A A . 4 LYS HG2 1 1 1 80 1 1 4 LYS HG3 H 7.355 4.465 -4.475 1.00 . A A . 4 LYS HG3 1 1 1 81 1 1 4 LYS HZ1 H 12.013 2.349 -3.909 1.00 . A A . 4 LYS HZ1 1 1 1 82 1 1 4 LYS HZ2 H 11.097 1.941 -5.273 1.00 . A A . 4 LYS HZ2 1 1 1 83 1 1 4 LYS HZ3 H 12.238 3.187 -5.362 1.00 . A A . 4 LYS HZ3 1 1 1 84 1 1 4 LYS N N 5.416 4.972 -6.132 1.00 . A A . 4 LYS N 1 1 1 85 1 1 4 LYS NZ N 11.533 2.729 -4.751 1.00 . A A . 4 LYS NZ 1 1 1 86 1 1 4 LYS O O 5.303 5.277 -8.807 1.00 . A A . 4 LYS O 1 1 1 87 1 1 5 VAL C C 7.875 5.246 -11.201 1.00 . A A . 5 VAL C 1 1 1 88 1 1 5 VAL CA C 7.240 6.403 -10.438 1.00 . A A . 5 VAL CA 1 1 1 89 1 1 5 VAL CB C 7.911 7.719 -10.873 1.00 . A A . 5 VAL CB 1 1 1 90 1 1 5 VAL CG1 C 7.628 8.004 -12.340 1.00 . A A . 5 VAL CG1 1 1 1 91 1 1 5 VAL CG2 C 7.441 8.871 -9.998 1.00 . A A . 5 VAL CG2 1 1 1 92 1 1 5 VAL H H 8.162 6.482 -8.535 1.00 . A A . 5 VAL H 1 1 1 93 1 1 5 VAL HA H 6.191 6.457 -10.693 1.00 . A A . 5 VAL HA 1 1 1 94 1 1 5 VAL HB H 8.979 7.614 -10.749 1.00 . A A . 5 VAL HB 1 1 1 95 1 1 5 VAL HG11 H 6.933 8.827 -12.420 1.00 . A A . 5 VAL HG11 1 1 1 96 1 1 5 VAL HG12 H 8.550 8.262 -12.841 1.00 . A A . 5 VAL HG12 1 1 1 97 1 1 5 VAL HG13 H 7.201 7.126 -12.802 1.00 . A A . 5 VAL HG13 1 1 1 98 1 1 5 VAL HG21 H 7.469 9.790 -10.565 1.00 . A A . 5 VAL HG21 1 1 1 99 1 1 5 VAL HG22 H 6.429 8.683 -9.668 1.00 . A A . 5 VAL HG22 1 1 1 100 1 1 5 VAL HG23 H 8.089 8.958 -9.138 1.00 . A A . 5 VAL HG23 1 1 1 101 1 1 5 VAL N N 7.345 6.204 -8.998 1.00 . A A . 5 VAL N 1 1 1 102 1 1 5 VAL O O 9.003 4.844 -10.913 1.00 . A A . 5 VAL O 1 1 1 103 1 1 6 ILE C C 8.297 4.103 -14.260 1.00 . A A . 6 ILE C 1 1 1 104 1 1 6 ILE CA C 7.636 3.603 -12.980 1.00 . A A . 6 ILE CA 1 1 1 105 1 1 6 ILE CB C 6.502 2.628 -13.348 1.00 . A A . 6 ILE CB 1 1 1 106 1 1 6 ILE CD1 C 4.415 3.339 -12.076 1.00 . A A . 6 ILE CD1 1 1 1 107 1 1 6 ILE CG1 C 5.592 2.391 -12.141 1.00 . A A . 6 ILE CG1 1 1 1 108 1 1 6 ILE CG2 C 7.077 1.313 -13.852 1.00 . A A . 6 ILE CG2 1 1 1 109 1 1 6 ILE H H 6.252 5.077 -12.356 1.00 . A A . 6 ILE H 1 1 1 110 1 1 6 ILE HA H 8.369 3.067 -12.395 1.00 . A A . 6 ILE HA 1 1 1 111 1 1 6 ILE HB H 5.923 3.069 -14.145 1.00 . A A . 6 ILE HB 1 1 1 112 1 1 6 ILE HD11 H 4.182 3.692 -13.070 1.00 . A A . 6 ILE HD11 1 1 1 113 1 1 6 ILE HD12 H 3.559 2.822 -11.668 1.00 . A A . 6 ILE HD12 1 1 1 114 1 1 6 ILE HD13 H 4.663 4.178 -11.444 1.00 . A A . 6 ILE HD13 1 1 1 115 1 1 6 ILE HG12 H 5.206 1.385 -12.182 1.00 . A A . 6 ILE HG12 1 1 1 116 1 1 6 ILE HG13 H 6.169 2.514 -11.236 1.00 . A A . 6 ILE HG13 1 1 1 117 1 1 6 ILE HG21 H 7.014 0.570 -13.070 1.00 . A A . 6 ILE HG21 1 1 1 118 1 1 6 ILE HG22 H 6.515 0.980 -14.711 1.00 . A A . 6 ILE HG22 1 1 1 119 1 1 6 ILE HG23 H 8.111 1.455 -14.131 1.00 . A A . 6 ILE HG23 1 1 1 120 1 1 6 ILE N N 7.143 4.714 -12.174 1.00 . A A . 6 ILE N 1 1 1 121 1 1 6 ILE O O 8.247 3.441 -15.296 1.00 . A A . 6 ILE O 1 1 1 122 1 1 7 TRP C C 10.750 4.987 -15.791 1.00 . A A . 7 TRP C 1 1 1 123 1 1 7 TRP CA C 9.591 5.863 -15.332 1.00 . A A . 7 TRP CA 1 1 1 124 1 1 7 TRP CB C 10.099 7.265 -14.991 1.00 . A A . 7 TRP CB 1 1 1 125 1 1 7 TRP CD1 C 12.161 8.413 -15.988 1.00 . A A . 7 TRP CD1 1 1 1 126 1 1 7 TRP CD2 C 10.508 8.054 -17.455 1.00 . A A . 7 TRP CD2 1 1 1 127 1 1 7 TRP CE2 C 11.574 8.686 -18.125 1.00 . A A . 7 TRP CE2 1 1 1 128 1 1 7 TRP CE3 C 9.357 7.729 -18.178 1.00 . A A . 7 TRP CE3 1 1 1 129 1 1 7 TRP CG C 10.904 7.889 -16.090 1.00 . A A . 7 TRP CG 1 1 1 130 1 1 7 TRP CH2 C 10.381 8.668 -20.164 1.00 . A A . 7 TRP CH2 1 1 1 131 1 1 7 TRP CZ2 C 11.520 8.998 -19.481 1.00 . A A . 7 TRP CZ2 1 1 1 132 1 1 7 TRP CZ3 C 9.305 8.040 -19.523 1.00 . A A . 7 TRP CZ3 1 1 1 133 1 1 7 TRP H H 8.923 5.756 -13.326 1.00 . A A . 7 TRP H 1 1 1 134 1 1 7 TRP HA H 8.870 5.937 -16.134 1.00 . A A . 7 TRP HA 1 1 1 135 1 1 7 TRP HB2 H 9.255 7.908 -14.790 1.00 . A A . 7 TRP HB2 1 1 1 136 1 1 7 TRP HB3 H 10.722 7.209 -14.110 1.00 . A A . 7 TRP HB3 1 1 1 137 1 1 7 TRP HD1 H 12.737 8.440 -15.076 1.00 . A A . 7 TRP HD1 1 1 1 138 1 1 7 TRP HE1 H 13.435 9.318 -17.392 1.00 . A A . 7 TRP HE1 1 1 1 139 1 1 7 TRP HE3 H 8.517 7.244 -17.702 1.00 . A A . 7 TRP HE3 1 1 1 140 1 1 7 TRP HH2 H 10.296 8.893 -21.216 1.00 . A A . 7 TRP HH2 1 1 1 141 1 1 7 TRP HZ2 H 12.341 9.482 -19.989 1.00 . A A . 7 TRP HZ2 1 1 1 142 1 1 7 TRP HZ3 H 8.423 7.796 -20.098 1.00 . A A . 7 TRP HZ3 1 1 1 143 1 1 7 TRP N N 8.917 5.275 -14.180 1.00 . A A . 7 TRP N 1 1 1 144 1 1 7 TRP NE1 N 12.570 8.895 -17.208 1.00 . A A . 7 TRP NE1 1 1 1 145 1 1 7 TRP O O 11.013 4.863 -16.988 1.00 . A A . 7 TRP O 1 1 1 146 1 1 8 LYS C C 12.168 2.411 -16.114 1.00 . A A . 8 LYS C 1 1 1 147 1 1 8 LYS CA C 12.574 3.512 -15.139 1.00 . A A . 8 LYS CA 1 1 1 148 1 1 8 LYS CB C 13.129 2.891 -13.855 1.00 . A A . 8 LYS CB 1 1 1 149 1 1 8 LYS CD C 12.000 2.907 -11.611 1.00 . A A . 8 LYS CD 1 1 1 150 1 1 8 LYS CE C 13.193 2.522 -10.750 1.00 . A A . 8 LYS CE 1 1 1 151 1 1 8 LYS CG C 12.065 2.251 -12.980 1.00 . A A . 8 LYS CG 1 1 1 152 1 1 8 LYS H H 11.184 4.516 -13.897 1.00 . A A . 8 LYS H 1 1 1 153 1 1 8 LYS HA H 13.341 4.117 -15.598 1.00 . A A . 8 LYS HA 1 1 1 154 1 1 8 LYS HB2 H 13.853 2.134 -14.119 1.00 . A A . 8 LYS HB2 1 1 1 155 1 1 8 LYS HB3 H 13.621 3.663 -13.280 1.00 . A A . 8 LYS HB3 1 1 1 156 1 1 8 LYS HD2 H 11.992 3.980 -11.736 1.00 . A A . 8 LYS HD2 1 1 1 157 1 1 8 LYS HD3 H 11.092 2.594 -11.114 1.00 . A A . 8 LYS HD3 1 1 1 158 1 1 8 LYS HE2 H 13.084 1.492 -10.447 1.00 . A A . 8 LYS HE2 1 1 1 159 1 1 8 LYS HE3 H 14.093 2.630 -11.337 1.00 . A A . 8 LYS HE3 1 1 1 160 1 1 8 LYS HG2 H 11.105 2.353 -13.463 1.00 . A A . 8 LYS HG2 1 1 1 161 1 1 8 LYS HG3 H 12.298 1.202 -12.856 1.00 . A A . 8 LYS HG3 1 1 1 162 1 1 8 LYS HZ1 H 12.609 4.152 -9.583 1.00 . A A . 8 LYS HZ1 1 1 1 163 1 1 8 LYS HZ2 H 13.112 2.811 -8.683 1.00 . A A . 8 LYS HZ2 1 1 1 164 1 1 8 LYS HZ3 H 14.255 3.781 -9.466 1.00 . A A . 8 LYS HZ3 1 1 1 165 1 1 8 LYS N N 11.442 4.379 -14.833 1.00 . A A . 8 LYS N 1 1 1 166 1 1 8 LYS NZ N 13.300 3.376 -9.535 1.00 . A A . 8 LYS NZ 1 1 1 167 1 1 8 LYS O O 12.953 2.008 -16.973 1.00 . A A . 8 LYS O 1 1 1 168 1 1 9 SER C C 9.905 1.451 -18.154 1.00 . A A . 9 SER C 1 1 1 169 1 1 9 SER CA C 10.428 0.872 -16.842 1.00 . A A . 9 SER CA 1 1 1 170 1 1 9 SER CB C 9.316 0.094 -16.135 1.00 . A A . 9 SER CB 1 1 1 171 1 1 9 SER H H 10.358 2.290 -15.271 1.00 . A A . 9 SER H 1 1 1 172 1 1 9 SER HA H 11.244 0.199 -17.059 1.00 . A A . 9 SER HA 1 1 1 173 1 1 9 SER HB2 H 8.411 0.682 -16.139 1.00 . A A . 9 SER HB2 1 1 1 174 1 1 9 SER HB3 H 9.144 -0.836 -16.657 1.00 . A A . 9 SER HB3 1 1 1 175 1 1 9 SER HG H 9.807 -1.138 -14.694 1.00 . A A . 9 SER HG 1 1 1 176 1 1 9 SER N N 10.937 1.928 -15.975 1.00 . A A . 9 SER N 1 1 1 177 1 1 9 SER O O 10.046 0.842 -19.214 1.00 . A A . 9 SER O 1 1 1 178 1 1 9 SER OG O 9.669 -0.193 -14.793 1.00 . A A . 9 SER OG 1 1 1 179 1 1 10 PHE C C 9.864 3.656 -20.234 1.00 . A A . 10 PHE C 1 1 1 180 1 1 10 PHE CA C 8.754 3.293 -19.252 1.00 . A A . 10 PHE CA 1 1 1 181 1 1 10 PHE CB C 7.985 4.552 -18.846 1.00 . A A . 10 PHE CB 1 1 1 182 1 1 10 PHE CD1 C 6.160 3.334 -17.628 1.00 . A A . 10 PHE CD1 1 1 1 183 1 1 10 PHE CD2 C 5.545 5.024 -19.194 1.00 . A A . 10 PHE CD2 1 1 1 184 1 1 10 PHE CE1 C 4.826 3.098 -17.353 1.00 . A A . 10 PHE CE1 1 1 1 185 1 1 10 PHE CE2 C 4.210 4.793 -18.923 1.00 . A A . 10 PHE CE2 1 1 1 186 1 1 10 PHE CG C 6.534 4.298 -18.550 1.00 . A A . 10 PHE CG 1 1 1 187 1 1 10 PHE CZ C 3.849 3.828 -18.002 1.00 . A A . 10 PHE CZ 1 1 1 188 1 1 10 PHE H H 9.218 3.067 -17.198 1.00 . A A . 10 PHE H 1 1 1 189 1 1 10 PHE HA H 8.075 2.605 -19.732 1.00 . A A . 10 PHE HA 1 1 1 190 1 1 10 PHE HB2 H 8.435 4.970 -17.959 1.00 . A A . 10 PHE HB2 1 1 1 191 1 1 10 PHE HB3 H 8.040 5.273 -19.648 1.00 . A A . 10 PHE HB3 1 1 1 192 1 1 10 PHE HD1 H 6.923 2.762 -17.119 1.00 . A A . 10 PHE HD1 1 1 1 193 1 1 10 PHE HD2 H 5.825 5.777 -19.915 1.00 . A A . 10 PHE HD2 1 1 1 194 1 1 10 PHE HE1 H 4.548 2.343 -16.632 1.00 . A A . 10 PHE HE1 1 1 1 195 1 1 10 PHE HE2 H 3.448 5.365 -19.432 1.00 . A A . 10 PHE HE2 1 1 1 196 1 1 10 PHE HZ H 2.807 3.646 -17.788 1.00 . A A . 10 PHE HZ 1 1 1 197 1 1 10 PHE N N 9.300 2.631 -18.073 1.00 . A A . 10 PHE N 1 1 1 198 1 1 10 PHE O O 9.715 3.491 -21.446 1.00 . A A . 10 PHE O 1 1 1 199 1 1 11 LEU C C 12.518 3.404 -21.467 1.00 . A A . 11 LEU C 1 1 1 200 1 1 11 LEU CA C 12.112 4.539 -20.532 1.00 . A A . 11 LEU CA 1 1 1 201 1 1 11 LEU CB C 13.298 4.939 -19.652 1.00 . A A . 11 LEU CB 1 1 1 202 1 1 11 LEU CD1 C 15.157 6.518 -19.075 1.00 . A A . 11 LEU CD1 1 1 1 203 1 1 11 LEU CD2 C 14.503 6.181 -21.466 1.00 . A A . 11 LEU CD2 1 1 1 204 1 1 11 LEU CG C 14.005 6.241 -20.029 1.00 . A A . 11 LEU CG 1 1 1 205 1 1 11 LEU H H 11.036 4.260 -18.732 1.00 . A A . 11 LEU H 1 1 1 206 1 1 11 LEU HA H 11.814 5.390 -21.127 1.00 . A A . 11 LEU HA 1 1 1 207 1 1 11 LEU HB2 H 12.939 5.038 -18.639 1.00 . A A . 11 LEU HB2 1 1 1 208 1 1 11 LEU HB3 H 14.026 4.141 -19.698 1.00 . A A . 11 LEU HB3 1 1 1 209 1 1 11 LEU HD11 H 15.487 7.539 -19.197 1.00 . A A . 11 LEU HD11 1 1 1 210 1 1 11 LEU HD12 H 14.826 6.366 -18.058 1.00 . A A . 11 LEU HD12 1 1 1 211 1 1 11 LEU HD13 H 15.974 5.847 -19.293 1.00 . A A . 11 LEU HD13 1 1 1 212 1 1 11 LEU HD21 H 13.876 6.801 -22.090 1.00 . A A . 11 LEU HD21 1 1 1 213 1 1 11 LEU HD22 H 15.521 6.540 -21.509 1.00 . A A . 11 LEU HD22 1 1 1 214 1 1 11 LEU HD23 H 14.466 5.161 -21.818 1.00 . A A . 11 LEU HD23 1 1 1 215 1 1 11 LEU HG H 13.303 7.060 -19.951 1.00 . A A . 11 LEU HG 1 1 1 216 1 1 11 LEU N N 10.976 4.152 -19.704 1.00 . A A . 11 LEU N 1 1 1 217 1 1 11 LEU O O 12.547 3.570 -22.686 1.00 . A A . 11 LEU O 1 1 2 218 1 1 1 LYS C C 3.332 0.130 -4.792 1.00 . A A . 1 LYS C 1 1 2 219 1 1 1 LYS CA C 3.484 -1.188 -5.545 1.00 . A A . 1 LYS CA 1 1 2 220 1 1 1 LYS CB C 3.904 -2.296 -4.576 1.00 . A A . 1 LYS CB 1 1 2 221 1 1 1 LYS CD C 1.648 -3.220 -3.972 1.00 . A A . 1 LYS CD 1 1 2 222 1 1 1 LYS CE C 0.533 -3.196 -5.007 1.00 . A A . 1 LYS CE 1 1 2 223 1 1 1 LYS CG C 2.995 -3.512 -4.612 1.00 . A A . 1 LYS CG 1 1 2 224 1 1 1 LYS H1 H 5.349 -1.456 -6.509 1.00 . A A . 1 LYS H1 1 1 2 225 1 1 1 LYS HA H 2.534 -1.448 -5.986 1.00 . A A . 1 LYS HA 1 1 2 226 1 1 1 LYS HB2 H 4.906 -2.614 -4.824 1.00 . A A . 1 LYS HB2 1 1 2 227 1 1 1 LYS HB3 H 3.900 -1.899 -3.571 1.00 . A A . 1 LYS HB3 1 1 2 228 1 1 1 LYS HD2 H 1.431 -3.987 -3.244 1.00 . A A . 1 LYS HD2 1 1 2 229 1 1 1 LYS HD3 H 1.693 -2.258 -3.482 1.00 . A A . 1 LYS HD3 1 1 2 230 1 1 1 LYS HE2 H -0.382 -2.889 -4.524 1.00 . A A . 1 LYS HE2 1 1 2 231 1 1 1 LYS HE3 H 0.790 -2.485 -5.777 1.00 . A A . 1 LYS HE3 1 1 2 232 1 1 1 LYS HG2 H 2.837 -3.802 -5.640 1.00 . A A . 1 LYS HG2 1 1 2 233 1 1 1 LYS HG3 H 3.470 -4.321 -4.076 1.00 . A A . 1 LYS HG3 1 1 2 234 1 1 1 LYS HZ1 H 0.621 -4.511 -6.627 1.00 . A A . 1 LYS HZ1 1 1 2 235 1 1 1 LYS HZ2 H 0.887 -5.252 -5.129 1.00 . A A . 1 LYS HZ2 1 1 2 236 1 1 1 LYS HZ3 H -0.679 -4.798 -5.583 1.00 . A A . 1 LYS HZ3 1 1 2 237 1 1 1 LYS N N 4.459 -1.062 -6.622 1.00 . A A . 1 LYS N 1 1 2 238 1 1 1 LYS NZ N 0.326 -4.533 -5.630 1.00 . A A . 1 LYS NZ 1 1 2 239 1 1 1 LYS O O 2.231 0.502 -4.387 1.00 . A A . 1 LYS O 1 1 2 240 1 1 2 PHE C C 3.679 3.167 -4.705 1.00 . A A . 2 PHE C 1 1 2 241 1 1 2 PHE CA C 4.435 2.110 -3.905 1.00 . A A . 2 PHE CA 1 1 2 242 1 1 2 PHE CB C 5.866 2.582 -3.640 1.00 . A A . 2 PHE CB 1 1 2 243 1 1 2 PHE CD1 C 6.759 2.337 -1.308 1.00 . A A . 2 PHE CD1 1 1 2 244 1 1 2 PHE CD2 C 7.037 0.517 -2.824 1.00 . A A . 2 PHE CD2 1 1 2 245 1 1 2 PHE CE1 C 7.404 1.616 -0.320 1.00 . A A . 2 PHE CE1 1 1 2 246 1 1 2 PHE CE2 C 7.682 -0.208 -1.840 1.00 . A A . 2 PHE CE2 1 1 2 247 1 1 2 PHE CG C 6.568 1.796 -2.569 1.00 . A A . 2 PHE CG 1 1 2 248 1 1 2 PHE CZ C 7.867 0.343 -0.587 1.00 . A A . 2 PHE CZ 1 1 2 249 1 1 2 PHE H H 5.293 0.484 -4.955 1.00 . A A . 2 PHE H 1 1 2 250 1 1 2 PHE HA H 3.933 1.963 -2.961 1.00 . A A . 2 PHE HA 1 1 2 251 1 1 2 PHE HB2 H 6.442 2.490 -4.549 1.00 . A A . 2 PHE HB2 1 1 2 252 1 1 2 PHE HB3 H 5.846 3.617 -3.335 1.00 . A A . 2 PHE HB3 1 1 2 253 1 1 2 PHE HD1 H 6.397 3.334 -1.098 1.00 . A A . 2 PHE HD1 1 1 2 254 1 1 2 PHE HD2 H 6.894 0.086 -3.804 1.00 . A A . 2 PHE HD2 1 1 2 255 1 1 2 PHE HE1 H 7.546 2.050 0.659 1.00 . A A . 2 PHE HE1 1 1 2 256 1 1 2 PHE HE2 H 8.043 -1.203 -2.051 1.00 . A A . 2 PHE HE2 1 1 2 257 1 1 2 PHE HZ H 8.370 -0.222 0.184 1.00 . A A . 2 PHE HZ 1 1 2 258 1 1 2 PHE N N 4.445 0.833 -4.609 1.00 . A A . 2 PHE N 1 1 2 259 1 1 2 PHE O O 3.299 2.938 -5.853 1.00 . A A . 2 PHE O 1 1 2 260 1 1 3 LYS C C 3.736 6.431 -5.326 1.00 . A A . 3 LYS C 1 1 2 261 1 1 3 LYS CA C 2.756 5.419 -4.743 1.00 . A A . 3 LYS CA 1 1 2 262 1 1 3 LYS CB C 1.820 6.112 -3.751 1.00 . A A . 3 LYS CB 1 1 2 263 1 1 3 LYS CD C 1.837 6.436 -1.260 1.00 . A A . 3 LYS CD 1 1 2 264 1 1 3 LYS CE C 2.044 4.990 -0.837 1.00 . A A . 3 LYS CE 1 1 2 265 1 1 3 LYS CG C 2.542 6.740 -2.571 1.00 . A A . 3 LYS CG 1 1 2 266 1 1 3 LYS H H 3.793 4.447 -3.174 1.00 . A A . 3 LYS H 1 1 2 267 1 1 3 LYS HA H 2.169 5.000 -5.547 1.00 . A A . 3 LYS HA 1 1 2 268 1 1 3 LYS HB2 H 1.277 6.889 -4.268 1.00 . A A . 3 LYS HB2 1 1 2 269 1 1 3 LYS HB3 H 1.117 5.386 -3.370 1.00 . A A . 3 LYS HB3 1 1 2 270 1 1 3 LYS HD2 H 2.230 7.084 -0.491 1.00 . A A . 3 LYS HD2 1 1 2 271 1 1 3 LYS HD3 H 0.778 6.619 -1.380 1.00 . A A . 3 LYS HD3 1 1 2 272 1 1 3 LYS HE2 H 2.767 4.536 -1.497 1.00 . A A . 3 LYS HE2 1 1 2 273 1 1 3 LYS HE3 H 2.421 4.975 0.175 1.00 . A A . 3 LYS HE3 1 1 2 274 1 1 3 LYS HG2 H 3.547 6.347 -2.525 1.00 . A A . 3 LYS HG2 1 1 2 275 1 1 3 LYS HG3 H 2.578 7.811 -2.711 1.00 . A A . 3 LYS HG3 1 1 2 276 1 1 3 LYS HZ1 H -0.036 4.852 -0.972 1.00 . A A . 3 LYS HZ1 1 1 2 277 1 1 3 LYS HZ2 H 0.785 3.575 -1.718 1.00 . A A . 3 LYS HZ2 1 1 2 278 1 1 3 LYS HZ3 H 0.671 3.637 -0.031 1.00 . A A . 3 LYS HZ3 1 1 2 279 1 1 3 LYS N N 3.465 4.325 -4.090 1.00 . A A . 3 LYS N 1 1 2 280 1 1 3 LYS NZ N 0.777 4.209 -0.894 1.00 . A A . 3 LYS NZ 1 1 2 281 1 1 3 LYS O O 3.514 7.640 -5.252 1.00 . A A . 3 LYS O 1 1 2 282 1 1 4 LYS C C 5.928 6.555 -8.011 1.00 . A A . 4 LYS C 1 1 2 283 1 1 4 LYS CA C 5.834 6.791 -6.507 1.00 . A A . 4 LYS CA 1 1 2 284 1 1 4 LYS CB C 7.196 6.539 -5.855 1.00 . A A . 4 LYS CB 1 1 2 285 1 1 4 LYS CD C 8.268 4.439 -4.989 1.00 . A A . 4 LYS CD 1 1 2 286 1 1 4 LYS CE C 9.606 4.958 -4.483 1.00 . A A . 4 LYS CE 1 1 2 287 1 1 4 LYS CG C 7.807 5.198 -6.222 1.00 . A A . 4 LYS CG 1 1 2 288 1 1 4 LYS H H 4.942 4.958 -5.937 1.00 . A A . 4 LYS H 1 1 2 289 1 1 4 LYS HA H 5.545 7.816 -6.333 1.00 . A A . 4 LYS HA 1 1 2 290 1 1 4 LYS HB2 H 7.878 7.318 -6.162 1.00 . A A . 4 LYS HB2 1 1 2 291 1 1 4 LYS HB3 H 7.080 6.577 -4.782 1.00 . A A . 4 LYS HB3 1 1 2 292 1 1 4 LYS HD2 H 7.531 4.556 -4.208 1.00 . A A . 4 LYS HD2 1 1 2 293 1 1 4 LYS HD3 H 8.369 3.392 -5.237 1.00 . A A . 4 LYS HD3 1 1 2 294 1 1 4 LYS HE2 H 10.382 4.275 -4.791 1.00 . A A . 4 LYS HE2 1 1 2 295 1 1 4 LYS HE3 H 9.788 5.930 -4.918 1.00 . A A . 4 LYS HE3 1 1 2 296 1 1 4 LYS HG2 H 7.069 4.605 -6.740 1.00 . A A . 4 LYS HG2 1 1 2 297 1 1 4 LYS HG3 H 8.657 5.365 -6.869 1.00 . A A . 4 LYS HG3 1 1 2 298 1 1 4 LYS HZ1 H 10.346 4.442 -2.599 1.00 . A A . 4 LYS HZ1 1 1 2 299 1 1 4 LYS HZ2 H 9.855 6.056 -2.723 1.00 . A A . 4 LYS HZ2 1 1 2 300 1 1 4 LYS HZ3 H 8.699 4.827 -2.605 1.00 . A A . 4 LYS HZ3 1 1 2 301 1 1 4 LYS N N 4.821 5.931 -5.908 1.00 . A A . 4 LYS N 1 1 2 302 1 1 4 LYS NZ N 9.628 5.079 -2.999 1.00 . A A . 4 LYS NZ 1 1 2 303 1 1 4 LYS O O 5.333 5.617 -8.541 1.00 . A A . 4 LYS O 1 1 2 304 1 1 5 VAL C C 8.272 6.863 -10.487 1.00 . A A . 5 VAL C 1 1 2 305 1 1 5 VAL CA C 6.853 7.297 -10.137 1.00 . A A . 5 VAL CA 1 1 2 306 1 1 5 VAL CB C 6.545 8.628 -10.849 1.00 . A A . 5 VAL CB 1 1 2 307 1 1 5 VAL CG1 C 6.727 8.484 -12.352 1.00 . A A . 5 VAL CG1 1 1 2 308 1 1 5 VAL CG2 C 5.137 9.095 -10.516 1.00 . A A . 5 VAL CG2 1 1 2 309 1 1 5 VAL H H 7.129 8.141 -8.216 1.00 . A A . 5 VAL H 1 1 2 310 1 1 5 VAL HA H 6.160 6.551 -10.498 1.00 . A A . 5 VAL HA 1 1 2 311 1 1 5 VAL HB H 7.243 9.372 -10.494 1.00 . A A . 5 VAL HB 1 1 2 312 1 1 5 VAL HG11 H 6.289 7.553 -12.680 1.00 . A A . 5 VAL HG11 1 1 2 313 1 1 5 VAL HG12 H 6.240 9.308 -12.854 1.00 . A A . 5 VAL HG12 1 1 2 314 1 1 5 VAL HG13 H 7.780 8.490 -12.590 1.00 . A A . 5 VAL HG13 1 1 2 315 1 1 5 VAL HG21 H 4.478 8.241 -10.456 1.00 . A A . 5 VAL HG21 1 1 2 316 1 1 5 VAL HG22 H 5.143 9.612 -9.567 1.00 . A A . 5 VAL HG22 1 1 2 317 1 1 5 VAL HG23 H 4.788 9.765 -11.288 1.00 . A A . 5 VAL HG23 1 1 2 318 1 1 5 VAL N N 6.680 7.413 -8.694 1.00 . A A . 5 VAL N 1 1 2 319 1 1 5 VAL O O 9.237 7.291 -9.853 1.00 . A A . 5 VAL O 1 1 2 320 1 1 6 ILE C C 9.725 5.311 -13.445 1.00 . A A . 6 ILE C 1 1 2 321 1 1 6 ILE CA C 9.694 5.520 -11.935 1.00 . A A . 6 ILE CA 1 1 2 322 1 1 6 ILE CB C 10.059 4.197 -11.237 1.00 . A A . 6 ILE CB 1 1 2 323 1 1 6 ILE CD1 C 9.539 2.759 -9.203 1.00 . A A . 6 ILE CD1 1 1 2 324 1 1 6 ILE CG1 C 9.153 3.968 -10.025 1.00 . A A . 6 ILE CG1 1 1 2 325 1 1 6 ILE CG2 C 11.521 4.206 -10.818 1.00 . A A . 6 ILE CG2 1 1 2 326 1 1 6 ILE H H 7.586 5.706 -11.966 1.00 . A A . 6 ILE H 1 1 2 327 1 1 6 ILE HA H 10.434 6.261 -11.670 1.00 . A A . 6 ILE HA 1 1 2 328 1 1 6 ILE HB H 9.916 3.393 -11.941 1.00 . A A . 6 ILE HB 1 1 2 329 1 1 6 ILE HD11 H 9.518 1.878 -9.827 1.00 . A A . 6 ILE HD11 1 1 2 330 1 1 6 ILE HD12 H 10.534 2.895 -8.806 1.00 . A A . 6 ILE HD12 1 1 2 331 1 1 6 ILE HD13 H 8.840 2.640 -8.388 1.00 . A A . 6 ILE HD13 1 1 2 332 1 1 6 ILE HG12 H 9.197 4.833 -9.382 1.00 . A A . 6 ILE HG12 1 1 2 333 1 1 6 ILE HG13 H 8.137 3.829 -10.366 1.00 . A A . 6 ILE HG13 1 1 2 334 1 1 6 ILE HG21 H 12.119 4.643 -11.604 1.00 . A A . 6 ILE HG21 1 1 2 335 1 1 6 ILE HG22 H 11.634 4.788 -9.915 1.00 . A A . 6 ILE HG22 1 1 2 336 1 1 6 ILE HG23 H 11.850 3.193 -10.637 1.00 . A A . 6 ILE HG23 1 1 2 337 1 1 6 ILE N N 8.392 6.011 -11.500 1.00 . A A . 6 ILE N 1 1 2 338 1 1 6 ILE O O 9.179 4.334 -13.958 1.00 . A A . 6 ILE O 1 1 2 339 1 1 7 TRP C C 11.200 4.875 -16.024 1.00 . A A . 7 TRP C 1 1 2 340 1 1 7 TRP CA C 10.474 6.148 -15.604 1.00 . A A . 7 TRP CA 1 1 2 341 1 1 7 TRP CB C 11.204 7.373 -16.156 1.00 . A A . 7 TRP CB 1 1 2 342 1 1 7 TRP CD1 C 12.643 7.498 -18.273 1.00 . A A . 7 TRP CD1 1 1 2 343 1 1 7 TRP CD2 C 10.489 7.014 -18.651 1.00 . A A . 7 TRP CD2 1 1 2 344 1 1 7 TRP CE2 C 11.164 7.053 -19.886 1.00 . A A . 7 TRP CE2 1 1 2 345 1 1 7 TRP CE3 C 9.121 6.727 -18.639 1.00 . A A . 7 TRP CE3 1 1 2 346 1 1 7 TRP CG C 11.453 7.301 -17.632 1.00 . A A . 7 TRP CG 1 1 2 347 1 1 7 TRP CH2 C 9.177 6.537 -21.055 1.00 . A A . 7 TRP CH2 1 1 2 348 1 1 7 TRP CZ2 C 10.516 6.816 -21.096 1.00 . A A . 7 TRP CZ2 1 1 2 349 1 1 7 TRP CZ3 C 8.480 6.492 -19.841 1.00 . A A . 7 TRP CZ3 1 1 2 350 1 1 7 TRP H H 10.784 6.989 -13.686 1.00 . A A . 7 TRP H 1 1 2 351 1 1 7 TRP HA H 9.472 6.126 -16.007 1.00 . A A . 7 TRP HA 1 1 2 352 1 1 7 TRP HB2 H 10.614 8.255 -15.960 1.00 . A A . 7 TRP HB2 1 1 2 353 1 1 7 TRP HB3 H 12.160 7.466 -15.660 1.00 . A A . 7 TRP HB3 1 1 2 354 1 1 7 TRP HD1 H 13.570 7.735 -17.775 1.00 . A A . 7 TRP HD1 1 1 2 355 1 1 7 TRP HE1 H 13.183 7.442 -20.302 1.00 . A A . 7 TRP HE1 1 1 2 356 1 1 7 TRP HE3 H 8.566 6.688 -17.713 1.00 . A A . 7 TRP HE3 1 1 2 357 1 1 7 TRP HH2 H 8.636 6.347 -21.969 1.00 . A A . 7 TRP HH2 1 1 2 358 1 1 7 TRP HZ2 H 11.040 6.846 -22.040 1.00 . A A . 7 TRP HZ2 1 1 2 359 1 1 7 TRP HZ3 H 7.423 6.269 -19.852 1.00 . A A . 7 TRP HZ3 1 1 2 360 1 1 7 TRP N N 10.369 6.233 -14.152 1.00 . A A . 7 TRP N 1 1 2 361 1 1 7 TRP NE1 N 12.476 7.351 -19.629 1.00 . A A . 7 TRP NE1 1 1 2 362 1 1 7 TRP O O 10.816 4.219 -16.992 1.00 . A A . 7 TRP O 1 1 2 363 1 1 8 LYS C C 12.132 2.110 -15.700 1.00 . A A . 8 LYS C 1 1 2 364 1 1 8 LYS CA C 13.034 3.335 -15.585 1.00 . A A . 8 LYS CA 1 1 2 365 1 1 8 LYS CB C 14.086 3.106 -14.497 1.00 . A A . 8 LYS CB 1 1 2 366 1 1 8 LYS CD C 14.413 3.197 -12.009 1.00 . A A . 8 LYS CD 1 1 2 367 1 1 8 LYS CE C 15.655 2.322 -11.939 1.00 . A A . 8 LYS CE 1 1 2 368 1 1 8 LYS CG C 13.493 2.769 -13.140 1.00 . A A . 8 LYS CG 1 1 2 369 1 1 8 LYS H H 12.511 5.094 -14.530 1.00 . A A . 8 LYS H 1 1 2 370 1 1 8 LYS HA H 13.533 3.489 -16.530 1.00 . A A . 8 LYS HA 1 1 2 371 1 1 8 LYS HB2 H 14.727 2.292 -14.799 1.00 . A A . 8 LYS HB2 1 1 2 372 1 1 8 LYS HB3 H 14.681 4.003 -14.395 1.00 . A A . 8 LYS HB3 1 1 2 373 1 1 8 LYS HD2 H 14.716 4.221 -12.170 1.00 . A A . 8 LYS HD2 1 1 2 374 1 1 8 LYS HD3 H 13.877 3.121 -11.073 1.00 . A A . 8 LYS HD3 1 1 2 375 1 1 8 LYS HE2 H 16.034 2.177 -12.939 1.00 . A A . 8 LYS HE2 1 1 2 376 1 1 8 LYS HE3 H 16.401 2.825 -11.342 1.00 . A A . 8 LYS HE3 1 1 2 377 1 1 8 LYS HG2 H 12.548 3.280 -13.033 1.00 . A A . 8 LYS HG2 1 1 2 378 1 1 8 LYS HG3 H 13.337 1.701 -13.081 1.00 . A A . 8 LYS HG3 1 1 2 379 1 1 8 LYS HZ1 H 15.403 1.057 -10.296 1.00 . A A . 8 LYS HZ1 1 1 2 380 1 1 8 LYS HZ2 H 14.417 0.671 -11.615 1.00 . A A . 8 LYS HZ2 1 1 2 381 1 1 8 LYS HZ3 H 16.065 0.294 -11.652 1.00 . A A . 8 LYS HZ3 1 1 2 382 1 1 8 LYS N N 12.253 4.531 -15.290 1.00 . A A . 8 LYS N 1 1 2 383 1 1 8 LYS NZ N 15.365 0.993 -11.333 1.00 . A A . 8 LYS NZ 1 1 2 384 1 1 8 LYS O O 12.380 1.219 -16.512 1.00 . A A . 8 LYS O 1 1 2 385 1 1 9 SER C C 9.070 1.161 -15.956 1.00 . A A . 9 SER C 1 1 2 386 1 1 9 SER CA C 10.145 0.959 -14.893 1.00 . A A . 9 SER CA 1 1 2 387 1 1 9 SER CB C 9.494 0.801 -13.517 1.00 . A A . 9 SER CB 1 1 2 388 1 1 9 SER H H 10.939 2.816 -14.259 1.00 . A A . 9 SER H 1 1 2 389 1 1 9 SER HA H 10.700 0.061 -15.124 1.00 . A A . 9 SER HA 1 1 2 390 1 1 9 SER HB2 H 10.251 0.886 -12.752 1.00 . A A . 9 SER HB2 1 1 2 391 1 1 9 SER HB3 H 8.755 1.577 -13.381 1.00 . A A . 9 SER HB3 1 1 2 392 1 1 9 SER HG H 8.486 -0.547 -12.515 1.00 . A A . 9 SER HG 1 1 2 393 1 1 9 SER N N 11.083 2.075 -14.884 1.00 . A A . 9 SER N 1 1 2 394 1 1 9 SER O O 8.623 0.206 -16.592 1.00 . A A . 9 SER O 1 1 2 395 1 1 9 SER OG O 8.861 -0.461 -13.394 1.00 . A A . 9 SER OG 1 1 2 396 1 1 10 PHE C C 8.094 2.363 -18.535 1.00 . A A . 10 PHE C 1 1 2 397 1 1 10 PHE CA C 7.637 2.740 -17.129 1.00 . A A . 10 PHE CA 1 1 2 398 1 1 10 PHE CB C 7.305 4.233 -17.072 1.00 . A A . 10 PHE CB 1 1 2 399 1 1 10 PHE CD1 C 6.180 4.062 -14.836 1.00 . A A . 10 PHE CD1 1 1 2 400 1 1 10 PHE CD2 C 5.136 5.372 -16.533 1.00 . A A . 10 PHE CD2 1 1 2 401 1 1 10 PHE CE1 C 5.150 4.364 -13.965 1.00 . A A . 10 PHE CE1 1 1 2 402 1 1 10 PHE CE2 C 4.104 5.677 -15.666 1.00 . A A . 10 PHE CE2 1 1 2 403 1 1 10 PHE CG C 6.185 4.562 -16.128 1.00 . A A . 10 PHE CG 1 1 2 404 1 1 10 PHE CZ C 4.110 5.171 -14.381 1.00 . A A . 10 PHE CZ 1 1 2 405 1 1 10 PHE H H 9.055 3.129 -15.606 1.00 . A A . 10 PHE H 1 1 2 406 1 1 10 PHE HA H 6.751 2.174 -16.888 1.00 . A A . 10 PHE HA 1 1 2 407 1 1 10 PHE HB2 H 8.181 4.777 -16.750 1.00 . A A . 10 PHE HB2 1 1 2 408 1 1 10 PHE HB3 H 7.021 4.569 -18.058 1.00 . A A . 10 PHE HB3 1 1 2 409 1 1 10 PHE HD1 H 6.993 3.429 -14.510 1.00 . A A . 10 PHE HD1 1 1 2 410 1 1 10 PHE HD2 H 5.128 5.767 -17.539 1.00 . A A . 10 PHE HD2 1 1 2 411 1 1 10 PHE HE1 H 5.158 3.966 -12.961 1.00 . A A . 10 PHE HE1 1 1 2 412 1 1 10 PHE HE2 H 3.291 6.309 -15.994 1.00 . A A . 10 PHE HE2 1 1 2 413 1 1 10 PHE HZ H 3.305 5.409 -13.702 1.00 . A A . 10 PHE HZ 1 1 2 414 1 1 10 PHE N N 8.660 2.411 -16.144 1.00 . A A . 10 PHE N 1 1 2 415 1 1 10 PHE O O 7.305 1.882 -19.350 1.00 . A A . 10 PHE O 1 1 2 416 1 1 11 LEU C C 9.727 0.796 -20.465 1.00 . A A . 11 LEU C 1 1 2 417 1 1 11 LEU CA C 9.939 2.267 -20.121 1.00 . A A . 11 LEU CA 1 1 2 418 1 1 11 LEU CB C 11.432 2.599 -20.148 1.00 . A A . 11 LEU CB 1 1 2 419 1 1 11 LEU CD1 C 13.402 3.714 -21.224 1.00 . A A . 11 LEU CD1 1 1 2 420 1 1 11 LEU CD2 C 11.650 2.634 -22.645 1.00 . A A . 11 LEU CD2 1 1 2 421 1 1 11 LEU CG C 11.920 3.398 -21.357 1.00 . A A . 11 LEU CG 1 1 2 422 1 1 11 LEU H H 9.955 2.968 -18.124 1.00 . A A . 11 LEU H 1 1 2 423 1 1 11 LEU HA H 9.430 2.873 -20.857 1.00 . A A . 11 LEU HA 1 1 2 424 1 1 11 LEU HB2 H 11.660 3.170 -19.261 1.00 . A A . 11 LEU HB2 1 1 2 425 1 1 11 LEU HB3 H 11.977 1.666 -20.124 1.00 . A A . 11 LEU HB3 1 1 2 426 1 1 11 LEU HD11 H 13.794 4.013 -22.185 1.00 . A A . 11 LEU HD11 1 1 2 427 1 1 11 LEU HD12 H 13.536 4.517 -20.514 1.00 . A A . 11 LEU HD12 1 1 2 428 1 1 11 LEU HD13 H 13.928 2.837 -20.878 1.00 . A A . 11 LEU HD13 1 1 2 429 1 1 11 LEU HD21 H 11.692 1.573 -22.450 1.00 . A A . 11 LEU HD21 1 1 2 430 1 1 11 LEU HD22 H 10.670 2.893 -23.018 1.00 . A A . 11 LEU HD22 1 1 2 431 1 1 11 LEU HD23 H 12.395 2.895 -23.382 1.00 . A A . 11 LEU HD23 1 1 2 432 1 1 11 LEU HG H 11.382 4.335 -21.403 1.00 . A A . 11 LEU HG 1 1 2 433 1 1 11 LEU N N 9.374 2.583 -18.814 1.00 . A A . 11 LEU N 1 1 2 434 1 1 11 LEU O O 9.518 -0.034 -19.581 1.00 . A A . 11 LEU O 1 1 3 435 1 1 1 LYS C C 2.574 3.856 -1.884 1.00 . A A . 1 LYS C 1 1 3 436 1 1 1 LYS CA C 1.646 5.006 -1.509 1.00 . A A . 1 LYS CA 1 1 3 437 1 1 1 LYS CB C 2.119 6.297 -2.180 1.00 . A A . 1 LYS CB 1 1 3 438 1 1 1 LYS CD C 0.436 7.915 -1.251 1.00 . A A . 1 LYS CD 1 1 3 439 1 1 1 LYS CE C -0.721 8.847 -1.574 1.00 . A A . 1 LYS CE 1 1 3 440 1 1 1 LYS CG C 0.991 7.262 -2.506 1.00 . A A . 1 LYS CG 1 1 3 441 1 1 1 LYS H1 H 2.384 5.512 0.410 1.00 . A A . 1 LYS H1 1 1 3 442 1 1 1 LYS HA H 0.649 4.776 -1.853 1.00 . A A . 1 LYS HA 1 1 3 443 1 1 1 LYS HB2 H 2.814 6.798 -1.523 1.00 . A A . 1 LYS HB2 1 1 3 444 1 1 1 LYS HB3 H 2.625 6.045 -3.101 1.00 . A A . 1 LYS HB3 1 1 3 445 1 1 1 LYS HD2 H 0.087 7.145 -0.580 1.00 . A A . 1 LYS HD2 1 1 3 446 1 1 1 LYS HD3 H 1.222 8.482 -0.773 1.00 . A A . 1 LYS HD3 1 1 3 447 1 1 1 LYS HE2 H -0.561 9.273 -2.552 1.00 . A A . 1 LYS HE2 1 1 3 448 1 1 1 LYS HE3 H -1.637 8.275 -1.575 1.00 . A A . 1 LYS HE3 1 1 3 449 1 1 1 LYS HG2 H 1.367 8.032 -3.163 1.00 . A A . 1 LYS HG2 1 1 3 450 1 1 1 LYS HG3 H 0.198 6.720 -3.001 1.00 . A A . 1 LYS HG3 1 1 3 451 1 1 1 LYS HZ1 H -1.801 10.344 -0.596 1.00 . A A . 1 LYS HZ1 1 1 3 452 1 1 1 LYS HZ2 H -0.641 9.590 0.377 1.00 . A A . 1 LYS HZ2 1 1 3 453 1 1 1 LYS HZ3 H -0.161 10.706 -0.801 1.00 . A A . 1 LYS HZ3 1 1 3 454 1 1 1 LYS N N 1.591 5.180 -0.062 1.00 . A A . 1 LYS N 1 1 3 455 1 1 1 LYS NZ N -0.839 9.949 -0.579 1.00 . A A . 1 LYS NZ 1 1 3 456 1 1 1 LYS O O 3.785 4.037 -2.007 1.00 . A A . 1 LYS O 1 1 3 457 1 1 2 PHE C C 3.203 1.551 -3.890 1.00 . A A . 2 PHE C 1 1 3 458 1 1 2 PHE CA C 2.774 1.492 -2.427 1.00 . A A . 2 PHE CA 1 1 3 459 1 1 2 PHE CB C 1.959 0.222 -2.174 1.00 . A A . 2 PHE CB 1 1 3 460 1 1 2 PHE CD1 C 2.783 -0.176 0.163 1.00 . A A . 2 PHE CD1 1 1 3 461 1 1 2 PHE CD2 C 0.431 -0.199 -0.228 1.00 . A A . 2 PHE CD2 1 1 3 462 1 1 2 PHE CE1 C 2.567 -0.431 1.504 1.00 . A A . 2 PHE CE1 1 1 3 463 1 1 2 PHE CE2 C 0.208 -0.454 1.112 1.00 . A A . 2 PHE CE2 1 1 3 464 1 1 2 PHE CG C 1.720 -0.056 -0.717 1.00 . A A . 2 PHE CG 1 1 3 465 1 1 2 PHE CZ C 1.277 -0.571 1.979 1.00 . A A . 2 PHE CZ 1 1 3 466 1 1 2 PHE H H 1.028 2.590 -1.952 1.00 . A A . 2 PHE H 1 1 3 467 1 1 2 PHE HA H 3.657 1.473 -1.806 1.00 . A A . 2 PHE HA 1 1 3 468 1 1 2 PHE HB2 H 0.998 0.318 -2.655 1.00 . A A . 2 PHE HB2 1 1 3 469 1 1 2 PHE HB3 H 2.484 -0.624 -2.592 1.00 . A A . 2 PHE HB3 1 1 3 470 1 1 2 PHE HD1 H 3.793 -0.067 -0.208 1.00 . A A . 2 PHE HD1 1 1 3 471 1 1 2 PHE HD2 H -0.406 -0.108 -0.905 1.00 . A A . 2 PHE HD2 1 1 3 472 1 1 2 PHE HE1 H 3.405 -0.523 2.179 1.00 . A A . 2 PHE HE1 1 1 3 473 1 1 2 PHE HE2 H -0.801 -0.563 1.480 1.00 . A A . 2 PHE HE2 1 1 3 474 1 1 2 PHE HZ H 1.106 -0.770 3.026 1.00 . A A . 2 PHE HZ 1 1 3 475 1 1 2 PHE N N 1.998 2.672 -2.065 1.00 . A A . 2 PHE N 1 1 3 476 1 1 2 PHE O O 2.555 2.196 -4.714 1.00 . A A . 2 PHE O 1 1 3 477 1 1 3 LYS C C 4.968 2.258 -6.123 1.00 . A A . 3 LYS C 1 1 3 478 1 1 3 LYS CA C 4.819 0.845 -5.569 1.00 . A A . 3 LYS CA 1 1 3 479 1 1 3 LYS CB C 3.893 0.027 -6.472 1.00 . A A . 3 LYS CB 1 1 3 480 1 1 3 LYS CD C 4.470 -2.057 -5.196 1.00 . A A . 3 LYS CD 1 1 3 481 1 1 3 LYS CE C 5.517 -2.441 -6.230 1.00 . A A . 3 LYS CE 1 1 3 482 1 1 3 LYS CG C 3.354 -1.230 -5.812 1.00 . A A . 3 LYS CG 1 1 3 483 1 1 3 LYS H H 4.775 0.376 -3.505 1.00 . A A . 3 LYS H 1 1 3 484 1 1 3 LYS HA H 5.791 0.376 -5.546 1.00 . A A . 3 LYS HA 1 1 3 485 1 1 3 LYS HB2 H 3.054 0.645 -6.761 1.00 . A A . 3 LYS HB2 1 1 3 486 1 1 3 LYS HB3 H 4.438 -0.262 -7.359 1.00 . A A . 3 LYS HB3 1 1 3 487 1 1 3 LYS HD2 H 4.945 -1.481 -4.416 1.00 . A A . 3 LYS HD2 1 1 3 488 1 1 3 LYS HD3 H 4.047 -2.958 -4.773 1.00 . A A . 3 LYS HD3 1 1 3 489 1 1 3 LYS HE2 H 5.119 -2.247 -7.215 1.00 . A A . 3 LYS HE2 1 1 3 490 1 1 3 LYS HE3 H 6.398 -1.836 -6.073 1.00 . A A . 3 LYS HE3 1 1 3 491 1 1 3 LYS HG2 H 2.658 -0.949 -5.036 1.00 . A A . 3 LYS HG2 1 1 3 492 1 1 3 LYS HG3 H 2.845 -1.826 -6.557 1.00 . A A . 3 LYS HG3 1 1 3 493 1 1 3 LYS HZ1 H 6.367 -4.184 -7.007 1.00 . A A . 3 LYS HZ1 1 1 3 494 1 1 3 LYS HZ2 H 6.537 -4.026 -5.331 1.00 . A A . 3 LYS HZ2 1 1 3 495 1 1 3 LYS HZ3 H 5.042 -4.461 -5.992 1.00 . A A . 3 LYS HZ3 1 1 3 496 1 1 3 LYS N N 4.301 0.872 -4.206 1.00 . A A . 3 LYS N 1 1 3 497 1 1 3 LYS NZ N 5.892 -3.879 -6.133 1.00 . A A . 3 LYS NZ 1 1 3 498 1 1 3 LYS O O 4.122 2.733 -6.880 1.00 . A A . 3 LYS O 1 1 3 499 1 1 4 LYS C C 6.306 4.356 -7.724 1.00 . A A . 4 LYS C 1 1 3 500 1 1 4 LYS CA C 6.314 4.286 -6.200 1.00 . A A . 4 LYS CA 1 1 3 501 1 1 4 LYS CB C 7.660 4.777 -5.663 1.00 . A A . 4 LYS CB 1 1 3 502 1 1 4 LYS CD C 6.718 6.542 -4.144 1.00 . A A . 4 LYS CD 1 1 3 503 1 1 4 LYS CE C 7.467 7.704 -3.510 1.00 . A A . 4 LYS CE 1 1 3 504 1 1 4 LYS CG C 7.591 5.303 -4.240 1.00 . A A . 4 LYS CG 1 1 3 505 1 1 4 LYS H H 6.690 2.496 -5.135 1.00 . A A . 4 LYS H 1 1 3 506 1 1 4 LYS HA H 5.530 4.922 -5.819 1.00 . A A . 4 LYS HA 1 1 3 507 1 1 4 LYS HB2 H 8.364 3.958 -5.689 1.00 . A A . 4 LYS HB2 1 1 3 508 1 1 4 LYS HB3 H 8.020 5.571 -6.301 1.00 . A A . 4 LYS HB3 1 1 3 509 1 1 4 LYS HD2 H 6.406 6.829 -5.138 1.00 . A A . 4 LYS HD2 1 1 3 510 1 1 4 LYS HD3 H 5.849 6.314 -3.544 1.00 . A A . 4 LYS HD3 1 1 3 511 1 1 4 LYS HE2 H 8.383 7.867 -4.057 1.00 . A A . 4 LYS HE2 1 1 3 512 1 1 4 LYS HE3 H 6.850 8.589 -3.571 1.00 . A A . 4 LYS HE3 1 1 3 513 1 1 4 LYS HG2 H 7.179 4.535 -3.601 1.00 . A A . 4 LYS HG2 1 1 3 514 1 1 4 LYS HG3 H 8.590 5.551 -3.909 1.00 . A A . 4 LYS HG3 1 1 3 515 1 1 4 LYS HZ1 H 8.597 6.781 -2.016 1.00 . A A . 4 LYS HZ1 1 1 3 516 1 1 4 LYS HZ2 H 8.049 8.327 -1.603 1.00 . A A . 4 LYS HZ2 1 1 3 517 1 1 4 LYS HZ3 H 6.975 7.019 -1.599 1.00 . A A . 4 LYS HZ3 1 1 3 518 1 1 4 LYS N N 6.051 2.927 -5.740 1.00 . A A . 4 LYS N 1 1 3 519 1 1 4 LYS NZ N 7.795 7.439 -2.082 1.00 . A A . 4 LYS NZ 1 1 3 520 1 1 4 LYS O O 6.232 3.331 -8.402 1.00 . A A . 4 LYS O 1 1 3 521 1 1 5 VAL C C 7.737 5.391 -10.304 1.00 . A A . 5 VAL C 1 1 3 522 1 1 5 VAL CA C 6.391 5.774 -9.700 1.00 . A A . 5 VAL CA 1 1 3 523 1 1 5 VAL CB C 6.076 7.237 -10.063 1.00 . A A . 5 VAL CB 1 1 3 524 1 1 5 VAL CG1 C 6.082 7.427 -11.572 1.00 . A A . 5 VAL CG1 1 1 3 525 1 1 5 VAL CG2 C 4.739 7.657 -9.469 1.00 . A A . 5 VAL CG2 1 1 3 526 1 1 5 VAL H H 6.442 6.350 -7.664 1.00 . A A . 5 VAL H 1 1 3 527 1 1 5 VAL HA H 5.623 5.146 -10.129 1.00 . A A . 5 VAL HA 1 1 3 528 1 1 5 VAL HB H 6.847 7.865 -9.640 1.00 . A A . 5 VAL HB 1 1 3 529 1 1 5 VAL HG11 H 5.884 6.482 -12.054 1.00 . A A . 5 VAL HG11 1 1 3 530 1 1 5 VAL HG12 H 5.318 8.139 -11.848 1.00 . A A . 5 VAL HG12 1 1 3 531 1 1 5 VAL HG13 H 7.048 7.796 -11.884 1.00 . A A . 5 VAL HG13 1 1 3 532 1 1 5 VAL HG21 H 4.318 8.456 -10.062 1.00 . A A . 5 VAL HG21 1 1 3 533 1 1 5 VAL HG22 H 4.065 6.814 -9.470 1.00 . A A . 5 VAL HG22 1 1 3 534 1 1 5 VAL HG23 H 4.887 8.000 -8.456 1.00 . A A . 5 VAL HG23 1 1 3 535 1 1 5 VAL N N 6.385 5.571 -8.257 1.00 . A A . 5 VAL N 1 1 3 536 1 1 5 VAL O O 8.788 5.643 -9.714 1.00 . A A . 5 VAL O 1 1 3 537 1 1 6 ILE C C 8.834 4.657 -13.663 1.00 . A A . 6 ILE C 1 1 3 538 1 1 6 ILE CA C 8.915 4.363 -12.168 1.00 . A A . 6 ILE CA 1 1 3 539 1 1 6 ILE CB C 9.189 2.861 -11.966 1.00 . A A . 6 ILE CB 1 1 3 540 1 1 6 ILE CD1 C 6.816 2.088 -12.464 1.00 . A A . 6 ILE CD1 1 1 3 541 1 1 6 ILE CG1 C 7.933 2.157 -11.447 1.00 . A A . 6 ILE CG1 1 1 3 542 1 1 6 ILE CG2 C 10.351 2.659 -11.006 1.00 . A A . 6 ILE CG2 1 1 3 543 1 1 6 ILE H H 6.830 4.607 -11.904 1.00 . A A . 6 ILE H 1 1 3 544 1 1 6 ILE HA H 9.741 4.919 -11.748 1.00 . A A . 6 ILE HA 1 1 3 545 1 1 6 ILE HB H 9.463 2.437 -12.920 1.00 . A A . 6 ILE HB 1 1 3 546 1 1 6 ILE HD11 H 5.883 1.878 -11.960 1.00 . A A . 6 ILE HD11 1 1 3 547 1 1 6 ILE HD12 H 6.740 3.033 -12.982 1.00 . A A . 6 ILE HD12 1 1 3 548 1 1 6 ILE HD13 H 7.025 1.303 -13.176 1.00 . A A . 6 ILE HD13 1 1 3 549 1 1 6 ILE HG12 H 8.186 1.148 -11.163 1.00 . A A . 6 ILE HG12 1 1 3 550 1 1 6 ILE HG13 H 7.564 2.689 -10.582 1.00 . A A . 6 ILE HG13 1 1 3 551 1 1 6 ILE HG21 H 11.209 2.293 -11.551 1.00 . A A . 6 ILE HG21 1 1 3 552 1 1 6 ILE HG22 H 10.598 3.600 -10.536 1.00 . A A . 6 ILE HG22 1 1 3 553 1 1 6 ILE HG23 H 10.073 1.941 -10.250 1.00 . A A . 6 ILE HG23 1 1 3 554 1 1 6 ILE N N 7.698 4.780 -11.484 1.00 . A A . 6 ILE N 1 1 3 555 1 1 6 ILE O O 8.266 3.879 -14.428 1.00 . A A . 6 ILE O 1 1 3 556 1 1 7 TRP C C 10.429 5.384 -16.269 1.00 . A A . 7 TRP C 1 1 3 557 1 1 7 TRP CA C 9.400 6.180 -15.474 1.00 . A A . 7 TRP CA 1 1 3 558 1 1 7 TRP CB C 9.685 7.678 -15.604 1.00 . A A . 7 TRP CB 1 1 3 559 1 1 7 TRP CD1 C 8.655 8.561 -17.778 1.00 . A A . 7 TRP CD1 1 1 3 560 1 1 7 TRP CD2 C 10.875 8.273 -17.861 1.00 . A A . 7 TRP CD2 1 1 3 561 1 1 7 TRP CE2 C 10.437 8.758 -19.109 1.00 . A A . 7 TRP CE2 1 1 3 562 1 1 7 TRP CE3 C 12.236 8.018 -17.677 1.00 . A A . 7 TRP CE3 1 1 3 563 1 1 7 TRP CG C 9.719 8.155 -17.024 1.00 . A A . 7 TRP CG 1 1 3 564 1 1 7 TRP CH2 C 12.642 8.733 -19.957 1.00 . A A . 7 TRP CH2 1 1 3 565 1 1 7 TRP CZ2 C 11.314 8.991 -20.165 1.00 . A A . 7 TRP CZ2 1 1 3 566 1 1 7 TRP CZ3 C 13.105 8.250 -18.726 1.00 . A A . 7 TRP CZ3 1 1 3 567 1 1 7 TRP H H 9.844 6.364 -13.412 1.00 . A A . 7 TRP H 1 1 3 568 1 1 7 TRP HA H 8.417 5.974 -15.871 1.00 . A A . 7 TRP HA 1 1 3 569 1 1 7 TRP HB2 H 8.917 8.230 -15.085 1.00 . A A . 7 TRP HB2 1 1 3 570 1 1 7 TRP HB3 H 10.644 7.894 -15.155 1.00 . A A . 7 TRP HB3 1 1 3 571 1 1 7 TRP HD1 H 7.635 8.585 -17.426 1.00 . A A . 7 TRP HD1 1 1 3 572 1 1 7 TRP HE1 H 8.504 9.252 -19.756 1.00 . A A . 7 TRP HE1 1 1 3 573 1 1 7 TRP HE3 H 12.613 7.646 -16.736 1.00 . A A . 7 TRP HE3 1 1 3 574 1 1 7 TRP HH2 H 13.356 8.899 -20.749 1.00 . A A . 7 TRP HH2 1 1 3 575 1 1 7 TRP HZ2 H 10.973 9.364 -21.120 1.00 . A A . 7 TRP HZ2 1 1 3 576 1 1 7 TRP HZ3 H 14.161 8.059 -18.603 1.00 . A A . 7 TRP HZ3 1 1 3 577 1 1 7 TRP N N 9.407 5.784 -14.070 1.00 . A A . 7 TRP N 1 1 3 578 1 1 7 TRP NE1 N 9.080 8.925 -19.033 1.00 . A A . 7 TRP NE1 1 1 3 579 1 1 7 TRP O O 10.188 5.009 -17.416 1.00 . A A . 7 TRP O 1 1 3 580 1 1 8 LYS C C 12.119 3.050 -16.849 1.00 . A A . 8 LYS C 1 1 3 581 1 1 8 LYS CA C 12.644 4.374 -16.301 1.00 . A A . 8 LYS CA 1 1 3 582 1 1 8 LYS CB C 13.785 4.113 -15.316 1.00 . A A . 8 LYS CB 1 1 3 583 1 1 8 LYS CD C 13.641 4.528 -12.842 1.00 . A A . 8 LYS CD 1 1 3 584 1 1 8 LYS CE C 15.087 4.393 -12.391 1.00 . A A . 8 LYS CE 1 1 3 585 1 1 8 LYS CG C 13.320 3.568 -13.976 1.00 . A A . 8 LYS CG 1 1 3 586 1 1 8 LYS H H 11.712 5.453 -14.737 1.00 . A A . 8 LYS H 1 1 3 587 1 1 8 LYS HA H 13.017 4.967 -17.122 1.00 . A A . 8 LYS HA 1 1 3 588 1 1 8 LYS HB2 H 14.467 3.400 -15.754 1.00 . A A . 8 LYS HB2 1 1 3 589 1 1 8 LYS HB3 H 14.312 5.040 -15.140 1.00 . A A . 8 LYS HB3 1 1 3 590 1 1 8 LYS HD2 H 13.474 5.540 -13.180 1.00 . A A . 8 LYS HD2 1 1 3 591 1 1 8 LYS HD3 H 12.990 4.313 -12.006 1.00 . A A . 8 LYS HD3 1 1 3 592 1 1 8 LYS HE2 H 15.130 3.698 -11.566 1.00 . A A . 8 LYS HE2 1 1 3 593 1 1 8 LYS HE3 H 15.673 4.012 -13.214 1.00 . A A . 8 LYS HE3 1 1 3 594 1 1 8 LYS HG2 H 12.252 3.414 -14.012 1.00 . A A . 8 LYS HG2 1 1 3 595 1 1 8 LYS HG3 H 13.816 2.626 -13.790 1.00 . A A . 8 LYS HG3 1 1 3 596 1 1 8 LYS HZ1 H 16.684 5.710 -12.107 1.00 . A A . 8 LYS HZ1 1 1 3 597 1 1 8 LYS HZ2 H 15.226 6.475 -12.496 1.00 . A A . 8 LYS HZ2 1 1 3 598 1 1 8 LYS HZ3 H 15.465 5.850 -10.942 1.00 . A A . 8 LYS HZ3 1 1 3 599 1 1 8 LYS N N 11.578 5.128 -15.652 1.00 . A A . 8 LYS N 1 1 3 600 1 1 8 LYS NZ N 15.655 5.699 -11.954 1.00 . A A . 8 LYS NZ 1 1 3 601 1 1 8 LYS O O 12.556 2.586 -17.902 1.00 . A A . 8 LYS O 1 1 3 602 1 1 9 SER C C 10.088 1.253 -17.977 1.00 . A A . 9 SER C 1 1 3 603 1 1 9 SER CA C 10.595 1.177 -16.540 1.00 . A A . 9 SER CA 1 1 3 604 1 1 9 SER CB C 9.451 0.788 -15.603 1.00 . A A . 9 SER CB 1 1 3 605 1 1 9 SER H H 10.871 2.868 -15.297 1.00 . A A . 9 SER H 1 1 3 606 1 1 9 SER HA H 11.367 0.424 -16.483 1.00 . A A . 9 SER HA 1 1 3 607 1 1 9 SER HB2 H 9.401 1.494 -14.788 1.00 . A A . 9 SER HB2 1 1 3 608 1 1 9 SER HB3 H 8.519 0.804 -16.150 1.00 . A A . 9 SER HB3 1 1 3 609 1 1 9 SER HG H 9.674 -0.463 -14.112 1.00 . A A . 9 SER HG 1 1 3 610 1 1 9 SER N N 11.178 2.448 -16.128 1.00 . A A . 9 SER N 1 1 3 611 1 1 9 SER O O 10.177 0.284 -18.731 1.00 . A A . 9 SER O 1 1 3 612 1 1 9 SER OG O 9.646 -0.510 -15.070 1.00 . A A . 9 SER OG 1 1 3 613 1 1 10 PHE C C 10.124 3.114 -20.634 1.00 . A A . 10 PHE C 1 1 3 614 1 1 10 PHE CA C 9.030 2.616 -19.694 1.00 . A A . 10 PHE CA 1 1 3 615 1 1 10 PHE CB C 7.872 3.616 -19.667 1.00 . A A . 10 PHE CB 1 1 3 616 1 1 10 PHE CD1 C 6.553 3.026 -17.616 1.00 . A A . 10 PHE CD1 1 1 3 617 1 1 10 PHE CD2 C 5.561 2.641 -19.750 1.00 . A A . 10 PHE CD2 1 1 3 618 1 1 10 PHE CE1 C 5.418 2.538 -16.996 1.00 . A A . 10 PHE CE1 1 1 3 619 1 1 10 PHE CE2 C 4.423 2.153 -19.136 1.00 . A A . 10 PHE CE2 1 1 3 620 1 1 10 PHE CG C 6.637 3.084 -18.997 1.00 . A A . 10 PHE CG 1 1 3 621 1 1 10 PHE CZ C 4.352 2.099 -17.757 1.00 . A A . 10 PHE CZ 1 1 3 622 1 1 10 PHE H H 9.511 3.148 -17.702 1.00 . A A . 10 PHE H 1 1 3 623 1 1 10 PHE HA H 8.667 1.667 -20.055 1.00 . A A . 10 PHE HA 1 1 3 624 1 1 10 PHE HB2 H 8.182 4.502 -19.134 1.00 . A A . 10 PHE HB2 1 1 3 625 1 1 10 PHE HB3 H 7.612 3.882 -20.681 1.00 . A A . 10 PHE HB3 1 1 3 626 1 1 10 PHE HD1 H 7.387 3.368 -17.019 1.00 . A A . 10 PHE HD1 1 1 3 627 1 1 10 PHE HD2 H 5.615 2.681 -20.828 1.00 . A A . 10 PHE HD2 1 1 3 628 1 1 10 PHE HE1 H 5.366 2.497 -15.918 1.00 . A A . 10 PHE HE1 1 1 3 629 1 1 10 PHE HE2 H 3.591 1.810 -19.733 1.00 . A A . 10 PHE HE2 1 1 3 630 1 1 10 PHE HZ H 3.464 1.718 -17.275 1.00 . A A . 10 PHE HZ 1 1 3 631 1 1 10 PHE N N 9.554 2.412 -18.348 1.00 . A A . 10 PHE N 1 1 3 632 1 1 10 PHE O O 10.215 2.683 -21.784 1.00 . A A . 10 PHE O 1 1 3 633 1 1 11 LEU C C 11.534 5.073 -22.283 1.00 . A A . 11 LEU C 1 1 3 634 1 1 11 LEU CA C 12.042 4.584 -20.931 1.00 . A A . 11 LEU CA 1 1 3 635 1 1 11 LEU CB C 13.140 3.539 -21.133 1.00 . A A . 11 LEU CB 1 1 3 636 1 1 11 LEU CD1 C 15.553 2.868 -21.020 1.00 . A A . 11 LEU CD1 1 1 3 637 1 1 11 LEU CD2 C 14.916 5.068 -22.024 1.00 . A A . 11 LEU CD2 1 1 3 638 1 1 11 LEU CG C 14.577 4.033 -20.961 1.00 . A A . 11 LEU CG 1 1 3 639 1 1 11 LEU H H 10.831 4.330 -19.214 1.00 . A A . 11 LEU H 1 1 3 640 1 1 11 LEU HA H 12.451 5.424 -20.388 1.00 . A A . 11 LEU HA 1 1 3 641 1 1 11 LEU HB2 H 12.977 2.745 -20.420 1.00 . A A . 11 LEU HB2 1 1 3 642 1 1 11 LEU HB3 H 13.042 3.146 -22.135 1.00 . A A . 11 LEU HB3 1 1 3 643 1 1 11 LEU HD11 H 16.456 3.128 -20.488 1.00 . A A . 11 LEU HD11 1 1 3 644 1 1 11 LEU HD12 H 15.104 1.999 -20.562 1.00 . A A . 11 LEU HD12 1 1 3 645 1 1 11 LEU HD13 H 15.792 2.650 -22.050 1.00 . A A . 11 LEU HD13 1 1 3 646 1 1 11 LEU HD21 H 15.121 4.570 -22.960 1.00 . A A . 11 LEU HD21 1 1 3 647 1 1 11 LEU HD22 H 14.080 5.741 -22.150 1.00 . A A . 11 LEU HD22 1 1 3 648 1 1 11 LEU HD23 H 15.786 5.629 -21.716 1.00 . A A . 11 LEU HD23 1 1 3 649 1 1 11 LEU HG H 14.676 4.502 -19.992 1.00 . A A . 11 LEU HG 1 1 3 650 1 1 11 LEU N N 10.953 4.025 -20.136 1.00 . A A . 11 LEU N 1 1 3 651 1 1 11 LEU O O 11.021 6.186 -22.400 1.00 . A A . 11 LEU O 1 1 4 652 1 1 1 LYS C C 2.778 1.573 -1.967 1.00 . A A . 1 LYS C 1 1 4 653 1 1 1 LYS CA C 3.391 1.524 -0.571 1.00 . A A . 1 LYS CA 1 1 4 654 1 1 1 LYS CB C 2.737 2.581 0.323 1.00 . A A . 1 LYS CB 1 1 4 655 1 1 1 LYS CD C 2.166 2.857 2.753 1.00 . A A . 1 LYS CD 1 1 4 656 1 1 1 LYS CE C 2.730 3.317 4.089 1.00 . A A . 1 LYS CE 1 1 4 657 1 1 1 LYS CG C 3.271 2.589 1.745 1.00 . A A . 1 LYS CG 1 1 4 658 1 1 1 LYS H1 H 5.191 2.437 -1.209 1.00 . A A . 1 LYS H1 1 1 4 659 1 1 1 LYS HA H 3.214 0.547 -0.147 1.00 . A A . 1 LYS HA 1 1 4 660 1 1 1 LYS HB2 H 2.907 3.556 -0.110 1.00 . A A . 1 LYS HB2 1 1 4 661 1 1 1 LYS HB3 H 1.673 2.394 0.361 1.00 . A A . 1 LYS HB3 1 1 4 662 1 1 1 LYS HD2 H 1.516 3.628 2.366 1.00 . A A . 1 LYS HD2 1 1 4 663 1 1 1 LYS HD3 H 1.600 1.949 2.904 1.00 . A A . 1 LYS HD3 1 1 4 664 1 1 1 LYS HE2 H 3.366 4.172 3.921 1.00 . A A . 1 LYS HE2 1 1 4 665 1 1 1 LYS HE3 H 1.910 3.600 4.732 1.00 . A A . 1 LYS HE3 1 1 4 666 1 1 1 LYS HG2 H 3.714 1.628 1.959 1.00 . A A . 1 LYS HG2 1 1 4 667 1 1 1 LYS HG3 H 4.021 3.362 1.833 1.00 . A A . 1 LYS HG3 1 1 4 668 1 1 1 LYS HZ1 H 3.072 1.321 4.602 1.00 . A A . 1 LYS HZ1 1 1 4 669 1 1 1 LYS HZ2 H 4.486 2.220 4.363 1.00 . A A . 1 LYS HZ2 1 1 4 670 1 1 1 LYS HZ3 H 3.580 2.428 5.777 1.00 . A A . 1 LYS HZ3 1 1 4 671 1 1 1 LYS N N 4.833 1.733 -0.628 1.00 . A A . 1 LYS N 1 1 4 672 1 1 1 LYS NZ N 3.523 2.246 4.754 1.00 . A A . 1 LYS NZ 1 1 4 673 1 1 1 LYS O O 1.672 2.080 -2.152 1.00 . A A . 1 LYS O 1 1 4 674 1 1 2 PHE C C 2.799 2.445 -4.838 1.00 . A A . 2 PHE C 1 1 4 675 1 1 2 PHE CA C 3.031 1.027 -4.325 1.00 . A A . 2 PHE CA 1 1 4 676 1 1 2 PHE CB C 1.738 0.215 -4.434 1.00 . A A . 2 PHE CB 1 1 4 677 1 1 2 PHE CD1 C 0.740 -0.625 -6.577 1.00 . A A . 2 PHE CD1 1 1 4 678 1 1 2 PHE CD2 C 2.680 -1.719 -5.726 1.00 . A A . 2 PHE CD2 1 1 4 679 1 1 2 PHE CE1 C 0.719 -1.491 -7.654 1.00 . A A . 2 PHE CE1 1 1 4 680 1 1 2 PHE CE2 C 2.665 -2.587 -6.801 1.00 . A A . 2 PHE CE2 1 1 4 681 1 1 2 PHE CG C 1.719 -0.728 -5.602 1.00 . A A . 2 PHE CG 1 1 4 682 1 1 2 PHE CZ C 1.683 -2.474 -7.765 1.00 . A A . 2 PHE CZ 1 1 4 683 1 1 2 PHE H H 4.379 0.654 -2.735 1.00 . A A . 2 PHE H 1 1 4 684 1 1 2 PHE HA H 3.792 0.558 -4.930 1.00 . A A . 2 PHE HA 1 1 4 685 1 1 2 PHE HB2 H 1.612 -0.369 -3.535 1.00 . A A . 2 PHE HB2 1 1 4 686 1 1 2 PHE HB3 H 0.905 0.893 -4.539 1.00 . A A . 2 PHE HB3 1 1 4 687 1 1 2 PHE HD1 H -0.015 0.145 -6.491 1.00 . A A . 2 PHE HD1 1 1 4 688 1 1 2 PHE HD2 H 3.448 -1.809 -4.972 1.00 . A A . 2 PHE HD2 1 1 4 689 1 1 2 PHE HE1 H -0.050 -1.399 -8.406 1.00 . A A . 2 PHE HE1 1 1 4 690 1 1 2 PHE HE2 H 3.419 -3.355 -6.885 1.00 . A A . 2 PHE HE2 1 1 4 691 1 1 2 PHE HZ H 1.669 -3.151 -8.606 1.00 . A A . 2 PHE HZ 1 1 4 692 1 1 2 PHE N N 3.504 1.043 -2.946 1.00 . A A . 2 PHE N 1 1 4 693 1 1 2 PHE O O 3.078 3.422 -4.143 1.00 . A A . 2 PHE O 1 1 4 694 1 1 3 LYS C C 3.245 4.748 -6.597 1.00 . A A . 3 LYS C 1 1 4 695 1 1 3 LYS CA C 2.016 3.847 -6.667 1.00 . A A . 3 LYS CA 1 1 4 696 1 1 3 LYS CB C 0.834 4.524 -5.969 1.00 . A A . 3 LYS CB 1 1 4 697 1 1 3 LYS CD C -0.708 2.734 -6.821 1.00 . A A . 3 LYS CD 1 1 4 698 1 1 3 LYS CE C -1.133 3.610 -7.990 1.00 . A A . 3 LYS CE 1 1 4 699 1 1 3 LYS CG C -0.295 3.569 -5.621 1.00 . A A . 3 LYS CG 1 1 4 700 1 1 3 LYS H H 2.085 1.734 -6.564 1.00 . A A . 3 LYS H 1 1 4 701 1 1 3 LYS HA H 1.764 3.682 -7.703 1.00 . A A . 3 LYS HA 1 1 4 702 1 1 3 LYS HB2 H 1.185 4.981 -5.055 1.00 . A A . 3 LYS HB2 1 1 4 703 1 1 3 LYS HB3 H 0.440 5.292 -6.618 1.00 . A A . 3 LYS HB3 1 1 4 704 1 1 3 LYS HD2 H 0.127 2.123 -7.129 1.00 . A A . 3 LYS HD2 1 1 4 705 1 1 3 LYS HD3 H -1.537 2.099 -6.539 1.00 . A A . 3 LYS HD3 1 1 4 706 1 1 3 LYS HE2 H -1.274 4.619 -7.634 1.00 . A A . 3 LYS HE2 1 1 4 707 1 1 3 LYS HE3 H -0.350 3.597 -8.735 1.00 . A A . 3 LYS HE3 1 1 4 708 1 1 3 LYS HG2 H 0.035 2.908 -4.833 1.00 . A A . 3 LYS HG2 1 1 4 709 1 1 3 LYS HG3 H -1.146 4.141 -5.281 1.00 . A A . 3 LYS HG3 1 1 4 710 1 1 3 LYS HZ1 H -2.884 2.472 -7.969 1.00 . A A . 3 LYS HZ1 1 1 4 711 1 1 3 LYS HZ2 H -3.030 3.938 -8.800 1.00 . A A . 3 LYS HZ2 1 1 4 712 1 1 3 LYS HZ3 H -2.198 2.645 -9.506 1.00 . A A . 3 LYS HZ3 1 1 4 713 1 1 3 LYS N N 2.287 2.550 -6.059 1.00 . A A . 3 LYS N 1 1 4 714 1 1 3 LYS NZ N -2.400 3.133 -8.610 1.00 . A A . 3 LYS NZ 1 1 4 715 1 1 3 LYS O O 3.231 5.784 -5.932 1.00 . A A . 3 LYS O 1 1 4 716 1 1 4 LYS C C 5.931 5.490 -8.736 1.00 . A A . 4 LYS C 1 1 4 717 1 1 4 LYS CA C 5.543 5.120 -7.308 1.00 . A A . 4 LYS CA 1 1 4 718 1 1 4 LYS CB C 6.675 4.326 -6.651 1.00 . A A . 4 LYS CB 1 1 4 719 1 1 4 LYS CD C 6.574 1.825 -6.438 1.00 . A A . 4 LYS CD 1 1 4 720 1 1 4 LYS CE C 7.233 0.534 -6.901 1.00 . A A . 4 LYS CE 1 1 4 721 1 1 4 LYS CG C 6.957 2.996 -7.328 1.00 . A A . 4 LYS CG 1 1 4 722 1 1 4 LYS H H 4.257 3.512 -7.799 1.00 . A A . 4 LYS H 1 1 4 723 1 1 4 LYS HA H 5.378 6.026 -6.746 1.00 . A A . 4 LYS HA 1 1 4 724 1 1 4 LYS HB2 H 7.577 4.919 -6.677 1.00 . A A . 4 LYS HB2 1 1 4 725 1 1 4 LYS HB3 H 6.411 4.133 -5.621 1.00 . A A . 4 LYS HB3 1 1 4 726 1 1 4 LYS HD2 H 6.888 2.034 -5.427 1.00 . A A . 4 LYS HD2 1 1 4 727 1 1 4 LYS HD3 H 5.500 1.700 -6.465 1.00 . A A . 4 LYS HD3 1 1 4 728 1 1 4 LYS HE2 H 6.581 0.046 -7.609 1.00 . A A . 4 LYS HE2 1 1 4 729 1 1 4 LYS HE3 H 8.170 0.776 -7.381 1.00 . A A . 4 LYS HE3 1 1 4 730 1 1 4 LYS HG2 H 6.388 2.940 -8.243 1.00 . A A . 4 LYS HG2 1 1 4 731 1 1 4 LYS HG3 H 8.013 2.934 -7.553 1.00 . A A . 4 LYS HG3 1 1 4 732 1 1 4 LYS HZ1 H 7.854 0.139 -4.946 1.00 . A A . 4 LYS HZ1 1 1 4 733 1 1 4 LYS HZ2 H 6.617 -0.879 -5.491 1.00 . A A . 4 LYS HZ2 1 1 4 734 1 1 4 LYS HZ3 H 8.202 -1.104 -6.040 1.00 . A A . 4 LYS HZ3 1 1 4 735 1 1 4 LYS N N 4.307 4.348 -7.288 1.00 . A A . 4 LYS N 1 1 4 736 1 1 4 LYS NZ N 7.495 -0.392 -5.765 1.00 . A A . 4 LYS NZ 1 1 4 737 1 1 4 LYS O O 5.386 4.949 -9.698 1.00 . A A . 4 LYS O 1 1 4 738 1 1 5 VAL C C 8.740 6.330 -10.471 1.00 . A A . 5 VAL C 1 1 4 739 1 1 5 VAL CA C 7.340 6.856 -10.177 1.00 . A A . 5 VAL CA 1 1 4 740 1 1 5 VAL CB C 7.348 8.392 -10.282 1.00 . A A . 5 VAL CB 1 1 4 741 1 1 5 VAL CG1 C 7.677 8.829 -11.701 1.00 . A A . 5 VAL CG1 1 1 4 742 1 1 5 VAL CG2 C 6.010 8.963 -9.836 1.00 . A A . 5 VAL CG2 1 1 4 743 1 1 5 VAL H H 7.274 6.809 -8.062 1.00 . A A . 5 VAL H 1 1 4 744 1 1 5 VAL HA H 6.657 6.469 -10.919 1.00 . A A . 5 VAL HA 1 1 4 745 1 1 5 VAL HB H 8.115 8.774 -9.624 1.00 . A A . 5 VAL HB 1 1 4 746 1 1 5 VAL HG11 H 8.481 8.221 -12.087 1.00 . A A . 5 VAL HG11 1 1 4 747 1 1 5 VAL HG12 H 6.804 8.711 -12.325 1.00 . A A . 5 VAL HG12 1 1 4 748 1 1 5 VAL HG13 H 7.980 9.866 -11.697 1.00 . A A . 5 VAL HG13 1 1 4 749 1 1 5 VAL HG21 H 5.230 8.606 -10.491 1.00 . A A . 5 VAL HG21 1 1 4 750 1 1 5 VAL HG22 H 5.803 8.648 -8.824 1.00 . A A . 5 VAL HG22 1 1 4 751 1 1 5 VAL HG23 H 6.048 10.042 -9.876 1.00 . A A . 5 VAL HG23 1 1 4 752 1 1 5 VAL N N 6.877 6.415 -8.866 1.00 . A A . 5 VAL N 1 1 4 753 1 1 5 VAL O O 9.669 6.540 -9.691 1.00 . A A . 5 VAL O 1 1 4 754 1 1 6 ILE C C 10.341 5.127 -13.514 1.00 . A A . 6 ILE C 1 1 4 755 1 1 6 ILE CA C 10.172 5.091 -11.999 1.00 . A A . 6 ILE CA 1 1 4 756 1 1 6 ILE CB C 10.335 3.640 -11.510 1.00 . A A . 6 ILE CB 1 1 4 757 1 1 6 ILE CD1 C 9.473 1.957 -9.806 1.00 . A A . 6 ILE CD1 1 1 4 758 1 1 6 ILE CG1 C 9.291 3.319 -10.438 1.00 . A A . 6 ILE CG1 1 1 4 759 1 1 6 ILE CG2 C 11.741 3.418 -10.970 1.00 . A A . 6 ILE CG2 1 1 4 760 1 1 6 ILE H H 8.106 5.512 -12.181 1.00 . A A . 6 ILE H 1 1 4 761 1 1 6 ILE HA H 10.947 5.692 -11.546 1.00 . A A . 6 ILE HA 1 1 4 762 1 1 6 ILE HB H 10.191 2.981 -12.352 1.00 . A A . 6 ILE HB 1 1 4 763 1 1 6 ILE HD11 H 10.430 1.917 -9.307 1.00 . A A . 6 ILE HD11 1 1 4 764 1 1 6 ILE HD12 H 8.685 1.786 -9.087 1.00 . A A . 6 ILE HD12 1 1 4 765 1 1 6 ILE HD13 H 9.434 1.197 -10.571 1.00 . A A . 6 ILE HD13 1 1 4 766 1 1 6 ILE HG12 H 9.349 4.059 -9.655 1.00 . A A . 6 ILE HG12 1 1 4 767 1 1 6 ILE HG13 H 8.307 3.350 -10.885 1.00 . A A . 6 ILE HG13 1 1 4 768 1 1 6 ILE HG21 H 12.431 4.070 -11.485 1.00 . A A . 6 ILE HG21 1 1 4 769 1 1 6 ILE HG22 H 11.759 3.637 -9.913 1.00 . A A . 6 ILE HG22 1 1 4 770 1 1 6 ILE HG23 H 12.029 2.390 -11.130 1.00 . A A . 6 ILE HG23 1 1 4 771 1 1 6 ILE N N 8.884 5.646 -11.601 1.00 . A A . 6 ILE N 1 1 4 772 1 1 6 ILE O O 9.762 4.313 -14.233 1.00 . A A . 6 ILE O 1 1 4 773 1 1 7 TRP C C 11.826 4.888 -16.032 1.00 . A A . 7 TRP C 1 1 4 774 1 1 7 TRP CA C 11.388 6.215 -15.422 1.00 . A A . 7 TRP CA 1 1 4 775 1 1 7 TRP CB C 12.454 7.283 -15.674 1.00 . A A . 7 TRP CB 1 1 4 776 1 1 7 TRP CD1 C 14.175 7.360 -17.570 1.00 . A A . 7 TRP CD1 1 1 4 777 1 1 7 TRP CD2 C 12.045 7.450 -18.256 1.00 . A A . 7 TRP CD2 1 1 4 778 1 1 7 TRP CE2 C 12.884 7.500 -19.387 1.00 . A A . 7 TRP CE2 1 1 4 779 1 1 7 TRP CE3 C 10.661 7.490 -18.443 1.00 . A A . 7 TRP CE3 1 1 4 780 1 1 7 TRP CG C 12.891 7.360 -17.105 1.00 . A A . 7 TRP CG 1 1 4 781 1 1 7 TRP CH2 C 11.023 7.628 -20.836 1.00 . A A . 7 TRP CH2 1 1 4 782 1 1 7 TRP CZ2 C 12.382 7.590 -20.683 1.00 . A A . 7 TRP CZ2 1 1 4 783 1 1 7 TRP CZ3 C 10.164 7.580 -19.729 1.00 . A A . 7 TRP CZ3 1 1 4 784 1 1 7 TRP H H 11.574 6.694 -13.368 1.00 . A A . 7 TRP H 1 1 4 785 1 1 7 TRP HA H 10.464 6.524 -15.889 1.00 . A A . 7 TRP HA 1 1 4 786 1 1 7 TRP HB2 H 12.060 8.248 -15.393 1.00 . A A . 7 TRP HB2 1 1 4 787 1 1 7 TRP HB3 H 13.322 7.063 -15.070 1.00 . A A . 7 TRP HB3 1 1 4 788 1 1 7 TRP HD1 H 15.050 7.303 -16.941 1.00 . A A . 7 TRP HD1 1 1 4 789 1 1 7 TRP HE1 H 14.978 7.461 -19.509 1.00 . A A . 7 TRP HE1 1 1 4 790 1 1 7 TRP HE3 H 9.983 7.454 -17.603 1.00 . A A . 7 TRP HE3 1 1 4 791 1 1 7 TRP HH2 H 10.591 7.698 -21.822 1.00 . A A . 7 TRP HH2 1 1 4 792 1 1 7 TRP HZ2 H 13.031 7.627 -21.546 1.00 . A A . 7 TRP HZ2 1 1 4 793 1 1 7 TRP HZ3 H 9.097 7.613 -19.893 1.00 . A A . 7 TRP HZ3 1 1 4 794 1 1 7 TRP N N 11.140 6.074 -13.992 1.00 . A A . 7 TRP N 1 1 4 795 1 1 7 TRP NE1 N 14.178 7.445 -18.942 1.00 . A A . 7 TRP NE1 1 1 4 796 1 1 7 TRP O O 11.477 4.570 -17.169 1.00 . A A . 7 TRP O 1 1 4 797 1 1 8 LYS C C 11.922 1.938 -16.189 1.00 . A A . 8 LYS C 1 1 4 798 1 1 8 LYS CA C 13.079 2.822 -15.734 1.00 . A A . 8 LYS CA 1 1 4 799 1 1 8 LYS CB C 13.864 2.121 -14.623 1.00 . A A . 8 LYS CB 1 1 4 800 1 1 8 LYS CD C 14.999 3.205 -12.662 1.00 . A A . 8 LYS CD 1 1 4 801 1 1 8 LYS CE C 16.332 3.701 -12.123 1.00 . A A . 8 LYS CE 1 1 4 802 1 1 8 LYS CG C 15.077 2.902 -14.149 1.00 . A A . 8 LYS CG 1 1 4 803 1 1 8 LYS H H 12.838 4.424 -14.371 1.00 . A A . 8 LYS H 1 1 4 804 1 1 8 LYS HA H 13.736 2.996 -16.573 1.00 . A A . 8 LYS HA 1 1 4 805 1 1 8 LYS HB2 H 13.209 1.965 -13.779 1.00 . A A . 8 LYS HB2 1 1 4 806 1 1 8 LYS HB3 H 14.201 1.161 -14.988 1.00 . A A . 8 LYS HB3 1 1 4 807 1 1 8 LYS HD2 H 14.251 3.967 -12.497 1.00 . A A . 8 LYS HD2 1 1 4 808 1 1 8 LYS HD3 H 14.720 2.304 -12.134 1.00 . A A . 8 LYS HD3 1 1 4 809 1 1 8 LYS HE2 H 16.685 4.503 -12.754 1.00 . A A . 8 LYS HE2 1 1 4 810 1 1 8 LYS HE3 H 16.184 4.072 -11.120 1.00 . A A . 8 LYS HE3 1 1 4 811 1 1 8 LYS HG2 H 15.967 2.321 -14.340 1.00 . A A . 8 LYS HG2 1 1 4 812 1 1 8 LYS HG3 H 15.130 3.834 -14.695 1.00 . A A . 8 LYS HG3 1 1 4 813 1 1 8 LYS HZ1 H 17.511 2.301 -11.118 1.00 . A A . 8 LYS HZ1 1 1 4 814 1 1 8 LYS HZ2 H 17.037 1.812 -12.666 1.00 . A A . 8 LYS HZ2 1 1 4 815 1 1 8 LYS HZ3 H 18.256 2.970 -12.481 1.00 . A A . 8 LYS HZ3 1 1 4 816 1 1 8 LYS N N 12.594 4.116 -15.270 1.00 . A A . 8 LYS N 1 1 4 817 1 1 8 LYS NZ N 17.356 2.620 -12.095 1.00 . A A . 8 LYS NZ 1 1 4 818 1 1 8 LYS O O 12.053 1.172 -17.144 1.00 . A A . 8 LYS O 1 1 4 819 1 1 9 SER C C 8.782 1.950 -16.913 1.00 . A A . 9 SER C 1 1 4 820 1 1 9 SER CA C 9.612 1.261 -15.834 1.00 . A A . 9 SER CA 1 1 4 821 1 1 9 SER CB C 8.757 1.031 -14.586 1.00 . A A . 9 SER CB 1 1 4 822 1 1 9 SER H H 10.749 2.680 -14.750 1.00 . A A . 9 SER H 1 1 4 823 1 1 9 SER HA H 9.948 0.306 -16.210 1.00 . A A . 9 SER HA 1 1 4 824 1 1 9 SER HB2 H 9.294 1.377 -13.716 1.00 . A A . 9 SER HB2 1 1 4 825 1 1 9 SER HB3 H 7.832 1.581 -14.681 1.00 . A A . 9 SER HB3 1 1 4 826 1 1 9 SER HG H 7.669 -0.563 -14.924 1.00 . A A . 9 SER HG 1 1 4 827 1 1 9 SER N N 10.791 2.051 -15.501 1.00 . A A . 9 SER N 1 1 4 828 1 1 9 SER O O 8.207 1.295 -17.783 1.00 . A A . 9 SER O 1 1 4 829 1 1 9 SER OG O 8.456 -0.344 -14.420 1.00 . A A . 9 SER OG 1 1 4 830 1 1 10 PHE C C 8.495 3.829 -19.233 1.00 . A A . 10 PHE C 1 1 4 831 1 1 10 PHE CA C 7.966 4.056 -17.820 1.00 . A A . 10 PHE CA 1 1 4 832 1 1 10 PHE CB C 8.029 5.544 -17.472 1.00 . A A . 10 PHE CB 1 1 4 833 1 1 10 PHE CD1 C 7.447 6.218 -15.126 1.00 . A A . 10 PHE CD1 1 1 4 834 1 1 10 PHE CD2 C 5.692 6.085 -16.735 1.00 . A A . 10 PHE CD2 1 1 4 835 1 1 10 PHE CE1 C 6.536 6.598 -14.159 1.00 . A A . 10 PHE CE1 1 1 4 836 1 1 10 PHE CE2 C 4.777 6.465 -15.772 1.00 . A A . 10 PHE CE2 1 1 4 837 1 1 10 PHE CG C 7.036 5.957 -16.423 1.00 . A A . 10 PHE CG 1 1 4 838 1 1 10 PHE CZ C 5.199 6.721 -14.482 1.00 . A A . 10 PHE CZ 1 1 4 839 1 1 10 PHE H H 9.205 3.741 -16.133 1.00 . A A . 10 PHE H 1 1 4 840 1 1 10 PHE HA H 6.939 3.728 -17.776 1.00 . A A . 10 PHE HA 1 1 4 841 1 1 10 PHE HB2 H 9.016 5.779 -17.104 1.00 . A A . 10 PHE HB2 1 1 4 842 1 1 10 PHE HB3 H 7.834 6.123 -18.362 1.00 . A A . 10 PHE HB3 1 1 4 843 1 1 10 PHE HD1 H 8.493 6.121 -14.872 1.00 . A A . 10 PHE HD1 1 1 4 844 1 1 10 PHE HD2 H 5.360 5.884 -17.743 1.00 . A A . 10 PHE HD2 1 1 4 845 1 1 10 PHE HE1 H 6.870 6.798 -13.151 1.00 . A A . 10 PHE HE1 1 1 4 846 1 1 10 PHE HE2 H 3.732 6.561 -16.027 1.00 . A A . 10 PHE HE2 1 1 4 847 1 1 10 PHE HZ H 4.486 7.019 -13.728 1.00 . A A . 10 PHE HZ 1 1 4 848 1 1 10 PHE N N 8.725 3.276 -16.850 1.00 . A A . 10 PHE N 1 1 4 849 1 1 10 PHE O O 7.730 3.806 -20.199 1.00 . A A . 10 PHE O 1 1 4 850 1 1 11 LEU C C 10.593 1.948 -20.924 1.00 . A A . 11 LEU C 1 1 4 851 1 1 11 LEU CA C 10.441 3.440 -20.643 1.00 . A A . 11 LEU CA 1 1 4 852 1 1 11 LEU CB C 11.810 4.121 -20.687 1.00 . A A . 11 LEU CB 1 1 4 853 1 1 11 LEU CD1 C 12.410 3.354 -22.997 1.00 . A A . 11 LEU CD1 1 1 4 854 1 1 11 LEU CD2 C 14.196 4.181 -21.454 1.00 . A A . 11 LEU CD2 1 1 4 855 1 1 11 LEU CG C 12.871 3.438 -21.551 1.00 . A A . 11 LEU CG 1 1 4 856 1 1 11 LEU H H 10.365 3.693 -18.543 1.00 . A A . 11 LEU H 1 1 4 857 1 1 11 LEU HA H 9.807 3.874 -21.401 1.00 . A A . 11 LEU HA 1 1 4 858 1 1 11 LEU HB2 H 11.669 5.121 -21.067 1.00 . A A . 11 LEU HB2 1 1 4 859 1 1 11 LEU HB3 H 12.187 4.171 -19.676 1.00 . A A . 11 LEU HB3 1 1 4 860 1 1 11 LEU HD11 H 12.506 2.337 -23.348 1.00 . A A . 11 LEU HD11 1 1 4 861 1 1 11 LEU HD12 H 11.376 3.661 -23.064 1.00 . A A . 11 LEU HD12 1 1 4 862 1 1 11 LEU HD13 H 13.018 4.005 -23.608 1.00 . A A . 11 LEU HD13 1 1 4 863 1 1 11 LEU HD21 H 14.462 4.309 -20.415 1.00 . A A . 11 LEU HD21 1 1 4 864 1 1 11 LEU HD22 H 14.965 3.611 -21.954 1.00 . A A . 11 LEU HD22 1 1 4 865 1 1 11 LEU HD23 H 14.101 5.148 -21.924 1.00 . A A . 11 LEU HD23 1 1 4 866 1 1 11 LEU HG H 13.025 2.430 -21.191 1.00 . A A . 11 LEU HG 1 1 4 867 1 1 11 LEU N N 9.808 3.664 -19.348 1.00 . A A . 11 LEU N 1 1 4 868 1 1 11 LEU O O 10.791 1.151 -20.008 1.00 . A A . 11 LEU O 1 1 5 869 1 1 1 LYS C C 3.464 2.586 -1.434 1.00 . A A . 1 LYS C 1 1 5 870 1 1 1 LYS CA C 4.332 2.563 -0.180 1.00 . A A . 1 LYS CA 1 1 5 871 1 1 1 LYS CB C 3.567 3.178 0.994 1.00 . A A . 1 LYS CB 1 1 5 872 1 1 1 LYS CD C 4.597 5.323 1.798 1.00 . A A . 1 LYS CD 1 1 5 873 1 1 1 LYS CE C 4.102 6.572 2.511 1.00 . A A . 1 LYS CE 1 1 5 874 1 1 1 LYS CG C 3.503 4.694 0.951 1.00 . A A . 1 LYS CG 1 1 5 875 1 1 1 LYS H1 H 5.574 4.103 -0.935 1.00 . A A . 1 LYS H1 1 1 5 876 1 1 1 LYS HA H 4.575 1.538 0.057 1.00 . A A . 1 LYS HA 1 1 5 877 1 1 1 LYS HB2 H 2.557 2.795 0.990 1.00 . A A . 1 LYS HB2 1 1 5 878 1 1 1 LYS HB3 H 4.050 2.885 1.916 1.00 . A A . 1 LYS HB3 1 1 5 879 1 1 1 LYS HD2 H 4.925 4.607 2.537 1.00 . A A . 1 LYS HD2 1 1 5 880 1 1 1 LYS HD3 H 5.427 5.589 1.158 1.00 . A A . 1 LYS HD3 1 1 5 881 1 1 1 LYS HE2 H 3.096 6.783 2.183 1.00 . A A . 1 LYS HE2 1 1 5 882 1 1 1 LYS HE3 H 4.103 6.387 3.575 1.00 . A A . 1 LYS HE3 1 1 5 883 1 1 1 LYS HG2 H 3.621 5.022 -0.071 1.00 . A A . 1 LYS HG2 1 1 5 884 1 1 1 LYS HG3 H 2.541 5.016 1.326 1.00 . A A . 1 LYS HG3 1 1 5 885 1 1 1 LYS HZ1 H 5.677 7.509 1.507 1.00 . A A . 1 LYS HZ1 1 1 5 886 1 1 1 LYS HZ2 H 4.383 8.539 1.865 1.00 . A A . 1 LYS HZ2 1 1 5 887 1 1 1 LYS HZ3 H 5.448 8.061 3.090 1.00 . A A . 1 LYS HZ3 1 1 5 888 1 1 1 LYS N N 5.582 3.281 -0.400 1.00 . A A . 1 LYS N 1 1 5 889 1 1 1 LYS NZ N 4.963 7.753 2.223 1.00 . A A . 1 LYS NZ 1 1 5 890 1 1 1 LYS O O 2.577 3.428 -1.571 1.00 . A A . 1 LYS O 1 1 5 891 1 1 2 PHE C C 3.131 2.839 -4.415 1.00 . A A . 2 PHE C 1 1 5 892 1 1 2 PHE CA C 2.967 1.568 -3.588 1.00 . A A . 2 PHE CA 1 1 5 893 1 1 2 PHE CB C 1.485 1.328 -3.290 1.00 . A A . 2 PHE CB 1 1 5 894 1 1 2 PHE CD1 C -0.118 -0.180 -4.496 1.00 . A A . 2 PHE CD1 1 1 5 895 1 1 2 PHE CD2 C 1.677 -1.174 -3.280 1.00 . A A . 2 PHE CD2 1 1 5 896 1 1 2 PHE CE1 C -0.562 -1.434 -4.872 1.00 . A A . 2 PHE CE1 1 1 5 897 1 1 2 PHE CE2 C 1.238 -2.430 -3.654 1.00 . A A . 2 PHE CE2 1 1 5 898 1 1 2 PHE CG C 1.005 -0.036 -3.697 1.00 . A A . 2 PHE CG 1 1 5 899 1 1 2 PHE CZ C 0.116 -2.560 -4.450 1.00 . A A . 2 PHE CZ 1 1 5 900 1 1 2 PHE H H 4.445 1.011 -2.179 1.00 . A A . 2 PHE H 1 1 5 901 1 1 2 PHE HA H 3.351 0.733 -4.152 1.00 . A A . 2 PHE HA 1 1 5 902 1 1 2 PHE HB2 H 1.316 1.435 -2.229 1.00 . A A . 2 PHE HB2 1 1 5 903 1 1 2 PHE HB3 H 0.896 2.060 -3.821 1.00 . A A . 2 PHE HB3 1 1 5 904 1 1 2 PHE HD1 H -0.649 0.701 -4.827 1.00 . A A . 2 PHE HD1 1 1 5 905 1 1 2 PHE HD2 H 2.553 -1.074 -2.657 1.00 . A A . 2 PHE HD2 1 1 5 906 1 1 2 PHE HE1 H -1.439 -1.532 -5.495 1.00 . A A . 2 PHE HE1 1 1 5 907 1 1 2 PHE HE2 H 1.770 -3.309 -3.322 1.00 . A A . 2 PHE HE2 1 1 5 908 1 1 2 PHE HZ H -0.228 -3.541 -4.743 1.00 . A A . 2 PHE HZ 1 1 5 909 1 1 2 PHE N N 3.725 1.655 -2.345 1.00 . A A . 2 PHE N 1 1 5 910 1 1 2 PHE O O 3.855 3.757 -4.028 1.00 . A A . 2 PHE O 1 1 5 911 1 1 3 LYS C C 3.973 4.422 -6.730 1.00 . A A . 3 LYS C 1 1 5 912 1 1 3 LYS CA C 2.523 4.043 -6.442 1.00 . A A . 3 LYS CA 1 1 5 913 1 1 3 LYS CB C 1.789 5.232 -5.818 1.00 . A A . 3 LYS CB 1 1 5 914 1 1 3 LYS CD C 0.066 5.398 -3.997 1.00 . A A . 3 LYS CD 1 1 5 915 1 1 3 LYS CE C -0.881 4.454 -3.273 1.00 . A A . 3 LYS CE 1 1 5 916 1 1 3 LYS CG C 0.361 4.917 -5.408 1.00 . A A . 3 LYS CG 1 1 5 917 1 1 3 LYS H H 1.894 2.123 -5.813 1.00 . A A . 3 LYS H 1 1 5 918 1 1 3 LYS HA H 2.041 3.780 -7.371 1.00 . A A . 3 LYS HA 1 1 5 919 1 1 3 LYS HB2 H 2.330 5.554 -4.941 1.00 . A A . 3 LYS HB2 1 1 5 920 1 1 3 LYS HB3 H 1.766 6.041 -6.534 1.00 . A A . 3 LYS HB3 1 1 5 921 1 1 3 LYS HD2 H 0.992 5.454 -3.445 1.00 . A A . 3 LYS HD2 1 1 5 922 1 1 3 LYS HD3 H -0.385 6.379 -4.047 1.00 . A A . 3 LYS HD3 1 1 5 923 1 1 3 LYS HE2 H -0.685 3.445 -3.603 1.00 . A A . 3 LYS HE2 1 1 5 924 1 1 3 LYS HE3 H -0.698 4.527 -2.211 1.00 . A A . 3 LYS HE3 1 1 5 925 1 1 3 LYS HG2 H -0.317 5.407 -6.092 1.00 . A A . 3 LYS HG2 1 1 5 926 1 1 3 LYS HG3 H 0.210 3.848 -5.453 1.00 . A A . 3 LYS HG3 1 1 5 927 1 1 3 LYS HZ1 H -2.930 4.125 -3.033 1.00 . A A . 3 LYS HZ1 1 1 5 928 1 1 3 LYS HZ2 H -2.516 5.754 -3.230 1.00 . A A . 3 LYS HZ2 1 1 5 929 1 1 3 LYS HZ3 H -2.504 4.711 -4.562 1.00 . A A . 3 LYS HZ3 1 1 5 930 1 1 3 LYS N N 2.454 2.886 -5.558 1.00 . A A . 3 LYS N 1 1 5 931 1 1 3 LYS NZ N -2.308 4.784 -3.543 1.00 . A A . 3 LYS NZ 1 1 5 932 1 1 3 LYS O O 4.314 5.603 -6.801 1.00 . A A . 3 LYS O 1 1 5 933 1 1 4 LYS C C 6.407 4.489 -8.436 1.00 . A A . 4 LYS C 1 1 5 934 1 1 4 LYS CA C 6.233 3.639 -7.181 1.00 . A A . 4 LYS CA 1 1 5 935 1 1 4 LYS CB C 6.960 2.304 -7.352 1.00 . A A . 4 LYS CB 1 1 5 936 1 1 4 LYS CD C 8.274 1.856 -5.259 1.00 . A A . 4 LYS CD 1 1 5 937 1 1 4 LYS CE C 9.354 0.791 -5.369 1.00 . A A . 4 LYS CE 1 1 5 938 1 1 4 LYS CG C 7.045 1.489 -6.073 1.00 . A A . 4 LYS CG 1 1 5 939 1 1 4 LYS H H 4.489 2.493 -6.830 1.00 . A A . 4 LYS H 1 1 5 940 1 1 4 LYS HA H 6.660 4.167 -6.342 1.00 . A A . 4 LYS HA 1 1 5 941 1 1 4 LYS HB2 H 6.440 1.717 -8.095 1.00 . A A . 4 LYS HB2 1 1 5 942 1 1 4 LYS HB3 H 7.966 2.497 -7.698 1.00 . A A . 4 LYS HB3 1 1 5 943 1 1 4 LYS HD2 H 8.670 2.793 -5.622 1.00 . A A . 4 LYS HD2 1 1 5 944 1 1 4 LYS HD3 H 7.989 1.961 -4.221 1.00 . A A . 4 LYS HD3 1 1 5 945 1 1 4 LYS HE2 H 9.589 0.642 -6.412 1.00 . A A . 4 LYS HE2 1 1 5 946 1 1 4 LYS HE3 H 10.235 1.135 -4.848 1.00 . A A . 4 LYS HE3 1 1 5 947 1 1 4 LYS HG2 H 6.163 1.677 -5.479 1.00 . A A . 4 LYS HG2 1 1 5 948 1 1 4 LYS HG3 H 7.093 0.440 -6.328 1.00 . A A . 4 LYS HG3 1 1 5 949 1 1 4 LYS HZ1 H 8.336 -1.031 -5.464 1.00 . A A . 4 LYS HZ1 1 1 5 950 1 1 4 LYS HZ2 H 9.747 -1.082 -4.531 1.00 . A A . 4 LYS HZ2 1 1 5 951 1 1 4 LYS HZ3 H 8.356 -0.336 -3.922 1.00 . A A . 4 LYS HZ3 1 1 5 952 1 1 4 LYS N N 4.821 3.413 -6.898 1.00 . A A . 4 LYS N 1 1 5 953 1 1 4 LYS NZ N 8.918 -0.505 -4.780 1.00 . A A . 4 LYS NZ 1 1 5 954 1 1 4 LYS O O 5.429 4.871 -9.080 1.00 . A A . 4 LYS O 1 1 5 955 1 1 5 VAL C C 7.707 4.795 -11.239 1.00 . A A . 5 VAL C 1 1 5 956 1 1 5 VAL CA C 7.959 5.583 -9.959 1.00 . A A . 5 VAL CA 1 1 5 957 1 1 5 VAL CB C 9.420 6.070 -9.948 1.00 . A A . 5 VAL CB 1 1 5 958 1 1 5 VAL CG1 C 9.718 6.894 -11.192 1.00 . A A . 5 VAL CG1 1 1 5 959 1 1 5 VAL CG2 C 9.705 6.872 -8.687 1.00 . A A . 5 VAL CG2 1 1 5 960 1 1 5 VAL H H 8.395 4.448 -8.227 1.00 . A A . 5 VAL H 1 1 5 961 1 1 5 VAL HA H 7.313 6.449 -9.948 1.00 . A A . 5 VAL HA 1 1 5 962 1 1 5 VAL HB H 10.066 5.205 -9.953 1.00 . A A . 5 VAL HB 1 1 5 963 1 1 5 VAL HG11 H 10.514 7.592 -10.979 1.00 . A A . 5 VAL HG11 1 1 5 964 1 1 5 VAL HG12 H 10.019 6.237 -11.995 1.00 . A A . 5 VAL HG12 1 1 5 965 1 1 5 VAL HG13 H 8.831 7.437 -11.485 1.00 . A A . 5 VAL HG13 1 1 5 966 1 1 5 VAL HG21 H 10.129 6.222 -7.936 1.00 . A A . 5 VAL HG21 1 1 5 967 1 1 5 VAL HG22 H 10.403 7.664 -8.914 1.00 . A A . 5 VAL HG22 1 1 5 968 1 1 5 VAL HG23 H 8.784 7.298 -8.316 1.00 . A A . 5 VAL HG23 1 1 5 969 1 1 5 VAL N N 7.657 4.781 -8.780 1.00 . A A . 5 VAL N 1 1 5 970 1 1 5 VAL O O 8.113 3.638 -11.358 1.00 . A A . 5 VAL O 1 1 5 971 1 1 6 ILE C C 7.879 4.953 -14.457 1.00 . A A . 6 ILE C 1 1 5 972 1 1 6 ILE CA C 6.731 4.785 -13.468 1.00 . A A . 6 ILE CA 1 1 5 973 1 1 6 ILE CB C 5.443 5.355 -14.092 1.00 . A A . 6 ILE CB 1 1 5 974 1 1 6 ILE CD1 C 3.919 3.681 -12.930 1.00 . A A . 6 ILE CD1 1 1 5 975 1 1 6 ILE CG1 C 4.256 5.139 -13.152 1.00 . A A . 6 ILE CG1 1 1 5 976 1 1 6 ILE CG2 C 5.180 4.710 -15.445 1.00 . A A . 6 ILE CG2 1 1 5 977 1 1 6 ILE H H 6.738 6.348 -12.041 1.00 . A A . 6 ILE H 1 1 5 978 1 1 6 ILE HA H 6.581 3.732 -13.281 1.00 . A A . 6 ILE HA 1 1 5 979 1 1 6 ILE HB H 5.583 6.414 -14.247 1.00 . A A . 6 ILE HB 1 1 5 980 1 1 6 ILE HD11 H 4.661 3.062 -13.413 1.00 . A A . 6 ILE HD11 1 1 5 981 1 1 6 ILE HD12 H 3.910 3.471 -11.870 1.00 . A A . 6 ILE HD12 1 1 5 982 1 1 6 ILE HD13 H 2.946 3.468 -13.347 1.00 . A A . 6 ILE HD13 1 1 5 983 1 1 6 ILE HG12 H 4.479 5.577 -12.193 1.00 . A A . 6 ILE HG12 1 1 5 984 1 1 6 ILE HG13 H 3.384 5.621 -13.570 1.00 . A A . 6 ILE HG13 1 1 5 985 1 1 6 ILE HG21 H 4.231 5.054 -15.829 1.00 . A A . 6 ILE HG21 1 1 5 986 1 1 6 ILE HG22 H 5.967 4.982 -16.133 1.00 . A A . 6 ILE HG22 1 1 5 987 1 1 6 ILE HG23 H 5.156 3.636 -15.333 1.00 . A A . 6 ILE HG23 1 1 5 988 1 1 6 ILE N N 7.035 5.428 -12.195 1.00 . A A . 6 ILE N 1 1 5 989 1 1 6 ILE O O 8.002 4.190 -15.415 1.00 . A A . 6 ILE O 1 1 5 990 1 1 7 TRP C C 10.672 4.951 -15.321 1.00 . A A . 7 TRP C 1 1 5 991 1 1 7 TRP CA C 9.859 6.220 -15.085 1.00 . A A . 7 TRP CA 1 1 5 992 1 1 7 TRP CB C 10.749 7.304 -14.475 1.00 . A A . 7 TRP CB 1 1 5 993 1 1 7 TRP CD1 C 13.249 7.670 -14.902 1.00 . A A . 7 TRP CD1 1 1 5 994 1 1 7 TRP CD2 C 11.954 7.964 -16.705 1.00 . A A . 7 TRP CD2 1 1 5 995 1 1 7 TRP CE2 C 13.295 8.193 -17.073 1.00 . A A . 7 TRP CE2 1 1 5 996 1 1 7 TRP CE3 C 10.959 8.089 -17.678 1.00 . A A . 7 TRP CE3 1 1 5 997 1 1 7 TRP CG C 11.948 7.630 -15.313 1.00 . A A . 7 TRP CG 1 1 5 998 1 1 7 TRP CH2 C 12.667 8.657 -19.302 1.00 . A A . 7 TRP CH2 1 1 5 999 1 1 7 TRP CZ2 C 13.662 8.542 -18.370 1.00 . A A . 7 TRP CZ2 1 1 5 1000 1 1 7 TRP CZ3 C 11.325 8.435 -18.965 1.00 . A A . 7 TRP CZ3 1 1 5 1001 1 1 7 TRP H H 8.568 6.527 -13.436 1.00 . A A . 7 TRP H 1 1 5 1002 1 1 7 TRP HA H 9.478 6.571 -16.032 1.00 . A A . 7 TRP HA 1 1 5 1003 1 1 7 TRP HB2 H 10.172 8.208 -14.352 1.00 . A A . 7 TRP HB2 1 1 5 1004 1 1 7 TRP HB3 H 11.099 6.970 -13.508 1.00 . A A . 7 TRP HB3 1 1 5 1005 1 1 7 TRP HD1 H 13.575 7.466 -13.894 1.00 . A A . 7 TRP HD1 1 1 5 1006 1 1 7 TRP HE1 H 15.040 8.102 -15.912 1.00 . A A . 7 TRP HE1 1 1 5 1007 1 1 7 TRP HE3 H 9.919 7.921 -17.438 1.00 . A A . 7 TRP HE3 1 1 5 1008 1 1 7 TRP HH2 H 12.906 8.926 -20.319 1.00 . A A . 7 TRP HH2 1 1 5 1009 1 1 7 TRP HZ2 H 14.692 8.716 -18.645 1.00 . A A . 7 TRP HZ2 1 1 5 1010 1 1 7 TRP HZ3 H 10.569 8.537 -19.730 1.00 . A A . 7 TRP HZ3 1 1 5 1011 1 1 7 TRP N N 8.718 5.953 -14.216 1.00 . A A . 7 TRP N 1 1 5 1012 1 1 7 TRP NE1 N 14.065 8.009 -15.955 1.00 . A A . 7 TRP NE1 1 1 5 1013 1 1 7 TRP O O 11.214 4.742 -16.406 1.00 . A A . 7 TRP O 1 1 5 1014 1 1 8 LYS C C 11.066 2.060 -15.622 1.00 . A A . 8 LYS C 1 1 5 1015 1 1 8 LYS CA C 11.497 2.857 -14.394 1.00 . A A . 8 LYS CA 1 1 5 1016 1 1 8 LYS CB C 11.291 2.018 -13.131 1.00 . A A . 8 LYS CB 1 1 5 1017 1 1 8 LYS CD C 10.706 2.395 -10.717 1.00 . A A . 8 LYS CD 1 1 5 1018 1 1 8 LYS CE C 11.277 1.294 -9.836 1.00 . A A . 8 LYS CE 1 1 5 1019 1 1 8 LYS CG C 11.655 2.749 -11.850 1.00 . A A . 8 LYS CG 1 1 5 1020 1 1 8 LYS H H 10.298 4.329 -13.458 1.00 . A A . 8 LYS H 1 1 5 1021 1 1 8 LYS HA H 12.544 3.101 -14.488 1.00 . A A . 8 LYS HA 1 1 5 1022 1 1 8 LYS HB2 H 10.253 1.726 -13.072 1.00 . A A . 8 LYS HB2 1 1 5 1023 1 1 8 LYS HB3 H 11.903 1.130 -13.199 1.00 . A A . 8 LYS HB3 1 1 5 1024 1 1 8 LYS HD2 H 10.537 3.273 -10.112 1.00 . A A . 8 LYS HD2 1 1 5 1025 1 1 8 LYS HD3 H 9.768 2.058 -11.137 1.00 . A A . 8 LYS HD3 1 1 5 1026 1 1 8 LYS HE2 H 10.523 0.994 -9.124 1.00 . A A . 8 LYS HE2 1 1 5 1027 1 1 8 LYS HE3 H 11.539 0.452 -10.459 1.00 . A A . 8 LYS HE3 1 1 5 1028 1 1 8 LYS HG2 H 12.659 2.476 -11.563 1.00 . A A . 8 LYS HG2 1 1 5 1029 1 1 8 LYS HG3 H 11.606 3.814 -12.028 1.00 . A A . 8 LYS HG3 1 1 5 1030 1 1 8 LYS HZ1 H 12.308 2.666 -8.645 1.00 . A A . 8 LYS HZ1 1 1 5 1031 1 1 8 LYS HZ2 H 12.739 1.054 -8.364 1.00 . A A . 8 LYS HZ2 1 1 5 1032 1 1 8 LYS HZ3 H 13.289 1.847 -9.753 1.00 . A A . 8 LYS HZ3 1 1 5 1033 1 1 8 LYS N N 10.752 4.106 -14.298 1.00 . A A . 8 LYS N 1 1 5 1034 1 1 8 LYS NZ N 12.488 1.747 -9.098 1.00 . A A . 8 LYS NZ 1 1 5 1035 1 1 8 LYS O O 11.900 1.497 -16.332 1.00 . A A . 8 LYS O 1 1 5 1036 1 1 9 SER C C 9.382 2.091 -18.293 1.00 . A A . 9 SER C 1 1 5 1037 1 1 9 SER CA C 9.219 1.287 -17.006 1.00 . A A . 9 SER CA 1 1 5 1038 1 1 9 SER CB C 7.742 0.963 -16.777 1.00 . A A . 9 SER CB 1 1 5 1039 1 1 9 SER H H 9.146 2.486 -15.263 1.00 . A A . 9 SER H 1 1 5 1040 1 1 9 SER HA H 9.771 0.363 -17.101 1.00 . A A . 9 SER HA 1 1 5 1041 1 1 9 SER HB2 H 7.659 0.157 -16.064 1.00 . A A . 9 SER HB2 1 1 5 1042 1 1 9 SER HB3 H 7.240 1.839 -16.391 1.00 . A A . 9 SER HB3 1 1 5 1043 1 1 9 SER HG H 6.449 1.221 -18.226 1.00 . A A . 9 SER HG 1 1 5 1044 1 1 9 SER N N 9.760 2.017 -15.866 1.00 . A A . 9 SER N 1 1 5 1045 1 1 9 SER O O 9.635 1.532 -19.360 1.00 . A A . 9 SER O 1 1 5 1046 1 1 9 SER OG O 7.113 0.571 -17.985 1.00 . A A . 9 SER OG 1 1 5 1047 1 1 10 PHE C C 10.766 4.204 -19.933 1.00 . A A . 10 PHE C 1 1 5 1048 1 1 10 PHE CA C 9.364 4.289 -19.337 1.00 . A A . 10 PHE CA 1 1 5 1049 1 1 10 PHE CB C 9.055 5.734 -18.938 1.00 . A A . 10 PHE CB 1 1 5 1050 1 1 10 PHE CD1 C 6.610 5.255 -18.640 1.00 . A A . 10 PHE CD1 1 1 5 1051 1 1 10 PHE CD2 C 7.244 7.296 -19.697 1.00 . A A . 10 PHE CD2 1 1 5 1052 1 1 10 PHE CE1 C 5.277 5.591 -18.782 1.00 . A A . 10 PHE CE1 1 1 5 1053 1 1 10 PHE CE2 C 5.913 7.637 -19.842 1.00 . A A . 10 PHE CE2 1 1 5 1054 1 1 10 PHE CG C 7.607 6.102 -19.095 1.00 . A A . 10 PHE CG 1 1 5 1055 1 1 10 PHE CZ C 4.928 6.783 -19.385 1.00 . A A . 10 PHE CZ 1 1 5 1056 1 1 10 PHE H H 9.035 3.794 -17.305 1.00 . A A . 10 PHE H 1 1 5 1057 1 1 10 PHE HA H 8.650 3.969 -20.079 1.00 . A A . 10 PHE HA 1 1 5 1058 1 1 10 PHE HB2 H 9.323 5.879 -17.902 1.00 . A A . 10 PHE HB2 1 1 5 1059 1 1 10 PHE HB3 H 9.638 6.402 -19.554 1.00 . A A . 10 PHE HB3 1 1 5 1060 1 1 10 PHE HD1 H 6.882 4.321 -18.168 1.00 . A A . 10 PHE HD1 1 1 5 1061 1 1 10 PHE HD2 H 8.013 7.964 -20.056 1.00 . A A . 10 PHE HD2 1 1 5 1062 1 1 10 PHE HE1 H 4.510 4.920 -18.424 1.00 . A A . 10 PHE HE1 1 1 5 1063 1 1 10 PHE HE2 H 5.642 8.570 -20.314 1.00 . A A . 10 PHE HE2 1 1 5 1064 1 1 10 PHE HZ H 3.887 7.048 -19.497 1.00 . A A . 10 PHE HZ 1 1 5 1065 1 1 10 PHE N N 9.235 3.407 -18.183 1.00 . A A . 10 PHE N 1 1 5 1066 1 1 10 PHE O O 10.932 4.132 -21.151 1.00 . A A . 10 PHE O 1 1 5 1067 1 1 11 LEU C C 13.375 2.944 -20.432 1.00 . A A . 11 LEU C 1 1 5 1068 1 1 11 LEU CA C 13.162 4.136 -19.505 1.00 . A A . 11 LEU CA 1 1 5 1069 1 1 11 LEU CB C 14.094 4.030 -18.297 1.00 . A A . 11 LEU CB 1 1 5 1070 1 1 11 LEU CD1 C 16.123 4.788 -17.035 1.00 . A A . 11 LEU CD1 1 1 5 1071 1 1 11 LEU CD2 C 16.000 5.115 -19.512 1.00 . A A . 11 LEU CD2 1 1 5 1072 1 1 11 LEU CG C 15.206 5.076 -18.214 1.00 . A A . 11 LEU CG 1 1 5 1073 1 1 11 LEU H H 11.578 4.271 -18.107 1.00 . A A . 11 LEU H 1 1 5 1074 1 1 11 LEU HA H 13.388 5.043 -20.046 1.00 . A A . 11 LEU HA 1 1 5 1075 1 1 11 LEU HB2 H 13.492 4.117 -17.406 1.00 . A A . 11 LEU HB2 1 1 5 1076 1 1 11 LEU HB3 H 14.558 3.054 -18.322 1.00 . A A . 11 LEU HB3 1 1 5 1077 1 1 11 LEU HD11 H 17.050 5.328 -17.160 1.00 . A A . 11 LEU HD11 1 1 5 1078 1 1 11 LEU HD12 H 15.643 5.103 -16.120 1.00 . A A . 11 LEU HD12 1 1 5 1079 1 1 11 LEU HD13 H 16.327 3.728 -16.988 1.00 . A A . 11 LEU HD13 1 1 5 1080 1 1 11 LEU HD21 H 15.722 5.993 -20.077 1.00 . A A . 11 LEU HD21 1 1 5 1081 1 1 11 LEU HD22 H 17.056 5.151 -19.287 1.00 . A A . 11 LEU HD22 1 1 5 1082 1 1 11 LEU HD23 H 15.785 4.230 -20.092 1.00 . A A . 11 LEU HD23 1 1 5 1083 1 1 11 LEU HG H 14.764 6.051 -18.061 1.00 . A A . 11 LEU HG 1 1 5 1084 1 1 11 LEU N N 11.773 4.212 -19.066 1.00 . A A . 11 LEU N 1 1 5 1085 1 1 11 LEU O O 13.694 3.109 -21.609 1.00 . A A . 11 LEU O 1 1 6 1086 1 1 1 LYS C C 3.446 2.499 -2.141 1.00 . A A . 1 LYS C 1 1 6 1087 1 1 1 LYS CA C 3.417 1.067 -1.618 1.00 . A A . 1 LYS CA 1 1 6 1088 1 1 1 LYS CB C 4.701 0.771 -0.838 1.00 . A A . 1 LYS CB 1 1 6 1089 1 1 1 LYS CD C 5.658 -0.438 1.144 1.00 . A A . 1 LYS CD 1 1 6 1090 1 1 1 LYS CE C 6.264 0.301 2.328 1.00 . A A . 1 LYS CE 1 1 6 1091 1 1 1 LYS CG C 4.454 0.300 0.584 1.00 . A A . 1 LYS CG 1 1 6 1092 1 1 1 LYS H1 H 3.257 0.447 -3.635 1.00 . A A . 1 LYS H1 1 1 6 1093 1 1 1 LYS HA H 2.571 0.954 -0.957 1.00 . A A . 1 LYS HA 1 1 6 1094 1 1 1 LYS HB2 H 5.255 0.004 -1.359 1.00 . A A . 1 LYS HB2 1 1 6 1095 1 1 1 LYS HB3 H 5.298 1.671 -0.799 1.00 . A A . 1 LYS HB3 1 1 6 1096 1 1 1 LYS HD2 H 5.349 -1.421 1.468 1.00 . A A . 1 LYS HD2 1 1 6 1097 1 1 1 LYS HD3 H 6.405 -0.531 0.368 1.00 . A A . 1 LYS HD3 1 1 6 1098 1 1 1 LYS HE2 H 6.101 1.359 2.196 1.00 . A A . 1 LYS HE2 1 1 6 1099 1 1 1 LYS HE3 H 5.772 -0.030 3.231 1.00 . A A . 1 LYS HE3 1 1 6 1100 1 1 1 LYS HG2 H 4.249 1.157 1.208 1.00 . A A . 1 LYS HG2 1 1 6 1101 1 1 1 LYS HG3 H 3.601 -0.364 0.591 1.00 . A A . 1 LYS HG3 1 1 6 1102 1 1 1 LYS HZ1 H 7.964 -0.879 2.041 1.00 . A A . 1 LYS HZ1 1 1 6 1103 1 1 1 LYS HZ2 H 8.260 0.784 1.948 1.00 . A A . 1 LYS HZ2 1 1 6 1104 1 1 1 LYS HZ3 H 8.007 0.052 3.453 1.00 . A A . 1 LYS HZ3 1 1 6 1105 1 1 1 LYS N N 3.260 0.116 -2.712 1.00 . A A . 1 LYS N 1 1 6 1106 1 1 1 LYS NZ N 7.726 0.047 2.451 1.00 . A A . 1 LYS NZ 1 1 6 1107 1 1 1 LYS O O 4.478 2.978 -2.612 1.00 . A A . 1 LYS O 1 1 6 1108 1 1 2 PHE C C 2.463 4.647 -4.018 1.00 . A A . 2 PHE C 1 1 6 1109 1 1 2 PHE CA C 2.203 4.557 -2.518 1.00 . A A . 2 PHE CA 1 1 6 1110 1 1 2 PHE CB C 3.191 5.449 -1.763 1.00 . A A . 2 PHE CB 1 1 6 1111 1 1 2 PHE CD1 C 3.467 7.853 -2.427 1.00 . A A . 2 PHE CD1 1 1 6 1112 1 1 2 PHE CD2 C 1.696 7.285 -0.934 1.00 . A A . 2 PHE CD2 1 1 6 1113 1 1 2 PHE CE1 C 3.087 9.181 -2.378 1.00 . A A . 2 PHE CE1 1 1 6 1114 1 1 2 PHE CE2 C 1.311 8.612 -0.882 1.00 . A A . 2 PHE CE2 1 1 6 1115 1 1 2 PHE CG C 2.776 6.891 -1.707 1.00 . A A . 2 PHE CG 1 1 6 1116 1 1 2 PHE CZ C 2.008 9.561 -1.604 1.00 . A A . 2 PHE CZ 1 1 6 1117 1 1 2 PHE H H 1.519 2.743 -1.668 1.00 . A A . 2 PHE H 1 1 6 1118 1 1 2 PHE HA H 1.199 4.898 -2.318 1.00 . A A . 2 PHE HA 1 1 6 1119 1 1 2 PHE HB2 H 3.285 5.092 -0.748 1.00 . A A . 2 PHE HB2 1 1 6 1120 1 1 2 PHE HB3 H 4.154 5.398 -2.249 1.00 . A A . 2 PHE HB3 1 1 6 1121 1 1 2 PHE HD1 H 4.311 7.556 -3.033 1.00 . A A . 2 PHE HD1 1 1 6 1122 1 1 2 PHE HD2 H 1.150 6.545 -0.369 1.00 . A A . 2 PHE HD2 1 1 6 1123 1 1 2 PHE HE1 H 3.635 9.920 -2.944 1.00 . A A . 2 PHE HE1 1 1 6 1124 1 1 2 PHE HE2 H 0.468 8.906 -0.276 1.00 . A A . 2 PHE HE2 1 1 6 1125 1 1 2 PHE HZ H 1.710 10.598 -1.565 1.00 . A A . 2 PHE HZ 1 1 6 1126 1 1 2 PHE N N 2.307 3.179 -2.053 1.00 . A A . 2 PHE N 1 1 6 1127 1 1 2 PHE O O 2.859 5.695 -4.530 1.00 . A A . 2 PHE O 1 1 6 1128 1 1 3 LYS C C 3.840 3.998 -6.527 1.00 . A A . 3 LYS C 1 1 6 1129 1 1 3 LYS CA C 2.448 3.492 -6.161 1.00 . A A . 3 LYS CA 1 1 6 1130 1 1 3 LYS CB C 1.385 4.325 -6.880 1.00 . A A . 3 LYS CB 1 1 6 1131 1 1 3 LYS CD C -0.471 2.666 -6.543 1.00 . A A . 3 LYS CD 1 1 6 1132 1 1 3 LYS CE C -0.833 2.013 -5.218 1.00 . A A . 3 LYS CE 1 1 6 1133 1 1 3 LYS CG C -0.021 4.105 -6.350 1.00 . A A . 3 LYS CG 1 1 6 1134 1 1 3 LYS H H 1.924 2.736 -4.254 1.00 . A A . 3 LYS H 1 1 6 1135 1 1 3 LYS HA H 2.359 2.462 -6.474 1.00 . A A . 3 LYS HA 1 1 6 1136 1 1 3 LYS HB2 H 1.629 5.372 -6.768 1.00 . A A . 3 LYS HB2 1 1 6 1137 1 1 3 LYS HB3 H 1.395 4.072 -7.930 1.00 . A A . 3 LYS HB3 1 1 6 1138 1 1 3 LYS HD2 H -1.337 2.652 -7.187 1.00 . A A . 3 LYS HD2 1 1 6 1139 1 1 3 LYS HD3 H 0.331 2.106 -7.003 1.00 . A A . 3 LYS HD3 1 1 6 1140 1 1 3 LYS HE2 H -0.099 2.296 -4.479 1.00 . A A . 3 LYS HE2 1 1 6 1141 1 1 3 LYS HE3 H -1.806 2.367 -4.912 1.00 . A A . 3 LYS HE3 1 1 6 1142 1 1 3 LYS HG2 H -0.040 4.338 -5.296 1.00 . A A . 3 LYS HG2 1 1 6 1143 1 1 3 LYS HG3 H -0.701 4.759 -6.878 1.00 . A A . 3 LYS HG3 1 1 6 1144 1 1 3 LYS HZ1 H -0.712 0.236 -6.309 1.00 . A A . 3 LYS HZ1 1 1 6 1145 1 1 3 LYS HZ2 H -0.123 0.111 -4.727 1.00 . A A . 3 LYS HZ2 1 1 6 1146 1 1 3 LYS HZ3 H -1.791 0.169 -5.007 1.00 . A A . 3 LYS HZ3 1 1 6 1147 1 1 3 LYS N N 2.239 3.540 -4.719 1.00 . A A . 3 LYS N 1 1 6 1148 1 1 3 LYS NZ N -0.867 0.528 -5.322 1.00 . A A . 3 LYS NZ 1 1 6 1149 1 1 3 LYS O O 4.015 5.166 -6.874 1.00 . A A . 3 LYS O 1 1 6 1150 1 1 4 LYS C C 6.300 4.027 -8.189 1.00 . A A . 4 LYS C 1 1 6 1151 1 1 4 LYS CA C 6.203 3.468 -6.773 1.00 . A A . 4 LYS CA 1 1 6 1152 1 1 4 LYS CB C 7.114 2.247 -6.632 1.00 . A A . 4 LYS CB 1 1 6 1153 1 1 4 LYS CD C 6.911 0.204 -5.184 1.00 . A A . 4 LYS CD 1 1 6 1154 1 1 4 LYS CE C 6.618 -0.278 -3.771 1.00 . A A . 4 LYS CE 1 1 6 1155 1 1 4 LYS CG C 7.182 1.699 -5.217 1.00 . A A . 4 LYS CG 1 1 6 1156 1 1 4 LYS H H 4.624 2.195 -6.164 1.00 . A A . 4 LYS H 1 1 6 1157 1 1 4 LYS HA H 6.523 4.228 -6.076 1.00 . A A . 4 LYS HA 1 1 6 1158 1 1 4 LYS HB2 H 6.750 1.464 -7.281 1.00 . A A . 4 LYS HB2 1 1 6 1159 1 1 4 LYS HB3 H 8.113 2.521 -6.938 1.00 . A A . 4 LYS HB3 1 1 6 1160 1 1 4 LYS HD2 H 6.059 -0.013 -5.810 1.00 . A A . 4 LYS HD2 1 1 6 1161 1 1 4 LYS HD3 H 7.779 -0.318 -5.560 1.00 . A A . 4 LYS HD3 1 1 6 1162 1 1 4 LYS HE2 H 7.297 0.211 -3.090 1.00 . A A . 4 LYS HE2 1 1 6 1163 1 1 4 LYS HE3 H 5.602 -0.013 -3.519 1.00 . A A . 4 LYS HE3 1 1 6 1164 1 1 4 LYS HG2 H 8.168 1.884 -4.816 1.00 . A A . 4 LYS HG2 1 1 6 1165 1 1 4 LYS HG3 H 6.444 2.203 -4.609 1.00 . A A . 4 LYS HG3 1 1 6 1166 1 1 4 LYS HZ1 H 5.932 -2.170 -3.211 1.00 . A A . 4 LYS HZ1 1 1 6 1167 1 1 4 LYS HZ2 H 6.924 -2.179 -4.582 1.00 . A A . 4 LYS HZ2 1 1 6 1168 1 1 4 LYS HZ3 H 7.604 -1.971 -3.046 1.00 . A A . 4 LYS HZ3 1 1 6 1169 1 1 4 LYS N N 4.827 3.112 -6.448 1.00 . A A . 4 LYS N 1 1 6 1170 1 1 4 LYS NZ N 6.781 -1.753 -3.644 1.00 . A A . 4 LYS NZ 1 1 6 1171 1 1 4 LYS O O 5.614 3.563 -9.099 1.00 . A A . 4 LYS O 1 1 6 1172 1 1 5 VAL C C 8.748 5.379 -10.211 1.00 . A A . 5 VAL C 1 1 6 1173 1 1 5 VAL CA C 7.347 5.647 -9.673 1.00 . A A . 5 VAL CA 1 1 6 1174 1 1 5 VAL CB C 7.115 7.169 -9.610 1.00 . A A . 5 VAL CB 1 1 6 1175 1 1 5 VAL CG1 C 7.346 7.801 -10.974 1.00 . A A . 5 VAL CG1 1 1 6 1176 1 1 5 VAL CG2 C 5.714 7.473 -9.103 1.00 . A A . 5 VAL CG2 1 1 6 1177 1 1 5 VAL H H 7.677 5.354 -7.603 1.00 . A A . 5 VAL H 1 1 6 1178 1 1 5 VAL HA H 6.623 5.222 -10.353 1.00 . A A . 5 VAL HA 1 1 6 1179 1 1 5 VAL HB H 7.827 7.592 -8.917 1.00 . A A . 5 VAL HB 1 1 6 1180 1 1 5 VAL HG11 H 7.207 7.057 -11.744 1.00 . A A . 5 VAL HG11 1 1 6 1181 1 1 5 VAL HG12 H 6.643 8.607 -11.121 1.00 . A A . 5 VAL HG12 1 1 6 1182 1 1 5 VAL HG13 H 8.353 8.189 -11.026 1.00 . A A . 5 VAL HG13 1 1 6 1183 1 1 5 VAL HG21 H 5.356 8.384 -9.560 1.00 . A A . 5 VAL HG21 1 1 6 1184 1 1 5 VAL HG22 H 5.054 6.658 -9.358 1.00 . A A . 5 VAL HG22 1 1 6 1185 1 1 5 VAL HG23 H 5.738 7.595 -8.030 1.00 . A A . 5 VAL HG23 1 1 6 1186 1 1 5 VAL N N 7.158 5.027 -8.368 1.00 . A A . 5 VAL N 1 1 6 1187 1 1 5 VAL O O 9.743 5.606 -9.522 1.00 . A A . 5 VAL O 1 1 6 1188 1 1 6 ILE C C 10.051 4.882 -13.577 1.00 . A A . 6 ILE C 1 1 6 1189 1 1 6 ILE CA C 10.098 4.600 -12.079 1.00 . A A . 6 ILE CA 1 1 6 1190 1 1 6 ILE CB C 10.508 3.132 -11.857 1.00 . A A . 6 ILE CB 1 1 6 1191 1 1 6 ILE CD1 C 10.107 1.110 -10.364 1.00 . A A . 6 ILE CD1 1 1 6 1192 1 1 6 ILE CG1 C 9.670 2.509 -10.739 1.00 . A A . 6 ILE CG1 1 1 6 1193 1 1 6 ILE CG2 C 11.991 3.040 -11.529 1.00 . A A . 6 ILE CG2 1 1 6 1194 1 1 6 ILE H H 7.991 4.738 -11.947 1.00 . A A . 6 ILE H 1 1 6 1195 1 1 6 ILE HA H 10.848 5.234 -11.628 1.00 . A A . 6 ILE HA 1 1 6 1196 1 1 6 ILE HB H 10.333 2.590 -12.774 1.00 . A A . 6 ILE HB 1 1 6 1197 1 1 6 ILE HD11 H 9.453 0.722 -9.598 1.00 . A A . 6 ILE HD11 1 1 6 1198 1 1 6 ILE HD12 H 10.059 0.473 -11.235 1.00 . A A . 6 ILE HD12 1 1 6 1199 1 1 6 ILE HD13 H 11.121 1.137 -9.993 1.00 . A A . 6 ILE HD13 1 1 6 1200 1 1 6 ILE HG12 H 9.742 3.126 -9.857 1.00 . A A . 6 ILE HG12 1 1 6 1201 1 1 6 ILE HG13 H 8.639 2.462 -11.057 1.00 . A A . 6 ILE HG13 1 1 6 1202 1 1 6 ILE HG21 H 12.358 2.059 -11.793 1.00 . A A . 6 ILE HG21 1 1 6 1203 1 1 6 ILE HG22 H 12.531 3.790 -12.089 1.00 . A A . 6 ILE HG22 1 1 6 1204 1 1 6 ILE HG23 H 12.137 3.206 -10.472 1.00 . A A . 6 ILE HG23 1 1 6 1205 1 1 6 ILE N N 8.819 4.897 -11.447 1.00 . A A . 6 ILE N 1 1 6 1206 1 1 6 ILE O O 9.484 4.107 -14.347 1.00 . A A . 6 ILE O 1 1 6 1207 1 1 7 TRP C C 11.391 5.323 -16.228 1.00 . A A . 7 TRP C 1 1 6 1208 1 1 7 TRP CA C 10.679 6.378 -15.390 1.00 . A A . 7 TRP CA 1 1 6 1209 1 1 7 TRP CB C 11.370 7.733 -15.557 1.00 . A A . 7 TRP CB 1 1 6 1210 1 1 7 TRP CD1 C 12.709 8.560 -17.579 1.00 . A A . 7 TRP CD1 1 1 6 1211 1 1 7 TRP CD2 C 10.552 8.144 -18.012 1.00 . A A . 7 TRP CD2 1 1 6 1212 1 1 7 TRP CE2 C 11.170 8.589 -19.197 1.00 . A A . 7 TRP CE2 1 1 6 1213 1 1 7 TRP CE3 C 9.193 7.821 -18.042 1.00 . A A . 7 TRP CE3 1 1 6 1214 1 1 7 TRP CG C 11.554 8.133 -16.989 1.00 . A A . 7 TRP CG 1 1 6 1215 1 1 7 TRP CH2 C 9.145 8.395 -20.396 1.00 . A A . 7 TRP CH2 1 1 6 1216 1 1 7 TRP CZ2 C 10.474 8.718 -20.396 1.00 . A A . 7 TRP CZ2 1 1 6 1217 1 1 7 TRP CZ3 C 8.503 7.950 -19.233 1.00 . A A . 7 TRP CZ3 1 1 6 1218 1 1 7 TRP H H 11.086 6.573 -13.321 1.00 . A A . 7 TRP H 1 1 6 1219 1 1 7 TRP HA H 9.657 6.462 -15.730 1.00 . A A . 7 TRP HA 1 1 6 1220 1 1 7 TRP HB2 H 10.778 8.494 -15.071 1.00 . A A . 7 TRP HB2 1 1 6 1221 1 1 7 TRP HB3 H 12.345 7.690 -15.094 1.00 . A A . 7 TRP HB3 1 1 6 1222 1 1 7 TRP HD1 H 13.653 8.662 -17.065 1.00 . A A . 7 TRP HD1 1 1 6 1223 1 1 7 TRP HE1 H 13.160 9.158 -19.542 1.00 . A A . 7 TRP HE1 1 1 6 1224 1 1 7 TRP HE3 H 8.681 7.476 -17.155 1.00 . A A . 7 TRP HE3 1 1 6 1225 1 1 7 TRP HH2 H 8.567 8.480 -21.304 1.00 . A A . 7 TRP HH2 1 1 6 1226 1 1 7 TRP HZ2 H 10.954 9.059 -21.301 1.00 . A A . 7 TRP HZ2 1 1 6 1227 1 1 7 TRP HZ3 H 7.452 7.705 -19.275 1.00 . A A . 7 TRP HZ3 1 1 6 1228 1 1 7 TRP N N 10.651 5.995 -13.983 1.00 . A A . 7 TRP N 1 1 6 1229 1 1 7 TRP NE1 N 12.486 8.837 -18.906 1.00 . A A . 7 TRP NE1 1 1 6 1230 1 1 7 TRP O O 10.954 4.991 -17.330 1.00 . A A . 7 TRP O 1 1 6 1231 1 1 8 LYS C C 12.377 2.611 -16.813 1.00 . A A . 8 LYS C 1 1 6 1232 1 1 8 LYS CA C 13.265 3.779 -16.398 1.00 . A A . 8 LYS CA 1 1 6 1233 1 1 8 LYS CB C 14.405 3.276 -15.510 1.00 . A A . 8 LYS CB 1 1 6 1234 1 1 8 LYS CD C 14.961 2.570 -13.164 1.00 . A A . 8 LYS CD 1 1 6 1235 1 1 8 LYS CE C 16.063 1.544 -13.380 1.00 . A A . 8 LYS CE 1 1 6 1236 1 1 8 LYS CG C 13.930 2.523 -14.279 1.00 . A A . 8 LYS CG 1 1 6 1237 1 1 8 LYS H H 12.791 5.104 -14.817 1.00 . A A . 8 LYS H 1 1 6 1238 1 1 8 LYS HA H 13.684 4.230 -17.285 1.00 . A A . 8 LYS HA 1 1 6 1239 1 1 8 LYS HB2 H 15.033 2.615 -16.089 1.00 . A A . 8 LYS HB2 1 1 6 1240 1 1 8 LYS HB3 H 14.992 4.122 -15.184 1.00 . A A . 8 LYS HB3 1 1 6 1241 1 1 8 LYS HD2 H 15.403 3.555 -13.135 1.00 . A A . 8 LYS HD2 1 1 6 1242 1 1 8 LYS HD3 H 14.470 2.366 -12.223 1.00 . A A . 8 LYS HD3 1 1 6 1243 1 1 8 LYS HE2 H 16.049 0.843 -12.560 1.00 . A A . 8 LYS HE2 1 1 6 1244 1 1 8 LYS HE3 H 15.872 1.020 -14.305 1.00 . A A . 8 LYS HE3 1 1 6 1245 1 1 8 LYS HG2 H 13.013 2.971 -13.926 1.00 . A A . 8 LYS HG2 1 1 6 1246 1 1 8 LYS HG3 H 13.749 1.492 -14.546 1.00 . A A . 8 LYS HG3 1 1 6 1247 1 1 8 LYS HZ1 H 18.005 1.677 -14.137 1.00 . A A . 8 LYS HZ1 1 1 6 1248 1 1 8 LYS HZ2 H 17.317 3.173 -13.749 1.00 . A A . 8 LYS HZ2 1 1 6 1249 1 1 8 LYS HZ3 H 17.867 2.150 -12.519 1.00 . A A . 8 LYS HZ3 1 1 6 1250 1 1 8 LYS N N 12.492 4.798 -15.700 1.00 . A A . 8 LYS N 1 1 6 1251 1 1 8 LYS NZ N 17.407 2.181 -13.451 1.00 . A A . 8 LYS NZ 1 1 6 1252 1 1 8 LYS O O 12.573 2.014 -17.872 1.00 . A A . 8 LYS O 1 1 6 1253 1 1 9 SER C C 9.417 1.615 -17.260 1.00 . A A . 9 SER C 1 1 6 1254 1 1 9 SER CA C 10.480 1.191 -16.252 1.00 . A A . 9 SER CA 1 1 6 1255 1 1 9 SER CB C 9.814 0.715 -14.959 1.00 . A A . 9 SER CB 1 1 6 1256 1 1 9 SER H H 11.293 2.803 -15.144 1.00 . A A . 9 SER H 1 1 6 1257 1 1 9 SER HA H 11.054 0.378 -16.671 1.00 . A A . 9 SER HA 1 1 6 1258 1 1 9 SER HB2 H 10.459 0.934 -14.122 1.00 . A A . 9 SER HB2 1 1 6 1259 1 1 9 SER HB3 H 8.872 1.230 -14.833 1.00 . A A . 9 SER HB3 1 1 6 1260 1 1 9 SER HG H 8.717 -0.846 -15.403 1.00 . A A . 9 SER HG 1 1 6 1261 1 1 9 SER N N 11.398 2.290 -15.973 1.00 . A A . 9 SER N 1 1 6 1262 1 1 9 SER O O 8.995 0.824 -18.104 1.00 . A A . 9 SER O 1 1 6 1263 1 1 9 SER OG O 9.570 -0.680 -14.995 1.00 . A A . 9 SER OG 1 1 6 1264 1 1 10 PHE C C 8.504 3.487 -19.495 1.00 . A A . 10 PHE C 1 1 6 1265 1 1 10 PHE CA C 7.971 3.399 -18.068 1.00 . A A . 10 PHE CA 1 1 6 1266 1 1 10 PHE CB C 7.511 4.780 -17.597 1.00 . A A . 10 PHE CB 1 1 6 1267 1 1 10 PHE CD1 C 6.455 3.998 -15.460 1.00 . A A . 10 PHE CD1 1 1 6 1268 1 1 10 PHE CD2 C 5.189 5.421 -16.895 1.00 . A A . 10 PHE CD2 1 1 6 1269 1 1 10 PHE CE1 C 5.400 3.953 -14.568 1.00 . A A . 10 PHE CE1 1 1 6 1270 1 1 10 PHE CE2 C 4.131 5.380 -16.007 1.00 . A A . 10 PHE CE2 1 1 6 1271 1 1 10 PHE CG C 6.362 4.732 -16.631 1.00 . A A . 10 PHE CG 1 1 6 1272 1 1 10 PHE CZ C 4.236 4.643 -14.843 1.00 . A A . 10 PHE CZ 1 1 6 1273 1 1 10 PHE H H 9.361 3.451 -16.471 1.00 . A A . 10 PHE H 1 1 6 1274 1 1 10 PHE HA H 7.130 2.724 -18.051 1.00 . A A . 10 PHE HA 1 1 6 1275 1 1 10 PHE HB2 H 8.335 5.278 -17.108 1.00 . A A . 10 PHE HB2 1 1 6 1276 1 1 10 PHE HB3 H 7.203 5.360 -18.454 1.00 . A A . 10 PHE HB3 1 1 6 1277 1 1 10 PHE HD1 H 7.366 3.457 -15.244 1.00 . A A . 10 PHE HD1 1 1 6 1278 1 1 10 PHE HD2 H 5.105 5.996 -17.805 1.00 . A A . 10 PHE HD2 1 1 6 1279 1 1 10 PHE HE1 H 5.485 3.376 -13.659 1.00 . A A . 10 PHE HE1 1 1 6 1280 1 1 10 PHE HE2 H 3.222 5.920 -16.224 1.00 . A A . 10 PHE HE2 1 1 6 1281 1 1 10 PHE HZ H 3.410 4.610 -14.148 1.00 . A A . 10 PHE HZ 1 1 6 1282 1 1 10 PHE N N 8.987 2.869 -17.165 1.00 . A A . 10 PHE N 1 1 6 1283 1 1 10 PHE O O 7.784 3.216 -20.457 1.00 . A A . 10 PHE O 1 1 6 1284 1 1 11 LEU C C 10.223 2.714 -21.748 1.00 . A A . 11 LEU C 1 1 6 1285 1 1 11 LEU CA C 10.402 3.991 -20.934 1.00 . A A . 11 LEU CA 1 1 6 1286 1 1 11 LEU CB C 11.891 4.305 -20.776 1.00 . A A . 11 LEU CB 1 1 6 1287 1 1 11 LEU CD1 C 13.878 5.737 -21.306 1.00 . A A . 11 LEU CD1 1 1 6 1288 1 1 11 LEU CD2 C 12.376 4.957 -23.148 1.00 . A A . 11 LEU CD2 1 1 6 1289 1 1 11 LEU CG C 12.448 5.395 -21.692 1.00 . A A . 11 LEU CG 1 1 6 1290 1 1 11 LEU H H 10.294 4.068 -18.822 1.00 . A A . 11 LEU H 1 1 6 1291 1 1 11 LEU HA H 9.924 4.807 -21.456 1.00 . A A . 11 LEU HA 1 1 6 1292 1 1 11 LEU HB2 H 12.057 4.613 -19.756 1.00 . A A . 11 LEU HB2 1 1 6 1293 1 1 11 LEU HB3 H 12.442 3.395 -20.970 1.00 . A A . 11 LEU HB3 1 1 6 1294 1 1 11 LEU HD11 H 14.253 4.995 -20.617 1.00 . A A . 11 LEU HD11 1 1 6 1295 1 1 11 LEU HD12 H 14.496 5.752 -22.191 1.00 . A A . 11 LEU HD12 1 1 6 1296 1 1 11 LEU HD13 H 13.901 6.709 -20.835 1.00 . A A . 11 LEU HD13 1 1 6 1297 1 1 11 LEU HD21 H 12.303 5.828 -23.782 1.00 . A A . 11 LEU HD21 1 1 6 1298 1 1 11 LEU HD22 H 13.267 4.401 -23.400 1.00 . A A . 11 LEU HD22 1 1 6 1299 1 1 11 LEU HD23 H 11.509 4.331 -23.293 1.00 . A A . 11 LEU HD23 1 1 6 1300 1 1 11 LEU HG H 11.850 6.289 -21.581 1.00 . A A . 11 LEU HG 1 1 6 1301 1 1 11 LEU N N 9.771 3.867 -19.624 1.00 . A A . 11 LEU N 1 1 6 1302 1 1 11 LEU O O 10.933 1.730 -21.543 1.00 . A A . 11 LEU O 1 1 7 1303 1 1 1 LYS C C 1.671 0.984 -2.139 1.00 . A A . 1 LYS C 1 1 7 1304 1 1 1 LYS CA C 0.656 -0.098 -2.497 1.00 . A A . 1 LYS CA 1 1 7 1305 1 1 1 LYS CB C -0.289 0.415 -3.585 1.00 . A A . 1 LYS CB 1 1 7 1306 1 1 1 LYS CD C -0.596 2.896 -3.829 1.00 . A A . 1 LYS CD 1 1 7 1307 1 1 1 LYS CE C -1.490 3.313 -4.987 1.00 . A A . 1 LYS CE 1 1 7 1308 1 1 1 LYS CG C -1.102 1.627 -3.164 1.00 . A A . 1 LYS CG 1 1 7 1309 1 1 1 LYS H1 H -0.311 -1.459 -1.195 1.00 . A A . 1 LYS H1 1 1 7 1310 1 1 1 LYS HA H 1.185 -0.962 -2.869 1.00 . A A . 1 LYS HA 1 1 7 1311 1 1 1 LYS HB2 H 0.294 0.683 -4.455 1.00 . A A . 1 LYS HB2 1 1 7 1312 1 1 1 LYS HB3 H -0.975 -0.376 -3.852 1.00 . A A . 1 LYS HB3 1 1 7 1313 1 1 1 LYS HD2 H -0.577 3.692 -3.099 1.00 . A A . 1 LYS HD2 1 1 7 1314 1 1 1 LYS HD3 H 0.404 2.723 -4.202 1.00 . A A . 1 LYS HD3 1 1 7 1315 1 1 1 LYS HE2 H -1.287 2.671 -5.830 1.00 . A A . 1 LYS HE2 1 1 7 1316 1 1 1 LYS HE3 H -2.521 3.199 -4.687 1.00 . A A . 1 LYS HE3 1 1 7 1317 1 1 1 LYS HG2 H -2.133 1.473 -3.445 1.00 . A A . 1 LYS HG2 1 1 7 1318 1 1 1 LYS HG3 H -1.032 1.741 -2.092 1.00 . A A . 1 LYS HG3 1 1 7 1319 1 1 1 LYS HZ1 H -2.021 5.333 -5.028 1.00 . A A . 1 LYS HZ1 1 1 7 1320 1 1 1 LYS HZ2 H -0.351 5.065 -4.998 1.00 . A A . 1 LYS HZ2 1 1 7 1321 1 1 1 LYS HZ3 H -1.224 4.806 -6.424 1.00 . A A . 1 LYS HZ3 1 1 7 1322 1 1 1 LYS N N -0.103 -0.509 -1.321 1.00 . A A . 1 LYS N 1 1 7 1323 1 1 1 LYS NZ N -1.255 4.728 -5.387 1.00 . A A . 1 LYS NZ 1 1 7 1324 1 1 1 LYS O O 1.634 1.545 -1.044 1.00 . A A . 1 LYS O 1 1 7 1325 1 1 2 PHE C C 3.636 3.279 -4.010 1.00 . A A . 2 PHE C 1 1 7 1326 1 1 2 PHE CA C 3.599 2.286 -2.852 1.00 . A A . 2 PHE CA 1 1 7 1327 1 1 2 PHE CB C 4.971 1.629 -2.685 1.00 . A A . 2 PHE CB 1 1 7 1328 1 1 2 PHE CD1 C 6.334 2.751 -0.903 1.00 . A A . 2 PHE CD1 1 1 7 1329 1 1 2 PHE CD2 C 5.184 0.737 -0.349 1.00 . A A . 2 PHE CD2 1 1 7 1330 1 1 2 PHE CE1 C 6.829 2.827 0.386 1.00 . A A . 2 PHE CE1 1 1 7 1331 1 1 2 PHE CE2 C 5.676 0.808 0.941 1.00 . A A . 2 PHE CE2 1 1 7 1332 1 1 2 PHE CG C 5.507 1.707 -1.284 1.00 . A A . 2 PHE CG 1 1 7 1333 1 1 2 PHE CZ C 6.500 1.853 1.308 1.00 . A A . 2 PHE CZ 1 1 7 1334 1 1 2 PHE H H 2.553 0.789 -3.923 1.00 . A A . 2 PHE H 1 1 7 1335 1 1 2 PHE HA H 3.351 2.817 -1.946 1.00 . A A . 2 PHE HA 1 1 7 1336 1 1 2 PHE HB2 H 4.897 0.586 -2.953 1.00 . A A . 2 PHE HB2 1 1 7 1337 1 1 2 PHE HB3 H 5.677 2.116 -3.340 1.00 . A A . 2 PHE HB3 1 1 7 1338 1 1 2 PHE HD1 H 6.592 3.514 -1.624 1.00 . A A . 2 PHE HD1 1 1 7 1339 1 1 2 PHE HD2 H 4.541 -0.082 -0.635 1.00 . A A . 2 PHE HD2 1 1 7 1340 1 1 2 PHE HE1 H 7.473 3.646 0.670 1.00 . A A . 2 PHE HE1 1 1 7 1341 1 1 2 PHE HE2 H 5.418 0.045 1.660 1.00 . A A . 2 PHE HE2 1 1 7 1342 1 1 2 PHE HZ H 6.885 1.911 2.315 1.00 . A A . 2 PHE HZ 1 1 7 1343 1 1 2 PHE N N 2.575 1.271 -3.069 1.00 . A A . 2 PHE N 1 1 7 1344 1 1 2 PHE O O 3.087 3.022 -5.081 1.00 . A A . 2 PHE O 1 1 7 1345 1 1 3 LYS C C 5.811 5.501 -5.379 1.00 . A A . 3 LYS C 1 1 7 1346 1 1 3 LYS CA C 4.397 5.449 -4.809 1.00 . A A . 3 LYS CA 1 1 7 1347 1 1 3 LYS CB C 4.018 6.813 -4.228 1.00 . A A . 3 LYS CB 1 1 7 1348 1 1 3 LYS CD C 3.746 7.120 -1.750 1.00 . A A . 3 LYS CD 1 1 7 1349 1 1 3 LYS CE C 4.426 7.538 -0.455 1.00 . A A . 3 LYS CE 1 1 7 1350 1 1 3 LYS CG C 4.718 7.132 -2.918 1.00 . A A . 3 LYS CG 1 1 7 1351 1 1 3 LYS H H 4.703 4.563 -2.911 1.00 . A A . 3 LYS H 1 1 7 1352 1 1 3 LYS HA H 3.710 5.203 -5.605 1.00 . A A . 3 LYS HA 1 1 7 1353 1 1 3 LYS HB2 H 4.274 7.580 -4.945 1.00 . A A . 3 LYS HB2 1 1 7 1354 1 1 3 LYS HB3 H 2.951 6.835 -4.057 1.00 . A A . 3 LYS HB3 1 1 7 1355 1 1 3 LYS HD2 H 2.938 7.806 -1.957 1.00 . A A . 3 LYS HD2 1 1 7 1356 1 1 3 LYS HD3 H 3.350 6.121 -1.632 1.00 . A A . 3 LYS HD3 1 1 7 1357 1 1 3 LYS HE2 H 3.971 7.003 0.364 1.00 . A A . 3 LYS HE2 1 1 7 1358 1 1 3 LYS HE3 H 5.473 7.283 -0.515 1.00 . A A . 3 LYS HE3 1 1 7 1359 1 1 3 LYS HG2 H 5.485 6.393 -2.741 1.00 . A A . 3 LYS HG2 1 1 7 1360 1 1 3 LYS HG3 H 5.168 8.112 -2.990 1.00 . A A . 3 LYS HG3 1 1 7 1361 1 1 3 LYS HZ1 H 4.274 9.191 0.814 1.00 . A A . 3 LYS HZ1 1 1 7 1362 1 1 3 LYS HZ2 H 5.104 9.507 -0.626 1.00 . A A . 3 LYS HZ2 1 1 7 1363 1 1 3 LYS HZ3 H 3.418 9.359 -0.636 1.00 . A A . 3 LYS HZ3 1 1 7 1364 1 1 3 LYS N N 4.286 4.416 -3.786 1.00 . A A . 3 LYS N 1 1 7 1365 1 1 3 LYS NZ N 4.296 9.001 -0.209 1.00 . A A . 3 LYS NZ 1 1 7 1366 1 1 3 LYS O O 6.533 6.480 -5.186 1.00 . A A . 3 LYS O 1 1 7 1367 1 1 4 LYS C C 7.436 4.397 -8.205 1.00 . A A . 4 LYS C 1 1 7 1368 1 1 4 LYS CA C 7.526 4.370 -6.683 1.00 . A A . 4 LYS CA 1 1 7 1369 1 1 4 LYS CB C 8.245 3.098 -6.227 1.00 . A A . 4 LYS CB 1 1 7 1370 1 1 4 LYS CD C 8.117 0.632 -5.765 1.00 . A A . 4 LYS CD 1 1 7 1371 1 1 4 LYS CE C 7.554 -0.649 -6.361 1.00 . A A . 4 LYS CE 1 1 7 1372 1 1 4 LYS CG C 7.372 1.856 -6.272 1.00 . A A . 4 LYS CG 1 1 7 1373 1 1 4 LYS H H 5.579 3.694 -6.201 1.00 . A A . 4 LYS H 1 1 7 1374 1 1 4 LYS HA H 8.089 5.230 -6.352 1.00 . A A . 4 LYS HA 1 1 7 1375 1 1 4 LYS HB2 H 9.102 2.935 -6.864 1.00 . A A . 4 LYS HB2 1 1 7 1376 1 1 4 LYS HB3 H 8.585 3.237 -5.210 1.00 . A A . 4 LYS HB3 1 1 7 1377 1 1 4 LYS HD2 H 9.158 0.716 -6.040 1.00 . A A . 4 LYS HD2 1 1 7 1378 1 1 4 LYS HD3 H 8.029 0.588 -4.689 1.00 . A A . 4 LYS HD3 1 1 7 1379 1 1 4 LYS HE2 H 7.010 -1.178 -5.593 1.00 . A A . 4 LYS HE2 1 1 7 1380 1 1 4 LYS HE3 H 6.881 -0.391 -7.166 1.00 . A A . 4 LYS HE3 1 1 7 1381 1 1 4 LYS HG2 H 6.502 2.016 -5.654 1.00 . A A . 4 LYS HG2 1 1 7 1382 1 1 4 LYS HG3 H 7.064 1.682 -7.293 1.00 . A A . 4 LYS HG3 1 1 7 1383 1 1 4 LYS HZ1 H 9.520 -1.355 -6.386 1.00 . A A . 4 LYS HZ1 1 1 7 1384 1 1 4 LYS HZ2 H 8.364 -2.531 -6.765 1.00 . A A . 4 LYS HZ2 1 1 7 1385 1 1 4 LYS HZ3 H 8.774 -1.350 -7.905 1.00 . A A . 4 LYS HZ3 1 1 7 1386 1 1 4 LYS N N 6.200 4.444 -6.082 1.00 . A A . 4 LYS N 1 1 7 1387 1 1 4 LYS NZ N 8.628 -1.533 -6.891 1.00 . A A . 4 LYS NZ 1 1 7 1388 1 1 4 LYS O O 7.938 3.500 -8.883 1.00 . A A . 4 LYS O 1 1 7 1389 1 1 5 VAL C C 7.936 6.064 -10.824 1.00 . A A . 5 VAL C 1 1 7 1390 1 1 5 VAL CA C 6.642 5.578 -10.180 1.00 . A A . 5 VAL CA 1 1 7 1391 1 1 5 VAL CB C 5.508 6.560 -10.528 1.00 . A A . 5 VAL CB 1 1 7 1392 1 1 5 VAL CG1 C 5.327 6.654 -12.036 1.00 . A A . 5 VAL CG1 1 1 7 1393 1 1 5 VAL CG2 C 4.212 6.137 -9.853 1.00 . A A . 5 VAL CG2 1 1 7 1394 1 1 5 VAL H H 6.417 6.116 -8.146 1.00 . A A . 5 VAL H 1 1 7 1395 1 1 5 VAL HA H 6.390 4.610 -10.588 1.00 . A A . 5 VAL HA 1 1 7 1396 1 1 5 VAL HB H 5.780 7.538 -10.159 1.00 . A A . 5 VAL HB 1 1 7 1397 1 1 5 VAL HG11 H 5.873 5.855 -12.515 1.00 . A A . 5 VAL HG11 1 1 7 1398 1 1 5 VAL HG12 H 4.278 6.568 -12.278 1.00 . A A . 5 VAL HG12 1 1 7 1399 1 1 5 VAL HG13 H 5.700 7.605 -12.385 1.00 . A A . 5 VAL HG13 1 1 7 1400 1 1 5 VAL HG21 H 4.315 6.237 -8.782 1.00 . A A . 5 VAL HG21 1 1 7 1401 1 1 5 VAL HG22 H 3.405 6.767 -10.197 1.00 . A A . 5 VAL HG22 1 1 7 1402 1 1 5 VAL HG23 H 3.996 5.108 -10.099 1.00 . A A . 5 VAL HG23 1 1 7 1403 1 1 5 VAL N N 6.795 5.432 -8.738 1.00 . A A . 5 VAL N 1 1 7 1404 1 1 5 VAL O O 8.537 7.038 -10.373 1.00 . A A . 5 VAL O 1 1 7 1405 1 1 6 ILE C C 9.451 5.470 -14.083 1.00 . A A . 6 ILE C 1 1 7 1406 1 1 6 ILE CA C 9.580 5.741 -12.588 1.00 . A A . 6 ILE CA 1 1 7 1407 1 1 6 ILE CB C 10.796 4.972 -12.041 1.00 . A A . 6 ILE CB 1 1 7 1408 1 1 6 ILE CD1 C 11.650 3.688 -10.016 1.00 . A A . 6 ILE CD1 1 1 7 1409 1 1 6 ILE CG1 C 10.463 4.344 -10.686 1.00 . A A . 6 ILE CG1 1 1 7 1410 1 1 6 ILE CG2 C 11.998 5.897 -11.922 1.00 . A A . 6 ILE CG2 1 1 7 1411 1 1 6 ILE H H 7.835 4.611 -12.193 1.00 . A A . 6 ILE H 1 1 7 1412 1 1 6 ILE HA H 9.750 6.798 -12.438 1.00 . A A . 6 ILE HA 1 1 7 1413 1 1 6 ILE HB H 11.044 4.189 -12.742 1.00 . A A . 6 ILE HB 1 1 7 1414 1 1 6 ILE HD11 H 11.335 3.238 -9.086 1.00 . A A . 6 ILE HD11 1 1 7 1415 1 1 6 ILE HD12 H 12.054 2.925 -10.666 1.00 . A A . 6 ILE HD12 1 1 7 1416 1 1 6 ILE HD13 H 12.408 4.431 -9.818 1.00 . A A . 6 ILE HD13 1 1 7 1417 1 1 6 ILE HG12 H 10.091 5.109 -10.024 1.00 . A A . 6 ILE HG12 1 1 7 1418 1 1 6 ILE HG13 H 9.701 3.591 -10.825 1.00 . A A . 6 ILE HG13 1 1 7 1419 1 1 6 ILE HG21 H 12.127 6.188 -10.889 1.00 . A A . 6 ILE HG21 1 1 7 1420 1 1 6 ILE HG22 H 12.884 5.383 -12.264 1.00 . A A . 6 ILE HG22 1 1 7 1421 1 1 6 ILE HG23 H 11.837 6.777 -12.526 1.00 . A A . 6 ILE HG23 1 1 7 1422 1 1 6 ILE N N 8.358 5.378 -11.881 1.00 . A A . 6 ILE N 1 1 7 1423 1 1 6 ILE O O 9.528 4.324 -14.525 1.00 . A A . 6 ILE O 1 1 7 1424 1 1 7 TRP C C 10.326 5.699 -16.906 1.00 . A A . 7 TRP C 1 1 7 1425 1 1 7 TRP CA C 9.119 6.409 -16.303 1.00 . A A . 7 TRP CA 1 1 7 1426 1 1 7 TRP CB C 8.954 7.790 -16.940 1.00 . A A . 7 TRP CB 1 1 7 1427 1 1 7 TRP CD1 C 9.741 8.559 -19.254 1.00 . A A . 7 TRP CD1 1 1 7 1428 1 1 7 TRP CD2 C 8.244 6.893 -19.298 1.00 . A A . 7 TRP CD2 1 1 7 1429 1 1 7 TRP CE2 C 8.593 7.219 -20.623 1.00 . A A . 7 TRP CE2 1 1 7 1430 1 1 7 TRP CE3 C 7.318 5.871 -19.077 1.00 . A A . 7 TRP CE3 1 1 7 1431 1 1 7 TRP CG C 8.991 7.761 -18.438 1.00 . A A . 7 TRP CG 1 1 7 1432 1 1 7 TRP CH2 C 7.140 5.563 -21.475 1.00 . A A . 7 TRP CH2 1 1 7 1433 1 1 7 TRP CZ2 C 8.045 6.560 -21.720 1.00 . A A . 7 TRP CZ2 1 1 7 1434 1 1 7 TRP CZ3 C 6.775 5.217 -20.167 1.00 . A A . 7 TRP CZ3 1 1 7 1435 1 1 7 TRP H H 9.204 7.420 -14.445 1.00 . A A . 7 TRP H 1 1 7 1436 1 1 7 TRP HA H 8.234 5.822 -16.503 1.00 . A A . 7 TRP HA 1 1 7 1437 1 1 7 TRP HB2 H 8.005 8.207 -16.638 1.00 . A A . 7 TRP HB2 1 1 7 1438 1 1 7 TRP HB3 H 9.751 8.433 -16.598 1.00 . A A . 7 TRP HB3 1 1 7 1439 1 1 7 TRP HD1 H 10.415 9.326 -18.903 1.00 . A A . 7 TRP HD1 1 1 7 1440 1 1 7 TRP HE1 H 9.926 8.669 -21.344 1.00 . A A . 7 TRP HE1 1 1 7 1441 1 1 7 TRP HE3 H 7.024 5.590 -18.076 1.00 . A A . 7 TRP HE3 1 1 7 1442 1 1 7 TRP HH2 H 6.690 5.026 -22.296 1.00 . A A . 7 TRP HH2 1 1 7 1443 1 1 7 TRP HZ2 H 8.316 6.814 -22.734 1.00 . A A . 7 TRP HZ2 1 1 7 1444 1 1 7 TRP HZ3 H 6.056 4.425 -20.016 1.00 . A A . 7 TRP HZ3 1 1 7 1445 1 1 7 TRP N N 9.256 6.532 -14.857 1.00 . A A . 7 TRP N 1 1 7 1446 1 1 7 TRP NE1 N 9.506 8.238 -20.570 1.00 . A A . 7 TRP NE1 1 1 7 1447 1 1 7 TRP O O 10.195 4.933 -17.862 1.00 . A A . 7 TRP O 1 1 7 1448 1 1 8 LYS C C 12.600 3.822 -16.869 1.00 . A A . 8 LYS C 1 1 7 1449 1 1 8 LYS CA C 12.732 5.341 -16.824 1.00 . A A . 8 LYS CA 1 1 7 1450 1 1 8 LYS CB C 13.908 5.735 -15.926 1.00 . A A . 8 LYS CB 1 1 7 1451 1 1 8 LYS CD C 14.180 7.681 -14.361 1.00 . A A . 8 LYS CD 1 1 7 1452 1 1 8 LYS CE C 15.619 7.784 -13.878 1.00 . A A . 8 LYS CE 1 1 7 1453 1 1 8 LYS CG C 14.110 7.236 -15.812 1.00 . A A . 8 LYS CG 1 1 7 1454 1 1 8 LYS H H 11.541 6.577 -15.584 1.00 . A A . 8 LYS H 1 1 7 1455 1 1 8 LYS HA H 12.917 5.704 -17.823 1.00 . A A . 8 LYS HA 1 1 7 1456 1 1 8 LYS HB2 H 13.737 5.339 -14.936 1.00 . A A . 8 LYS HB2 1 1 7 1457 1 1 8 LYS HB3 H 14.812 5.300 -16.327 1.00 . A A . 8 LYS HB3 1 1 7 1458 1 1 8 LYS HD2 H 13.710 8.648 -14.267 1.00 . A A . 8 LYS HD2 1 1 7 1459 1 1 8 LYS HD3 H 13.654 6.962 -13.748 1.00 . A A . 8 LYS HD3 1 1 7 1460 1 1 8 LYS HE2 H 16.263 7.914 -14.734 1.00 . A A . 8 LYS HE2 1 1 7 1461 1 1 8 LYS HE3 H 15.705 8.643 -13.229 1.00 . A A . 8 LYS HE3 1 1 7 1462 1 1 8 LYS HG2 H 15.034 7.504 -16.304 1.00 . A A . 8 LYS HG2 1 1 7 1463 1 1 8 LYS HG3 H 13.284 7.739 -16.295 1.00 . A A . 8 LYS HG3 1 1 7 1464 1 1 8 LYS HZ1 H 16.999 6.283 -13.426 1.00 . A A . 8 LYS HZ1 1 1 7 1465 1 1 8 LYS HZ2 H 16.048 6.759 -12.110 1.00 . A A . 8 LYS HZ2 1 1 7 1466 1 1 8 LYS HZ3 H 15.385 5.784 -13.324 1.00 . A A . 8 LYS HZ3 1 1 7 1467 1 1 8 LYS N N 11.501 5.957 -16.343 1.00 . A A . 8 LYS N 1 1 7 1468 1 1 8 LYS NZ N 16.042 6.567 -13.132 1.00 . A A . 8 LYS NZ 1 1 7 1469 1 1 8 LYS O O 13.142 3.168 -17.759 1.00 . A A . 8 LYS O 1 1 7 1470 1 1 9 SER C C 10.489 1.399 -16.696 1.00 . A A . 9 SER C 1 1 7 1471 1 1 9 SER CA C 11.672 1.825 -15.832 1.00 . A A . 9 SER CA 1 1 7 1472 1 1 9 SER CB C 11.441 1.392 -14.383 1.00 . A A . 9 SER CB 1 1 7 1473 1 1 9 SER H H 11.466 3.842 -15.222 1.00 . A A . 9 SER H 1 1 7 1474 1 1 9 SER HA H 12.565 1.346 -16.203 1.00 . A A . 9 SER HA 1 1 7 1475 1 1 9 SER HB2 H 12.393 1.291 -13.884 1.00 . A A . 9 SER HB2 1 1 7 1476 1 1 9 SER HB3 H 10.847 2.140 -13.877 1.00 . A A . 9 SER HB3 1 1 7 1477 1 1 9 SER HG H 9.946 0.256 -13.825 1.00 . A A . 9 SER HG 1 1 7 1478 1 1 9 SER N N 11.874 3.267 -15.903 1.00 . A A . 9 SER N 1 1 7 1479 1 1 9 SER O O 10.508 0.333 -17.313 1.00 . A A . 9 SER O 1 1 7 1480 1 1 9 SER OG O 10.759 0.151 -14.324 1.00 . A A . 9 SER OG 1 1 7 1481 1 1 10 PHE C C 8.616 1.794 -19.002 1.00 . A A . 10 PHE C 1 1 7 1482 1 1 10 PHE CA C 8.268 1.950 -17.524 1.00 . A A . 10 PHE CA 1 1 7 1483 1 1 10 PHE CB C 7.232 3.062 -17.348 1.00 . A A . 10 PHE CB 1 1 7 1484 1 1 10 PHE CD1 C 6.687 2.617 -14.939 1.00 . A A . 10 PHE CD1 1 1 7 1485 1 1 10 PHE CD2 C 4.892 2.728 -16.505 1.00 . A A . 10 PHE CD2 1 1 7 1486 1 1 10 PHE CE1 C 5.787 2.374 -13.919 1.00 . A A . 10 PHE CE1 1 1 7 1487 1 1 10 PHE CE2 C 3.987 2.485 -15.489 1.00 . A A . 10 PHE CE2 1 1 7 1488 1 1 10 PHE CG C 6.251 2.797 -16.242 1.00 . A A . 10 PHE CG 1 1 7 1489 1 1 10 PHE CZ C 4.435 2.307 -14.195 1.00 . A A . 10 PHE CZ 1 1 7 1490 1 1 10 PHE H H 9.504 3.073 -16.224 1.00 . A A . 10 PHE H 1 1 7 1491 1 1 10 PHE HA H 7.851 1.021 -17.165 1.00 . A A . 10 PHE HA 1 1 7 1492 1 1 10 PHE HB2 H 7.742 3.987 -17.124 1.00 . A A . 10 PHE HB2 1 1 7 1493 1 1 10 PHE HB3 H 6.676 3.176 -18.266 1.00 . A A . 10 PHE HB3 1 1 7 1494 1 1 10 PHE HD1 H 7.745 2.669 -14.722 1.00 . A A . 10 PHE HD1 1 1 7 1495 1 1 10 PHE HD2 H 4.541 2.866 -17.517 1.00 . A A . 10 PHE HD2 1 1 7 1496 1 1 10 PHE HE1 H 6.140 2.235 -12.908 1.00 . A A . 10 PHE HE1 1 1 7 1497 1 1 10 PHE HE2 H 2.931 2.433 -15.708 1.00 . A A . 10 PHE HE2 1 1 7 1498 1 1 10 PHE HZ H 3.730 2.118 -13.399 1.00 . A A . 10 PHE HZ 1 1 7 1499 1 1 10 PHE N N 9.460 2.239 -16.737 1.00 . A A . 10 PHE N 1 1 7 1500 1 1 10 PHE O O 8.025 0.976 -19.708 1.00 . A A . 10 PHE O 1 1 7 1501 1 1 11 LEU C C 11.229 1.636 -21.020 1.00 . A A . 11 LEU C 1 1 7 1502 1 1 11 LEU CA C 10.008 2.535 -20.856 1.00 . A A . 11 LEU CA 1 1 7 1503 1 1 11 LEU CB C 10.327 3.943 -21.362 1.00 . A A . 11 LEU CB 1 1 7 1504 1 1 11 LEU CD1 C 11.041 3.241 -23.660 1.00 . A A . 11 LEU CD1 1 1 7 1505 1 1 11 LEU CD2 C 11.678 5.498 -22.790 1.00 . A A . 11 LEU CD2 1 1 7 1506 1 1 11 LEU CG C 11.421 4.043 -22.425 1.00 . A A . 11 LEU CG 1 1 7 1507 1 1 11 LEU H H 10.014 3.215 -18.852 1.00 . A A . 11 LEU H 1 1 7 1508 1 1 11 LEU HA H 9.195 2.128 -21.439 1.00 . A A . 11 LEU HA 1 1 7 1509 1 1 11 LEU HB2 H 9.422 4.357 -21.779 1.00 . A A . 11 LEU HB2 1 1 7 1510 1 1 11 LEU HB3 H 10.634 4.537 -20.513 1.00 . A A . 11 LEU HB3 1 1 7 1511 1 1 11 LEU HD11 H 11.810 2.511 -23.866 1.00 . A A . 11 LEU HD11 1 1 7 1512 1 1 11 LEU HD12 H 10.102 2.736 -23.486 1.00 . A A . 11 LEU HD12 1 1 7 1513 1 1 11 LEU HD13 H 10.940 3.906 -24.504 1.00 . A A . 11 LEU HD13 1 1 7 1514 1 1 11 LEU HD21 H 12.175 5.546 -23.748 1.00 . A A . 11 LEU HD21 1 1 7 1515 1 1 11 LEU HD22 H 10.739 6.027 -22.846 1.00 . A A . 11 LEU HD22 1 1 7 1516 1 1 11 LEU HD23 H 12.304 5.953 -22.037 1.00 . A A . 11 LEU HD23 1 1 7 1517 1 1 11 LEU HG H 12.338 3.630 -22.028 1.00 . A A . 11 LEU HG 1 1 7 1518 1 1 11 LEU N N 9.580 2.584 -19.463 1.00 . A A . 11 LEU N 1 1 7 1519 1 1 11 LEU O O 12.280 1.886 -20.430 1.00 . A A . 11 LEU O 1 1 8 1520 1 1 1 LYS C C 2.666 0.877 -1.788 1.00 . A A . 1 LYS C 1 1 8 1521 1 1 1 LYS CA C 1.568 -0.169 -1.624 1.00 . A A . 1 LYS CA 1 1 8 1522 1 1 1 LYS CB C 0.553 0.301 -0.579 1.00 . A A . 1 LYS CB 1 1 8 1523 1 1 1 LYS CD C -1.486 -0.590 -1.744 1.00 . A A . 1 LYS CD 1 1 8 1524 1 1 1 LYS CE C -2.834 0.084 -1.535 1.00 . A A . 1 LYS CE 1 1 8 1525 1 1 1 LYS CG C -0.665 -0.600 -0.466 1.00 . A A . 1 LYS CG 1 1 8 1526 1 1 1 LYS H1 H 1.917 -2.252 -1.770 1.00 . A A . 1 LYS H1 1 1 8 1527 1 1 1 LYS HA H 1.065 -0.297 -2.570 1.00 . A A . 1 LYS HA 1 1 8 1528 1 1 1 LYS HB2 H 1.038 0.338 0.385 1.00 . A A . 1 LYS HB2 1 1 8 1529 1 1 1 LYS HB3 H 0.217 1.293 -0.842 1.00 . A A . 1 LYS HB3 1 1 8 1530 1 1 1 LYS HD2 H -0.943 -0.053 -2.507 1.00 . A A . 1 LYS HD2 1 1 8 1531 1 1 1 LYS HD3 H -1.650 -1.609 -2.065 1.00 . A A . 1 LYS HD3 1 1 8 1532 1 1 1 LYS HE2 H -3.552 -0.662 -1.233 1.00 . A A . 1 LYS HE2 1 1 8 1533 1 1 1 LYS HE3 H -2.734 0.824 -0.754 1.00 . A A . 1 LYS HE3 1 1 8 1534 1 1 1 LYS HG2 H -0.337 -1.610 -0.270 1.00 . A A . 1 LYS HG2 1 1 8 1535 1 1 1 LYS HG3 H -1.282 -0.255 0.351 1.00 . A A . 1 LYS HG3 1 1 8 1536 1 1 1 LYS HZ1 H -4.100 0.205 -3.192 1.00 . A A . 1 LYS HZ1 1 1 8 1537 1 1 1 LYS HZ2 H -3.658 1.709 -2.556 1.00 . A A . 1 LYS HZ2 1 1 8 1538 1 1 1 LYS HZ3 H -2.547 0.818 -3.470 1.00 . A A . 1 LYS HZ3 1 1 8 1539 1 1 1 LYS N N 2.131 -1.457 -1.237 1.00 . A A . 1 LYS N 1 1 8 1540 1 1 1 LYS NZ N -3.319 0.751 -2.775 1.00 . A A . 1 LYS NZ 1 1 8 1541 1 1 1 LYS O O 3.155 1.437 -0.807 1.00 . A A . 1 LYS O 1 1 8 1542 1 1 2 PHE C C 3.788 2.854 -4.630 1.00 . A A . 2 PHE C 1 1 8 1543 1 1 2 PHE CA C 4.086 2.118 -3.327 1.00 . A A . 2 PHE CA 1 1 8 1544 1 1 2 PHE CB C 5.452 1.434 -3.415 1.00 . A A . 2 PHE CB 1 1 8 1545 1 1 2 PHE CD1 C 6.595 2.590 -1.504 1.00 . A A . 2 PHE CD1 1 1 8 1546 1 1 2 PHE CD2 C 6.495 0.208 -1.490 1.00 . A A . 2 PHE CD2 1 1 8 1547 1 1 2 PHE CE1 C 7.279 2.572 -0.303 1.00 . A A . 2 PHE CE1 1 1 8 1548 1 1 2 PHE CE2 C 7.178 0.184 -0.289 1.00 . A A . 2 PHE CE2 1 1 8 1549 1 1 2 PHE CG C 6.195 1.410 -2.110 1.00 . A A . 2 PHE CG 1 1 8 1550 1 1 2 PHE CZ C 7.572 1.367 0.305 1.00 . A A . 2 PHE CZ 1 1 8 1551 1 1 2 PHE H H 2.619 0.659 -3.775 1.00 . A A . 2 PHE H 1 1 8 1552 1 1 2 PHE HA H 4.102 2.834 -2.519 1.00 . A A . 2 PHE HA 1 1 8 1553 1 1 2 PHE HB2 H 5.315 0.412 -3.736 1.00 . A A . 2 PHE HB2 1 1 8 1554 1 1 2 PHE HB3 H 6.062 1.956 -4.137 1.00 . A A . 2 PHE HB3 1 1 8 1555 1 1 2 PHE HD1 H 6.367 3.534 -1.979 1.00 . A A . 2 PHE HD1 1 1 8 1556 1 1 2 PHE HD2 H 6.189 -0.718 -1.953 1.00 . A A . 2 PHE HD2 1 1 8 1557 1 1 2 PHE HE1 H 7.586 3.499 0.158 1.00 . A A . 2 PHE HE1 1 1 8 1558 1 1 2 PHE HE2 H 7.406 -0.760 0.184 1.00 . A A . 2 PHE HE2 1 1 8 1559 1 1 2 PHE HZ H 8.106 1.351 1.243 1.00 . A A . 2 PHE HZ 1 1 8 1560 1 1 2 PHE N N 3.046 1.138 -3.034 1.00 . A A . 2 PHE N 1 1 8 1561 1 1 2 PHE O O 3.272 2.269 -5.583 1.00 . A A . 2 PHE O 1 1 8 1562 1 1 3 LYS C C 5.157 5.701 -6.253 1.00 . A A . 3 LYS C 1 1 8 1563 1 1 3 LYS CA C 3.887 4.958 -5.850 1.00 . A A . 3 LYS CA 1 1 8 1564 1 1 3 LYS CB C 2.758 5.959 -5.593 1.00 . A A . 3 LYS CB 1 1 8 1565 1 1 3 LYS CD C 2.284 6.197 -3.137 1.00 . A A . 3 LYS CD 1 1 8 1566 1 1 3 LYS CE C 3.034 6.520 -1.854 1.00 . A A . 3 LYS CE 1 1 8 1567 1 1 3 LYS CG C 2.968 6.807 -4.350 1.00 . A A . 3 LYS CG 1 1 8 1568 1 1 3 LYS H H 4.526 4.550 -3.873 1.00 . A A . 3 LYS H 1 1 8 1569 1 1 3 LYS HA H 3.598 4.301 -6.655 1.00 . A A . 3 LYS HA 1 1 8 1570 1 1 3 LYS HB2 H 2.677 6.619 -6.444 1.00 . A A . 3 LYS HB2 1 1 8 1571 1 1 3 LYS HB3 H 1.831 5.416 -5.480 1.00 . A A . 3 LYS HB3 1 1 8 1572 1 1 3 LYS HD2 H 1.282 6.592 -3.064 1.00 . A A . 3 LYS HD2 1 1 8 1573 1 1 3 LYS HD3 H 2.243 5.124 -3.260 1.00 . A A . 3 LYS HD3 1 1 8 1574 1 1 3 LYS HE2 H 4.005 6.051 -1.892 1.00 . A A . 3 LYS HE2 1 1 8 1575 1 1 3 LYS HE3 H 3.154 7.591 -1.782 1.00 . A A . 3 LYS HE3 1 1 8 1576 1 1 3 LYS HG2 H 4.027 6.883 -4.152 1.00 . A A . 3 LYS HG2 1 1 8 1577 1 1 3 LYS HG3 H 2.560 7.792 -4.525 1.00 . A A . 3 LYS HG3 1 1 8 1578 1 1 3 LYS HZ1 H 1.898 6.835 -0.129 1.00 . A A . 3 LYS HZ1 1 1 8 1579 1 1 3 LYS HZ2 H 1.540 5.388 -0.931 1.00 . A A . 3 LYS HZ2 1 1 8 1580 1 1 3 LYS HZ3 H 2.960 5.522 -0.020 1.00 . A A . 3 LYS HZ3 1 1 8 1581 1 1 3 LYS N N 4.117 4.141 -4.665 1.00 . A A . 3 LYS N 1 1 8 1582 1 1 3 LYS NZ N 2.307 6.032 -0.649 1.00 . A A . 3 LYS NZ 1 1 8 1583 1 1 3 LYS O O 5.224 6.928 -6.171 1.00 . A A . 3 LYS O 1 1 8 1584 1 1 4 LYS C C 7.366 5.984 -8.568 1.00 . A A . 4 LYS C 1 1 8 1585 1 1 4 LYS CA C 7.429 5.537 -7.110 1.00 . A A . 4 LYS CA 1 1 8 1586 1 1 4 LYS CB C 8.567 4.531 -6.923 1.00 . A A . 4 LYS CB 1 1 8 1587 1 1 4 LYS CD C 9.234 5.033 -4.554 1.00 . A A . 4 LYS CD 1 1 8 1588 1 1 4 LYS CE C 10.359 4.463 -3.704 1.00 . A A . 4 LYS CE 1 1 8 1589 1 1 4 LYS CG C 8.675 3.990 -5.508 1.00 . A A . 4 LYS CG 1 1 8 1590 1 1 4 LYS H H 6.048 3.977 -6.734 1.00 . A A . 4 LYS H 1 1 8 1591 1 1 4 LYS HA H 7.617 6.400 -6.490 1.00 . A A . 4 LYS HA 1 1 8 1592 1 1 4 LYS HB2 H 8.410 3.699 -7.593 1.00 . A A . 4 LYS HB2 1 1 8 1593 1 1 4 LYS HB3 H 9.502 5.012 -7.174 1.00 . A A . 4 LYS HB3 1 1 8 1594 1 1 4 LYS HD2 H 9.617 5.864 -5.127 1.00 . A A . 4 LYS HD2 1 1 8 1595 1 1 4 LYS HD3 H 8.441 5.376 -3.904 1.00 . A A . 4 LYS HD3 1 1 8 1596 1 1 4 LYS HE2 H 10.611 5.179 -2.937 1.00 . A A . 4 LYS HE2 1 1 8 1597 1 1 4 LYS HE3 H 10.016 3.548 -3.243 1.00 . A A . 4 LYS HE3 1 1 8 1598 1 1 4 LYS HG2 H 7.692 3.698 -5.168 1.00 . A A . 4 LYS HG2 1 1 8 1599 1 1 4 LYS HG3 H 9.328 3.129 -5.510 1.00 . A A . 4 LYS HG3 1 1 8 1600 1 1 4 LYS HZ1 H 11.829 3.167 -4.427 1.00 . A A . 4 LYS HZ1 1 1 8 1601 1 1 4 LYS HZ2 H 11.396 4.388 -5.515 1.00 . A A . 4 LYS HZ2 1 1 8 1602 1 1 4 LYS HZ3 H 12.372 4.750 -4.182 1.00 . A A . 4 LYS HZ3 1 1 8 1603 1 1 4 LYS N N 6.162 4.950 -6.691 1.00 . A A . 4 LYS N 1 1 8 1604 1 1 4 LYS NZ N 11.574 4.171 -4.514 1.00 . A A . 4 LYS NZ 1 1 8 1605 1 1 4 LYS O O 6.316 5.906 -9.206 1.00 . A A . 4 LYS O 1 1 8 1606 1 1 5 VAL C C 8.334 5.756 -11.443 1.00 . A A . 5 VAL C 1 1 8 1607 1 1 5 VAL CA C 8.570 6.906 -10.471 1.00 . A A . 5 VAL CA 1 1 8 1608 1 1 5 VAL CB C 9.935 7.551 -10.778 1.00 . A A . 5 VAL CB 1 1 8 1609 1 1 5 VAL CG1 C 9.931 8.179 -12.163 1.00 . A A . 5 VAL CG1 1 1 8 1610 1 1 5 VAL CG2 C 10.287 8.583 -9.717 1.00 . A A . 5 VAL CG2 1 1 8 1611 1 1 5 VAL H H 9.301 6.487 -8.530 1.00 . A A . 5 VAL H 1 1 8 1612 1 1 5 VAL HA H 7.803 7.652 -10.618 1.00 . A A . 5 VAL HA 1 1 8 1613 1 1 5 VAL HB H 10.688 6.777 -10.760 1.00 . A A . 5 VAL HB 1 1 8 1614 1 1 5 VAL HG11 H 10.168 9.229 -12.083 1.00 . A A . 5 VAL HG11 1 1 8 1615 1 1 5 VAL HG12 H 10.668 7.689 -12.783 1.00 . A A . 5 VAL HG12 1 1 8 1616 1 1 5 VAL HG13 H 8.953 8.063 -12.607 1.00 . A A . 5 VAL HG13 1 1 8 1617 1 1 5 VAL HG21 H 9.386 8.906 -9.217 1.00 . A A . 5 VAL HG21 1 1 8 1618 1 1 5 VAL HG22 H 10.961 8.144 -8.996 1.00 . A A . 5 VAL HG22 1 1 8 1619 1 1 5 VAL HG23 H 10.763 9.432 -10.185 1.00 . A A . 5 VAL HG23 1 1 8 1620 1 1 5 VAL N N 8.497 6.450 -9.088 1.00 . A A . 5 VAL N 1 1 8 1621 1 1 5 VAL O O 9.084 4.779 -11.458 1.00 . A A . 5 VAL O 1 1 8 1622 1 1 6 ILE C C 7.747 5.036 -14.519 1.00 . A A . 6 ILE C 1 1 8 1623 1 1 6 ILE CA C 6.954 4.848 -13.230 1.00 . A A . 6 ILE CA 1 1 8 1624 1 1 6 ILE CB C 5.450 4.852 -13.560 1.00 . A A . 6 ILE CB 1 1 8 1625 1 1 6 ILE CD1 C 3.134 4.601 -12.534 1.00 . A A . 6 ILE CD1 1 1 8 1626 1 1 6 ILE CG1 C 4.628 4.585 -12.297 1.00 . A A . 6 ILE CG1 1 1 8 1627 1 1 6 ILE CG2 C 5.140 3.816 -14.629 1.00 . A A . 6 ILE CG2 1 1 8 1628 1 1 6 ILE H H 6.728 6.680 -12.193 1.00 . A A . 6 ILE H 1 1 8 1629 1 1 6 ILE HA H 7.206 3.889 -12.801 1.00 . A A . 6 ILE HA 1 1 8 1630 1 1 6 ILE HB H 5.192 5.825 -13.950 1.00 . A A . 6 ILE HB 1 1 8 1631 1 1 6 ILE HD11 H 2.867 3.797 -13.204 1.00 . A A . 6 ILE HD11 1 1 8 1632 1 1 6 ILE HD12 H 2.619 4.472 -11.594 1.00 . A A . 6 ILE HD12 1 1 8 1633 1 1 6 ILE HD13 H 2.849 5.545 -12.974 1.00 . A A . 6 ILE HD13 1 1 8 1634 1 1 6 ILE HG12 H 4.890 3.617 -11.902 1.00 . A A . 6 ILE HG12 1 1 8 1635 1 1 6 ILE HG13 H 4.856 5.343 -11.561 1.00 . A A . 6 ILE HG13 1 1 8 1636 1 1 6 ILE HG21 H 5.642 4.084 -15.547 1.00 . A A . 6 ILE HG21 1 1 8 1637 1 1 6 ILE HG22 H 5.484 2.846 -14.301 1.00 . A A . 6 ILE HG22 1 1 8 1638 1 1 6 ILE HG23 H 4.074 3.781 -14.799 1.00 . A A . 6 ILE HG23 1 1 8 1639 1 1 6 ILE N N 7.288 5.878 -12.253 1.00 . A A . 6 ILE N 1 1 8 1640 1 1 6 ILE O O 7.920 4.096 -15.295 1.00 . A A . 6 ILE O 1 1 8 1641 1 1 7 TRP C C 10.136 5.561 -16.124 1.00 . A A . 7 TRP C 1 1 8 1642 1 1 7 TRP CA C 9.004 6.565 -15.934 1.00 . A A . 7 TRP CA 1 1 8 1643 1 1 7 TRP CB C 9.572 7.982 -15.844 1.00 . A A . 7 TRP CB 1 1 8 1644 1 1 7 TRP CD1 C 11.831 8.873 -16.664 1.00 . A A . 7 TRP CD1 1 1 8 1645 1 1 7 TRP CD2 C 10.566 7.956 -18.269 1.00 . A A . 7 TRP CD2 1 1 8 1646 1 1 7 TRP CE2 C 11.770 8.402 -18.846 1.00 . A A . 7 TRP CE2 1 1 8 1647 1 1 7 TRP CE3 C 9.613 7.342 -19.087 1.00 . A A . 7 TRP CE3 1 1 8 1648 1 1 7 TRP CG C 10.625 8.266 -16.872 1.00 . A A . 7 TRP CG 1 1 8 1649 1 1 7 TRP CH2 C 11.093 7.651 -20.981 1.00 . A A . 7 TRP CH2 1 1 8 1650 1 1 7 TRP CZ2 C 12.044 8.255 -20.204 1.00 . A A . 7 TRP CZ2 1 1 8 1651 1 1 7 TRP CZ3 C 9.886 7.197 -20.433 1.00 . A A . 7 TRP CZ3 1 1 8 1652 1 1 7 TRP H H 8.056 6.962 -14.083 1.00 . A A . 7 TRP H 1 1 8 1653 1 1 7 TRP HA H 8.340 6.506 -16.784 1.00 . A A . 7 TRP HA 1 1 8 1654 1 1 7 TRP HB2 H 8.772 8.693 -15.982 1.00 . A A . 7 TRP HB2 1 1 8 1655 1 1 7 TRP HB3 H 10.012 8.124 -14.867 1.00 . A A . 7 TRP HB3 1 1 8 1656 1 1 7 TRP HD1 H 12.175 9.230 -15.705 1.00 . A A . 7 TRP HD1 1 1 8 1657 1 1 7 TRP HE1 H 13.415 9.353 -17.957 1.00 . A A . 7 TRP HE1 1 1 8 1658 1 1 7 TRP HE3 H 8.677 6.986 -18.683 1.00 . A A . 7 TRP HE3 1 1 8 1659 1 1 7 TRP HH2 H 11.264 7.518 -22.038 1.00 . A A . 7 TRP HH2 1 1 8 1660 1 1 7 TRP HZ2 H 12.970 8.600 -20.641 1.00 . A A . 7 TRP HZ2 1 1 8 1661 1 1 7 TRP HZ3 H 9.162 6.726 -21.081 1.00 . A A . 7 TRP HZ3 1 1 8 1662 1 1 7 TRP N N 8.227 6.254 -14.739 1.00 . A A . 7 TRP N 1 1 8 1663 1 1 7 TRP NE1 N 12.524 8.959 -17.847 1.00 . A A . 7 TRP NE1 1 1 8 1664 1 1 7 TRP O O 10.494 5.219 -17.251 1.00 . A A . 7 TRP O 1 1 8 1665 1 1 8 LYS C C 11.262 2.724 -15.363 1.00 . A A . 8 LYS C 1 1 8 1666 1 1 8 LYS CA C 11.787 4.124 -15.058 1.00 . A A . 8 LYS CA 1 1 8 1667 1 1 8 LYS CB C 12.544 4.118 -13.728 1.00 . A A . 8 LYS CB 1 1 8 1668 1 1 8 LYS CD C 12.001 4.374 -11.289 1.00 . A A . 8 LYS CD 1 1 8 1669 1 1 8 LYS CE C 13.365 4.029 -10.712 1.00 . A A . 8 LYS CE 1 1 8 1670 1 1 8 LYS CG C 11.722 3.595 -12.563 1.00 . A A . 8 LYS CG 1 1 8 1671 1 1 8 LYS H H 10.366 5.400 -14.145 1.00 . A A . 8 LYS H 1 1 8 1672 1 1 8 LYS HA H 12.462 4.421 -15.846 1.00 . A A . 8 LYS HA 1 1 8 1673 1 1 8 LYS HB2 H 13.422 3.497 -13.830 1.00 . A A . 8 LYS HB2 1 1 8 1674 1 1 8 LYS HB3 H 12.852 5.128 -13.499 1.00 . A A . 8 LYS HB3 1 1 8 1675 1 1 8 LYS HD2 H 11.973 5.431 -11.510 1.00 . A A . 8 LYS HD2 1 1 8 1676 1 1 8 LYS HD3 H 11.240 4.138 -10.559 1.00 . A A . 8 LYS HD3 1 1 8 1677 1 1 8 LYS HE2 H 14.106 4.125 -11.491 1.00 . A A . 8 LYS HE2 1 1 8 1678 1 1 8 LYS HE3 H 13.590 4.722 -9.914 1.00 . A A . 8 LYS HE3 1 1 8 1679 1 1 8 LYS HG2 H 10.673 3.684 -12.805 1.00 . A A . 8 LYS HG2 1 1 8 1680 1 1 8 LYS HG3 H 11.968 2.555 -12.399 1.00 . A A . 8 LYS HG3 1 1 8 1681 1 1 8 LYS HZ1 H 13.998 2.605 -9.320 1.00 . A A . 8 LYS HZ1 1 1 8 1682 1 1 8 LYS HZ2 H 12.444 2.325 -9.929 1.00 . A A . 8 LYS HZ2 1 1 8 1683 1 1 8 LYS HZ3 H 13.800 1.993 -10.885 1.00 . A A . 8 LYS HZ3 1 1 8 1684 1 1 8 LYS N N 10.696 5.090 -15.015 1.00 . A A . 8 LYS N 1 1 8 1685 1 1 8 LYS NZ N 13.405 2.641 -10.174 1.00 . A A . 8 LYS NZ 1 1 8 1686 1 1 8 LYS O O 11.931 1.931 -16.024 1.00 . A A . 8 LYS O 1 1 8 1687 1 1 9 SER C C 9.451 0.764 -16.578 1.00 . A A . 9 SER C 1 1 8 1688 1 1 9 SER CA C 9.447 1.124 -15.096 1.00 . A A . 9 SER CA 1 1 8 1689 1 1 9 SER CB C 8.014 1.115 -14.561 1.00 . A A . 9 SER CB 1 1 8 1690 1 1 9 SER H H 9.576 3.105 -14.358 1.00 . A A . 9 SER H 1 1 8 1691 1 1 9 SER HA H 10.028 0.391 -14.557 1.00 . A A . 9 SER HA 1 1 8 1692 1 1 9 SER HB2 H 7.816 2.046 -14.052 1.00 . A A . 9 SER HB2 1 1 8 1693 1 1 9 SER HB3 H 7.325 1.002 -15.386 1.00 . A A . 9 SER HB3 1 1 8 1694 1 1 9 SER HG H 7.114 -0.523 -13.974 1.00 . A A . 9 SER HG 1 1 8 1695 1 1 9 SER N N 10.060 2.429 -14.877 1.00 . A A . 9 SER N 1 1 8 1696 1 1 9 SER O O 9.628 -0.398 -16.946 1.00 . A A . 9 SER O 1 1 8 1697 1 1 9 SER OG O 7.816 0.046 -13.651 1.00 . A A . 9 SER OG 1 1 8 1698 1 1 10 PHE C C 10.523 2.061 -19.510 1.00 . A A . 10 PHE C 1 1 8 1699 1 1 10 PHE CA C 9.233 1.559 -18.869 1.00 . A A . 10 PHE CA 1 1 8 1700 1 1 10 PHE CB C 8.030 2.270 -19.492 1.00 . A A . 10 PHE CB 1 1 8 1701 1 1 10 PHE CD1 C 6.197 1.817 -17.839 1.00 . A A . 10 PHE CD1 1 1 8 1702 1 1 10 PHE CD2 C 5.985 0.922 -20.039 1.00 . A A . 10 PHE CD2 1 1 8 1703 1 1 10 PHE CE1 C 4.983 1.255 -17.490 1.00 . A A . 10 PHE CE1 1 1 8 1704 1 1 10 PHE CE2 C 4.771 0.358 -19.696 1.00 . A A . 10 PHE CE2 1 1 8 1705 1 1 10 PHE CG C 6.711 1.657 -19.116 1.00 . A A . 10 PHE CG 1 1 8 1706 1 1 10 PHE CZ C 4.270 0.524 -18.419 1.00 . A A . 10 PHE CZ 1 1 8 1707 1 1 10 PHE H H 9.118 2.673 -17.072 1.00 . A A . 10 PHE H 1 1 8 1708 1 1 10 PHE HA H 9.146 0.498 -19.047 1.00 . A A . 10 PHE HA 1 1 8 1709 1 1 10 PHE HB2 H 8.022 3.299 -19.167 1.00 . A A . 10 PHE HB2 1 1 8 1710 1 1 10 PHE HB3 H 8.119 2.236 -20.567 1.00 . A A . 10 PHE HB3 1 1 8 1711 1 1 10 PHE HD1 H 6.754 2.389 -17.111 1.00 . A A . 10 PHE HD1 1 1 8 1712 1 1 10 PHE HD2 H 6.377 0.790 -21.037 1.00 . A A . 10 PHE HD2 1 1 8 1713 1 1 10 PHE HE1 H 4.594 1.387 -16.491 1.00 . A A . 10 PHE HE1 1 1 8 1714 1 1 10 PHE HE2 H 4.216 -0.213 -20.424 1.00 . A A . 10 PHE HE2 1 1 8 1715 1 1 10 PHE HZ H 3.321 0.085 -18.149 1.00 . A A . 10 PHE HZ 1 1 8 1716 1 1 10 PHE N N 9.254 1.768 -17.426 1.00 . A A . 10 PHE N 1 1 8 1717 1 1 10 PHE O O 11.112 1.389 -20.358 1.00 . A A . 10 PHE O 1 1 8 1718 1 1 11 LEU C C 12.172 3.821 -21.158 1.00 . A A . 11 LEU C 1 1 8 1719 1 1 11 LEU CA C 12.178 3.842 -19.633 1.00 . A A . 11 LEU CA 1 1 8 1720 1 1 11 LEU CB C 13.405 3.096 -19.106 1.00 . A A . 11 LEU CB 1 1 8 1721 1 1 11 LEU CD1 C 15.653 3.116 -17.997 1.00 . A A . 11 LEU CD1 1 1 8 1722 1 1 11 LEU CD2 C 15.150 4.746 -19.827 1.00 . A A . 11 LEU CD2 1 1 8 1723 1 1 11 LEU CG C 14.576 3.968 -18.652 1.00 . A A . 11 LEU CG 1 1 8 1724 1 1 11 LEU H H 10.446 3.736 -18.422 1.00 . A A . 11 LEU H 1 1 8 1725 1 1 11 LEU HA H 12.220 4.868 -19.300 1.00 . A A . 11 LEU HA 1 1 8 1726 1 1 11 LEU HB2 H 13.092 2.499 -18.264 1.00 . A A . 11 LEU HB2 1 1 8 1727 1 1 11 LEU HB3 H 13.760 2.447 -19.894 1.00 . A A . 11 LEU HB3 1 1 8 1728 1 1 11 LEU HD11 H 15.382 2.919 -16.971 1.00 . A A . 11 LEU HD11 1 1 8 1729 1 1 11 LEU HD12 H 15.747 2.182 -18.531 1.00 . A A . 11 LEU HD12 1 1 8 1730 1 1 11 LEU HD13 H 16.595 3.643 -18.026 1.00 . A A . 11 LEU HD13 1 1 8 1731 1 1 11 LEU HD21 H 15.732 5.577 -19.459 1.00 . A A . 11 LEU HD21 1 1 8 1732 1 1 11 LEU HD22 H 15.782 4.096 -20.415 1.00 . A A . 11 LEU HD22 1 1 8 1733 1 1 11 LEU HD23 H 14.343 5.115 -20.443 1.00 . A A . 11 LEU HD23 1 1 8 1734 1 1 11 LEU HG H 14.224 4.680 -17.919 1.00 . A A . 11 LEU HG 1 1 8 1735 1 1 11 LEU N N 10.957 3.248 -19.100 1.00 . A A . 11 LEU N 1 1 8 1736 1 1 11 LEU O O 11.150 4.091 -21.789 1.00 . A A . 11 LEU O 1 1 9 1737 1 1 1 LYS C C 3.077 2.358 -0.962 1.00 . A A . 1 LYS C 1 1 9 1738 1 1 1 LYS CA C 2.295 3.325 -0.079 1.00 . A A . 1 LYS CA 1 1 9 1739 1 1 1 LYS CB C 3.169 4.530 0.275 1.00 . A A . 1 LYS CB 1 1 9 1740 1 1 1 LYS CD C 2.112 6.700 -0.419 1.00 . A A . 1 LYS CD 1 1 9 1741 1 1 1 LYS CE C 2.613 8.091 -0.779 1.00 . A A . 1 LYS CE 1 1 9 1742 1 1 1 LYS CG C 3.136 5.633 -0.769 1.00 . A A . 1 LYS CG 1 1 9 1743 1 1 1 LYS H1 H 1.416 3.199 1.843 1.00 . A A . 1 LYS H1 1 1 9 1744 1 1 1 LYS HA H 1.427 3.668 -0.622 1.00 . A A . 1 LYS HA 1 1 9 1745 1 1 1 LYS HB2 H 2.831 4.942 1.214 1.00 . A A . 1 LYS HB2 1 1 9 1746 1 1 1 LYS HB3 H 4.192 4.198 0.384 1.00 . A A . 1 LYS HB3 1 1 9 1747 1 1 1 LYS HD2 H 1.201 6.506 -0.965 1.00 . A A . 1 LYS HD2 1 1 9 1748 1 1 1 LYS HD3 H 1.913 6.662 0.642 1.00 . A A . 1 LYS HD3 1 1 9 1749 1 1 1 LYS HE2 H 3.683 8.121 -0.643 1.00 . A A . 1 LYS HE2 1 1 9 1750 1 1 1 LYS HE3 H 2.375 8.288 -1.814 1.00 . A A . 1 LYS HE3 1 1 9 1751 1 1 1 LYS HG2 H 4.112 6.091 -0.827 1.00 . A A . 1 LYS HG2 1 1 9 1752 1 1 1 LYS HG3 H 2.880 5.202 -1.727 1.00 . A A . 1 LYS HG3 1 1 9 1753 1 1 1 LYS HZ1 H 0.978 9.237 -0.164 1.00 . A A . 1 LYS HZ1 1 1 9 1754 1 1 1 LYS HZ2 H 2.076 8.890 1.075 1.00 . A A . 1 LYS HZ2 1 1 9 1755 1 1 1 LYS HZ3 H 2.456 10.057 -0.090 1.00 . A A . 1 LYS HZ3 1 1 9 1756 1 1 1 LYS N N 1.831 2.663 1.135 1.00 . A A . 1 LYS N 1 1 9 1757 1 1 1 LYS NZ N 1.987 9.142 0.070 1.00 . A A . 1 LYS NZ 1 1 9 1758 1 1 1 LYS O O 4.216 2.004 -0.656 1.00 . A A . 1 LYS O 1 1 9 1759 1 1 2 PHE C C 2.909 1.466 -4.430 1.00 . A A . 2 PHE C 1 1 9 1760 1 1 2 PHE CA C 3.097 1.007 -2.987 1.00 . A A . 2 PHE CA 1 1 9 1761 1 1 2 PHE CB C 2.526 -0.401 -2.809 1.00 . A A . 2 PHE CB 1 1 9 1762 1 1 2 PHE CD1 C 3.916 -1.702 -1.175 1.00 . A A . 2 PHE CD1 1 1 9 1763 1 1 2 PHE CD2 C 1.842 -0.795 -0.427 1.00 . A A . 2 PHE CD2 1 1 9 1764 1 1 2 PHE CE1 C 4.141 -2.234 0.081 1.00 . A A . 2 PHE CE1 1 1 9 1765 1 1 2 PHE CE2 C 2.061 -1.323 0.831 1.00 . A A . 2 PHE CE2 1 1 9 1766 1 1 2 PHE CG C 2.766 -0.977 -1.443 1.00 . A A . 2 PHE CG 1 1 9 1767 1 1 2 PHE CZ C 3.211 -2.045 1.085 1.00 . A A . 2 PHE CZ 1 1 9 1768 1 1 2 PHE H H 1.550 2.251 -2.249 1.00 . A A . 2 PHE H 1 1 9 1769 1 1 2 PHE HA H 4.152 0.989 -2.762 1.00 . A A . 2 PHE HA 1 1 9 1770 1 1 2 PHE HB2 H 1.459 -0.373 -2.973 1.00 . A A . 2 PHE HB2 1 1 9 1771 1 1 2 PHE HB3 H 2.980 -1.060 -3.533 1.00 . A A . 2 PHE HB3 1 1 9 1772 1 1 2 PHE HD1 H 4.644 -1.851 -1.960 1.00 . A A . 2 PHE HD1 1 1 9 1773 1 1 2 PHE HD2 H 0.941 -0.232 -0.624 1.00 . A A . 2 PHE HD2 1 1 9 1774 1 1 2 PHE HE1 H 5.041 -2.797 0.276 1.00 . A A . 2 PHE HE1 1 1 9 1775 1 1 2 PHE HE2 H 1.333 -1.174 1.614 1.00 . A A . 2 PHE HE2 1 1 9 1776 1 1 2 PHE HZ H 3.385 -2.458 2.067 1.00 . A A . 2 PHE HZ 1 1 9 1777 1 1 2 PHE N N 2.458 1.933 -2.059 1.00 . A A . 2 PHE N 1 1 9 1778 1 1 2 PHE O O 2.959 0.662 -5.361 1.00 . A A . 2 PHE O 1 1 9 1779 1 1 3 LYS C C 3.698 4.176 -6.349 1.00 . A A . 3 LYS C 1 1 9 1780 1 1 3 LYS CA C 2.496 3.334 -5.936 1.00 . A A . 3 LYS CA 1 1 9 1781 1 1 3 LYS CB C 1.227 4.188 -5.965 1.00 . A A . 3 LYS CB 1 1 9 1782 1 1 3 LYS CD C -0.043 5.669 -4.383 1.00 . A A . 3 LYS CD 1 1 9 1783 1 1 3 LYS CE C -0.245 4.765 -3.176 1.00 . A A . 3 LYS CE 1 1 9 1784 1 1 3 LYS CG C 1.292 5.405 -5.059 1.00 . A A . 3 LYS CG 1 1 9 1785 1 1 3 LYS H H 2.662 3.356 -3.825 1.00 . A A . 3 LYS H 1 1 9 1786 1 1 3 LYS HA H 2.387 2.517 -6.633 1.00 . A A . 3 LYS HA 1 1 9 1787 1 1 3 LYS HB2 H 1.059 4.527 -6.977 1.00 . A A . 3 LYS HB2 1 1 9 1788 1 1 3 LYS HB3 H 0.390 3.579 -5.655 1.00 . A A . 3 LYS HB3 1 1 9 1789 1 1 3 LYS HD2 H -0.075 6.697 -4.056 1.00 . A A . 3 LYS HD2 1 1 9 1790 1 1 3 LYS HD3 H -0.838 5.489 -5.093 1.00 . A A . 3 LYS HD3 1 1 9 1791 1 1 3 LYS HE2 H 0.496 3.980 -3.203 1.00 . A A . 3 LYS HE2 1 1 9 1792 1 1 3 LYS HE3 H -0.117 5.351 -2.278 1.00 . A A . 3 LYS HE3 1 1 9 1793 1 1 3 LYS HG2 H 2.041 5.238 -4.299 1.00 . A A . 3 LYS HG2 1 1 9 1794 1 1 3 LYS HG3 H 1.562 6.269 -5.650 1.00 . A A . 3 LYS HG3 1 1 9 1795 1 1 3 LYS HZ1 H -2.308 4.836 -3.498 1.00 . A A . 3 LYS HZ1 1 1 9 1796 1 1 3 LYS HZ2 H -1.622 3.317 -3.787 1.00 . A A . 3 LYS HZ2 1 1 9 1797 1 1 3 LYS HZ3 H -1.851 3.853 -2.199 1.00 . A A . 3 LYS HZ3 1 1 9 1798 1 1 3 LYS N N 2.691 2.765 -4.607 1.00 . A A . 3 LYS N 1 1 9 1799 1 1 3 LYS NZ N -1.601 4.150 -3.164 1.00 . A A . 3 LYS NZ 1 1 9 1800 1 1 3 LYS O O 3.546 5.260 -6.913 1.00 . A A . 3 LYS O 1 1 9 1801 1 1 4 LYS C C 6.141 4.749 -7.889 1.00 . A A . 4 LYS C 1 1 9 1802 1 1 4 LYS CA C 6.124 4.375 -6.411 1.00 . A A . 4 LYS CA 1 1 9 1803 1 1 4 LYS CB C 7.342 3.509 -6.079 1.00 . A A . 4 LYS CB 1 1 9 1804 1 1 4 LYS CD C 7.833 1.055 -5.867 1.00 . A A . 4 LYS CD 1 1 9 1805 1 1 4 LYS CE C 9.263 1.302 -5.411 1.00 . A A . 4 LYS CE 1 1 9 1806 1 1 4 LYS CG C 7.341 2.163 -6.782 1.00 . A A . 4 LYS CG 1 1 9 1807 1 1 4 LYS H H 4.952 2.802 -5.615 1.00 . A A . 4 LYS H 1 1 9 1808 1 1 4 LYS HA H 6.164 5.279 -5.822 1.00 . A A . 4 LYS HA 1 1 9 1809 1 1 4 LYS HB2 H 8.236 4.042 -6.366 1.00 . A A . 4 LYS HB2 1 1 9 1810 1 1 4 LYS HB3 H 7.364 3.335 -5.013 1.00 . A A . 4 LYS HB3 1 1 9 1811 1 1 4 LYS HD2 H 7.194 1.008 -4.998 1.00 . A A . 4 LYS HD2 1 1 9 1812 1 1 4 LYS HD3 H 7.791 0.115 -6.399 1.00 . A A . 4 LYS HD3 1 1 9 1813 1 1 4 LYS HE2 H 9.854 0.426 -5.632 1.00 . A A . 4 LYS HE2 1 1 9 1814 1 1 4 LYS HE3 H 9.658 2.148 -5.953 1.00 . A A . 4 LYS HE3 1 1 9 1815 1 1 4 LYS HG2 H 6.335 1.933 -7.100 1.00 . A A . 4 LYS HG2 1 1 9 1816 1 1 4 LYS HG3 H 7.989 2.219 -7.646 1.00 . A A . 4 LYS HG3 1 1 9 1817 1 1 4 LYS HZ1 H 9.303 2.609 -3.782 1.00 . A A . 4 LYS HZ1 1 1 9 1818 1 1 4 LYS HZ2 H 8.542 1.133 -3.458 1.00 . A A . 4 LYS HZ2 1 1 9 1819 1 1 4 LYS HZ3 H 10.229 1.210 -3.561 1.00 . A A . 4 LYS HZ3 1 1 9 1820 1 1 4 LYS N N 4.894 3.671 -6.066 1.00 . A A . 4 LYS N 1 1 9 1821 1 1 4 LYS NZ N 9.340 1.583 -3.951 1.00 . A A . 4 LYS NZ 1 1 9 1822 1 1 4 LYS O O 5.359 4.224 -8.682 1.00 . A A . 4 LYS O 1 1 9 1823 1 1 5 VAL C C 8.468 5.623 -10.256 1.00 . A A . 5 VAL C 1 1 9 1824 1 1 5 VAL CA C 7.159 6.101 -9.639 1.00 . A A . 5 VAL CA 1 1 9 1825 1 1 5 VAL CB C 7.083 7.636 -9.746 1.00 . A A . 5 VAL CB 1 1 9 1826 1 1 5 VAL CG1 C 7.240 8.078 -11.193 1.00 . A A . 5 VAL CG1 1 1 9 1827 1 1 5 VAL CG2 C 5.774 8.147 -9.163 1.00 . A A . 5 VAL CG2 1 1 9 1828 1 1 5 VAL H H 7.634 6.042 -7.577 1.00 . A A . 5 VAL H 1 1 9 1829 1 1 5 VAL HA H 6.334 5.681 -10.196 1.00 . A A . 5 VAL HA 1 1 9 1830 1 1 5 VAL HB H 7.897 8.057 -9.174 1.00 . A A . 5 VAL HB 1 1 9 1831 1 1 5 VAL HG11 H 8.228 7.820 -11.543 1.00 . A A . 5 VAL HG11 1 1 9 1832 1 1 5 VAL HG12 H 6.500 7.582 -11.803 1.00 . A A . 5 VAL HG12 1 1 9 1833 1 1 5 VAL HG13 H 7.102 9.148 -11.259 1.00 . A A . 5 VAL HG13 1 1 9 1834 1 1 5 VAL HG21 H 5.687 7.823 -8.136 1.00 . A A . 5 VAL HG21 1 1 9 1835 1 1 5 VAL HG22 H 5.759 9.226 -9.202 1.00 . A A . 5 VAL HG22 1 1 9 1836 1 1 5 VAL HG23 H 4.947 7.754 -9.735 1.00 . A A . 5 VAL HG23 1 1 9 1837 1 1 5 VAL N N 7.038 5.659 -8.255 1.00 . A A . 5 VAL N 1 1 9 1838 1 1 5 VAL O O 9.524 5.693 -9.627 1.00 . A A . 5 VAL O 1 1 9 1839 1 1 6 ILE C C 9.479 4.941 -13.689 1.00 . A A . 6 ILE C 1 1 9 1840 1 1 6 ILE CA C 9.571 4.651 -12.195 1.00 . A A . 6 ILE CA 1 1 9 1841 1 1 6 ILE CB C 9.764 3.137 -11.988 1.00 . A A . 6 ILE CB 1 1 9 1842 1 1 6 ILE CD1 C 9.145 1.197 -10.462 1.00 . A A . 6 ILE CD1 1 1 9 1843 1 1 6 ILE CG1 C 8.907 2.647 -10.819 1.00 . A A . 6 ILE CG1 1 1 9 1844 1 1 6 ILE CG2 C 11.232 2.819 -11.746 1.00 . A A . 6 ILE CG2 1 1 9 1845 1 1 6 ILE H H 7.521 5.110 -11.940 1.00 . A A . 6 ILE H 1 1 9 1846 1 1 6 ILE HA H 10.434 5.162 -11.792 1.00 . A A . 6 ILE HA 1 1 9 1847 1 1 6 ILE HB H 9.454 2.631 -12.889 1.00 . A A . 6 ILE HB 1 1 9 1848 1 1 6 ILE HD11 H 8.486 0.912 -9.655 1.00 . A A . 6 ILE HD11 1 1 9 1849 1 1 6 ILE HD12 H 8.948 0.576 -11.324 1.00 . A A . 6 ILE HD12 1 1 9 1850 1 1 6 ILE HD13 H 10.171 1.066 -10.152 1.00 . A A . 6 ILE HD13 1 1 9 1851 1 1 6 ILE HG12 H 9.124 3.243 -9.947 1.00 . A A . 6 ILE HG12 1 1 9 1852 1 1 6 ILE HG13 H 7.863 2.759 -11.076 1.00 . A A . 6 ILE HG13 1 1 9 1853 1 1 6 ILE HG21 H 11.847 3.532 -12.275 1.00 . A A . 6 ILE HG21 1 1 9 1854 1 1 6 ILE HG22 H 11.443 2.876 -10.688 1.00 . A A . 6 ILE HG22 1 1 9 1855 1 1 6 ILE HG23 H 11.447 1.823 -12.103 1.00 . A A . 6 ILE HG23 1 1 9 1856 1 1 6 ILE N N 8.391 5.139 -11.491 1.00 . A A . 6 ILE N 1 1 9 1857 1 1 6 ILE O O 8.756 4.264 -14.419 1.00 . A A . 6 ILE O 1 1 9 1858 1 1 7 TRP C C 10.988 5.311 -16.381 1.00 . A A . 7 TRP C 1 1 9 1859 1 1 7 TRP CA C 10.220 6.329 -15.545 1.00 . A A . 7 TRP CA 1 1 9 1860 1 1 7 TRP CB C 10.835 7.718 -15.720 1.00 . A A . 7 TRP CB 1 1 9 1861 1 1 7 TRP CD1 C 9.722 9.175 -17.511 1.00 . A A . 7 TRP CD1 1 1 9 1862 1 1 7 TRP CD2 C 11.454 7.965 -18.253 1.00 . A A . 7 TRP CD2 1 1 9 1863 1 1 7 TRP CE2 C 10.937 8.715 -19.328 1.00 . A A . 7 TRP CE2 1 1 9 1864 1 1 7 TRP CE3 C 12.550 7.129 -18.482 1.00 . A A . 7 TRP CE3 1 1 9 1865 1 1 7 TRP CG C 10.664 8.275 -17.101 1.00 . A A . 7 TRP CG 1 1 9 1866 1 1 7 TRP CH2 C 12.551 7.824 -20.804 1.00 . A A . 7 TRP CH2 1 1 9 1867 1 1 7 TRP CZ2 C 11.478 8.651 -20.609 1.00 . A A . 7 TRP CZ2 1 1 9 1868 1 1 7 TRP CZ3 C 13.086 7.066 -19.755 1.00 . A A . 7 TRP CZ3 1 1 9 1869 1 1 7 TRP H H 10.773 6.453 -13.505 1.00 . A A . 7 TRP H 1 1 9 1870 1 1 7 TRP HA H 9.194 6.354 -15.883 1.00 . A A . 7 TRP HA 1 1 9 1871 1 1 7 TRP HB2 H 10.369 8.401 -15.025 1.00 . A A . 7 TRP HB2 1 1 9 1872 1 1 7 TRP HB3 H 11.893 7.664 -15.510 1.00 . A A . 7 TRP HB3 1 1 9 1873 1 1 7 TRP HD1 H 8.969 9.603 -16.867 1.00 . A A . 7 TRP HD1 1 1 9 1874 1 1 7 TRP HE1 H 9.327 10.059 -19.375 1.00 . A A . 7 TRP HE1 1 1 9 1875 1 1 7 TRP HE3 H 12.978 6.537 -17.686 1.00 . A A . 7 TRP HE3 1 1 9 1876 1 1 7 TRP HH2 H 13.001 7.744 -21.782 1.00 . A A . 7 TRP HH2 1 1 9 1877 1 1 7 TRP HZ2 H 11.077 9.229 -21.428 1.00 . A A . 7 TRP HZ2 1 1 9 1878 1 1 7 TRP HZ3 H 13.933 6.425 -19.951 1.00 . A A . 7 TRP HZ3 1 1 9 1879 1 1 7 TRP N N 10.217 5.950 -14.137 1.00 . A A . 7 TRP N 1 1 9 1880 1 1 7 TRP NE1 N 9.880 9.444 -18.849 1.00 . A A . 7 TRP NE1 1 1 9 1881 1 1 7 TRP O O 10.580 4.968 -17.490 1.00 . A A . 7 TRP O 1 1 9 1882 1 1 8 LYS C C 12.092 2.659 -16.993 1.00 . A A . 8 LYS C 1 1 9 1883 1 1 8 LYS CA C 12.929 3.850 -16.536 1.00 . A A . 8 LYS CA 1 1 9 1884 1 1 8 LYS CB C 14.063 3.371 -15.627 1.00 . A A . 8 LYS CB 1 1 9 1885 1 1 8 LYS CD C 14.833 4.511 -13.525 1.00 . A A . 8 LYS CD 1 1 9 1886 1 1 8 LYS CE C 15.788 3.492 -12.922 1.00 . A A . 8 LYS CE 1 1 9 1887 1 1 8 LYS CG C 14.893 4.501 -15.043 1.00 . A A . 8 LYS CG 1 1 9 1888 1 1 8 LYS H H 12.378 5.143 -14.953 1.00 . A A . 8 LYS H 1 1 9 1889 1 1 8 LYS HA H 13.354 4.330 -17.405 1.00 . A A . 8 LYS HA 1 1 9 1890 1 1 8 LYS HB2 H 13.639 2.805 -14.811 1.00 . A A . 8 LYS HB2 1 1 9 1891 1 1 8 LYS HB3 H 14.719 2.729 -16.197 1.00 . A A . 8 LYS HB3 1 1 9 1892 1 1 8 LYS HD2 H 15.102 5.494 -13.168 1.00 . A A . 8 LYS HD2 1 1 9 1893 1 1 8 LYS HD3 H 13.825 4.276 -13.212 1.00 . A A . 8 LYS HD3 1 1 9 1894 1 1 8 LYS HE2 H 16.567 3.282 -13.638 1.00 . A A . 8 LYS HE2 1 1 9 1895 1 1 8 LYS HE3 H 16.224 3.912 -12.028 1.00 . A A . 8 LYS HE3 1 1 9 1896 1 1 8 LYS HG2 H 15.921 4.378 -15.351 1.00 . A A . 8 LYS HG2 1 1 9 1897 1 1 8 LYS HG3 H 14.515 5.443 -15.415 1.00 . A A . 8 LYS HG3 1 1 9 1898 1 1 8 LYS HZ1 H 14.161 2.424 -12.164 1.00 . A A . 8 LYS HZ1 1 1 9 1899 1 1 8 LYS HZ2 H 14.968 1.637 -13.425 1.00 . A A . 8 LYS HZ2 1 1 9 1900 1 1 8 LYS HZ3 H 15.657 1.686 -11.880 1.00 . A A . 8 LYS HZ3 1 1 9 1901 1 1 8 LYS N N 12.104 4.831 -15.842 1.00 . A A . 8 LYS N 1 1 9 1902 1 1 8 LYS NZ N 15.095 2.221 -12.573 1.00 . A A . 8 LYS NZ 1 1 9 1903 1 1 8 LYS O O 12.335 2.089 -18.056 1.00 . A A . 8 LYS O 1 1 9 1904 1 1 9 SER C C 9.600 1.344 -17.879 1.00 . A A . 9 SER C 1 1 9 1905 1 1 9 SER CA C 10.233 1.167 -16.503 1.00 . A A . 9 SER CA 1 1 9 1906 1 1 9 SER CB C 9.141 1.023 -15.441 1.00 . A A . 9 SER CB 1 1 9 1907 1 1 9 SER H H 10.961 2.786 -15.349 1.00 . A A . 9 SER H 1 1 9 1908 1 1 9 SER HA H 10.837 0.271 -16.510 1.00 . A A . 9 SER HA 1 1 9 1909 1 1 9 SER HB2 H 9.445 0.286 -14.713 1.00 . A A . 9 SER HB2 1 1 9 1910 1 1 9 SER HB3 H 8.993 1.974 -14.950 1.00 . A A . 9 SER HB3 1 1 9 1911 1 1 9 SER HG H 7.221 1.227 -15.774 1.00 . A A . 9 SER HG 1 1 9 1912 1 1 9 SER N N 11.105 2.291 -16.183 1.00 . A A . 9 SER N 1 1 9 1913 1 1 9 SER O O 9.408 0.377 -18.617 1.00 . A A . 9 SER O 1 1 9 1914 1 1 9 SER OG O 7.916 0.612 -16.023 1.00 . A A . 9 SER OG 1 1 9 1915 1 1 10 PHE C C 9.729 3.076 -20.586 1.00 . A A . 10 PHE C 1 1 9 1916 1 1 10 PHE CA C 8.665 2.894 -19.507 1.00 . A A . 10 PHE CA 1 1 9 1917 1 1 10 PHE CB C 7.809 4.158 -19.400 1.00 . A A . 10 PHE CB 1 1 9 1918 1 1 10 PHE CD1 C 6.795 4.120 -17.105 1.00 . A A . 10 PHE CD1 1 1 9 1919 1 1 10 PHE CD2 C 5.367 3.759 -18.981 1.00 . A A . 10 PHE CD2 1 1 9 1920 1 1 10 PHE CE1 C 5.715 3.985 -16.253 1.00 . A A . 10 PHE CE1 1 1 9 1921 1 1 10 PHE CE2 C 4.284 3.623 -18.134 1.00 . A A . 10 PHE CE2 1 1 9 1922 1 1 10 PHE CG C 6.634 4.010 -18.477 1.00 . A A . 10 PHE CG 1 1 9 1923 1 1 10 PHE CZ C 4.458 3.735 -16.768 1.00 . A A . 10 PHE CZ 1 1 9 1924 1 1 10 PHE H H 9.456 3.317 -17.589 1.00 . A A . 10 PHE H 1 1 9 1925 1 1 10 PHE HA H 8.033 2.063 -19.778 1.00 . A A . 10 PHE HA 1 1 9 1926 1 1 10 PHE HB2 H 8.420 4.968 -19.031 1.00 . A A . 10 PHE HB2 1 1 9 1927 1 1 10 PHE HB3 H 7.434 4.413 -20.379 1.00 . A A . 10 PHE HB3 1 1 9 1928 1 1 10 PHE HD1 H 7.778 4.315 -16.701 1.00 . A A . 10 PHE HD1 1 1 9 1929 1 1 10 PHE HD2 H 5.230 3.671 -20.049 1.00 . A A . 10 PHE HD2 1 1 9 1930 1 1 10 PHE HE1 H 5.855 4.072 -15.186 1.00 . A A . 10 PHE HE1 1 1 9 1931 1 1 10 PHE HE2 H 3.302 3.428 -18.539 1.00 . A A . 10 PHE HE2 1 1 9 1932 1 1 10 PHE HZ H 3.613 3.629 -16.105 1.00 . A A . 10 PHE HZ 1 1 9 1933 1 1 10 PHE N N 9.278 2.588 -18.219 1.00 . A A . 10 PHE N 1 1 9 1934 1 1 10 PHE O O 9.544 2.664 -21.731 1.00 . A A . 10 PHE O 1 1 9 1935 1 1 11 LEU C C 11.425 4.581 -22.430 1.00 . A A . 11 LEU C 1 1 9 1936 1 1 11 LEU CA C 11.936 3.935 -21.146 1.00 . A A . 11 LEU CA 1 1 9 1937 1 1 11 LEU CB C 12.650 2.622 -21.472 1.00 . A A . 11 LEU CB 1 1 9 1938 1 1 11 LEU CD1 C 14.759 1.279 -21.658 1.00 . A A . 11 LEU CD1 1 1 9 1939 1 1 11 LEU CD2 C 14.665 3.593 -22.605 1.00 . A A . 11 LEU CD2 1 1 9 1940 1 1 11 LEU CG C 14.178 2.675 -21.492 1.00 . A A . 11 LEU CG 1 1 9 1941 1 1 11 LEU H H 10.931 4.003 -19.285 1.00 . A A . 11 LEU H 1 1 9 1942 1 1 11 LEU HA H 12.636 4.608 -20.673 1.00 . A A . 11 LEU HA 1 1 9 1943 1 1 11 LEU HB2 H 12.355 1.893 -20.733 1.00 . A A . 11 LEU HB2 1 1 9 1944 1 1 11 LEU HB3 H 12.316 2.298 -22.447 1.00 . A A . 11 LEU HB3 1 1 9 1945 1 1 11 LEU HD11 H 13.972 0.547 -21.551 1.00 . A A . 11 LEU HD11 1 1 9 1946 1 1 11 LEU HD12 H 15.205 1.189 -22.637 1.00 . A A . 11 LEU HD12 1 1 9 1947 1 1 11 LEU HD13 H 15.512 1.111 -20.902 1.00 . A A . 11 LEU HD13 1 1 9 1948 1 1 11 LEU HD21 H 14.598 3.077 -23.551 1.00 . A A . 11 LEU HD21 1 1 9 1949 1 1 11 LEU HD22 H 14.050 4.480 -22.634 1.00 . A A . 11 LEU HD22 1 1 9 1950 1 1 11 LEU HD23 H 15.691 3.871 -22.418 1.00 . A A . 11 LEU HD23 1 1 9 1951 1 1 11 LEU HG H 14.531 3.073 -20.551 1.00 . A A . 11 LEU HG 1 1 9 1952 1 1 11 LEU N N 10.842 3.697 -20.211 1.00 . A A . 11 LEU N 1 1 9 1953 1 1 11 LEU O O 11.040 5.750 -22.438 1.00 . A A . 11 LEU O 1 1 10 1954 1 1 1 LYS C C 3.560 2.958 -0.381 1.00 . A A . 1 LYS C 1 1 10 1955 1 1 1 LYS CA C 3.944 4.033 0.630 1.00 . A A . 1 LYS CA 1 1 10 1956 1 1 1 LYS CB C 5.455 4.006 0.871 1.00 . A A . 1 LYS CB 1 1 10 1957 1 1 1 LYS CD C 6.940 6.017 0.621 1.00 . A A . 1 LYS CD 1 1 10 1958 1 1 1 LYS CE C 6.831 7.520 0.822 1.00 . A A . 1 LYS CE 1 1 10 1959 1 1 1 LYS CG C 5.989 5.263 1.536 1.00 . A A . 1 LYS CG 1 1 10 1960 1 1 1 LYS H1 H 3.718 3.517 2.671 1.00 . A A . 1 LYS H1 1 1 10 1961 1 1 1 LYS HA H 3.670 4.999 0.233 1.00 . A A . 1 LYS HA 1 1 10 1962 1 1 1 LYS HB2 H 5.692 3.162 1.502 1.00 . A A . 1 LYS HB2 1 1 10 1963 1 1 1 LYS HB3 H 5.957 3.885 -0.078 1.00 . A A . 1 LYS HB3 1 1 10 1964 1 1 1 LYS HD2 H 7.952 5.709 0.836 1.00 . A A . 1 LYS HD2 1 1 10 1965 1 1 1 LYS HD3 H 6.700 5.781 -0.406 1.00 . A A . 1 LYS HD3 1 1 10 1966 1 1 1 LYS HE2 H 6.668 7.720 1.870 1.00 . A A . 1 LYS HE2 1 1 10 1967 1 1 1 LYS HE3 H 7.757 7.980 0.508 1.00 . A A . 1 LYS HE3 1 1 10 1968 1 1 1 LYS HG2 H 5.159 5.908 1.784 1.00 . A A . 1 LYS HG2 1 1 10 1969 1 1 1 LYS HG3 H 6.515 4.986 2.439 1.00 . A A . 1 LYS HG3 1 1 10 1970 1 1 1 LYS HZ1 H 6.072 8.815 -0.631 1.00 . A A . 1 LYS HZ1 1 1 10 1971 1 1 1 LYS HZ2 H 5.221 7.359 -0.500 1.00 . A A . 1 LYS HZ2 1 1 10 1972 1 1 1 LYS HZ3 H 5.026 8.562 0.674 1.00 . A A . 1 LYS HZ3 1 1 10 1973 1 1 1 LYS N N 3.229 3.846 1.887 1.00 . A A . 1 LYS N 1 1 10 1974 1 1 1 LYS NZ N 5.709 8.105 0.036 1.00 . A A . 1 LYS NZ 1 1 10 1975 1 1 1 LYS O O 4.118 1.860 -0.376 1.00 . A A . 1 LYS O 1 1 10 1976 1 1 2 PHE C C 2.161 2.987 -3.646 1.00 . A A . 2 PHE C 1 1 10 1977 1 1 2 PHE CA C 2.147 2.341 -2.264 1.00 . A A . 2 PHE CA 1 1 10 1978 1 1 2 PHE CB C 0.738 1.846 -1.934 1.00 . A A . 2 PHE CB 1 1 10 1979 1 1 2 PHE CD1 C 0.142 -0.576 -2.211 1.00 . A A . 2 PHE CD1 1 1 10 1980 1 1 2 PHE CD2 C 1.223 0.102 -0.197 1.00 . A A . 2 PHE CD2 1 1 10 1981 1 1 2 PHE CE1 C 0.107 -1.881 -1.758 1.00 . A A . 2 PHE CE1 1 1 10 1982 1 1 2 PHE CE2 C 1.191 -1.201 0.262 1.00 . A A . 2 PHE CE2 1 1 10 1983 1 1 2 PHE CG C 0.700 0.429 -1.438 1.00 . A A . 2 PHE CG 1 1 10 1984 1 1 2 PHE CZ C 0.631 -2.194 -0.519 1.00 . A A . 2 PHE CZ 1 1 10 1985 1 1 2 PHE H H 2.198 4.171 -1.200 1.00 . A A . 2 PHE H 1 1 10 1986 1 1 2 PHE HA H 2.823 1.500 -2.266 1.00 . A A . 2 PHE HA 1 1 10 1987 1 1 2 PHE HB2 H 0.313 2.477 -1.168 1.00 . A A . 2 PHE HB2 1 1 10 1988 1 1 2 PHE HB3 H 0.127 1.904 -2.822 1.00 . A A . 2 PHE HB3 1 1 10 1989 1 1 2 PHE HD1 H -0.269 -0.331 -3.181 1.00 . A A . 2 PHE HD1 1 1 10 1990 1 1 2 PHE HD2 H 1.661 0.877 0.415 1.00 . A A . 2 PHE HD2 1 1 10 1991 1 1 2 PHE HE1 H -0.332 -2.654 -2.371 1.00 . A A . 2 PHE HE1 1 1 10 1992 1 1 2 PHE HE2 H 1.601 -1.444 1.231 1.00 . A A . 2 PHE HE2 1 1 10 1993 1 1 2 PHE HZ H 0.605 -3.213 -0.163 1.00 . A A . 2 PHE HZ 1 1 10 1994 1 1 2 PHE N N 2.605 3.280 -1.247 1.00 . A A . 2 PHE N 1 1 10 1995 1 1 2 PHE O O 2.319 4.201 -3.776 1.00 . A A . 2 PHE O 1 1 10 1996 1 1 3 LYS C C 3.219 3.510 -6.332 1.00 . A A . 3 LYS C 1 1 10 1997 1 1 3 LYS CA C 1.987 2.656 -6.052 1.00 . A A . 3 LYS CA 1 1 10 1998 1 1 3 LYS CB C 0.718 3.469 -6.318 1.00 . A A . 3 LYS CB 1 1 10 1999 1 1 3 LYS CD C -0.779 1.453 -6.404 1.00 . A A . 3 LYS CD 1 1 10 2000 1 1 3 LYS CE C -1.933 0.724 -5.734 1.00 . A A . 3 LYS CE 1 1 10 2001 1 1 3 LYS CG C -0.545 2.819 -5.780 1.00 . A A . 3 LYS CG 1 1 10 2002 1 1 3 LYS H H 1.874 1.208 -4.511 1.00 . A A . 3 LYS H 1 1 10 2003 1 1 3 LYS HA H 2.000 1.799 -6.709 1.00 . A A . 3 LYS HA 1 1 10 2004 1 1 3 LYS HB2 H 0.824 4.439 -5.857 1.00 . A A . 3 LYS HB2 1 1 10 2005 1 1 3 LYS HB3 H 0.605 3.597 -7.385 1.00 . A A . 3 LYS HB3 1 1 10 2006 1 1 3 LYS HD2 H -1.008 1.580 -7.452 1.00 . A A . 3 LYS HD2 1 1 10 2007 1 1 3 LYS HD3 H 0.119 0.861 -6.300 1.00 . A A . 3 LYS HD3 1 1 10 2008 1 1 3 LYS HE2 H -1.729 -0.335 -5.747 1.00 . A A . 3 LYS HE2 1 1 10 2009 1 1 3 LYS HE3 H -2.010 1.063 -4.711 1.00 . A A . 3 LYS HE3 1 1 10 2010 1 1 3 LYS HG2 H -0.451 2.702 -4.711 1.00 . A A . 3 LYS HG2 1 1 10 2011 1 1 3 LYS HG3 H -1.389 3.456 -6.003 1.00 . A A . 3 LYS HG3 1 1 10 2012 1 1 3 LYS HZ1 H -3.724 1.772 -5.975 1.00 . A A . 3 LYS HZ1 1 1 10 2013 1 1 3 LYS HZ2 H -3.057 1.212 -7.426 1.00 . A A . 3 LYS HZ2 1 1 10 2014 1 1 3 LYS HZ3 H -3.830 0.132 -6.378 1.00 . A A . 3 LYS HZ3 1 1 10 2015 1 1 3 LYS N N 1.995 2.167 -4.678 1.00 . A A . 3 LYS N 1 1 10 2016 1 1 3 LYS NZ N -3.226 0.978 -6.427 1.00 . A A . 3 LYS NZ 1 1 10 2017 1 1 3 LYS O O 3.120 4.725 -6.501 1.00 . A A . 3 LYS O 1 1 10 2018 1 1 4 LYS C C 5.722 3.991 -8.108 1.00 . A A . 4 LYS C 1 1 10 2019 1 1 4 LYS CA C 5.633 3.566 -6.645 1.00 . A A . 4 LYS CA 1 1 10 2020 1 1 4 LYS CB C 6.824 2.674 -6.289 1.00 . A A . 4 LYS CB 1 1 10 2021 1 1 4 LYS CD C 7.999 0.488 -6.678 1.00 . A A . 4 LYS CD 1 1 10 2022 1 1 4 LYS CE C 7.697 -0.918 -7.172 1.00 . A A . 4 LYS CE 1 1 10 2023 1 1 4 LYS CG C 7.006 1.497 -7.231 1.00 . A A . 4 LYS CG 1 1 10 2024 1 1 4 LYS H H 4.396 1.896 -6.240 1.00 . A A . 4 LYS H 1 1 10 2025 1 1 4 LYS HA H 5.656 4.449 -6.024 1.00 . A A . 4 LYS HA 1 1 10 2026 1 1 4 LYS HB2 H 7.724 3.270 -6.312 1.00 . A A . 4 LYS HB2 1 1 10 2027 1 1 4 LYS HB3 H 6.683 2.289 -5.289 1.00 . A A . 4 LYS HB3 1 1 10 2028 1 1 4 LYS HD2 H 8.994 0.763 -6.996 1.00 . A A . 4 LYS HD2 1 1 10 2029 1 1 4 LYS HD3 H 7.948 0.501 -5.599 1.00 . A A . 4 LYS HD3 1 1 10 2030 1 1 4 LYS HE2 H 7.483 -1.546 -6.320 1.00 . A A . 4 LYS HE2 1 1 10 2031 1 1 4 LYS HE3 H 6.833 -0.881 -7.818 1.00 . A A . 4 LYS HE3 1 1 10 2032 1 1 4 LYS HG2 H 6.053 1.009 -7.371 1.00 . A A . 4 LYS HG2 1 1 10 2033 1 1 4 LYS HG3 H 7.369 1.862 -8.182 1.00 . A A . 4 LYS HG3 1 1 10 2034 1 1 4 LYS HZ1 H 9.571 -1.837 -7.265 1.00 . A A . 4 LYS HZ1 1 1 10 2035 1 1 4 LYS HZ2 H 8.519 -2.299 -8.507 1.00 . A A . 4 LYS HZ2 1 1 10 2036 1 1 4 LYS HZ3 H 9.262 -0.779 -8.549 1.00 . A A . 4 LYS HZ3 1 1 10 2037 1 1 4 LYS N N 4.381 2.867 -6.382 1.00 . A A . 4 LYS N 1 1 10 2038 1 1 4 LYS NZ N 8.842 -1.499 -7.926 1.00 . A A . 4 LYS NZ 1 1 10 2039 1 1 4 LYS O O 4.891 3.603 -8.929 1.00 . A A . 4 LYS O 1 1 10 2040 1 1 5 VAL C C 8.040 4.478 -10.490 1.00 . A A . 5 VAL C 1 1 10 2041 1 1 5 VAL CA C 6.936 5.263 -9.791 1.00 . A A . 5 VAL CA 1 1 10 2042 1 1 5 VAL CB C 7.290 6.762 -9.817 1.00 . A A . 5 VAL CB 1 1 10 2043 1 1 5 VAL CG1 C 7.323 7.278 -11.248 1.00 . A A . 5 VAL CG1 1 1 10 2044 1 1 5 VAL CG2 C 6.303 7.557 -8.977 1.00 . A A . 5 VAL CG2 1 1 10 2045 1 1 5 VAL H H 7.366 5.063 -7.728 1.00 . A A . 5 VAL H 1 1 10 2046 1 1 5 VAL HA H 6.011 5.124 -10.331 1.00 . A A . 5 VAL HA 1 1 10 2047 1 1 5 VAL HB H 8.275 6.885 -9.391 1.00 . A A . 5 VAL HB 1 1 10 2048 1 1 5 VAL HG11 H 6.948 8.290 -11.274 1.00 . A A . 5 VAL HG11 1 1 10 2049 1 1 5 VAL HG12 H 8.340 7.261 -11.613 1.00 . A A . 5 VAL HG12 1 1 10 2050 1 1 5 VAL HG13 H 6.706 6.649 -11.872 1.00 . A A . 5 VAL HG13 1 1 10 2051 1 1 5 VAL HG21 H 5.328 7.096 -9.035 1.00 . A A . 5 VAL HG21 1 1 10 2052 1 1 5 VAL HG22 H 6.634 7.571 -7.949 1.00 . A A . 5 VAL HG22 1 1 10 2053 1 1 5 VAL HG23 H 6.245 8.569 -9.351 1.00 . A A . 5 VAL HG23 1 1 10 2054 1 1 5 VAL N N 6.737 4.788 -8.427 1.00 . A A . 5 VAL N 1 1 10 2055 1 1 5 VAL O O 8.995 4.031 -9.855 1.00 . A A . 5 VAL O 1 1 10 2056 1 1 6 ILE C C 9.255 4.349 -13.856 1.00 . A A . 6 ILE C 1 1 10 2057 1 1 6 ILE CA C 8.890 3.586 -12.588 1.00 . A A . 6 ILE CA 1 1 10 2058 1 1 6 ILE CB C 8.379 2.185 -12.974 1.00 . A A . 6 ILE CB 1 1 10 2059 1 1 6 ILE CD1 C 6.335 1.852 -11.494 1.00 . A A . 6 ILE CD1 1 1 10 2060 1 1 6 ILE CG1 C 6.852 2.134 -12.887 1.00 . A A . 6 ILE CG1 1 1 10 2061 1 1 6 ILE CG2 C 9.001 1.127 -12.074 1.00 . A A . 6 ILE CG2 1 1 10 2062 1 1 6 ILE H H 7.119 4.695 -12.251 1.00 . A A . 6 ILE H 1 1 10 2063 1 1 6 ILE HA H 9.777 3.469 -11.982 1.00 . A A . 6 ILE HA 1 1 10 2064 1 1 6 ILE HB H 8.682 1.983 -13.990 1.00 . A A . 6 ILE HB 1 1 10 2065 1 1 6 ILE HD11 H 5.388 2.352 -11.354 1.00 . A A . 6 ILE HD11 1 1 10 2066 1 1 6 ILE HD12 H 6.202 0.788 -11.368 1.00 . A A . 6 ILE HD12 1 1 10 2067 1 1 6 ILE HD13 H 7.045 2.215 -10.766 1.00 . A A . 6 ILE HD13 1 1 10 2068 1 1 6 ILE HG12 H 6.448 3.082 -13.205 1.00 . A A . 6 ILE HG12 1 1 10 2069 1 1 6 ILE HG13 H 6.488 1.354 -13.541 1.00 . A A . 6 ILE HG13 1 1 10 2070 1 1 6 ILE HG21 H 8.846 1.398 -11.040 1.00 . A A . 6 ILE HG21 1 1 10 2071 1 1 6 ILE HG22 H 8.539 0.171 -12.270 1.00 . A A . 6 ILE HG22 1 1 10 2072 1 1 6 ILE HG23 H 10.060 1.063 -12.275 1.00 . A A . 6 ILE HG23 1 1 10 2073 1 1 6 ILE N N 7.903 4.315 -11.802 1.00 . A A . 6 ILE N 1 1 10 2074 1 1 6 ILE O O 8.542 4.285 -14.858 1.00 . A A . 6 ILE O 1 1 10 2075 1 1 7 TRP C C 11.478 4.938 -15.996 1.00 . A A . 7 TRP C 1 1 10 2076 1 1 7 TRP CA C 10.832 5.842 -14.953 1.00 . A A . 7 TRP CA 1 1 10 2077 1 1 7 TRP CB C 11.826 6.915 -14.504 1.00 . A A . 7 TRP CB 1 1 10 2078 1 1 7 TRP CD1 C 11.739 9.096 -15.846 1.00 . A A . 7 TRP CD1 1 1 10 2079 1 1 7 TRP CD2 C 13.217 7.599 -16.615 1.00 . A A . 7 TRP CD2 1 1 10 2080 1 1 7 TRP CE2 C 13.269 8.744 -17.435 1.00 . A A . 7 TRP CE2 1 1 10 2081 1 1 7 TRP CE3 C 14.061 6.524 -16.906 1.00 . A A . 7 TRP CE3 1 1 10 2082 1 1 7 TRP CG C 12.233 7.846 -15.605 1.00 . A A . 7 TRP CG 1 1 10 2083 1 1 7 TRP CH2 C 14.945 7.773 -18.787 1.00 . A A . 7 TRP CH2 1 1 10 2084 1 1 7 TRP CZ2 C 14.130 8.840 -18.525 1.00 . A A . 7 TRP CZ2 1 1 10 2085 1 1 7 TRP CZ3 C 14.915 6.622 -17.988 1.00 . A A . 7 TRP CZ3 1 1 10 2086 1 1 7 TRP H H 10.896 5.079 -12.979 1.00 . A A . 7 TRP H 1 1 10 2087 1 1 7 TRP HA H 9.972 6.324 -15.395 1.00 . A A . 7 TRP HA 1 1 10 2088 1 1 7 TRP HB2 H 11.378 7.504 -13.717 1.00 . A A . 7 TRP HB2 1 1 10 2089 1 1 7 TRP HB3 H 12.716 6.434 -14.126 1.00 . A A . 7 TRP HB3 1 1 10 2090 1 1 7 TRP HD1 H 10.974 9.572 -15.253 1.00 . A A . 7 TRP HD1 1 1 10 2091 1 1 7 TRP HE1 H 12.176 10.531 -17.317 1.00 . A A . 7 TRP HE1 1 1 10 2092 1 1 7 TRP HE3 H 14.053 5.629 -16.303 1.00 . A A . 7 TRP HE3 1 1 10 2093 1 1 7 TRP HH2 H 15.628 7.805 -19.622 1.00 . A A . 7 TRP HH2 1 1 10 2094 1 1 7 TRP HZ2 H 14.165 9.721 -19.149 1.00 . A A . 7 TRP HZ2 1 1 10 2095 1 1 7 TRP HZ3 H 15.575 5.801 -18.229 1.00 . A A . 7 TRP HZ3 1 1 10 2096 1 1 7 TRP N N 10.370 5.068 -13.807 1.00 . A A . 7 TRP N 1 1 10 2097 1 1 7 TRP NE1 N 12.357 9.642 -16.946 1.00 . A A . 7 TRP NE1 1 1 10 2098 1 1 7 TRP O O 11.337 5.160 -17.199 1.00 . A A . 7 TRP O 1 1 10 2099 1 1 8 LYS C C 11.849 2.285 -17.335 1.00 . A A . 8 LYS C 1 1 10 2100 1 1 8 LYS CA C 12.856 2.976 -16.421 1.00 . A A . 8 LYS CA 1 1 10 2101 1 1 8 LYS CB C 13.627 1.932 -15.611 1.00 . A A . 8 LYS CB 1 1 10 2102 1 1 8 LYS CD C 13.935 2.363 -13.156 1.00 . A A . 8 LYS CD 1 1 10 2103 1 1 8 LYS CE C 14.528 1.160 -12.439 1.00 . A A . 8 LYS CE 1 1 10 2104 1 1 8 LYS CG C 14.527 2.532 -14.545 1.00 . A A . 8 LYS CG 1 1 10 2105 1 1 8 LYS H H 12.264 3.791 -14.559 1.00 . A A . 8 LYS H 1 1 10 2106 1 1 8 LYS HA H 13.553 3.533 -17.029 1.00 . A A . 8 LYS HA 1 1 10 2107 1 1 8 LYS HB2 H 12.919 1.275 -15.127 1.00 . A A . 8 LYS HB2 1 1 10 2108 1 1 8 LYS HB3 H 14.240 1.352 -16.285 1.00 . A A . 8 LYS HB3 1 1 10 2109 1 1 8 LYS HD2 H 14.140 3.251 -12.576 1.00 . A A . 8 LYS HD2 1 1 10 2110 1 1 8 LYS HD3 H 12.866 2.228 -13.243 1.00 . A A . 8 LYS HD3 1 1 10 2111 1 1 8 LYS HE2 H 15.586 1.323 -12.305 1.00 . A A . 8 LYS HE2 1 1 10 2112 1 1 8 LYS HE3 H 14.054 1.063 -11.473 1.00 . A A . 8 LYS HE3 1 1 10 2113 1 1 8 LYS HG2 H 15.487 2.038 -14.577 1.00 . A A . 8 LYS HG2 1 1 10 2114 1 1 8 LYS HG3 H 14.655 3.586 -14.746 1.00 . A A . 8 LYS HG3 1 1 10 2115 1 1 8 LYS HZ1 H 14.514 -0.923 -12.601 1.00 . A A . 8 LYS HZ1 1 1 10 2116 1 1 8 LYS HZ2 H 13.344 -0.154 -13.551 1.00 . A A . 8 LYS HZ2 1 1 10 2117 1 1 8 LYS HZ3 H 14.968 -0.128 -14.024 1.00 . A A . 8 LYS HZ3 1 1 10 2118 1 1 8 LYS N N 12.188 3.916 -15.529 1.00 . A A . 8 LYS N 1 1 10 2119 1 1 8 LYS NZ N 14.324 -0.099 -13.208 1.00 . A A . 8 LYS NZ 1 1 10 2120 1 1 8 LYS O O 12.143 2.002 -18.497 1.00 . A A . 8 LYS O 1 1 10 2121 1 1 9 SER C C 9.308 2.128 -18.852 1.00 . A A . 9 SER C 1 1 10 2122 1 1 9 SER CA C 9.612 1.357 -17.571 1.00 . A A . 9 SER CA 1 1 10 2123 1 1 9 SER CB C 8.341 1.224 -16.729 1.00 . A A . 9 SER CB 1 1 10 2124 1 1 9 SER H H 10.487 2.267 -15.872 1.00 . A A . 9 SER H 1 1 10 2125 1 1 9 SER HA H 9.964 0.370 -17.834 1.00 . A A . 9 SER HA 1 1 10 2126 1 1 9 SER HB2 H 8.603 0.883 -15.739 1.00 . A A . 9 SER HB2 1 1 10 2127 1 1 9 SER HB3 H 7.855 2.186 -16.662 1.00 . A A . 9 SER HB3 1 1 10 2128 1 1 9 SER HG H 6.739 0.770 -17.760 1.00 . A A . 9 SER HG 1 1 10 2129 1 1 9 SER N N 10.661 2.017 -16.804 1.00 . A A . 9 SER N 1 1 10 2130 1 1 9 SER O O 9.020 1.537 -19.893 1.00 . A A . 9 SER O 1 1 10 2131 1 1 9 SER OG O 7.440 0.296 -17.308 1.00 . A A . 9 SER OG 1 1 10 2132 1 1 10 PHE C C 10.324 4.387 -20.832 1.00 . A A . 10 PHE C 1 1 10 2133 1 1 10 PHE CA C 9.105 4.307 -19.918 1.00 . A A . 10 PHE CA 1 1 10 2134 1 1 10 PHE CB C 8.707 5.710 -19.456 1.00 . A A . 10 PHE CB 1 1 10 2135 1 1 10 PHE CD1 C 7.317 5.909 -17.377 1.00 . A A . 10 PHE CD1 1 1 10 2136 1 1 10 PHE CD2 C 6.198 5.644 -19.466 1.00 . A A . 10 PHE CD2 1 1 10 2137 1 1 10 PHE CE1 C 6.098 5.952 -16.726 1.00 . A A . 10 PHE CE1 1 1 10 2138 1 1 10 PHE CE2 C 4.977 5.687 -18.820 1.00 . A A . 10 PHE CE2 1 1 10 2139 1 1 10 PHE CG C 7.381 5.756 -18.752 1.00 . A A . 10 PHE CG 1 1 10 2140 1 1 10 PHE CZ C 4.927 5.839 -17.448 1.00 . A A . 10 PHE CZ 1 1 10 2141 1 1 10 PHE H H 9.608 3.865 -17.909 1.00 . A A . 10 PHE H 1 1 10 2142 1 1 10 PHE HA H 8.285 3.872 -20.468 1.00 . A A . 10 PHE HA 1 1 10 2143 1 1 10 PHE HB2 H 9.456 6.084 -18.775 1.00 . A A . 10 PHE HB2 1 1 10 2144 1 1 10 PHE HB3 H 8.650 6.361 -20.316 1.00 . A A . 10 PHE HB3 1 1 10 2145 1 1 10 PHE HD1 H 8.233 5.997 -16.810 1.00 . A A . 10 PHE HD1 1 1 10 2146 1 1 10 PHE HD2 H 6.236 5.524 -20.539 1.00 . A A . 10 PHE HD2 1 1 10 2147 1 1 10 PHE HE1 H 6.063 6.071 -15.653 1.00 . A A . 10 PHE HE1 1 1 10 2148 1 1 10 PHE HE2 H 4.062 5.598 -19.388 1.00 . A A . 10 PHE HE2 1 1 10 2149 1 1 10 PHE HZ H 3.974 5.873 -16.942 1.00 . A A . 10 PHE HZ 1 1 10 2150 1 1 10 PHE N N 9.374 3.453 -18.767 1.00 . A A . 10 PHE N 1 1 10 2151 1 1 10 PHE O O 10.201 4.330 -22.056 1.00 . A A . 10 PHE O 1 1 10 2152 1 1 11 LEU C C 12.636 5.660 -22.087 1.00 . A A . 11 LEU C 1 1 10 2153 1 1 11 LEU CA C 12.743 4.609 -20.988 1.00 . A A . 11 LEU CA 1 1 10 2154 1 1 11 LEU CB C 13.089 3.249 -21.598 1.00 . A A . 11 LEU CB 1 1 10 2155 1 1 11 LEU CD1 C 14.726 1.391 -21.984 1.00 . A A . 11 LEU CD1 1 1 10 2156 1 1 11 LEU CD2 C 15.443 3.768 -22.288 1.00 . A A . 11 LEU CD2 1 1 10 2157 1 1 11 LEU CG C 14.554 2.821 -21.496 1.00 . A A . 11 LEU CG 1 1 10 2158 1 1 11 LEU H H 11.535 4.560 -19.251 1.00 . A A . 11 LEU H 1 1 10 2159 1 1 11 LEU HA H 13.528 4.898 -20.305 1.00 . A A . 11 LEU HA 1 1 10 2160 1 1 11 LEU HB2 H 12.491 2.502 -21.101 1.00 . A A . 11 LEU HB2 1 1 10 2161 1 1 11 LEU HB3 H 12.825 3.282 -22.646 1.00 . A A . 11 LEU HB3 1 1 10 2162 1 1 11 LEU HD11 H 13.799 0.852 -21.856 1.00 . A A . 11 LEU HD11 1 1 10 2163 1 1 11 LEU HD12 H 14.998 1.397 -23.029 1.00 . A A . 11 LEU HD12 1 1 10 2164 1 1 11 LEU HD13 H 15.505 0.907 -21.413 1.00 . A A . 11 LEU HD13 1 1 10 2165 1 1 11 LEU HD21 H 15.371 3.534 -23.340 1.00 . A A . 11 LEU HD21 1 1 10 2166 1 1 11 LEU HD22 H 15.123 4.786 -22.123 1.00 . A A . 11 LEU HD22 1 1 10 2167 1 1 11 LEU HD23 H 16.467 3.656 -21.964 1.00 . A A . 11 LEU HD23 1 1 10 2168 1 1 11 LEU HG H 14.862 2.859 -20.460 1.00 . A A . 11 LEU HG 1 1 10 2169 1 1 11 LEU N N 11.500 4.520 -20.229 1.00 . A A . 11 LEU N 1 1 10 2170 1 1 11 LEU O O 11.980 6.688 -21.916 1.00 . A A . 11 LEU O 1 1 11 2171 1 1 1 LYS C C 2.276 2.137 -0.731 1.00 . A A . 1 LYS C 1 1 11 2172 1 1 1 LYS CA C 1.198 1.187 -0.220 1.00 . A A . 1 LYS CA 1 1 11 2173 1 1 1 LYS CB C 1.803 0.205 0.786 1.00 . A A . 1 LYS CB 1 1 11 2174 1 1 1 LYS CD C 0.516 0.504 2.923 1.00 . A A . 1 LYS CD 1 1 11 2175 1 1 1 LYS CE C -0.973 0.631 3.205 1.00 . A A . 1 LYS CE 1 1 11 2176 1 1 1 LYS CG C 0.782 -0.402 1.732 1.00 . A A . 1 LYS CG 1 1 11 2177 1 1 1 LYS H1 H -0.367 0.623 -1.530 1.00 . A A . 1 LYS H1 1 1 11 2178 1 1 1 LYS HA H 0.429 1.764 0.270 1.00 . A A . 1 LYS HA 1 1 11 2179 1 1 1 LYS HB2 H 2.283 -0.596 0.245 1.00 . A A . 1 LYS HB2 1 1 11 2180 1 1 1 LYS HB3 H 2.545 0.725 1.376 1.00 . A A . 1 LYS HB3 1 1 11 2181 1 1 1 LYS HD2 H 1.002 0.091 3.794 1.00 . A A . 1 LYS HD2 1 1 11 2182 1 1 1 LYS HD3 H 0.919 1.485 2.714 1.00 . A A . 1 LYS HD3 1 1 11 2183 1 1 1 LYS HE2 H -1.411 1.290 2.470 1.00 . A A . 1 LYS HE2 1 1 11 2184 1 1 1 LYS HE3 H -1.426 -0.347 3.126 1.00 . A A . 1 LYS HE3 1 1 11 2185 1 1 1 LYS HG2 H -0.144 -0.557 1.198 1.00 . A A . 1 LYS HG2 1 1 11 2186 1 1 1 LYS HG3 H 1.156 -1.351 2.090 1.00 . A A . 1 LYS HG3 1 1 11 2187 1 1 1 LYS HZ1 H -0.337 1.384 5.046 1.00 . A A . 1 LYS HZ1 1 1 11 2188 1 1 1 LYS HZ2 H -1.788 2.057 4.495 1.00 . A A . 1 LYS HZ2 1 1 11 2189 1 1 1 LYS HZ3 H -1.770 0.489 5.131 1.00 . A A . 1 LYS HZ3 1 1 11 2190 1 1 1 LYS N N 0.578 0.462 -1.323 1.00 . A A . 1 LYS N 1 1 11 2191 1 1 1 LYS NZ N -1.236 1.179 4.564 1.00 . A A . 1 LYS NZ 1 1 11 2192 1 1 1 LYS O O 2.445 3.239 -0.208 1.00 . A A . 1 LYS O 1 1 11 2193 1 1 2 PHE C C 3.798 2.782 -3.817 1.00 . A A . 2 PHE C 1 1 11 2194 1 1 2 PHE CA C 4.065 2.516 -2.338 1.00 . A A . 2 PHE CA 1 1 11 2195 1 1 2 PHE CB C 5.418 1.823 -2.168 1.00 . A A . 2 PHE CB 1 1 11 2196 1 1 2 PHE CD1 C 6.810 2.798 -0.323 1.00 . A A . 2 PHE CD1 1 1 11 2197 1 1 2 PHE CD2 C 5.504 0.859 0.147 1.00 . A A . 2 PHE CD2 1 1 11 2198 1 1 2 PHE CE1 C 7.275 2.805 0.979 1.00 . A A . 2 PHE CE1 1 1 11 2199 1 1 2 PHE CE2 C 5.964 0.861 1.450 1.00 . A A . 2 PHE CE2 1 1 11 2200 1 1 2 PHE CG C 5.921 1.827 -0.753 1.00 . A A . 2 PHE CG 1 1 11 2201 1 1 2 PHE CZ C 6.852 1.834 1.866 1.00 . A A . 2 PHE CZ 1 1 11 2202 1 1 2 PHE H H 2.821 0.816 -2.130 1.00 . A A . 2 PHE H 1 1 11 2203 1 1 2 PHE HA H 4.085 3.459 -1.813 1.00 . A A . 2 PHE HA 1 1 11 2204 1 1 2 PHE HB2 H 5.329 0.794 -2.486 1.00 . A A . 2 PHE HB2 1 1 11 2205 1 1 2 PHE HB3 H 6.150 2.323 -2.784 1.00 . A A . 2 PHE HB3 1 1 11 2206 1 1 2 PHE HD1 H 7.142 3.557 -1.017 1.00 . A A . 2 PHE HD1 1 1 11 2207 1 1 2 PHE HD2 H 4.811 0.097 -0.177 1.00 . A A . 2 PHE HD2 1 1 11 2208 1 1 2 PHE HE1 H 7.969 3.567 1.301 1.00 . A A . 2 PHE HE1 1 1 11 2209 1 1 2 PHE HE2 H 5.632 0.101 2.142 1.00 . A A . 2 PHE HE2 1 1 11 2210 1 1 2 PHE HZ H 7.213 1.838 2.884 1.00 . A A . 2 PHE HZ 1 1 11 2211 1 1 2 PHE N N 3.003 1.704 -1.756 1.00 . A A . 2 PHE N 1 1 11 2212 1 1 2 PHE O O 3.747 1.856 -4.626 1.00 . A A . 2 PHE O 1 1 11 2213 1 1 3 LYS C C 4.590 5.118 -6.157 1.00 . A A . 3 LYS C 1 1 11 2214 1 1 3 LYS CA C 3.367 4.444 -5.542 1.00 . A A . 3 LYS CA 1 1 11 2215 1 1 3 LYS CB C 2.164 5.387 -5.609 1.00 . A A . 3 LYS CB 1 1 11 2216 1 1 3 LYS CD C -0.064 5.756 -4.509 1.00 . A A . 3 LYS CD 1 1 11 2217 1 1 3 LYS CE C -0.345 5.398 -3.058 1.00 . A A . 3 LYS CE 1 1 11 2218 1 1 3 LYS CG C 0.862 4.744 -5.163 1.00 . A A . 3 LYS CG 1 1 11 2219 1 1 3 LYS H H 3.681 4.747 -3.471 1.00 . A A . 3 LYS H 1 1 11 2220 1 1 3 LYS HA H 3.144 3.549 -6.104 1.00 . A A . 3 LYS HA 1 1 11 2221 1 1 3 LYS HB2 H 2.355 6.241 -4.975 1.00 . A A . 3 LYS HB2 1 1 11 2222 1 1 3 LYS HB3 H 2.043 5.726 -6.628 1.00 . A A . 3 LYS HB3 1 1 11 2223 1 1 3 LYS HD2 H 0.399 6.731 -4.544 1.00 . A A . 3 LYS HD2 1 1 11 2224 1 1 3 LYS HD3 H -0.998 5.779 -5.052 1.00 . A A . 3 LYS HD3 1 1 11 2225 1 1 3 LYS HE2 H -0.870 4.456 -3.028 1.00 . A A . 3 LYS HE2 1 1 11 2226 1 1 3 LYS HE3 H 0.596 5.302 -2.536 1.00 . A A . 3 LYS HE3 1 1 11 2227 1 1 3 LYS HG2 H 0.366 4.322 -6.024 1.00 . A A . 3 LYS HG2 1 1 11 2228 1 1 3 LYS HG3 H 1.083 3.960 -4.452 1.00 . A A . 3 LYS HG3 1 1 11 2229 1 1 3 LYS HZ1 H -0.574 7.018 -1.759 1.00 . A A . 3 LYS HZ1 1 1 11 2230 1 1 3 LYS HZ2 H -1.622 7.051 -3.088 1.00 . A A . 3 LYS HZ2 1 1 11 2231 1 1 3 LYS HZ3 H -1.912 5.984 -1.807 1.00 . A A . 3 LYS HZ3 1 1 11 2232 1 1 3 LYS N N 3.628 4.054 -4.162 1.00 . A A . 3 LYS N 1 1 11 2233 1 1 3 LYS NZ N -1.171 6.435 -2.381 1.00 . A A . 3 LYS NZ 1 1 11 2234 1 1 3 LYS O O 4.474 6.142 -6.832 1.00 . A A . 3 LYS O 1 1 11 2235 1 1 4 LYS C C 6.918 5.258 -7.967 1.00 . A A . 4 LYS C 1 1 11 2236 1 1 4 LYS CA C 7.005 5.080 -6.455 1.00 . A A . 4 LYS CA 1 1 11 2237 1 1 4 LYS CB C 8.178 4.160 -6.106 1.00 . A A . 4 LYS CB 1 1 11 2238 1 1 4 LYS CD C 7.881 4.542 -3.641 1.00 . A A . 4 LYS CD 1 1 11 2239 1 1 4 LYS CE C 7.395 5.954 -3.351 1.00 . A A . 4 LYS CE 1 1 11 2240 1 1 4 LYS CG C 8.864 4.518 -4.800 1.00 . A A . 4 LYS CG 1 1 11 2241 1 1 4 LYS H H 5.790 3.723 -5.377 1.00 . A A . 4 LYS H 1 1 11 2242 1 1 4 LYS HA H 7.168 6.045 -5.999 1.00 . A A . 4 LYS HA 1 1 11 2243 1 1 4 LYS HB2 H 7.814 3.146 -6.031 1.00 . A A . 4 LYS HB2 1 1 11 2244 1 1 4 LYS HB3 H 8.909 4.213 -6.899 1.00 . A A . 4 LYS HB3 1 1 11 2245 1 1 4 LYS HD2 H 7.031 3.924 -3.889 1.00 . A A . 4 LYS HD2 1 1 11 2246 1 1 4 LYS HD3 H 8.368 4.150 -2.759 1.00 . A A . 4 LYS HD3 1 1 11 2247 1 1 4 LYS HE2 H 7.837 6.289 -2.426 1.00 . A A . 4 LYS HE2 1 1 11 2248 1 1 4 LYS HE3 H 7.710 6.601 -4.156 1.00 . A A . 4 LYS HE3 1 1 11 2249 1 1 4 LYS HG2 H 9.630 3.785 -4.593 1.00 . A A . 4 LYS HG2 1 1 11 2250 1 1 4 LYS HG3 H 9.316 5.495 -4.897 1.00 . A A . 4 LYS HG3 1 1 11 2251 1 1 4 LYS HZ1 H 5.544 5.108 -2.881 1.00 . A A . 4 LYS HZ1 1 1 11 2252 1 1 4 LYS HZ2 H 5.639 6.768 -2.567 1.00 . A A . 4 LYS HZ2 1 1 11 2253 1 1 4 LYS HZ3 H 5.487 6.216 -4.159 1.00 . A A . 4 LYS HZ3 1 1 11 2254 1 1 4 LYS N N 5.761 4.537 -5.922 1.00 . A A . 4 LYS N 1 1 11 2255 1 1 4 LYS NZ N 5.912 6.016 -3.231 1.00 . A A . 4 LYS NZ 1 1 11 2256 1 1 4 LYS O O 6.054 4.675 -8.622 1.00 . A A . 4 LYS O 1 1 11 2257 1 1 5 VAL C C 8.350 5.102 -10.716 1.00 . A A . 5 VAL C 1 1 11 2258 1 1 5 VAL CA C 7.844 6.320 -9.952 1.00 . A A . 5 VAL CA 1 1 11 2259 1 1 5 VAL CB C 8.733 7.531 -10.293 1.00 . A A . 5 VAL CB 1 1 11 2260 1 1 5 VAL CG1 C 8.605 7.890 -11.765 1.00 . A A . 5 VAL CG1 1 1 11 2261 1 1 5 VAL CG2 C 8.373 8.719 -9.413 1.00 . A A . 5 VAL CG2 1 1 11 2262 1 1 5 VAL H H 8.482 6.504 -7.942 1.00 . A A . 5 VAL H 1 1 11 2263 1 1 5 VAL HA H 6.835 6.539 -10.271 1.00 . A A . 5 VAL HA 1 1 11 2264 1 1 5 VAL HB H 9.761 7.264 -10.098 1.00 . A A . 5 VAL HB 1 1 11 2265 1 1 5 VAL HG11 H 8.611 8.964 -11.876 1.00 . A A . 5 VAL HG11 1 1 11 2266 1 1 5 VAL HG12 H 9.435 7.467 -12.312 1.00 . A A . 5 VAL HG12 1 1 11 2267 1 1 5 VAL HG13 H 7.679 7.493 -12.153 1.00 . A A . 5 VAL HG13 1 1 11 2268 1 1 5 VAL HG21 H 9.045 9.539 -9.623 1.00 . A A . 5 VAL HG21 1 1 11 2269 1 1 5 VAL HG22 H 7.358 9.024 -9.617 1.00 . A A . 5 VAL HG22 1 1 11 2270 1 1 5 VAL HG23 H 8.463 8.438 -8.374 1.00 . A A . 5 VAL HG23 1 1 11 2271 1 1 5 VAL N N 7.818 6.067 -8.516 1.00 . A A . 5 VAL N 1 1 11 2272 1 1 5 VAL O O 9.393 4.537 -10.383 1.00 . A A . 5 VAL O 1 1 11 2273 1 1 6 ILE C C 8.116 3.936 -14.022 1.00 . A A . 6 ILE C 1 1 11 2274 1 1 6 ILE CA C 7.980 3.551 -12.553 1.00 . A A . 6 ILE CA 1 1 11 2275 1 1 6 ILE CB C 6.950 2.413 -12.426 1.00 . A A . 6 ILE CB 1 1 11 2276 1 1 6 ILE CD1 C 5.591 1.071 -10.744 1.00 . A A . 6 ILE CD1 1 1 11 2277 1 1 6 ILE CG1 C 6.545 2.224 -10.962 1.00 . A A . 6 ILE CG1 1 1 11 2278 1 1 6 ILE CG2 C 7.515 1.121 -12.996 1.00 . A A . 6 ILE CG2 1 1 11 2279 1 1 6 ILE H H 6.786 5.193 -11.956 1.00 . A A . 6 ILE H 1 1 11 2280 1 1 6 ILE HA H 8.933 3.188 -12.197 1.00 . A A . 6 ILE HA 1 1 11 2281 1 1 6 ILE HB H 6.078 2.681 -13.002 1.00 . A A . 6 ILE HB 1 1 11 2282 1 1 6 ILE HD11 H 4.684 1.243 -11.305 1.00 . A A . 6 ILE HD11 1 1 11 2283 1 1 6 ILE HD12 H 6.052 0.153 -11.078 1.00 . A A . 6 ILE HD12 1 1 11 2284 1 1 6 ILE HD13 H 5.355 0.993 -9.693 1.00 . A A . 6 ILE HD13 1 1 11 2285 1 1 6 ILE HG12 H 7.428 2.039 -10.372 1.00 . A A . 6 ILE HG12 1 1 11 2286 1 1 6 ILE HG13 H 6.064 3.125 -10.611 1.00 . A A . 6 ILE HG13 1 1 11 2287 1 1 6 ILE HG21 H 8.391 1.341 -13.588 1.00 . A A . 6 ILE HG21 1 1 11 2288 1 1 6 ILE HG22 H 7.784 0.458 -12.187 1.00 . A A . 6 ILE HG22 1 1 11 2289 1 1 6 ILE HG23 H 6.771 0.646 -13.618 1.00 . A A . 6 ILE HG23 1 1 11 2290 1 1 6 ILE N N 7.606 4.702 -11.741 1.00 . A A . 6 ILE N 1 1 11 2291 1 1 6 ILE O O 7.841 3.132 -14.913 1.00 . A A . 6 ILE O 1 1 11 2292 1 1 7 TRP C C 9.958 5.049 -16.274 1.00 . A A . 7 TRP C 1 1 11 2293 1 1 7 TRP CA C 8.719 5.660 -15.630 1.00 . A A . 7 TRP CA 1 1 11 2294 1 1 7 TRP CB C 8.827 7.186 -15.633 1.00 . A A . 7 TRP CB 1 1 11 2295 1 1 7 TRP CD1 C 7.856 8.069 -17.835 1.00 . A A . 7 TRP CD1 1 1 11 2296 1 1 7 TRP CD2 C 10.092 8.132 -17.723 1.00 . A A . 7 TRP CD2 1 1 11 2297 1 1 7 TRP CE2 C 9.690 8.641 -18.974 1.00 . A A . 7 TRP CE2 1 1 11 2298 1 1 7 TRP CE3 C 11.457 8.076 -17.426 1.00 . A A . 7 TRP CE3 1 1 11 2299 1 1 7 TRP CG C 8.904 7.773 -17.010 1.00 . A A . 7 TRP CG 1 1 11 2300 1 1 7 TRP CH2 C 11.934 9.022 -19.607 1.00 . A A . 7 TRP CH2 1 1 11 2301 1 1 7 TRP CZ2 C 10.604 9.088 -19.924 1.00 . A A . 7 TRP CZ2 1 1 11 2302 1 1 7 TRP CZ3 C 12.363 8.520 -18.370 1.00 . A A . 7 TRP CZ3 1 1 11 2303 1 1 7 TRP H H 8.747 5.764 -13.515 1.00 . A A . 7 TRP H 1 1 11 2304 1 1 7 TRP HA H 7.850 5.369 -16.200 1.00 . A A . 7 TRP HA 1 1 11 2305 1 1 7 TRP HB2 H 7.961 7.603 -15.141 1.00 . A A . 7 TRP HB2 1 1 11 2306 1 1 7 TRP HB3 H 9.717 7.478 -15.095 1.00 . A A . 7 TRP HB3 1 1 11 2307 1 1 7 TRP HD1 H 6.819 7.909 -17.582 1.00 . A A . 7 TRP HD1 1 1 11 2308 1 1 7 TRP HE1 H 7.764 8.882 -19.770 1.00 . A A . 7 TRP HE1 1 1 11 2309 1 1 7 TRP HE3 H 11.807 7.693 -16.479 1.00 . A A . 7 TRP HE3 1 1 11 2310 1 1 7 TRP HH2 H 12.676 9.357 -20.314 1.00 . A A . 7 TRP HH2 1 1 11 2311 1 1 7 TRP HZ2 H 10.289 9.478 -20.881 1.00 . A A . 7 TRP HZ2 1 1 11 2312 1 1 7 TRP HZ3 H 13.421 8.484 -18.159 1.00 . A A . 7 TRP HZ3 1 1 11 2313 1 1 7 TRP N N 8.544 5.169 -14.267 1.00 . A A . 7 TRP N 1 1 11 2314 1 1 7 TRP NE1 N 8.322 8.591 -19.018 1.00 . A A . 7 TRP NE1 1 1 11 2315 1 1 7 TRP O O 9.961 4.735 -17.464 1.00 . A A . 7 TRP O 1 1 11 2316 1 1 8 LYS C C 12.012 2.945 -16.611 1.00 . A A . 8 LYS C 1 1 11 2317 1 1 8 LYS CA C 12.257 4.308 -15.973 1.00 . A A . 8 LYS CA 1 1 11 2318 1 1 8 LYS CB C 13.267 4.174 -14.830 1.00 . A A . 8 LYS CB 1 1 11 2319 1 1 8 LYS CD C 12.688 4.486 -12.406 1.00 . A A . 8 LYS CD 1 1 11 2320 1 1 8 LYS CE C 12.917 3.758 -11.091 1.00 . A A . 8 LYS CE 1 1 11 2321 1 1 8 LYS CG C 12.692 3.525 -13.583 1.00 . A A . 8 LYS CG 1 1 11 2322 1 1 8 LYS H H 10.948 5.154 -14.540 1.00 . A A . 8 LYS H 1 1 11 2323 1 1 8 LYS HA H 12.659 4.976 -16.720 1.00 . A A . 8 LYS HA 1 1 11 2324 1 1 8 LYS HB2 H 14.100 3.576 -15.171 1.00 . A A . 8 LYS HB2 1 1 11 2325 1 1 8 LYS HB3 H 13.626 5.158 -14.566 1.00 . A A . 8 LYS HB3 1 1 11 2326 1 1 8 LYS HD2 H 13.475 5.213 -12.543 1.00 . A A . 8 LYS HD2 1 1 11 2327 1 1 8 LYS HD3 H 11.733 4.990 -12.367 1.00 . A A . 8 LYS HD3 1 1 11 2328 1 1 8 LYS HE2 H 12.642 4.413 -10.279 1.00 . A A . 8 LYS HE2 1 1 11 2329 1 1 8 LYS HE3 H 12.292 2.877 -11.069 1.00 . A A . 8 LYS HE3 1 1 11 2330 1 1 8 LYS HG2 H 11.677 3.216 -13.784 1.00 . A A . 8 LYS HG2 1 1 11 2331 1 1 8 LYS HG3 H 13.290 2.662 -13.329 1.00 . A A . 8 LYS HG3 1 1 11 2332 1 1 8 LYS HZ1 H 14.464 2.361 -11.226 1.00 . A A . 8 LYS HZ1 1 1 11 2333 1 1 8 LYS HZ2 H 14.956 3.956 -11.499 1.00 . A A . 8 LYS HZ2 1 1 11 2334 1 1 8 LYS HZ3 H 14.620 3.432 -9.926 1.00 . A A . 8 LYS HZ3 1 1 11 2335 1 1 8 LYS N N 11.011 4.883 -15.480 1.00 . A A . 8 LYS N 1 1 11 2336 1 1 8 LYS NZ N 14.339 3.348 -10.924 1.00 . A A . 8 LYS NZ 1 1 11 2337 1 1 8 LYS O O 12.661 2.583 -17.593 1.00 . A A . 8 LYS O 1 1 11 2338 1 1 9 SER C C 10.443 0.925 -18.057 1.00 . A A . 9 SER C 1 1 11 2339 1 1 9 SER CA C 10.743 0.868 -16.562 1.00 . A A . 9 SER CA 1 1 11 2340 1 1 9 SER CB C 9.542 0.290 -15.811 1.00 . A A . 9 SER CB 1 1 11 2341 1 1 9 SER H H 10.589 2.537 -15.268 1.00 . A A . 9 SER H 1 1 11 2342 1 1 9 SER HA H 11.598 0.229 -16.403 1.00 . A A . 9 SER HA 1 1 11 2343 1 1 9 SER HB2 H 9.841 0.027 -14.808 1.00 . A A . 9 SER HB2 1 1 11 2344 1 1 9 SER HB3 H 8.757 1.031 -15.770 1.00 . A A . 9 SER HB3 1 1 11 2345 1 1 9 SER HG H 9.780 -1.405 -16.764 1.00 . A A . 9 SER HG 1 1 11 2346 1 1 9 SER N N 11.072 2.193 -16.049 1.00 . A A . 9 SER N 1 1 11 2347 1 1 9 SER O O 10.778 0.005 -18.805 1.00 . A A . 9 SER O 1 1 11 2348 1 1 9 SER OG O 9.045 -0.868 -16.459 1.00 . A A . 9 SER OG 1 1 11 2349 1 1 10 PHE C C 10.532 2.996 -20.619 1.00 . A A . 10 PHE C 1 1 11 2350 1 1 10 PHE CA C 9.461 2.188 -19.892 1.00 . A A . 10 PHE CA 1 1 11 2351 1 1 10 PHE CB C 8.106 2.885 -20.020 1.00 . A A . 10 PHE CB 1 1 11 2352 1 1 10 PHE CD1 C 6.632 1.898 -18.245 1.00 . A A . 10 PHE CD1 1 1 11 2353 1 1 10 PHE CD2 C 6.178 1.359 -20.523 1.00 . A A . 10 PHE CD2 1 1 11 2354 1 1 10 PHE CE1 C 5.568 1.113 -17.843 1.00 . A A . 10 PHE CE1 1 1 11 2355 1 1 10 PHE CE2 C 5.113 0.573 -20.127 1.00 . A A . 10 PHE CE2 1 1 11 2356 1 1 10 PHE CG C 6.949 2.031 -19.587 1.00 . A A . 10 PHE CG 1 1 11 2357 1 1 10 PHE CZ C 4.808 0.449 -18.785 1.00 . A A . 10 PHE CZ 1 1 11 2358 1 1 10 PHE H H 9.567 2.709 -17.842 1.00 . A A . 10 PHE H 1 1 11 2359 1 1 10 PHE HA H 9.398 1.210 -20.343 1.00 . A A . 10 PHE HA 1 1 11 2360 1 1 10 PHE HB2 H 8.107 3.775 -19.409 1.00 . A A . 10 PHE HB2 1 1 11 2361 1 1 10 PHE HB3 H 7.948 3.162 -21.051 1.00 . A A . 10 PHE HB3 1 1 11 2362 1 1 10 PHE HD1 H 7.227 2.418 -17.506 1.00 . A A . 10 PHE HD1 1 1 11 2363 1 1 10 PHE HD2 H 6.416 1.454 -21.572 1.00 . A A . 10 PHE HD2 1 1 11 2364 1 1 10 PHE HE1 H 5.333 1.018 -16.793 1.00 . A A . 10 PHE HE1 1 1 11 2365 1 1 10 PHE HE2 H 4.520 0.054 -20.866 1.00 . A A . 10 PHE HE2 1 1 11 2366 1 1 10 PHE HZ H 3.976 -0.165 -18.474 1.00 . A A . 10 PHE HZ 1 1 11 2367 1 1 10 PHE N N 9.809 2.011 -18.487 1.00 . A A . 10 PHE N 1 1 11 2368 1 1 10 PHE O O 10.910 2.675 -21.746 1.00 . A A . 10 PHE O 1 1 11 2369 1 1 11 LEU C C 11.654 5.341 -21.956 1.00 . A A . 11 LEU C 1 1 11 2370 1 1 11 LEU CA C 12.045 4.902 -20.549 1.00 . A A . 11 LEU CA 1 1 11 2371 1 1 11 LEU CB C 13.387 4.169 -20.585 1.00 . A A . 11 LEU CB 1 1 11 2372 1 1 11 LEU CD1 C 15.840 4.096 -20.076 1.00 . A A . 11 LEU CD1 1 1 11 2373 1 1 11 LEU CD2 C 14.843 6.137 -21.122 1.00 . A A . 11 LEU CD2 1 1 11 2374 1 1 11 LEU CG C 14.609 4.984 -20.158 1.00 . A A . 11 LEU CG 1 1 11 2375 1 1 11 LEU H H 10.677 4.252 -19.070 1.00 . A A . 11 LEU H 1 1 11 2376 1 1 11 LEU HA H 12.139 5.778 -19.925 1.00 . A A . 11 LEU HA 1 1 11 2377 1 1 11 LEU HB2 H 13.315 3.314 -19.930 1.00 . A A . 11 LEU HB2 1 1 11 2378 1 1 11 LEU HB3 H 13.551 3.831 -21.598 1.00 . A A . 11 LEU HB3 1 1 11 2379 1 1 11 LEU HD11 H 15.722 3.389 -19.269 1.00 . A A . 11 LEU HD11 1 1 11 2380 1 1 11 LEU HD12 H 15.962 3.562 -21.007 1.00 . A A . 11 LEU HD12 1 1 11 2381 1 1 11 LEU HD13 H 16.713 4.706 -19.895 1.00 . A A . 11 LEU HD13 1 1 11 2382 1 1 11 LEU HD21 H 15.314 5.766 -22.021 1.00 . A A . 11 LEU HD21 1 1 11 2383 1 1 11 LEU HD22 H 13.898 6.594 -21.374 1.00 . A A . 11 LEU HD22 1 1 11 2384 1 1 11 LEU HD23 H 15.485 6.871 -20.657 1.00 . A A . 11 LEU HD23 1 1 11 2385 1 1 11 LEU HG H 14.431 5.399 -19.175 1.00 . A A . 11 LEU HG 1 1 11 2386 1 1 11 LEU N N 11.017 4.046 -19.965 1.00 . A A . 11 LEU N 1 1 11 2387 1 1 11 LEU O O 11.297 6.497 -22.180 1.00 . A A . 11 LEU O 1 1 12 2388 1 1 1 LYS C C 2.424 1.427 -1.838 1.00 . A A . 1 LYS C 1 1 12 2389 1 1 1 LYS CA C 2.879 0.054 -1.352 1.00 . A A . 1 LYS CA 1 1 12 2390 1 1 1 LYS CB C 3.832 -0.570 -2.374 1.00 . A A . 1 LYS CB 1 1 12 2391 1 1 1 LYS CD C 2.956 -2.571 -3.615 1.00 . A A . 1 LYS CD 1 1 12 2392 1 1 1 LYS CE C 2.024 -3.034 -4.725 1.00 . A A . 1 LYS CE 1 1 12 2393 1 1 1 LYS CG C 3.137 -1.063 -3.632 1.00 . A A . 1 LYS CG 1 1 12 2394 1 1 1 LYS H1 H 1.132 -0.636 -0.376 1.00 . A A . 1 LYS H1 1 1 12 2395 1 1 1 LYS HA H 3.398 0.172 -0.414 1.00 . A A . 1 LYS HA 1 1 12 2396 1 1 1 LYS HB2 H 4.568 0.167 -2.660 1.00 . A A . 1 LYS HB2 1 1 12 2397 1 1 1 LYS HB3 H 4.334 -1.409 -1.914 1.00 . A A . 1 LYS HB3 1 1 12 2398 1 1 1 LYS HD2 H 3.918 -3.043 -3.748 1.00 . A A . 1 LYS HD2 1 1 12 2399 1 1 1 LYS HD3 H 2.538 -2.864 -2.661 1.00 . A A . 1 LYS HD3 1 1 12 2400 1 1 1 LYS HE2 H 1.066 -3.280 -4.294 1.00 . A A . 1 LYS HE2 1 1 12 2401 1 1 1 LYS HE3 H 1.904 -2.228 -5.434 1.00 . A A . 1 LYS HE3 1 1 12 2402 1 1 1 LYS HG2 H 2.166 -0.595 -3.703 1.00 . A A . 1 LYS HG2 1 1 12 2403 1 1 1 LYS HG3 H 3.733 -0.791 -4.492 1.00 . A A . 1 LYS HG3 1 1 12 2404 1 1 1 LYS HZ1 H 3.280 -4.699 -4.851 1.00 . A A . 1 LYS HZ1 1 1 12 2405 1 1 1 LYS HZ2 H 1.790 -4.904 -5.626 1.00 . A A . 1 LYS HZ2 1 1 12 2406 1 1 1 LYS HZ3 H 2.989 -3.946 -6.338 1.00 . A A . 1 LYS HZ3 1 1 12 2407 1 1 1 LYS N N 1.736 -0.822 -1.126 1.00 . A A . 1 LYS N 1 1 12 2408 1 1 1 LYS NZ N 2.558 -4.229 -5.434 1.00 . A A . 1 LYS NZ 1 1 12 2409 1 1 1 LYS O O 1.278 1.601 -2.253 1.00 . A A . 1 LYS O 1 1 12 2410 1 1 2 PHE C C 3.114 3.873 -3.739 1.00 . A A . 2 PHE C 1 1 12 2411 1 1 2 PHE CA C 3.022 3.755 -2.221 1.00 . A A . 2 PHE CA 1 1 12 2412 1 1 2 PHE CB C 3.975 4.754 -1.561 1.00 . A A . 2 PHE CB 1 1 12 2413 1 1 2 PHE CD1 C 3.106 6.554 -0.045 1.00 . A A . 2 PHE CD1 1 1 12 2414 1 1 2 PHE CD2 C 3.454 4.377 0.864 1.00 . A A . 2 PHE CD2 1 1 12 2415 1 1 2 PHE CE1 C 2.670 7.003 1.188 1.00 . A A . 2 PHE CE1 1 1 12 2416 1 1 2 PHE CE2 C 3.018 4.820 2.099 1.00 . A A . 2 PHE CE2 1 1 12 2417 1 1 2 PHE CG C 3.502 5.238 -0.221 1.00 . A A . 2 PHE CG 1 1 12 2418 1 1 2 PHE CZ C 2.627 6.135 2.261 1.00 . A A . 2 PHE CZ 1 1 12 2419 1 1 2 PHE H H 4.227 2.197 -1.445 1.00 . A A . 2 PHE H 1 1 12 2420 1 1 2 PHE HA H 2.012 3.979 -1.915 1.00 . A A . 2 PHE HA 1 1 12 2421 1 1 2 PHE HB2 H 4.937 4.285 -1.423 1.00 . A A . 2 PHE HB2 1 1 12 2422 1 1 2 PHE HB3 H 4.087 5.613 -2.205 1.00 . A A . 2 PHE HB3 1 1 12 2423 1 1 2 PHE HD1 H 3.140 7.234 -0.884 1.00 . A A . 2 PHE HD1 1 1 12 2424 1 1 2 PHE HD2 H 3.760 3.349 0.739 1.00 . A A . 2 PHE HD2 1 1 12 2425 1 1 2 PHE HE1 H 2.365 8.032 1.311 1.00 . A A . 2 PHE HE1 1 1 12 2426 1 1 2 PHE HE2 H 2.985 4.140 2.936 1.00 . A A . 2 PHE HE2 1 1 12 2427 1 1 2 PHE HZ H 2.286 6.484 3.224 1.00 . A A . 2 PHE HZ 1 1 12 2428 1 1 2 PHE N N 3.330 2.398 -1.786 1.00 . A A . 2 PHE N 1 1 12 2429 1 1 2 PHE O O 3.437 2.907 -4.431 1.00 . A A . 2 PHE O 1 1 12 2430 1 1 3 LYS C C 4.314 5.552 -6.149 1.00 . A A . 3 LYS C 1 1 12 2431 1 1 3 LYS CA C 2.879 5.313 -5.688 1.00 . A A . 3 LYS CA 1 1 12 2432 1 1 3 LYS CB C 2.009 6.519 -6.050 1.00 . A A . 3 LYS CB 1 1 12 2433 1 1 3 LYS CD C -0.274 7.489 -5.657 1.00 . A A . 3 LYS CD 1 1 12 2434 1 1 3 LYS CE C -1.264 7.244 -4.528 1.00 . A A . 3 LYS CE 1 1 12 2435 1 1 3 LYS CG C 0.519 6.235 -5.984 1.00 . A A . 3 LYS CG 1 1 12 2436 1 1 3 LYS H H 2.577 5.797 -3.650 1.00 . A A . 3 LYS H 1 1 12 2437 1 1 3 LYS HA H 2.494 4.438 -6.190 1.00 . A A . 3 LYS HA 1 1 12 2438 1 1 3 LYS HB2 H 2.231 7.326 -5.367 1.00 . A A . 3 LYS HB2 1 1 12 2439 1 1 3 LYS HB3 H 2.250 6.833 -7.055 1.00 . A A . 3 LYS HB3 1 1 12 2440 1 1 3 LYS HD2 H 0.410 8.269 -5.357 1.00 . A A . 3 LYS HD2 1 1 12 2441 1 1 3 LYS HD3 H -0.816 7.803 -6.538 1.00 . A A . 3 LYS HD3 1 1 12 2442 1 1 3 LYS HE2 H -2.054 6.606 -4.893 1.00 . A A . 3 LYS HE2 1 1 12 2443 1 1 3 LYS HE3 H -0.750 6.752 -3.716 1.00 . A A . 3 LYS HE3 1 1 12 2444 1 1 3 LYS HG2 H 0.191 5.855 -6.940 1.00 . A A . 3 LYS HG2 1 1 12 2445 1 1 3 LYS HG3 H 0.336 5.494 -5.218 1.00 . A A . 3 LYS HG3 1 1 12 2446 1 1 3 LYS HZ1 H -2.896 8.482 -4.114 1.00 . A A . 3 LYS HZ1 1 1 12 2447 1 1 3 LYS HZ2 H -1.611 8.655 -3.027 1.00 . A A . 3 LYS HZ2 1 1 12 2448 1 1 3 LYS HZ3 H -1.501 9.319 -4.579 1.00 . A A . 3 LYS HZ3 1 1 12 2449 1 1 3 LYS N N 2.828 5.065 -4.252 1.00 . A A . 3 LYS N 1 1 12 2450 1 1 3 LYS NZ N -1.859 8.514 -4.027 1.00 . A A . 3 LYS NZ 1 1 12 2451 1 1 3 LYS O O 4.658 6.644 -6.601 1.00 . A A . 3 LYS O 1 1 12 2452 1 1 4 LYS C C 6.658 4.880 -7.937 1.00 . A A . 4 LYS C 1 1 12 2453 1 1 4 LYS CA C 6.544 4.619 -6.439 1.00 . A A . 4 LYS CA 1 1 12 2454 1 1 4 LYS CB C 7.291 3.333 -6.076 1.00 . A A . 4 LYS CB 1 1 12 2455 1 1 4 LYS CD C 6.584 2.618 -3.774 1.00 . A A . 4 LYS CD 1 1 12 2456 1 1 4 LYS CE C 7.144 1.583 -2.810 1.00 . A A . 4 LYS CE 1 1 12 2457 1 1 4 LYS CG C 7.683 3.251 -4.611 1.00 . A A . 4 LYS CG 1 1 12 2458 1 1 4 LYS H H 4.813 3.677 -5.664 1.00 . A A . 4 LYS H 1 1 12 2459 1 1 4 LYS HA H 6.988 5.446 -5.906 1.00 . A A . 4 LYS HA 1 1 12 2460 1 1 4 LYS HB2 H 6.661 2.487 -6.306 1.00 . A A . 4 LYS HB2 1 1 12 2461 1 1 4 LYS HB3 H 8.191 3.274 -6.672 1.00 . A A . 4 LYS HB3 1 1 12 2462 1 1 4 LYS HD2 H 6.087 3.390 -3.206 1.00 . A A . 4 LYS HD2 1 1 12 2463 1 1 4 LYS HD3 H 5.874 2.138 -4.432 1.00 . A A . 4 LYS HD3 1 1 12 2464 1 1 4 LYS HE2 H 8.028 1.987 -2.341 1.00 . A A . 4 LYS HE2 1 1 12 2465 1 1 4 LYS HE3 H 6.400 1.374 -2.056 1.00 . A A . 4 LYS HE3 1 1 12 2466 1 1 4 LYS HG2 H 8.579 2.654 -4.520 1.00 . A A . 4 LYS HG2 1 1 12 2467 1 1 4 LYS HG3 H 7.875 4.249 -4.242 1.00 . A A . 4 LYS HG3 1 1 12 2468 1 1 4 LYS HZ1 H 6.649 -0.119 -3.916 1.00 . A A . 4 LYS HZ1 1 1 12 2469 1 1 4 LYS HZ2 H 8.183 0.504 -4.266 1.00 . A A . 4 LYS HZ2 1 1 12 2470 1 1 4 LYS HZ3 H 7.925 -0.354 -2.831 1.00 . A A . 4 LYS HZ3 1 1 12 2471 1 1 4 LYS N N 5.147 4.523 -6.032 1.00 . A A . 4 LYS N 1 1 12 2472 1 1 4 LYS NZ N 7.500 0.314 -3.505 1.00 . A A . 4 LYS NZ 1 1 12 2473 1 1 4 LYS O O 5.941 4.280 -8.738 1.00 . A A . 4 LYS O 1 1 12 2474 1 1 5 VAL C C 8.526 5.007 -10.438 1.00 . A A . 5 VAL C 1 1 12 2475 1 1 5 VAL CA C 7.774 6.116 -9.712 1.00 . A A . 5 VAL CA 1 1 12 2476 1 1 5 VAL CB C 8.556 7.435 -9.860 1.00 . A A . 5 VAL CB 1 1 12 2477 1 1 5 VAL CG1 C 8.764 7.770 -11.329 1.00 . A A . 5 VAL CG1 1 1 12 2478 1 1 5 VAL CG2 C 7.834 8.566 -9.144 1.00 . A A . 5 VAL CG2 1 1 12 2479 1 1 5 VAL H H 8.106 6.222 -7.624 1.00 . A A . 5 VAL H 1 1 12 2480 1 1 5 VAL HA H 6.805 6.243 -10.173 1.00 . A A . 5 VAL HA 1 1 12 2481 1 1 5 VAL HB H 9.526 7.308 -9.402 1.00 . A A . 5 VAL HB 1 1 12 2482 1 1 5 VAL HG11 H 7.876 7.512 -11.887 1.00 . A A . 5 VAL HG11 1 1 12 2483 1 1 5 VAL HG12 H 8.960 8.827 -11.433 1.00 . A A . 5 VAL HG12 1 1 12 2484 1 1 5 VAL HG13 H 9.604 7.209 -11.711 1.00 . A A . 5 VAL HG13 1 1 12 2485 1 1 5 VAL HG21 H 7.566 9.331 -9.858 1.00 . A A . 5 VAL HG21 1 1 12 2486 1 1 5 VAL HG22 H 6.940 8.182 -8.675 1.00 . A A . 5 VAL HG22 1 1 12 2487 1 1 5 VAL HG23 H 8.483 8.987 -8.391 1.00 . A A . 5 VAL HG23 1 1 12 2488 1 1 5 VAL N N 7.564 5.778 -8.309 1.00 . A A . 5 VAL N 1 1 12 2489 1 1 5 VAL O O 9.628 4.627 -10.041 1.00 . A A . 5 VAL O 1 1 12 2490 1 1 6 ILE C C 8.732 3.853 -13.739 1.00 . A A . 6 ILE C 1 1 12 2491 1 1 6 ILE CA C 8.539 3.427 -12.288 1.00 . A A . 6 ILE CA 1 1 12 2492 1 1 6 ILE CB C 7.693 2.140 -12.251 1.00 . A A . 6 ILE CB 1 1 12 2493 1 1 6 ILE CD1 C 6.429 0.574 -10.693 1.00 . A A . 6 ILE CD1 1 1 12 2494 1 1 6 ILE CG1 C 7.205 1.865 -10.827 1.00 . A A . 6 ILE CG1 1 1 12 2495 1 1 6 ILE CG2 C 8.497 0.962 -12.778 1.00 . A A . 6 ILE CG2 1 1 12 2496 1 1 6 ILE H H 7.047 4.836 -11.772 1.00 . A A . 6 ILE H 1 1 12 2497 1 1 6 ILE HA H 9.505 3.210 -11.856 1.00 . A A . 6 ILE HA 1 1 12 2498 1 1 6 ILE HB H 6.838 2.279 -12.896 1.00 . A A . 6 ILE HB 1 1 12 2499 1 1 6 ILE HD11 H 6.122 0.443 -9.666 1.00 . A A . 6 ILE HD11 1 1 12 2500 1 1 6 ILE HD12 H 5.555 0.612 -11.327 1.00 . A A . 6 ILE HD12 1 1 12 2501 1 1 6 ILE HD13 H 7.054 -0.255 -10.991 1.00 . A A . 6 ILE HD13 1 1 12 2502 1 1 6 ILE HG12 H 8.056 1.810 -10.167 1.00 . A A . 6 ILE HG12 1 1 12 2503 1 1 6 ILE HG13 H 6.562 2.675 -10.513 1.00 . A A . 6 ILE HG13 1 1 12 2504 1 1 6 ILE HG21 H 9.374 1.326 -13.294 1.00 . A A . 6 ILE HG21 1 1 12 2505 1 1 6 ILE HG22 H 8.800 0.335 -11.953 1.00 . A A . 6 ILE HG22 1 1 12 2506 1 1 6 ILE HG23 H 7.889 0.388 -13.462 1.00 . A A . 6 ILE HG23 1 1 12 2507 1 1 6 ILE N N 7.924 4.491 -11.505 1.00 . A A . 6 ILE N 1 1 12 2508 1 1 6 ILE O O 8.660 3.032 -14.653 1.00 . A A . 6 ILE O 1 1 12 2509 1 1 7 TRP C C 10.408 5.046 -15.941 1.00 . A A . 7 TRP C 1 1 12 2510 1 1 7 TRP CA C 9.186 5.678 -15.284 1.00 . A A . 7 TRP CA 1 1 12 2511 1 1 7 TRP CB C 9.350 7.198 -15.229 1.00 . A A . 7 TRP CB 1 1 12 2512 1 1 7 TRP CD1 C 7.518 8.579 -16.371 1.00 . A A . 7 TRP CD1 1 1 12 2513 1 1 7 TRP CD2 C 9.218 8.013 -17.715 1.00 . A A . 7 TRP CD2 1 1 12 2514 1 1 7 TRP CE2 C 8.287 8.764 -18.459 1.00 . A A . 7 TRP CE2 1 1 12 2515 1 1 7 TRP CE3 C 10.373 7.549 -18.352 1.00 . A A . 7 TRP CE3 1 1 12 2516 1 1 7 TRP CG C 8.707 7.907 -16.382 1.00 . A A . 7 TRP CG 1 1 12 2517 1 1 7 TRP CH2 C 9.615 8.591 -20.405 1.00 . A A . 7 TRP CH2 1 1 12 2518 1 1 7 TRP CZ2 C 8.477 9.058 -19.807 1.00 . A A . 7 TRP CZ2 1 1 12 2519 1 1 7 TRP CZ3 C 10.559 7.842 -19.689 1.00 . A A . 7 TRP CZ3 1 1 12 2520 1 1 7 TRP H H 9.025 5.748 -13.174 1.00 . A A . 7 TRP H 1 1 12 2521 1 1 7 TRP HA H 8.312 5.441 -15.873 1.00 . A A . 7 TRP HA 1 1 12 2522 1 1 7 TRP HB2 H 8.904 7.569 -14.318 1.00 . A A . 7 TRP HB2 1 1 12 2523 1 1 7 TRP HB3 H 10.403 7.438 -15.233 1.00 . A A . 7 TRP HB3 1 1 12 2524 1 1 7 TRP HD1 H 6.884 8.678 -15.503 1.00 . A A . 7 TRP HD1 1 1 12 2525 1 1 7 TRP HE1 H 6.467 9.619 -17.863 1.00 . A A . 7 TRP HE1 1 1 12 2526 1 1 7 TRP HE3 H 11.111 6.971 -17.817 1.00 . A A . 7 TRP HE3 1 1 12 2527 1 1 7 TRP HH2 H 9.802 8.796 -21.448 1.00 . A A . 7 TRP HH2 1 1 12 2528 1 1 7 TRP HZ2 H 7.759 9.635 -20.372 1.00 . A A . 7 TRP HZ2 1 1 12 2529 1 1 7 TRP HZ3 H 11.445 7.491 -20.199 1.00 . A A . 7 TRP HZ3 1 1 12 2530 1 1 7 TRP N N 8.980 5.142 -13.943 1.00 . A A . 7 TRP N 1 1 12 2531 1 1 7 TRP NE1 N 7.259 9.096 -17.617 1.00 . A A . 7 TRP NE1 1 1 12 2532 1 1 7 TRP O O 10.454 4.880 -17.160 1.00 . A A . 7 TRP O 1 1 12 2533 1 1 8 LYS C C 12.299 2.915 -16.562 1.00 . A A . 8 LYS C 1 1 12 2534 1 1 8 LYS CA C 12.619 4.078 -15.628 1.00 . A A . 8 LYS CA 1 1 12 2535 1 1 8 LYS CB C 13.483 3.588 -14.464 1.00 . A A . 8 LYS CB 1 1 12 2536 1 1 8 LYS CD C 13.292 4.181 -12.030 1.00 . A A . 8 LYS CD 1 1 12 2537 1 1 8 LYS CE C 13.352 5.310 -11.012 1.00 . A A . 8 LYS CE 1 1 12 2538 1 1 8 LYS CG C 13.736 4.648 -13.406 1.00 . A A . 8 LYS CG 1 1 12 2539 1 1 8 LYS H H 11.301 4.852 -14.163 1.00 . A A . 8 LYS H 1 1 12 2540 1 1 8 LYS HA H 13.166 4.827 -16.180 1.00 . A A . 8 LYS HA 1 1 12 2541 1 1 8 LYS HB2 H 12.990 2.750 -13.993 1.00 . A A . 8 LYS HB2 1 1 12 2542 1 1 8 LYS HB3 H 14.437 3.261 -14.851 1.00 . A A . 8 LYS HB3 1 1 12 2543 1 1 8 LYS HD2 H 12.276 3.821 -12.092 1.00 . A A . 8 LYS HD2 1 1 12 2544 1 1 8 LYS HD3 H 13.941 3.380 -11.705 1.00 . A A . 8 LYS HD3 1 1 12 2545 1 1 8 LYS HE2 H 13.030 4.930 -10.055 1.00 . A A . 8 LYS HE2 1 1 12 2546 1 1 8 LYS HE3 H 14.372 5.655 -10.937 1.00 . A A . 8 LYS HE3 1 1 12 2547 1 1 8 LYS HG2 H 14.793 4.869 -13.376 1.00 . A A . 8 LYS HG2 1 1 12 2548 1 1 8 LYS HG3 H 13.188 5.542 -13.667 1.00 . A A . 8 LYS HG3 1 1 12 2549 1 1 8 LYS HZ1 H 13.056 7.226 -11.789 1.00 . A A . 8 LYS HZ1 1 1 12 2550 1 1 8 LYS HZ2 H 11.793 6.150 -12.120 1.00 . A A . 8 LYS HZ2 1 1 12 2551 1 1 8 LYS HZ3 H 11.962 6.805 -10.569 1.00 . A A . 8 LYS HZ3 1 1 12 2552 1 1 8 LYS N N 11.397 4.694 -15.127 1.00 . A A . 8 LYS N 1 1 12 2553 1 1 8 LYS NZ N 12.480 6.453 -11.399 1.00 . A A . 8 LYS NZ 1 1 12 2554 1 1 8 LYS O O 13.012 2.675 -17.537 1.00 . A A . 8 LYS O 1 1 12 2555 1 1 9 SER C C 10.116 1.523 -18.346 1.00 . A A . 9 SER C 1 1 12 2556 1 1 9 SER CA C 10.810 1.058 -17.069 1.00 . A A . 9 SER CA 1 1 12 2557 1 1 9 SER CB C 9.876 0.147 -16.270 1.00 . A A . 9 SER CB 1 1 12 2558 1 1 9 SER H H 10.695 2.438 -15.468 1.00 . A A . 9 SER H 1 1 12 2559 1 1 9 SER HA H 11.697 0.503 -17.338 1.00 . A A . 9 SER HA 1 1 12 2560 1 1 9 SER HB2 H 9.230 0.752 -15.651 1.00 . A A . 9 SER HB2 1 1 12 2561 1 1 9 SER HB3 H 9.277 -0.437 -16.953 1.00 . A A . 9 SER HB3 1 1 12 2562 1 1 9 SER HG H 10.605 -1.615 -15.820 1.00 . A A . 9 SER HG 1 1 12 2563 1 1 9 SER N N 11.223 2.197 -16.258 1.00 . A A . 9 SER N 1 1 12 2564 1 1 9 SER O O 10.262 0.911 -19.404 1.00 . A A . 9 SER O 1 1 12 2565 1 1 9 SER OG O 10.611 -0.734 -15.438 1.00 . A A . 9 SER OG 1 1 12 2566 1 1 10 PHE C C 9.604 3.518 -20.508 1.00 . A A . 10 PHE C 1 1 12 2567 1 1 10 PHE CA C 8.640 3.158 -19.382 1.00 . A A . 10 PHE CA 1 1 12 2568 1 1 10 PHE CB C 7.840 4.394 -18.964 1.00 . A A . 10 PHE CB 1 1 12 2569 1 1 10 PHE CD1 C 6.454 3.250 -17.213 1.00 . A A . 10 PHE CD1 1 1 12 2570 1 1 10 PHE CD2 C 5.340 4.575 -18.853 1.00 . A A . 10 PHE CD2 1 1 12 2571 1 1 10 PHE CE1 C 5.239 2.947 -16.627 1.00 . A A . 10 PHE CE1 1 1 12 2572 1 1 10 PHE CE2 C 4.123 4.276 -18.271 1.00 . A A . 10 PHE CE2 1 1 12 2573 1 1 10 PHE CG C 6.518 4.067 -18.331 1.00 . A A . 10 PHE CG 1 1 12 2574 1 1 10 PHE CZ C 4.072 3.460 -17.158 1.00 . A A . 10 PHE CZ 1 1 12 2575 1 1 10 PHE H H 9.281 3.053 -17.367 1.00 . A A . 10 PHE H 1 1 12 2576 1 1 10 PHE HA H 7.958 2.401 -19.737 1.00 . A A . 10 PHE HA 1 1 12 2577 1 1 10 PHE HB2 H 8.417 4.963 -18.252 1.00 . A A . 10 PHE HB2 1 1 12 2578 1 1 10 PHE HB3 H 7.651 5.002 -19.836 1.00 . A A . 10 PHE HB3 1 1 12 2579 1 1 10 PHE HD1 H 7.367 2.848 -16.797 1.00 . A A . 10 PHE HD1 1 1 12 2580 1 1 10 PHE HD2 H 5.378 5.212 -19.724 1.00 . A A . 10 PHE HD2 1 1 12 2581 1 1 10 PHE HE1 H 5.204 2.309 -15.757 1.00 . A A . 10 PHE HE1 1 1 12 2582 1 1 10 PHE HE2 H 3.211 4.678 -18.688 1.00 . A A . 10 PHE HE2 1 1 12 2583 1 1 10 PHE HZ H 3.122 3.226 -16.701 1.00 . A A . 10 PHE HZ 1 1 12 2584 1 1 10 PHE N N 9.359 2.610 -18.237 1.00 . A A . 10 PHE N 1 1 12 2585 1 1 10 PHE O O 9.268 3.411 -21.688 1.00 . A A . 10 PHE O 1 1 12 2586 1 1 11 LEU C C 11.982 3.243 -22.175 1.00 . A A . 11 LEU C 1 1 12 2587 1 1 11 LEU CA C 11.820 4.325 -21.113 1.00 . A A . 11 LEU CA 1 1 12 2588 1 1 11 LEU CB C 13.158 4.577 -20.417 1.00 . A A . 11 LEU CB 1 1 12 2589 1 1 11 LEU CD1 C 13.771 6.746 -19.318 1.00 . A A . 11 LEU CD1 1 1 12 2590 1 1 11 LEU CD2 C 15.185 5.844 -21.174 1.00 . A A . 11 LEU CD2 1 1 12 2591 1 1 11 LEU CG C 13.772 5.963 -20.622 1.00 . A A . 11 LEU CG 1 1 12 2592 1 1 11 LEU H H 11.015 4.013 -19.181 1.00 . A A . 11 LEU H 1 1 12 2593 1 1 11 LEU HA H 11.495 5.237 -21.592 1.00 . A A . 11 LEU HA 1 1 12 2594 1 1 11 LEU HB2 H 13.012 4.435 -19.357 1.00 . A A . 11 LEU HB2 1 1 12 2595 1 1 11 LEU HB3 H 13.864 3.844 -20.783 1.00 . A A . 11 LEU HB3 1 1 12 2596 1 1 11 LEU HD11 H 14.065 7.766 -19.511 1.00 . A A . 11 LEU HD11 1 1 12 2597 1 1 11 LEU HD12 H 12.779 6.732 -18.891 1.00 . A A . 11 LEU HD12 1 1 12 2598 1 1 11 LEU HD13 H 14.467 6.294 -18.627 1.00 . A A . 11 LEU HD13 1 1 12 2599 1 1 11 LEU HD21 H 15.538 6.820 -21.473 1.00 . A A . 11 LEU HD21 1 1 12 2600 1 1 11 LEU HD22 H 15.836 5.443 -20.412 1.00 . A A . 11 LEU HD22 1 1 12 2601 1 1 11 LEU HD23 H 15.183 5.184 -22.029 1.00 . A A . 11 LEU HD23 1 1 12 2602 1 1 11 LEU HG H 13.176 6.510 -21.340 1.00 . A A . 11 LEU HG 1 1 12 2603 1 1 11 LEU N N 10.805 3.948 -20.135 1.00 . A A . 11 LEU N 1 1 12 2604 1 1 11 LEU O O 11.499 3.384 -23.299 1.00 . A A . 11 LEU O 1 1 13 2605 1 1 1 LYS C C 3.320 0.569 -3.014 1.00 . A A . 1 LYS C 1 1 13 2606 1 1 1 LYS CA C 4.291 -0.563 -3.334 1.00 . A A . 1 LYS CA 1 1 13 2607 1 1 1 LYS CB C 3.514 -1.849 -3.626 1.00 . A A . 1 LYS CB 1 1 13 2608 1 1 1 LYS CD C 4.534 -4.144 -3.637 1.00 . A A . 1 LYS CD 1 1 13 2609 1 1 1 LYS CE C 4.769 -5.335 -4.554 1.00 . A A . 1 LYS CE 1 1 13 2610 1 1 1 LYS CG C 4.304 -2.868 -4.428 1.00 . A A . 1 LYS CG 1 1 13 2611 1 1 1 LYS H1 H 4.916 -0.635 -1.312 1.00 . A A . 1 LYS H1 1 1 13 2612 1 1 1 LYS HA H 4.865 -0.293 -4.207 1.00 . A A . 1 LYS HA 1 1 13 2613 1 1 1 LYS HB2 H 3.228 -2.303 -2.688 1.00 . A A . 1 LYS HB2 1 1 13 2614 1 1 1 LYS HB3 H 2.622 -1.598 -4.181 1.00 . A A . 1 LYS HB3 1 1 13 2615 1 1 1 LYS HD2 H 5.400 -4.015 -3.005 1.00 . A A . 1 LYS HD2 1 1 13 2616 1 1 1 LYS HD3 H 3.665 -4.339 -3.024 1.00 . A A . 1 LYS HD3 1 1 13 2617 1 1 1 LYS HE2 H 3.979 -5.368 -5.288 1.00 . A A . 1 LYS HE2 1 1 13 2618 1 1 1 LYS HE3 H 5.718 -5.206 -5.052 1.00 . A A . 1 LYS HE3 1 1 13 2619 1 1 1 LYS HG2 H 3.756 -3.108 -5.327 1.00 . A A . 1 LYS HG2 1 1 13 2620 1 1 1 LYS HG3 H 5.262 -2.441 -4.692 1.00 . A A . 1 LYS HG3 1 1 13 2621 1 1 1 LYS HZ1 H 5.714 -6.760 -3.355 1.00 . A A . 1 LYS HZ1 1 1 13 2622 1 1 1 LYS HZ2 H 4.055 -6.610 -3.062 1.00 . A A . 1 LYS HZ2 1 1 13 2623 1 1 1 LYS HZ3 H 4.600 -7.414 -4.447 1.00 . A A . 1 LYS HZ3 1 1 13 2624 1 1 1 LYS N N 5.224 -0.775 -2.233 1.00 . A A . 1 LYS N 1 1 13 2625 1 1 1 LYS NZ N 4.786 -6.620 -3.802 1.00 . A A . 1 LYS NZ 1 1 13 2626 1 1 1 LYS O O 2.392 0.399 -2.223 1.00 . A A . 1 LYS O 1 1 13 2627 1 1 2 PHE C C 2.551 3.710 -4.693 1.00 . A A . 2 PHE C 1 1 13 2628 1 1 2 PHE CA C 2.682 2.883 -3.418 1.00 . A A . 2 PHE CA 1 1 13 2629 1 1 2 PHE CB C 3.241 3.751 -2.289 1.00 . A A . 2 PHE CB 1 1 13 2630 1 1 2 PHE CD1 C 2.200 5.958 -1.705 1.00 . A A . 2 PHE CD1 1 1 13 2631 1 1 2 PHE CD2 C 1.211 3.973 -0.831 1.00 . A A . 2 PHE CD2 1 1 13 2632 1 1 2 PHE CE1 C 1.240 6.721 -1.067 1.00 . A A . 2 PHE CE1 1 1 13 2633 1 1 2 PHE CE2 C 0.248 4.730 -0.191 1.00 . A A . 2 PHE CE2 1 1 13 2634 1 1 2 PHE CG C 2.196 4.577 -1.594 1.00 . A A . 2 PHE CG 1 1 13 2635 1 1 2 PHE CZ C 0.263 6.106 -0.309 1.00 . A A . 2 PHE CZ 1 1 13 2636 1 1 2 PHE H H 4.295 1.797 -4.255 1.00 . A A . 2 PHE H 1 1 13 2637 1 1 2 PHE HA H 1.705 2.524 -3.134 1.00 . A A . 2 PHE HA 1 1 13 2638 1 1 2 PHE HB2 H 3.705 3.115 -1.550 1.00 . A A . 2 PHE HB2 1 1 13 2639 1 1 2 PHE HB3 H 3.982 4.424 -2.695 1.00 . A A . 2 PHE HB3 1 1 13 2640 1 1 2 PHE HD1 H 2.964 6.441 -2.298 1.00 . A A . 2 PHE HD1 1 1 13 2641 1 1 2 PHE HD2 H 1.198 2.897 -0.737 1.00 . A A . 2 PHE HD2 1 1 13 2642 1 1 2 PHE HE1 H 1.254 7.797 -1.162 1.00 . A A . 2 PHE HE1 1 1 13 2643 1 1 2 PHE HE2 H -0.514 4.247 0.401 1.00 . A A . 2 PHE HE2 1 1 13 2644 1 1 2 PHE HZ H -0.488 6.701 0.189 1.00 . A A . 2 PHE HZ 1 1 13 2645 1 1 2 PHE N N 3.539 1.723 -3.636 1.00 . A A . 2 PHE N 1 1 13 2646 1 1 2 PHE O O 2.271 4.908 -4.645 1.00 . A A . 2 PHE O 1 1 13 2647 1 1 3 LYS C C 3.521 4.995 -7.146 1.00 . A A . 3 LYS C 1 1 13 2648 1 1 3 LYS CA C 2.662 3.735 -7.125 1.00 . A A . 3 LYS CA 1 1 13 2649 1 1 3 LYS CB C 1.206 4.092 -7.431 1.00 . A A . 3 LYS CB 1 1 13 2650 1 1 3 LYS CD C 0.510 1.743 -7.989 1.00 . A A . 3 LYS CD 1 1 13 2651 1 1 3 LYS CE C -0.297 0.541 -7.523 1.00 . A A . 3 LYS CE 1 1 13 2652 1 1 3 LYS CG C 0.228 2.968 -7.134 1.00 . A A . 3 LYS CG 1 1 13 2653 1 1 3 LYS H H 2.977 2.107 -5.809 1.00 . A A . 3 LYS H 1 1 13 2654 1 1 3 LYS HA H 3.024 3.055 -7.881 1.00 . A A . 3 LYS HA 1 1 13 2655 1 1 3 LYS HB2 H 0.926 4.950 -6.838 1.00 . A A . 3 LYS HB2 1 1 13 2656 1 1 3 LYS HB3 H 1.122 4.345 -8.478 1.00 . A A . 3 LYS HB3 1 1 13 2657 1 1 3 LYS HD2 H 0.250 1.962 -9.014 1.00 . A A . 3 LYS HD2 1 1 13 2658 1 1 3 LYS HD3 H 1.563 1.506 -7.926 1.00 . A A . 3 LYS HD3 1 1 13 2659 1 1 3 LYS HE2 H -0.164 0.425 -6.459 1.00 . A A . 3 LYS HE2 1 1 13 2660 1 1 3 LYS HE3 H -1.340 0.719 -7.739 1.00 . A A . 3 LYS HE3 1 1 13 2661 1 1 3 LYS HG2 H 0.314 2.694 -6.093 1.00 . A A . 3 LYS HG2 1 1 13 2662 1 1 3 LYS HG3 H -0.776 3.313 -7.336 1.00 . A A . 3 LYS HG3 1 1 13 2663 1 1 3 LYS HZ1 H -0.416 -0.849 -9.078 1.00 . A A . 3 LYS HZ1 1 1 13 2664 1 1 3 LYS HZ2 H 1.142 -0.660 -8.446 1.00 . A A . 3 LYS HZ2 1 1 13 2665 1 1 3 LYS HZ3 H -0.022 -1.529 -7.580 1.00 . A A . 3 LYS HZ3 1 1 13 2666 1 1 3 LYS N N 2.757 3.062 -5.835 1.00 . A A . 3 LYS N 1 1 13 2667 1 1 3 LYS NZ N 0.132 -0.712 -8.205 1.00 . A A . 3 LYS NZ 1 1 13 2668 1 1 3 LYS O O 3.003 6.112 -7.118 1.00 . A A . 3 LYS O 1 1 13 2669 1 1 4 LYS C C 6.315 6.148 -8.631 1.00 . A A . 4 LYS C 1 1 13 2670 1 1 4 LYS CA C 5.767 5.931 -7.225 1.00 . A A . 4 LYS CA 1 1 13 2671 1 1 4 LYS CB C 6.920 5.686 -6.249 1.00 . A A . 4 LYS CB 1 1 13 2672 1 1 4 LYS CD C 8.746 4.116 -5.535 1.00 . A A . 4 LYS CD 1 1 13 2673 1 1 4 LYS CE C 10.022 3.465 -6.047 1.00 . A A . 4 LYS CE 1 1 13 2674 1 1 4 LYS CG C 7.855 4.570 -6.680 1.00 . A A . 4 LYS CG 1 1 13 2675 1 1 4 LYS H H 5.188 3.894 -7.217 1.00 . A A . 4 LYS H 1 1 13 2676 1 1 4 LYS HA H 5.229 6.816 -6.919 1.00 . A A . 4 LYS HA 1 1 13 2677 1 1 4 LYS HB2 H 7.497 6.595 -6.157 1.00 . A A . 4 LYS HB2 1 1 13 2678 1 1 4 LYS HB3 H 6.510 5.431 -5.282 1.00 . A A . 4 LYS HB3 1 1 13 2679 1 1 4 LYS HD2 H 9.009 4.972 -4.933 1.00 . A A . 4 LYS HD2 1 1 13 2680 1 1 4 LYS HD3 H 8.205 3.401 -4.931 1.00 . A A . 4 LYS HD3 1 1 13 2681 1 1 4 LYS HE2 H 9.823 3.020 -7.009 1.00 . A A . 4 LYS HE2 1 1 13 2682 1 1 4 LYS HE3 H 10.781 4.226 -6.152 1.00 . A A . 4 LYS HE3 1 1 13 2683 1 1 4 LYS HG2 H 7.267 3.730 -7.019 1.00 . A A . 4 LYS HG2 1 1 13 2684 1 1 4 LYS HG3 H 8.477 4.926 -7.489 1.00 . A A . 4 LYS HG3 1 1 13 2685 1 1 4 LYS HZ1 H 11.545 2.505 -4.987 1.00 . A A . 4 LYS HZ1 1 1 13 2686 1 1 4 LYS HZ2 H 10.051 2.502 -4.193 1.00 . A A . 4 LYS HZ2 1 1 13 2687 1 1 4 LYS HZ3 H 10.313 1.468 -5.507 1.00 . A A . 4 LYS HZ3 1 1 13 2688 1 1 4 LYS N N 4.835 4.809 -7.197 1.00 . A A . 4 LYS N 1 1 13 2689 1 1 4 LYS NZ N 10.518 2.411 -5.118 1.00 . A A . 4 LYS NZ 1 1 13 2690 1 1 4 LYS O O 6.236 5.263 -9.483 1.00 . A A . 4 LYS O 1 1 13 2691 1 1 5 VAL C C 8.725 6.893 -10.425 1.00 . A A . 5 VAL C 1 1 13 2692 1 1 5 VAL CA C 7.435 7.665 -10.171 1.00 . A A . 5 VAL CA 1 1 13 2693 1 1 5 VAL CB C 7.720 9.174 -10.290 1.00 . A A . 5 VAL CB 1 1 13 2694 1 1 5 VAL CG1 C 8.158 9.524 -11.704 1.00 . A A . 5 VAL CG1 1 1 13 2695 1 1 5 VAL CG2 C 6.496 9.981 -9.887 1.00 . A A . 5 VAL CG2 1 1 13 2696 1 1 5 VAL H H 6.904 7.997 -8.149 1.00 . A A . 5 VAL H 1 1 13 2697 1 1 5 VAL HA H 6.711 7.396 -10.927 1.00 . A A . 5 VAL HA 1 1 13 2698 1 1 5 VAL HB H 8.527 9.421 -9.616 1.00 . A A . 5 VAL HB 1 1 13 2699 1 1 5 VAL HG11 H 8.625 10.498 -11.705 1.00 . A A . 5 VAL HG11 1 1 13 2700 1 1 5 VAL HG12 H 8.864 8.786 -12.056 1.00 . A A . 5 VAL HG12 1 1 13 2701 1 1 5 VAL HG13 H 7.296 9.538 -12.355 1.00 . A A . 5 VAL HG13 1 1 13 2702 1 1 5 VAL HG21 H 6.410 10.848 -10.525 1.00 . A A . 5 VAL HG21 1 1 13 2703 1 1 5 VAL HG22 H 5.612 9.369 -9.990 1.00 . A A . 5 VAL HG22 1 1 13 2704 1 1 5 VAL HG23 H 6.596 10.298 -8.859 1.00 . A A . 5 VAL HG23 1 1 13 2705 1 1 5 VAL N N 6.871 7.332 -8.868 1.00 . A A . 5 VAL N 1 1 13 2706 1 1 5 VAL O O 9.678 6.985 -9.651 1.00 . A A . 5 VAL O 1 1 13 2707 1 1 6 ILE C C 10.091 5.267 -13.385 1.00 . A A . 6 ILE C 1 1 13 2708 1 1 6 ILE CA C 9.921 5.345 -11.872 1.00 . A A . 6 ILE CA 1 1 13 2709 1 1 6 ILE CB C 9.837 3.917 -11.302 1.00 . A A . 6 ILE CB 1 1 13 2710 1 1 6 ILE CD1 C 8.708 2.504 -9.511 1.00 . A A . 6 ILE CD1 1 1 13 2711 1 1 6 ILE CG1 C 8.757 3.840 -10.220 1.00 . A A . 6 ILE CG1 1 1 13 2712 1 1 6 ILE CG2 C 11.186 3.489 -10.744 1.00 . A A . 6 ILE CG2 1 1 13 2713 1 1 6 ILE H H 7.957 6.100 -12.092 1.00 . A A . 6 ILE H 1 1 13 2714 1 1 6 ILE HA H 10.789 5.830 -11.447 1.00 . A A . 6 ILE HA 1 1 13 2715 1 1 6 ILE HB H 9.578 3.247 -12.107 1.00 . A A . 6 ILE HB 1 1 13 2716 1 1 6 ILE HD11 H 7.904 2.510 -8.789 1.00 . A A . 6 ILE HD11 1 1 13 2717 1 1 6 ILE HD12 H 8.537 1.720 -10.233 1.00 . A A . 6 ILE HD12 1 1 13 2718 1 1 6 ILE HD13 H 9.646 2.330 -9.005 1.00 . A A . 6 ILE HD13 1 1 13 2719 1 1 6 ILE HG12 H 8.944 4.601 -9.479 1.00 . A A . 6 ILE HG12 1 1 13 2720 1 1 6 ILE HG13 H 7.792 4.012 -10.672 1.00 . A A . 6 ILE HG13 1 1 13 2721 1 1 6 ILE HG21 H 11.967 4.079 -11.199 1.00 . A A . 6 ILE HG21 1 1 13 2722 1 1 6 ILE HG22 H 11.197 3.639 -9.674 1.00 . A A . 6 ILE HG22 1 1 13 2723 1 1 6 ILE HG23 H 11.350 2.444 -10.962 1.00 . A A . 6 ILE HG23 1 1 13 2724 1 1 6 ILE N N 8.747 6.132 -11.515 1.00 . A A . 6 ILE N 1 1 13 2725 1 1 6 ILE O O 9.380 4.525 -14.062 1.00 . A A . 6 ILE O 1 1 13 2726 1 1 7 TRP C C 11.681 4.663 -15.843 1.00 . A A . 7 TRP C 1 1 13 2727 1 1 7 TRP CA C 11.304 6.053 -15.343 1.00 . A A . 7 TRP CA 1 1 13 2728 1 1 7 TRP CB C 12.423 7.045 -15.664 1.00 . A A . 7 TRP CB 1 1 13 2729 1 1 7 TRP CD1 C 14.162 6.900 -17.541 1.00 . A A . 7 TRP CD1 1 1 13 2730 1 1 7 TRP CD2 C 12.042 7.019 -18.256 1.00 . A A . 7 TRP CD2 1 1 13 2731 1 1 7 TRP CE2 C 12.892 6.944 -19.378 1.00 . A A . 7 TRP CE2 1 1 13 2732 1 1 7 TRP CE3 C 10.663 7.100 -18.461 1.00 . A A . 7 TRP CE3 1 1 13 2733 1 1 7 TRP CG C 12.875 6.989 -17.092 1.00 . A A . 7 TRP CG 1 1 13 2734 1 1 7 TRP CH2 C 11.049 7.030 -20.853 1.00 . A A . 7 TRP CH2 1 1 13 2735 1 1 7 TRP CZ2 C 12.404 6.949 -20.682 1.00 . A A . 7 TRP CZ2 1 1 13 2736 1 1 7 TRP CZ3 C 10.180 7.106 -19.756 1.00 . A A . 7 TRP CZ3 1 1 13 2737 1 1 7 TRP H H 11.574 6.607 -13.317 1.00 . A A . 7 TRP H 1 1 13 2738 1 1 7 TRP HA H 10.400 6.370 -15.842 1.00 . A A . 7 TRP HA 1 1 13 2739 1 1 7 TRP HB2 H 12.075 8.048 -15.464 1.00 . A A . 7 TRP HB2 1 1 13 2740 1 1 7 TRP HB3 H 13.275 6.831 -15.035 1.00 . A A . 7 TRP HB3 1 1 13 2741 1 1 7 TRP HD1 H 15.028 6.859 -16.899 1.00 . A A . 7 TRP HD1 1 1 13 2742 1 1 7 TRP HE1 H 14.983 6.811 -19.472 1.00 . A A . 7 TRP HE1 1 1 13 2743 1 1 7 TRP HE3 H 9.977 7.159 -17.629 1.00 . A A . 7 TRP HE3 1 1 13 2744 1 1 7 TRP HH2 H 10.628 7.037 -21.847 1.00 . A A . 7 TRP HH2 1 1 13 2745 1 1 7 TRP HZ2 H 13.061 6.891 -21.538 1.00 . A A . 7 TRP HZ2 1 1 13 2746 1 1 7 TRP HZ3 H 9.117 7.168 -19.934 1.00 . A A . 7 TRP HZ3 1 1 13 2747 1 1 7 TRP N N 11.039 6.036 -13.909 1.00 . A A . 7 TRP N 1 1 13 2748 1 1 7 TRP NE1 N 14.179 6.873 -18.915 1.00 . A A . 7 TRP NE1 1 1 13 2749 1 1 7 TRP O O 11.325 4.275 -16.956 1.00 . A A . 7 TRP O 1 1 13 2750 1 1 8 LYS C C 11.626 1.696 -15.727 1.00 . A A . 8 LYS C 1 1 13 2751 1 1 8 LYS CA C 12.827 2.568 -15.372 1.00 . A A . 8 LYS CA 1 1 13 2752 1 1 8 LYS CB C 13.608 1.934 -14.218 1.00 . A A . 8 LYS CB 1 1 13 2753 1 1 8 LYS CD C 14.727 3.304 -12.435 1.00 . A A . 8 LYS CD 1 1 13 2754 1 1 8 LYS CE C 15.311 2.378 -11.380 1.00 . A A . 8 LYS CE 1 1 13 2755 1 1 8 LYS CG C 14.853 2.711 -13.828 1.00 . A A . 8 LYS CG 1 1 13 2756 1 1 8 LYS H H 12.655 4.281 -14.140 1.00 . A A . 8 LYS H 1 1 13 2757 1 1 8 LYS HA H 13.471 2.641 -16.235 1.00 . A A . 8 LYS HA 1 1 13 2758 1 1 8 LYS HB2 H 12.963 1.872 -13.354 1.00 . A A . 8 LYS HB2 1 1 13 2759 1 1 8 LYS HB3 H 13.906 0.937 -14.507 1.00 . A A . 8 LYS HB3 1 1 13 2760 1 1 8 LYS HD2 H 15.257 4.245 -12.405 1.00 . A A . 8 LYS HD2 1 1 13 2761 1 1 8 LYS HD3 H 13.682 3.471 -12.217 1.00 . A A . 8 LYS HD3 1 1 13 2762 1 1 8 LYS HE2 H 16.319 2.119 -11.665 1.00 . A A . 8 LYS HE2 1 1 13 2763 1 1 8 LYS HE3 H 15.327 2.897 -10.433 1.00 . A A . 8 LYS HE3 1 1 13 2764 1 1 8 LYS HG2 H 15.703 2.045 -13.849 1.00 . A A . 8 LYS HG2 1 1 13 2765 1 1 8 LYS HG3 H 15.004 3.512 -14.539 1.00 . A A . 8 LYS HG3 1 1 13 2766 1 1 8 LYS HZ1 H 13.514 1.362 -11.059 1.00 . A A . 8 LYS HZ1 1 1 13 2767 1 1 8 LYS HZ2 H 14.577 0.561 -12.104 1.00 . A A . 8 LYS HZ2 1 1 13 2768 1 1 8 LYS HZ3 H 14.872 0.565 -10.438 1.00 . A A . 8 LYS HZ3 1 1 13 2769 1 1 8 LYS N N 12.402 3.916 -15.015 1.00 . A A . 8 LYS N 1 1 13 2770 1 1 8 LYS NZ N 14.513 1.129 -11.235 1.00 . A A . 8 LYS NZ 1 1 13 2771 1 1 8 LYS O O 11.706 0.844 -16.611 1.00 . A A . 8 LYS O 1 1 13 2772 1 1 9 SER C C 8.491 1.754 -16.416 1.00 . A A . 9 SER C 1 1 13 2773 1 1 9 SER CA C 9.299 1.148 -15.272 1.00 . A A . 9 SER CA 1 1 13 2774 1 1 9 SER CB C 8.446 1.093 -14.003 1.00 . A A . 9 SER CB 1 1 13 2775 1 1 9 SER H H 10.514 2.609 -14.339 1.00 . A A . 9 SER H 1 1 13 2776 1 1 9 SER HA H 9.589 0.144 -15.544 1.00 . A A . 9 SER HA 1 1 13 2777 1 1 9 SER HB2 H 8.901 0.416 -13.296 1.00 . A A . 9 SER HB2 1 1 13 2778 1 1 9 SER HB3 H 8.387 2.081 -13.570 1.00 . A A . 9 SER HB3 1 1 13 2779 1 1 9 SER HG H 6.696 0.391 -13.473 1.00 . A A . 9 SER HG 1 1 13 2780 1 1 9 SER N N 10.515 1.916 -15.032 1.00 . A A . 9 SER N 1 1 13 2781 1 1 9 SER O O 7.887 1.036 -17.213 1.00 . A A . 9 SER O 1 1 13 2782 1 1 9 SER OG O 7.134 0.640 -14.290 1.00 . A A . 9 SER OG 1 1 13 2783 1 1 10 PHE C C 8.298 3.435 -18.914 1.00 . A A . 10 PHE C 1 1 13 2784 1 1 10 PHE CA C 7.750 3.785 -17.533 1.00 . A A . 10 PHE CA 1 1 13 2785 1 1 10 PHE CB C 7.829 5.297 -17.310 1.00 . A A . 10 PHE CB 1 1 13 2786 1 1 10 PHE CD1 C 7.564 6.670 -15.227 1.00 . A A . 10 PHE CD1 1 1 13 2787 1 1 10 PHE CD2 C 5.731 5.319 -15.934 1.00 . A A . 10 PHE CD2 1 1 13 2788 1 1 10 PHE CE1 C 6.827 7.110 -14.143 1.00 . A A . 10 PHE CE1 1 1 13 2789 1 1 10 PHE CE2 C 4.989 5.755 -14.852 1.00 . A A . 10 PHE CE2 1 1 13 2790 1 1 10 PHE CG C 7.025 5.772 -16.134 1.00 . A A . 10 PHE CG 1 1 13 2791 1 1 10 PHE CZ C 5.538 6.650 -13.955 1.00 . A A . 10 PHE CZ 1 1 13 2792 1 1 10 PHE H H 8.985 3.599 -15.824 1.00 . A A . 10 PHE H 1 1 13 2793 1 1 10 PHE HA H 6.718 3.475 -17.479 1.00 . A A . 10 PHE HA 1 1 13 2794 1 1 10 PHE HB2 H 8.858 5.576 -17.143 1.00 . A A . 10 PHE HB2 1 1 13 2795 1 1 10 PHE HB3 H 7.462 5.803 -18.191 1.00 . A A . 10 PHE HB3 1 1 13 2796 1 1 10 PHE HD1 H 8.573 7.030 -15.373 1.00 . A A . 10 PHE HD1 1 1 13 2797 1 1 10 PHE HD2 H 5.300 4.618 -16.634 1.00 . A A . 10 PHE HD2 1 1 13 2798 1 1 10 PHE HE1 H 7.260 7.810 -13.444 1.00 . A A . 10 PHE HE1 1 1 13 2799 1 1 10 PHE HE2 H 3.982 5.394 -14.707 1.00 . A A . 10 PHE HE2 1 1 13 2800 1 1 10 PHE HZ H 4.961 6.993 -13.110 1.00 . A A . 10 PHE HZ 1 1 13 2801 1 1 10 PHE N N 8.485 3.081 -16.489 1.00 . A A . 10 PHE N 1 1 13 2802 1 1 10 PHE O O 7.548 3.343 -19.887 1.00 . A A . 10 PHE O 1 1 13 2803 1 1 11 LEU C C 10.343 1.387 -20.431 1.00 . A A . 11 LEU C 1 1 13 2804 1 1 11 LEU CA C 10.259 2.900 -20.253 1.00 . A A . 11 LEU CA 1 1 13 2805 1 1 11 LEU CB C 11.661 3.509 -20.307 1.00 . A A . 11 LEU CB 1 1 13 2806 1 1 11 LEU CD1 C 12.279 2.560 -22.543 1.00 . A A . 11 LEU CD1 1 1 13 2807 1 1 11 LEU CD2 C 14.066 3.397 -21.006 1.00 . A A . 11 LEU CD2 1 1 13 2808 1 1 11 LEU CG C 12.707 2.717 -21.093 1.00 . A A . 11 LEU CG 1 1 13 2809 1 1 11 LEU H H 10.155 3.328 -18.182 1.00 . A A . 11 LEU H 1 1 13 2810 1 1 11 LEU HA H 9.665 3.313 -21.054 1.00 . A A . 11 LEU HA 1 1 13 2811 1 1 11 LEU HB2 H 11.580 4.486 -20.758 1.00 . A A . 11 LEU HB2 1 1 13 2812 1 1 11 LEU HB3 H 12.016 3.612 -19.292 1.00 . A A . 11 LEU HB3 1 1 13 2813 1 1 11 LEU HD11 H 11.234 2.292 -22.583 1.00 . A A . 11 LEU HD11 1 1 13 2814 1 1 11 LEU HD12 H 12.432 3.492 -23.067 1.00 . A A . 11 LEU HD12 1 1 13 2815 1 1 11 LEU HD13 H 12.868 1.784 -23.010 1.00 . A A . 11 LEU HD13 1 1 13 2816 1 1 11 LEU HD21 H 14.142 4.149 -21.778 1.00 . A A . 11 LEU HD21 1 1 13 2817 1 1 11 LEU HD22 H 14.175 3.862 -20.038 1.00 . A A . 11 LEU HD22 1 1 13 2818 1 1 11 LEU HD23 H 14.846 2.662 -21.142 1.00 . A A . 11 LEU HD23 1 1 13 2819 1 1 11 LEU HG H 12.799 1.729 -20.663 1.00 . A A . 11 LEU HG 1 1 13 2820 1 1 11 LEU N N 9.610 3.240 -18.992 1.00 . A A . 11 LEU N 1 1 13 2821 1 1 11 LEU O O 9.448 0.653 -20.013 1.00 . A A . 11 LEU O 1 1 14 2822 1 1 1 LYS C C 2.932 0.633 -1.596 1.00 . A A . 1 LYS C 1 1 14 2823 1 1 1 LYS CA C 2.474 -0.816 -1.465 1.00 . A A . 1 LYS CA 1 1 14 2824 1 1 1 LYS CB C 1.067 -0.971 -2.046 1.00 . A A . 1 LYS CB 1 1 14 2825 1 1 1 LYS CD C -0.374 -2.462 -3.464 1.00 . A A . 1 LYS CD 1 1 14 2826 1 1 1 LYS CE C -1.637 -3.127 -2.937 1.00 . A A . 1 LYS CE 1 1 14 2827 1 1 1 LYS CG C 0.710 -2.404 -2.401 1.00 . A A . 1 LYS CG 1 1 14 2828 1 1 1 LYS H1 H 3.271 -1.744 0.263 1.00 . A A . 1 LYS H1 1 1 14 2829 1 1 1 LYS HA H 3.154 -1.447 -2.017 1.00 . A A . 1 LYS HA 1 1 14 2830 1 1 1 LYS HB2 H 0.350 -0.612 -1.322 1.00 . A A . 1 LYS HB2 1 1 14 2831 1 1 1 LYS HB3 H 0.992 -0.371 -2.941 1.00 . A A . 1 LYS HB3 1 1 14 2832 1 1 1 LYS HD2 H -0.615 -1.456 -3.776 1.00 . A A . 1 LYS HD2 1 1 14 2833 1 1 1 LYS HD3 H -0.007 -3.025 -4.310 1.00 . A A . 1 LYS HD3 1 1 14 2834 1 1 1 LYS HE2 H -2.132 -3.628 -3.755 1.00 . A A . 1 LYS HE2 1 1 14 2835 1 1 1 LYS HE3 H -1.359 -3.852 -2.186 1.00 . A A . 1 LYS HE3 1 1 14 2836 1 1 1 LYS HG2 H 1.591 -2.903 -2.774 1.00 . A A . 1 LYS HG2 1 1 14 2837 1 1 1 LYS HG3 H 0.357 -2.908 -1.512 1.00 . A A . 1 LYS HG3 1 1 14 2838 1 1 1 LYS HZ1 H -2.083 -1.575 -1.612 1.00 . A A . 1 LYS HZ1 1 1 14 2839 1 1 1 LYS HZ2 H -2.940 -1.499 -3.069 1.00 . A A . 1 LYS HZ2 1 1 14 2840 1 1 1 LYS HZ3 H -3.375 -2.631 -1.890 1.00 . A A . 1 LYS HZ3 1 1 14 2841 1 1 1 LYS N N 2.496 -1.245 -0.072 1.00 . A A . 1 LYS N 1 1 14 2842 1 1 1 LYS NZ N -2.574 -2.139 -2.335 1.00 . A A . 1 LYS NZ 1 1 14 2843 1 1 1 LYS O O 3.024 1.357 -0.604 1.00 . A A . 1 LYS O 1 1 14 2844 1 1 2 PHE C C 3.151 2.907 -4.433 1.00 . A A . 2 PHE C 1 1 14 2845 1 1 2 PHE CA C 3.666 2.413 -3.085 1.00 . A A . 2 PHE CA 1 1 14 2846 1 1 2 PHE CB C 5.194 2.485 -3.053 1.00 . A A . 2 PHE CB 1 1 14 2847 1 1 2 PHE CD1 C 5.822 2.900 -0.659 1.00 . A A . 2 PHE CD1 1 1 14 2848 1 1 2 PHE CD2 C 6.312 0.767 -1.605 1.00 . A A . 2 PHE CD2 1 1 14 2849 1 1 2 PHE CE1 C 6.367 2.495 0.545 1.00 . A A . 2 PHE CE1 1 1 14 2850 1 1 2 PHE CE2 C 6.858 0.356 -0.404 1.00 . A A . 2 PHE CE2 1 1 14 2851 1 1 2 PHE CG C 5.788 2.041 -1.746 1.00 . A A . 2 PHE CG 1 1 14 2852 1 1 2 PHE CZ C 6.887 1.222 0.672 1.00 . A A . 2 PHE CZ 1 1 14 2853 1 1 2 PHE H H 3.125 0.426 -3.575 1.00 . A A . 2 PHE H 1 1 14 2854 1 1 2 PHE HA H 3.268 3.046 -2.307 1.00 . A A . 2 PHE HA 1 1 14 2855 1 1 2 PHE HB2 H 5.594 1.851 -3.830 1.00 . A A . 2 PHE HB2 1 1 14 2856 1 1 2 PHE HB3 H 5.503 3.504 -3.230 1.00 . A A . 2 PHE HB3 1 1 14 2857 1 1 2 PHE HD1 H 5.415 3.896 -0.757 1.00 . A A . 2 PHE HD1 1 1 14 2858 1 1 2 PHE HD2 H 6.292 0.089 -2.446 1.00 . A A . 2 PHE HD2 1 1 14 2859 1 1 2 PHE HE1 H 6.388 3.174 1.384 1.00 . A A . 2 PHE HE1 1 1 14 2860 1 1 2 PHE HE2 H 7.265 -0.640 -0.307 1.00 . A A . 2 PHE HE2 1 1 14 2861 1 1 2 PHE HZ H 7.313 0.903 1.612 1.00 . A A . 2 PHE HZ 1 1 14 2862 1 1 2 PHE N N 3.218 1.050 -2.825 1.00 . A A . 2 PHE N 1 1 14 2863 1 1 2 PHE O O 2.844 2.114 -5.323 1.00 . A A . 2 PHE O 1 1 14 2864 1 1 3 LYS C C 3.593 5.830 -6.359 1.00 . A A . 3 LYS C 1 1 14 2865 1 1 3 LYS CA C 2.579 4.828 -5.816 1.00 . A A . 3 LYS CA 1 1 14 2866 1 1 3 LYS CB C 1.235 5.521 -5.584 1.00 . A A . 3 LYS CB 1 1 14 2867 1 1 3 LYS CD C 1.136 7.947 -4.941 1.00 . A A . 3 LYS CD 1 1 14 2868 1 1 3 LYS CE C 2.015 8.894 -4.138 1.00 . A A . 3 LYS CE 1 1 14 2869 1 1 3 LYS CG C 1.254 6.518 -4.439 1.00 . A A . 3 LYS CG 1 1 14 2870 1 1 3 LYS H H 3.316 4.807 -3.831 1.00 . A A . 3 LYS H 1 1 14 2871 1 1 3 LYS HA H 2.448 4.038 -6.540 1.00 . A A . 3 LYS HA 1 1 14 2872 1 1 3 LYS HB2 H 0.954 6.045 -6.486 1.00 . A A . 3 LYS HB2 1 1 14 2873 1 1 3 LYS HB3 H 0.489 4.770 -5.368 1.00 . A A . 3 LYS HB3 1 1 14 2874 1 1 3 LYS HD2 H 1.442 7.982 -5.976 1.00 . A A . 3 LYS HD2 1 1 14 2875 1 1 3 LYS HD3 H 0.107 8.266 -4.857 1.00 . A A . 3 LYS HD3 1 1 14 2876 1 1 3 LYS HE2 H 2.767 8.317 -3.623 1.00 . A A . 3 LYS HE2 1 1 14 2877 1 1 3 LYS HE3 H 2.493 9.584 -4.817 1.00 . A A . 3 LYS HE3 1 1 14 2878 1 1 3 LYS HG2 H 0.424 6.311 -3.779 1.00 . A A . 3 LYS HG2 1 1 14 2879 1 1 3 LYS HG3 H 2.182 6.412 -3.896 1.00 . A A . 3 LYS HG3 1 1 14 2880 1 1 3 LYS HZ1 H 0.212 9.606 -3.357 1.00 . A A . 3 LYS HZ1 1 1 14 2881 1 1 3 LYS HZ2 H 1.387 9.283 -2.183 1.00 . A A . 3 LYS HZ2 1 1 14 2882 1 1 3 LYS HZ3 H 1.515 10.666 -3.150 1.00 . A A . 3 LYS HZ3 1 1 14 2883 1 1 3 LYS N N 3.057 4.225 -4.577 1.00 . A A . 3 LYS N 1 1 14 2884 1 1 3 LYS NZ N 1.227 9.666 -3.137 1.00 . A A . 3 LYS NZ 1 1 14 2885 1 1 3 LYS O O 3.223 6.865 -6.913 1.00 . A A . 3 LYS O 1 1 14 2886 1 1 4 LYS C C 6.009 6.380 -8.200 1.00 . A A . 4 LYS C 1 1 14 2887 1 1 4 LYS CA C 5.942 6.385 -6.676 1.00 . A A . 4 LYS CA 1 1 14 2888 1 1 4 LYS CB C 7.286 5.943 -6.094 1.00 . A A . 4 LYS CB 1 1 14 2889 1 1 4 LYS CD C 8.628 3.869 -5.637 1.00 . A A . 4 LYS CD 1 1 14 2890 1 1 4 LYS CE C 9.547 2.862 -6.312 1.00 . A A . 4 LYS CE 1 1 14 2891 1 1 4 LYS CG C 7.787 4.622 -6.654 1.00 . A A . 4 LYS CG 1 1 14 2892 1 1 4 LYS H H 5.107 4.675 -5.750 1.00 . A A . 4 LYS H 1 1 14 2893 1 1 4 LYS HA H 5.727 7.388 -6.341 1.00 . A A . 4 LYS HA 1 1 14 2894 1 1 4 LYS HB2 H 8.024 6.703 -6.306 1.00 . A A . 4 LYS HB2 1 1 14 2895 1 1 4 LYS HB3 H 7.185 5.841 -5.023 1.00 . A A . 4 LYS HB3 1 1 14 2896 1 1 4 LYS HD2 H 9.229 4.575 -5.086 1.00 . A A . 4 LYS HD2 1 1 14 2897 1 1 4 LYS HD3 H 7.971 3.344 -4.958 1.00 . A A . 4 LYS HD3 1 1 14 2898 1 1 4 LYS HE2 H 9.965 3.313 -7.198 1.00 . A A . 4 LYS HE2 1 1 14 2899 1 1 4 LYS HE3 H 10.343 2.607 -5.628 1.00 . A A . 4 LYS HE3 1 1 14 2900 1 1 4 LYS HG2 H 6.938 4.013 -6.926 1.00 . A A . 4 LYS HG2 1 1 14 2901 1 1 4 LYS HG3 H 8.388 4.818 -7.531 1.00 . A A . 4 LYS HG3 1 1 14 2902 1 1 4 LYS HZ1 H 9.491 0.918 -7.073 1.00 . A A . 4 LYS HZ1 1 1 14 2903 1 1 4 LYS HZ2 H 8.343 1.214 -5.867 1.00 . A A . 4 LYS HZ2 1 1 14 2904 1 1 4 LYS HZ3 H 8.111 1.831 -7.425 1.00 . A A . 4 LYS HZ3 1 1 14 2905 1 1 4 LYS N N 4.874 5.515 -6.199 1.00 . A A . 4 LYS N 1 1 14 2906 1 1 4 LYS NZ N 8.822 1.619 -6.696 1.00 . A A . 4 LYS NZ 1 1 14 2907 1 1 4 LYS O O 5.166 5.779 -8.866 1.00 . A A . 4 LYS O 1 1 14 2908 1 1 5 VAL C C 8.337 6.218 -10.648 1.00 . A A . 5 VAL C 1 1 14 2909 1 1 5 VAL CA C 7.197 7.121 -10.191 1.00 . A A . 5 VAL CA 1 1 14 2910 1 1 5 VAL CB C 7.481 8.563 -10.652 1.00 . A A . 5 VAL CB 1 1 14 2911 1 1 5 VAL CG1 C 7.694 8.610 -12.158 1.00 . A A . 5 VAL CG1 1 1 14 2912 1 1 5 VAL CG2 C 6.348 9.488 -10.236 1.00 . A A . 5 VAL CG2 1 1 14 2913 1 1 5 VAL H H 7.658 7.510 -8.162 1.00 . A A . 5 VAL H 1 1 14 2914 1 1 5 VAL HA H 6.280 6.790 -10.657 1.00 . A A . 5 VAL HA 1 1 14 2915 1 1 5 VAL HB H 8.388 8.900 -10.173 1.00 . A A . 5 VAL HB 1 1 14 2916 1 1 5 VAL HG11 H 8.742 8.473 -12.378 1.00 . A A . 5 VAL HG11 1 1 14 2917 1 1 5 VAL HG12 H 7.122 7.823 -12.627 1.00 . A A . 5 VAL HG12 1 1 14 2918 1 1 5 VAL HG13 H 7.368 9.567 -12.538 1.00 . A A . 5 VAL HG13 1 1 14 2919 1 1 5 VAL HG21 H 5.522 8.901 -9.863 1.00 . A A . 5 VAL HG21 1 1 14 2920 1 1 5 VAL HG22 H 6.695 10.156 -9.462 1.00 . A A . 5 VAL HG22 1 1 14 2921 1 1 5 VAL HG23 H 6.022 10.065 -11.090 1.00 . A A . 5 VAL HG23 1 1 14 2922 1 1 5 VAL N N 7.018 7.051 -8.746 1.00 . A A . 5 VAL N 1 1 14 2923 1 1 5 VAL O O 9.365 6.114 -9.979 1.00 . A A . 5 VAL O 1 1 14 2924 1 1 6 ILE C C 9.384 4.941 -13.824 1.00 . A A . 6 ILE C 1 1 14 2925 1 1 6 ILE CA C 9.161 4.675 -12.339 1.00 . A A . 6 ILE CA 1 1 14 2926 1 1 6 ILE CB C 8.774 3.197 -12.145 1.00 . A A . 6 ILE CB 1 1 14 2927 1 1 6 ILE CD1 C 6.883 3.291 -10.444 1.00 . A A . 6 ILE CD1 1 1 14 2928 1 1 6 ILE CG1 C 7.271 3.071 -11.889 1.00 . A A . 6 ILE CG1 1 1 14 2929 1 1 6 ILE CG2 C 9.565 2.588 -10.998 1.00 . A A . 6 ILE CG2 1 1 14 2930 1 1 6 ILE H H 7.307 5.693 -12.279 1.00 . A A . 6 ILE H 1 1 14 2931 1 1 6 ILE HA H 10.086 4.857 -11.810 1.00 . A A . 6 ILE HA 1 1 14 2932 1 1 6 ILE HB H 9.024 2.661 -13.048 1.00 . A A . 6 ILE HB 1 1 14 2933 1 1 6 ILE HD11 H 5.906 3.747 -10.398 1.00 . A A . 6 ILE HD11 1 1 14 2934 1 1 6 ILE HD12 H 6.862 2.342 -9.928 1.00 . A A . 6 ILE HD12 1 1 14 2935 1 1 6 ILE HD13 H 7.606 3.940 -9.972 1.00 . A A . 6 ILE HD13 1 1 14 2936 1 1 6 ILE HG12 H 6.747 3.801 -12.487 1.00 . A A . 6 ILE HG12 1 1 14 2937 1 1 6 ILE HG13 H 6.947 2.080 -12.174 1.00 . A A . 6 ILE HG13 1 1 14 2938 1 1 6 ILE HG21 H 9.456 3.205 -10.118 1.00 . A A . 6 ILE HG21 1 1 14 2939 1 1 6 ILE HG22 H 9.192 1.596 -10.790 1.00 . A A . 6 ILE HG22 1 1 14 2940 1 1 6 ILE HG23 H 10.609 2.531 -11.270 1.00 . A A . 6 ILE HG23 1 1 14 2941 1 1 6 ILE N N 8.148 5.568 -11.791 1.00 . A A . 6 ILE N 1 1 14 2942 1 1 6 ILE O O 8.633 4.455 -14.671 1.00 . A A . 6 ILE O 1 1 14 2943 1 1 7 TRP C C 11.509 4.904 -16.182 1.00 . A A . 7 TRP C 1 1 14 2944 1 1 7 TRP CA C 10.742 6.041 -15.517 1.00 . A A . 7 TRP CA 1 1 14 2945 1 1 7 TRP CB C 11.562 7.331 -15.579 1.00 . A A . 7 TRP CB 1 1 14 2946 1 1 7 TRP CD1 C 13.394 7.961 -17.256 1.00 . A A . 7 TRP CD1 1 1 14 2947 1 1 7 TRP CD2 C 11.385 7.602 -18.179 1.00 . A A . 7 TRP CD2 1 1 14 2948 1 1 7 TRP CE2 C 12.295 7.938 -19.200 1.00 . A A . 7 TRP CE2 1 1 14 2949 1 1 7 TRP CE3 C 10.058 7.331 -18.522 1.00 . A A . 7 TRP CE3 1 1 14 2950 1 1 7 TRP CG C 12.109 7.622 -16.943 1.00 . A A . 7 TRP CG 1 1 14 2951 1 1 7 TRP CH2 C 10.612 7.740 -20.846 1.00 . A A . 7 TRP CH2 1 1 14 2952 1 1 7 TRP CZ2 C 11.918 8.010 -20.538 1.00 . A A . 7 TRP CZ2 1 1 14 2953 1 1 7 TRP CZ3 C 9.685 7.404 -19.850 1.00 . A A . 7 TRP CZ3 1 1 14 2954 1 1 7 TRP H H 10.981 6.070 -13.413 1.00 . A A . 7 TRP H 1 1 14 2955 1 1 7 TRP HA H 9.812 6.191 -16.046 1.00 . A A . 7 TRP HA 1 1 14 2956 1 1 7 TRP HB2 H 10.938 8.161 -15.285 1.00 . A A . 7 TRP HB2 1 1 14 2957 1 1 7 TRP HB3 H 12.395 7.251 -14.895 1.00 . A A . 7 TRP HB3 1 1 14 2958 1 1 7 TRP HD1 H 14.189 8.061 -16.533 1.00 . A A . 7 TRP HD1 1 1 14 2959 1 1 7 TRP HE1 H 14.338 8.401 -19.080 1.00 . A A . 7 TRP HE1 1 1 14 2960 1 1 7 TRP HE3 H 9.328 7.070 -17.769 1.00 . A A . 7 TRP HE3 1 1 14 2961 1 1 7 TRP HH2 H 10.277 7.785 -21.870 1.00 . A A . 7 TRP HH2 1 1 14 2962 1 1 7 TRP HZ2 H 12.621 8.267 -21.317 1.00 . A A . 7 TRP HZ2 1 1 14 2963 1 1 7 TRP HZ3 H 8.663 7.198 -20.134 1.00 . A A . 7 TRP HZ3 1 1 14 2964 1 1 7 TRP N N 10.419 5.713 -14.133 1.00 . A A . 7 TRP N 1 1 14 2965 1 1 7 TRP NE1 N 13.513 8.152 -18.612 1.00 . A A . 7 TRP NE1 1 1 14 2966 1 1 7 TRP O O 11.330 4.631 -17.369 1.00 . A A . 7 TRP O 1 1 14 2967 1 1 8 LYS C C 12.262 2.056 -16.528 1.00 . A A . 8 LYS C 1 1 14 2968 1 1 8 LYS CA C 13.158 3.132 -15.923 1.00 . A A . 8 LYS CA 1 1 14 2969 1 1 8 LYS CB C 14.012 2.529 -14.806 1.00 . A A . 8 LYS CB 1 1 14 2970 1 1 8 LYS CD C 14.753 3.583 -12.649 1.00 . A A . 8 LYS CD 1 1 14 2971 1 1 8 LYS CE C 15.483 4.766 -12.032 1.00 . A A . 8 LYS CE 1 1 14 2972 1 1 8 LYS CG C 14.953 3.528 -14.154 1.00 . A A . 8 LYS CG 1 1 14 2973 1 1 8 LYS H H 12.463 4.506 -14.470 1.00 . A A . 8 LYS H 1 1 14 2974 1 1 8 LYS HA H 13.808 3.517 -16.694 1.00 . A A . 8 LYS HA 1 1 14 2975 1 1 8 LYS HB2 H 13.359 2.132 -14.043 1.00 . A A . 8 LYS HB2 1 1 14 2976 1 1 8 LYS HB3 H 14.604 1.724 -15.216 1.00 . A A . 8 LYS HB3 1 1 14 2977 1 1 8 LYS HD2 H 13.698 3.675 -12.438 1.00 . A A . 8 LYS HD2 1 1 14 2978 1 1 8 LYS HD3 H 15.131 2.670 -12.211 1.00 . A A . 8 LYS HD3 1 1 14 2979 1 1 8 LYS HE2 H 15.817 4.491 -11.044 1.00 . A A . 8 LYS HE2 1 1 14 2980 1 1 8 LYS HE3 H 16.337 5.006 -12.648 1.00 . A A . 8 LYS HE3 1 1 14 2981 1 1 8 LYS HG2 H 15.972 3.236 -14.360 1.00 . A A . 8 LYS HG2 1 1 14 2982 1 1 8 LYS HG3 H 14.767 4.508 -14.569 1.00 . A A . 8 LYS HG3 1 1 14 2983 1 1 8 LYS HZ1 H 15.131 6.757 -11.505 1.00 . A A . 8 LYS HZ1 1 1 14 2984 1 1 8 LYS HZ2 H 14.279 6.251 -12.877 1.00 . A A . 8 LYS HZ2 1 1 14 2985 1 1 8 LYS HZ3 H 13.778 5.755 -11.339 1.00 . A A . 8 LYS HZ3 1 1 14 2986 1 1 8 LYS N N 12.364 4.242 -15.410 1.00 . A A . 8 LYS N 1 1 14 2987 1 1 8 LYS NZ N 14.606 5.966 -11.931 1.00 . A A . 8 LYS NZ 1 1 14 2988 1 1 8 LYS O O 12.619 1.424 -17.522 1.00 . A A . 8 LYS O 1 1 14 2989 1 1 9 SER C C 9.309 1.404 -17.550 1.00 . A A . 9 SER C 1 1 14 2990 1 1 9 SER CA C 10.149 0.853 -16.402 1.00 . A A . 9 SER CA 1 1 14 2991 1 1 9 SER CB C 9.237 0.397 -15.262 1.00 . A A . 9 SER CB 1 1 14 2992 1 1 9 SER H H 10.867 2.390 -15.135 1.00 . A A . 9 SER H 1 1 14 2993 1 1 9 SER HA H 10.715 0.006 -16.760 1.00 . A A . 9 SER HA 1 1 14 2994 1 1 9 SER HB2 H 9.005 -0.650 -15.386 1.00 . A A . 9 SER HB2 1 1 14 2995 1 1 9 SER HB3 H 9.744 0.544 -14.319 1.00 . A A . 9 SER HB3 1 1 14 2996 1 1 9 SER HG H 7.365 0.655 -14.747 1.00 . A A . 9 SER HG 1 1 14 2997 1 1 9 SER N N 11.095 1.854 -15.924 1.00 . A A . 9 SER N 1 1 14 2998 1 1 9 SER O O 8.972 0.683 -18.490 1.00 . A A . 9 SER O 1 1 14 2999 1 1 9 SER OG O 8.027 1.134 -15.250 1.00 . A A . 9 SER OG 1 1 14 3000 1 1 10 PHE C C 8.912 3.348 -19.835 1.00 . A A . 10 PHE C 1 1 14 3001 1 1 10 PHE CA C 8.174 3.337 -18.499 1.00 . A A . 10 PHE CA 1 1 14 3002 1 1 10 PHE CB C 7.830 4.768 -18.082 1.00 . A A . 10 PHE CB 1 1 14 3003 1 1 10 PHE CD1 C 6.265 3.991 -16.280 1.00 . A A . 10 PHE CD1 1 1 14 3004 1 1 10 PHE CD2 C 5.621 5.861 -17.613 1.00 . A A . 10 PHE CD2 1 1 14 3005 1 1 10 PHE CE1 C 5.085 4.088 -15.567 1.00 . A A . 10 PHE CE1 1 1 14 3006 1 1 10 PHE CE2 C 4.439 5.962 -16.903 1.00 . A A . 10 PHE CE2 1 1 14 3007 1 1 10 PHE CG C 6.547 4.876 -17.309 1.00 . A A . 10 PHE CG 1 1 14 3008 1 1 10 PHE CZ C 4.170 5.074 -15.880 1.00 . A A . 10 PHE CZ 1 1 14 3009 1 1 10 PHE H H 9.274 3.211 -16.694 1.00 . A A . 10 PHE H 1 1 14 3010 1 1 10 PHE HA H 7.260 2.774 -18.610 1.00 . A A . 10 PHE HA 1 1 14 3011 1 1 10 PHE HB2 H 8.624 5.155 -17.460 1.00 . A A . 10 PHE HB2 1 1 14 3012 1 1 10 PHE HB3 H 7.740 5.381 -18.966 1.00 . A A . 10 PHE HB3 1 1 14 3013 1 1 10 PHE HD1 H 6.981 3.219 -16.035 1.00 . A A . 10 PHE HD1 1 1 14 3014 1 1 10 PHE HD2 H 5.829 6.556 -18.413 1.00 . A A . 10 PHE HD2 1 1 14 3015 1 1 10 PHE HE1 H 4.879 3.391 -14.768 1.00 . A A . 10 PHE HE1 1 1 14 3016 1 1 10 PHE HE2 H 3.725 6.734 -17.149 1.00 . A A . 10 PHE HE2 1 1 14 3017 1 1 10 PHE HZ H 3.248 5.151 -15.324 1.00 . A A . 10 PHE HZ 1 1 14 3018 1 1 10 PHE N N 8.975 2.688 -17.468 1.00 . A A . 10 PHE N 1 1 14 3019 1 1 10 PHE O O 8.300 3.216 -20.896 1.00 . A A . 10 PHE O 1 1 14 3020 1 1 11 LEU C C 11.599 2.148 -21.298 1.00 . A A . 11 LEU C 1 1 14 3021 1 1 11 LEU CA C 11.052 3.535 -20.979 1.00 . A A . 11 LEU CA 1 1 14 3022 1 1 11 LEU CB C 12.206 4.524 -20.808 1.00 . A A . 11 LEU CB 1 1 14 3023 1 1 11 LEU CD1 C 13.256 4.097 -23.044 1.00 . A A . 11 LEU CD1 1 1 14 3024 1 1 11 LEU CD2 C 14.581 5.205 -21.235 1.00 . A A . 11 LEU CD2 1 1 14 3025 1 1 11 LEU CG C 13.501 4.179 -21.545 1.00 . A A . 11 LEU CG 1 1 14 3026 1 1 11 LEU H H 10.660 3.606 -18.900 1.00 . A A . 11 LEU H 1 1 14 3027 1 1 11 LEU HA H 10.428 3.861 -21.798 1.00 . A A . 11 LEU HA 1 1 14 3028 1 1 11 LEU HB2 H 11.872 5.487 -21.161 1.00 . A A . 11 LEU HB2 1 1 14 3029 1 1 11 LEU HB3 H 12.432 4.589 -19.753 1.00 . A A . 11 LEU HB3 1 1 14 3030 1 1 11 LEU HD11 H 13.158 5.094 -23.448 1.00 . A A . 11 LEU HD11 1 1 14 3031 1 1 11 LEU HD12 H 14.087 3.596 -23.517 1.00 . A A . 11 LEU HD12 1 1 14 3032 1 1 11 LEU HD13 H 12.348 3.543 -23.230 1.00 . A A . 11 LEU HD13 1 1 14 3033 1 1 11 LEU HD21 H 15.466 4.699 -20.876 1.00 . A A . 11 LEU HD21 1 1 14 3034 1 1 11 LEU HD22 H 14.821 5.758 -22.131 1.00 . A A . 11 LEU HD22 1 1 14 3035 1 1 11 LEU HD23 H 14.224 5.886 -20.476 1.00 . A A . 11 LEU HD23 1 1 14 3036 1 1 11 LEU HG H 13.851 3.212 -21.211 1.00 . A A . 11 LEU HG 1 1 14 3037 1 1 11 LEU N N 10.229 3.507 -19.774 1.00 . A A . 11 LEU N 1 1 14 3038 1 1 11 LEU O O 11.138 1.147 -20.750 1.00 . A A . 11 LEU O 1 1 15 3039 1 1 1 LYS C C 2.741 0.616 -1.537 1.00 . A A . 1 LYS C 1 1 15 3040 1 1 1 LYS CA C 2.472 -0.885 -1.583 1.00 . A A . 1 LYS CA 1 1 15 3041 1 1 1 LYS CB C 0.982 -1.139 -1.822 1.00 . A A . 1 LYS CB 1 1 15 3042 1 1 1 LYS CD C -0.752 -0.099 -3.312 1.00 . A A . 1 LYS CD 1 1 15 3043 1 1 1 LYS CE C -1.963 -1.017 -3.371 1.00 . A A . 1 LYS CE 1 1 15 3044 1 1 1 LYS CG C 0.544 -0.890 -3.255 1.00 . A A . 1 LYS CG 1 1 15 3045 1 1 1 LYS H1 H 2.438 -2.336 -0.042 1.00 . A A . 1 LYS H1 1 1 15 3046 1 1 1 LYS HA H 3.037 -1.315 -2.396 1.00 . A A . 1 LYS HA 1 1 15 3047 1 1 1 LYS HB2 H 0.760 -2.167 -1.573 1.00 . A A . 1 LYS HB2 1 1 15 3048 1 1 1 LYS HB3 H 0.410 -0.490 -1.175 1.00 . A A . 1 LYS HB3 1 1 15 3049 1 1 1 LYS HD2 H -0.825 0.520 -2.430 1.00 . A A . 1 LYS HD2 1 1 15 3050 1 1 1 LYS HD3 H -0.742 0.527 -4.194 1.00 . A A . 1 LYS HD3 1 1 15 3051 1 1 1 LYS HE2 H -2.824 -0.437 -3.668 1.00 . A A . 1 LYS HE2 1 1 15 3052 1 1 1 LYS HE3 H -1.779 -1.788 -4.104 1.00 . A A . 1 LYS HE3 1 1 15 3053 1 1 1 LYS HG2 H 1.316 -0.334 -3.766 1.00 . A A . 1 LYS HG2 1 1 15 3054 1 1 1 LYS HG3 H 0.397 -1.841 -3.747 1.00 . A A . 1 LYS HG3 1 1 15 3055 1 1 1 LYS HZ1 H -3.212 -1.443 -1.751 1.00 . A A . 1 LYS HZ1 1 1 15 3056 1 1 1 LYS HZ2 H -2.127 -2.687 -2.126 1.00 . A A . 1 LYS HZ2 1 1 15 3057 1 1 1 LYS HZ3 H -1.578 -1.295 -1.337 1.00 . A A . 1 LYS HZ3 1 1 15 3058 1 1 1 LYS N N 2.903 -1.529 -0.348 1.00 . A A . 1 LYS N 1 1 15 3059 1 1 1 LYS NZ N -2.239 -1.655 -2.054 1.00 . A A . 1 LYS NZ 1 1 15 3060 1 1 1 LYS O O 2.193 1.329 -0.696 1.00 . A A . 1 LYS O 1 1 15 3061 1 1 2 PHE C C 3.446 3.123 -3.819 1.00 . A A . 2 PHE C 1 1 15 3062 1 1 2 PHE CA C 3.927 2.506 -2.510 1.00 . A A . 2 PHE CA 1 1 15 3063 1 1 2 PHE CB C 5.439 2.695 -2.368 1.00 . A A . 2 PHE CB 1 1 15 3064 1 1 2 PHE CD1 C 5.385 2.733 0.140 1.00 . A A . 2 PHE CD1 1 1 15 3065 1 1 2 PHE CD2 C 7.064 1.427 -0.937 1.00 . A A . 2 PHE CD2 1 1 15 3066 1 1 2 PHE CE1 C 5.874 2.350 1.375 1.00 . A A . 2 PHE CE1 1 1 15 3067 1 1 2 PHE CE2 C 7.557 1.040 0.295 1.00 . A A . 2 PHE CE2 1 1 15 3068 1 1 2 PHE CG C 5.973 2.277 -1.028 1.00 . A A . 2 PHE CG 1 1 15 3069 1 1 2 PHE CZ C 6.962 1.503 1.452 1.00 . A A . 2 PHE CZ 1 1 15 3070 1 1 2 PHE H H 3.992 0.471 -3.090 1.00 . A A . 2 PHE H 1 1 15 3071 1 1 2 PHE HA H 3.433 3.002 -1.689 1.00 . A A . 2 PHE HA 1 1 15 3072 1 1 2 PHE HB2 H 5.940 2.107 -3.123 1.00 . A A . 2 PHE HB2 1 1 15 3073 1 1 2 PHE HB3 H 5.679 3.738 -2.512 1.00 . A A . 2 PHE HB3 1 1 15 3074 1 1 2 PHE HD1 H 4.534 3.397 0.080 1.00 . A A . 2 PHE HD1 1 1 15 3075 1 1 2 PHE HD2 H 7.531 1.065 -1.841 1.00 . A A . 2 PHE HD2 1 1 15 3076 1 1 2 PHE HE1 H 5.406 2.714 2.277 1.00 . A A . 2 PHE HE1 1 1 15 3077 1 1 2 PHE HE2 H 8.408 0.377 0.353 1.00 . A A . 2 PHE HE2 1 1 15 3078 1 1 2 PHE HZ H 7.345 1.202 2.416 1.00 . A A . 2 PHE HZ 1 1 15 3079 1 1 2 PHE N N 3.587 1.089 -2.446 1.00 . A A . 2 PHE N 1 1 15 3080 1 1 2 PHE O O 3.390 2.454 -4.851 1.00 . A A . 2 PHE O 1 1 15 3081 1 1 3 LYS C C 3.654 6.135 -5.425 1.00 . A A . 3 LYS C 1 1 15 3082 1 1 3 LYS CA C 2.623 5.115 -4.951 1.00 . A A . 3 LYS CA 1 1 15 3083 1 1 3 LYS CB C 1.297 5.816 -4.649 1.00 . A A . 3 LYS CB 1 1 15 3084 1 1 3 LYS CD C 0.620 5.979 -2.236 1.00 . A A . 3 LYS CD 1 1 15 3085 1 1 3 LYS CE C 1.317 6.252 -0.912 1.00 . A A . 3 LYS CE 1 1 15 3086 1 1 3 LYS CG C 1.330 6.666 -3.391 1.00 . A A . 3 LYS CG 1 1 15 3087 1 1 3 LYS H H 3.166 4.885 -2.918 1.00 . A A . 3 LYS H 1 1 15 3088 1 1 3 LYS HA H 2.467 4.389 -5.734 1.00 . A A . 3 LYS HA 1 1 15 3089 1 1 3 LYS HB2 H 1.043 6.455 -5.483 1.00 . A A . 3 LYS HB2 1 1 15 3090 1 1 3 LYS HB3 H 0.526 5.068 -4.533 1.00 . A A . 3 LYS HB3 1 1 15 3091 1 1 3 LYS HD2 H -0.394 6.347 -2.178 1.00 . A A . 3 LYS HD2 1 1 15 3092 1 1 3 LYS HD3 H 0.609 4.913 -2.414 1.00 . A A . 3 LYS HD3 1 1 15 3093 1 1 3 LYS HE2 H 2.335 5.899 -0.976 1.00 . A A . 3 LYS HE2 1 1 15 3094 1 1 3 LYS HE3 H 1.316 7.317 -0.732 1.00 . A A . 3 LYS HE3 1 1 15 3095 1 1 3 LYS HG2 H 2.359 6.841 -3.113 1.00 . A A . 3 LYS HG2 1 1 15 3096 1 1 3 LYS HG3 H 0.843 7.609 -3.591 1.00 . A A . 3 LYS HG3 1 1 15 3097 1 1 3 LYS HZ1 H -0.094 6.188 0.628 1.00 . A A . 3 LYS HZ1 1 1 15 3098 1 1 3 LYS HZ2 H 0.189 4.690 -0.105 1.00 . A A . 3 LYS HZ2 1 1 15 3099 1 1 3 LYS HZ3 H 1.329 5.336 0.966 1.00 . A A . 3 LYS HZ3 1 1 15 3100 1 1 3 LYS N N 3.099 4.405 -3.770 1.00 . A A . 3 LYS N 1 1 15 3101 1 1 3 LYS NZ N 0.638 5.569 0.224 1.00 . A A . 3 LYS NZ 1 1 15 3102 1 1 3 LYS O O 3.467 7.341 -5.265 1.00 . A A . 3 LYS O 1 1 15 3103 1 1 4 LYS C C 5.826 6.516 -8.034 1.00 . A A . 4 LYS C 1 1 15 3104 1 1 4 LYS CA C 5.800 6.511 -6.509 1.00 . A A . 4 LYS CA 1 1 15 3105 1 1 4 LYS CB C 7.158 6.057 -5.967 1.00 . A A . 4 LYS CB 1 1 15 3106 1 1 4 LYS CD C 7.805 3.689 -5.438 1.00 . A A . 4 LYS CD 1 1 15 3107 1 1 4 LYS CE C 8.722 2.560 -5.886 1.00 . A A . 4 LYS CE 1 1 15 3108 1 1 4 LYS CG C 7.624 4.727 -6.533 1.00 . A A . 4 LYS CG 1 1 15 3109 1 1 4 LYS H H 4.832 4.672 -6.108 1.00 . A A . 4 LYS H 1 1 15 3110 1 1 4 LYS HA H 5.600 7.513 -6.161 1.00 . A A . 4 LYS HA 1 1 15 3111 1 1 4 LYS HB2 H 7.897 6.807 -6.208 1.00 . A A . 4 LYS HB2 1 1 15 3112 1 1 4 LYS HB3 H 7.090 5.964 -4.893 1.00 . A A . 4 LYS HB3 1 1 15 3113 1 1 4 LYS HD2 H 8.237 4.164 -4.570 1.00 . A A . 4 LYS HD2 1 1 15 3114 1 1 4 LYS HD3 H 6.839 3.276 -5.182 1.00 . A A . 4 LYS HD3 1 1 15 3115 1 1 4 LYS HE2 H 8.714 2.515 -6.965 1.00 . A A . 4 LYS HE2 1 1 15 3116 1 1 4 LYS HE3 H 9.724 2.770 -5.542 1.00 . A A . 4 LYS HE3 1 1 15 3117 1 1 4 LYS HG2 H 6.889 4.368 -7.237 1.00 . A A . 4 LYS HG2 1 1 15 3118 1 1 4 LYS HG3 H 8.569 4.873 -7.038 1.00 . A A . 4 LYS HG3 1 1 15 3119 1 1 4 LYS HZ1 H 7.721 1.382 -4.481 1.00 . A A . 4 LYS HZ1 1 1 15 3120 1 1 4 LYS HZ2 H 7.712 0.739 -6.046 1.00 . A A . 4 LYS HZ2 1 1 15 3121 1 1 4 LYS HZ3 H 9.118 0.663 -5.108 1.00 . A A . 4 LYS HZ3 1 1 15 3122 1 1 4 LYS N N 4.741 5.643 -6.009 1.00 . A A . 4 LYS N 1 1 15 3123 1 1 4 LYS NZ N 8.288 1.244 -5.342 1.00 . A A . 4 LYS NZ 1 1 15 3124 1 1 4 LYS O O 4.954 5.935 -8.681 1.00 . A A . 4 LYS O 1 1 15 3125 1 1 5 VAL C C 8.062 6.311 -10.550 1.00 . A A . 5 VAL C 1 1 15 3126 1 1 5 VAL CA C 6.971 7.252 -10.052 1.00 . A A . 5 VAL CA 1 1 15 3127 1 1 5 VAL CB C 7.298 8.687 -10.508 1.00 . A A . 5 VAL CB 1 1 15 3128 1 1 5 VAL CG1 C 7.311 8.774 -12.026 1.00 . A A . 5 VAL CG1 1 1 15 3129 1 1 5 VAL CG2 C 6.303 9.673 -9.917 1.00 . A A . 5 VAL CG2 1 1 15 3130 1 1 5 VAL H H 7.495 7.617 -8.034 1.00 . A A . 5 VAL H 1 1 15 3131 1 1 5 VAL HA H 6.029 6.962 -10.494 1.00 . A A . 5 VAL HA 1 1 15 3132 1 1 5 VAL HB H 8.284 8.942 -10.146 1.00 . A A . 5 VAL HB 1 1 15 3133 1 1 5 VAL HG11 H 6.804 7.916 -12.441 1.00 . A A . 5 VAL HG11 1 1 15 3134 1 1 5 VAL HG12 H 6.807 9.677 -12.339 1.00 . A A . 5 VAL HG12 1 1 15 3135 1 1 5 VAL HG13 H 8.333 8.793 -12.377 1.00 . A A . 5 VAL HG13 1 1 15 3136 1 1 5 VAL HG21 H 6.331 9.612 -8.839 1.00 . A A . 5 VAL HG21 1 1 15 3137 1 1 5 VAL HG22 H 6.561 10.675 -10.227 1.00 . A A . 5 VAL HG22 1 1 15 3138 1 1 5 VAL HG23 H 5.309 9.433 -10.265 1.00 . A A . 5 VAL HG23 1 1 15 3139 1 1 5 VAL N N 6.831 7.174 -8.603 1.00 . A A . 5 VAL N 1 1 15 3140 1 1 5 VAL O O 9.136 6.218 -9.953 1.00 . A A . 5 VAL O 1 1 15 3141 1 1 6 ILE C C 8.865 4.887 -13.731 1.00 . A A . 6 ILE C 1 1 15 3142 1 1 6 ILE CA C 8.740 4.683 -12.225 1.00 . A A . 6 ILE CA 1 1 15 3143 1 1 6 ILE CB C 8.340 3.221 -11.949 1.00 . A A . 6 ILE CB 1 1 15 3144 1 1 6 ILE CD1 C 6.795 3.470 -9.942 1.00 . A A . 6 ILE CD1 1 1 15 3145 1 1 6 ILE CG1 C 6.907 3.153 -11.416 1.00 . A A . 6 ILE CG1 1 1 15 3146 1 1 6 ILE CG2 C 9.308 2.585 -10.963 1.00 . A A . 6 ILE CG2 1 1 15 3147 1 1 6 ILE H H 6.909 5.733 -12.076 1.00 . A A . 6 ILE H 1 1 15 3148 1 1 6 ILE HA H 9.701 4.865 -11.767 1.00 . A A . 6 ILE HA 1 1 15 3149 1 1 6 ILE HB H 8.398 2.674 -12.877 1.00 . A A . 6 ILE HB 1 1 15 3150 1 1 6 ILE HD11 H 5.896 4.042 -9.764 1.00 . A A . 6 ILE HD11 1 1 15 3151 1 1 6 ILE HD12 H 6.754 2.550 -9.378 1.00 . A A . 6 ILE HD12 1 1 15 3152 1 1 6 ILE HD13 H 7.655 4.045 -9.631 1.00 . A A . 6 ILE HD13 1 1 15 3153 1 1 6 ILE HG12 H 6.296 3.860 -11.955 1.00 . A A . 6 ILE HG12 1 1 15 3154 1 1 6 ILE HG13 H 6.521 2.156 -11.573 1.00 . A A . 6 ILE HG13 1 1 15 3155 1 1 6 ILE HG21 H 10.108 2.101 -11.504 1.00 . A A . 6 ILE HG21 1 1 15 3156 1 1 6 ILE HG22 H 9.720 3.349 -10.319 1.00 . A A . 6 ILE HG22 1 1 15 3157 1 1 6 ILE HG23 H 8.784 1.855 -10.364 1.00 . A A . 6 ILE HG23 1 1 15 3158 1 1 6 ILE N N 7.781 5.616 -11.646 1.00 . A A . 6 ILE N 1 1 15 3159 1 1 6 ILE O O 8.061 4.371 -14.507 1.00 . A A . 6 ILE O 1 1 15 3160 1 1 7 TRP C C 10.833 4.749 -16.218 1.00 . A A . 7 TRP C 1 1 15 3161 1 1 7 TRP CA C 10.111 5.914 -15.551 1.00 . A A . 7 TRP CA 1 1 15 3162 1 1 7 TRP CB C 10.925 7.198 -15.718 1.00 . A A . 7 TRP CB 1 1 15 3163 1 1 7 TRP CD1 C 13.045 7.240 -14.278 1.00 . A A . 7 TRP CD1 1 1 15 3164 1 1 7 TRP CD2 C 13.377 6.561 -16.386 1.00 . A A . 7 TRP CD2 1 1 15 3165 1 1 7 TRP CE2 C 14.611 6.538 -15.707 1.00 . A A . 7 TRP CE2 1 1 15 3166 1 1 7 TRP CE3 C 13.340 6.171 -17.728 1.00 . A A . 7 TRP CE3 1 1 15 3167 1 1 7 TRP CG C 12.389 7.012 -15.454 1.00 . A A . 7 TRP CG 1 1 15 3168 1 1 7 TRP CH2 C 15.728 5.767 -17.640 1.00 . A A . 7 TRP CH2 1 1 15 3169 1 1 7 TRP CZ2 C 15.794 6.143 -16.326 1.00 . A A . 7 TRP CZ2 1 1 15 3170 1 1 7 TRP CZ3 C 14.515 5.780 -18.341 1.00 . A A . 7 TRP CZ3 1 1 15 3171 1 1 7 TRP H H 10.486 6.027 -13.471 1.00 . A A . 7 TRP H 1 1 15 3172 1 1 7 TRP HA H 9.149 6.045 -16.025 1.00 . A A . 7 TRP HA 1 1 15 3173 1 1 7 TRP HB2 H 10.813 7.560 -16.729 1.00 . A A . 7 TRP HB2 1 1 15 3174 1 1 7 TRP HB3 H 10.554 7.943 -15.030 1.00 . A A . 7 TRP HB3 1 1 15 3175 1 1 7 TRP HD1 H 12.570 7.592 -13.376 1.00 . A A . 7 TRP HD1 1 1 15 3176 1 1 7 TRP HE1 H 15.060 7.042 -13.721 1.00 . A A . 7 TRP HE1 1 1 15 3177 1 1 7 TRP HE3 H 12.415 6.174 -18.285 1.00 . A A . 7 TRP HE3 1 1 15 3178 1 1 7 TRP HH2 H 16.621 5.455 -18.159 1.00 . A A . 7 TRP HH2 1 1 15 3179 1 1 7 TRP HZ2 H 16.737 6.128 -15.799 1.00 . A A . 7 TRP HZ2 1 1 15 3180 1 1 7 TRP HZ3 H 14.506 5.476 -19.377 1.00 . A A . 7 TRP HZ3 1 1 15 3181 1 1 7 TRP N N 9.879 5.643 -14.137 1.00 . A A . 7 TRP N 1 1 15 3182 1 1 7 TRP NE1 N 14.382 6.958 -14.424 1.00 . A A . 7 TRP NE1 1 1 15 3183 1 1 7 TRP O O 10.627 4.472 -17.400 1.00 . A A . 7 TRP O 1 1 15 3184 1 1 8 LYS C C 11.507 1.930 -16.651 1.00 . A A . 8 LYS C 1 1 15 3185 1 1 8 LYS CA C 12.434 2.932 -15.971 1.00 . A A . 8 LYS CA 1 1 15 3186 1 1 8 LYS CB C 13.202 2.246 -14.838 1.00 . A A . 8 LYS CB 1 1 15 3187 1 1 8 LYS CD C 13.657 3.260 -12.585 1.00 . A A . 8 LYS CD 1 1 15 3188 1 1 8 LYS CE C 14.186 4.514 -11.907 1.00 . A A . 8 LYS CE 1 1 15 3189 1 1 8 LYS CG C 14.085 3.191 -14.042 1.00 . A A . 8 LYS CG 1 1 15 3190 1 1 8 LYS H H 11.804 4.339 -14.519 1.00 . A A . 8 LYS H 1 1 15 3191 1 1 8 LYS HA H 13.139 3.304 -16.698 1.00 . A A . 8 LYS HA 1 1 15 3192 1 1 8 LYS HB2 H 12.492 1.793 -14.161 1.00 . A A . 8 LYS HB2 1 1 15 3193 1 1 8 LYS HB3 H 13.827 1.473 -15.261 1.00 . A A . 8 LYS HB3 1 1 15 3194 1 1 8 LYS HD2 H 12.578 3.265 -12.536 1.00 . A A . 8 LYS HD2 1 1 15 3195 1 1 8 LYS HD3 H 14.039 2.392 -12.066 1.00 . A A . 8 LYS HD3 1 1 15 3196 1 1 8 LYS HE2 H 14.050 5.352 -12.573 1.00 . A A . 8 LYS HE2 1 1 15 3197 1 1 8 LYS HE3 H 13.625 4.681 -11.000 1.00 . A A . 8 LYS HE3 1 1 15 3198 1 1 8 LYS HG2 H 15.106 2.842 -14.090 1.00 . A A . 8 LYS HG2 1 1 15 3199 1 1 8 LYS HG3 H 14.019 4.180 -14.474 1.00 . A A . 8 LYS HG3 1 1 15 3200 1 1 8 LYS HZ1 H 16.209 4.866 -12.293 1.00 . A A . 8 LYS HZ1 1 1 15 3201 1 1 8 LYS HZ2 H 15.820 4.837 -10.647 1.00 . A A . 8 LYS HZ2 1 1 15 3202 1 1 8 LYS HZ3 H 15.905 3.391 -11.521 1.00 . A A . 8 LYS HZ3 1 1 15 3203 1 1 8 LYS N N 11.682 4.069 -15.454 1.00 . A A . 8 LYS N 1 1 15 3204 1 1 8 LYS NZ N 15.631 4.394 -11.568 1.00 . A A . 8 LYS NZ 1 1 15 3205 1 1 8 LYS O O 11.880 1.298 -17.640 1.00 . A A . 8 LYS O 1 1 15 3206 1 1 9 SER C C 9.149 1.086 -18.170 1.00 . A A . 9 SER C 1 1 15 3207 1 1 9 SER CA C 9.319 0.863 -16.670 1.00 . A A . 9 SER CA 1 1 15 3208 1 1 9 SER CB C 7.973 1.027 -15.962 1.00 . A A . 9 SER CB 1 1 15 3209 1 1 9 SER H H 10.061 2.323 -15.328 1.00 . A A . 9 SER H 1 1 15 3210 1 1 9 SER HA H 9.683 -0.140 -16.506 1.00 . A A . 9 SER HA 1 1 15 3211 1 1 9 SER HB2 H 7.977 0.452 -15.049 1.00 . A A . 9 SER HB2 1 1 15 3212 1 1 9 SER HB3 H 7.816 2.070 -15.731 1.00 . A A . 9 SER HB3 1 1 15 3213 1 1 9 SER HG H 6.342 1.316 -17.008 1.00 . A A . 9 SER HG 1 1 15 3214 1 1 9 SER N N 10.299 1.791 -16.116 1.00 . A A . 9 SER N 1 1 15 3215 1 1 9 SER O O 8.938 0.140 -18.930 1.00 . A A . 9 SER O 1 1 15 3216 1 1 9 SER OG O 6.908 0.575 -16.781 1.00 . A A . 9 SER OG 1 1 15 3217 1 1 10 PHE C C 10.456 2.741 -20.689 1.00 . A A . 10 PHE C 1 1 15 3218 1 1 10 PHE CA C 9.096 2.693 -19.998 1.00 . A A . 10 PHE CA 1 1 15 3219 1 1 10 PHE CB C 8.391 4.043 -20.140 1.00 . A A . 10 PHE CB 1 1 15 3220 1 1 10 PHE CD1 C 6.627 4.430 -18.398 1.00 . A A . 10 PHE CD1 1 1 15 3221 1 1 10 PHE CD2 C 5.952 3.599 -20.529 1.00 . A A . 10 PHE CD2 1 1 15 3222 1 1 10 PHE CE1 C 5.312 4.414 -17.972 1.00 . A A . 10 PHE CE1 1 1 15 3223 1 1 10 PHE CE2 C 4.636 3.582 -20.108 1.00 . A A . 10 PHE CE2 1 1 15 3224 1 1 10 PHE CG C 6.961 4.024 -19.680 1.00 . A A . 10 PHE CG 1 1 15 3225 1 1 10 PHE CZ C 4.316 3.988 -18.828 1.00 . A A . 10 PHE CZ 1 1 15 3226 1 1 10 PHE H H 9.411 3.054 -17.935 1.00 . A A . 10 PHE H 1 1 15 3227 1 1 10 PHE HA H 8.494 1.930 -20.467 1.00 . A A . 10 PHE HA 1 1 15 3228 1 1 10 PHE HB2 H 8.918 4.780 -19.554 1.00 . A A . 10 PHE HB2 1 1 15 3229 1 1 10 PHE HB3 H 8.403 4.339 -21.178 1.00 . A A . 10 PHE HB3 1 1 15 3230 1 1 10 PHE HD1 H 7.407 4.763 -17.727 1.00 . A A . 10 PHE HD1 1 1 15 3231 1 1 10 PHE HD2 H 6.201 3.280 -21.530 1.00 . A A . 10 PHE HD2 1 1 15 3232 1 1 10 PHE HE1 H 5.066 4.733 -16.970 1.00 . A A . 10 PHE HE1 1 1 15 3233 1 1 10 PHE HE2 H 3.858 3.248 -20.779 1.00 . A A . 10 PHE HE2 1 1 15 3234 1 1 10 PHE HZ H 3.288 3.976 -18.496 1.00 . A A . 10 PHE HZ 1 1 15 3235 1 1 10 PHE N N 9.241 2.344 -18.589 1.00 . A A . 10 PHE N 1 1 15 3236 1 1 10 PHE O O 10.585 2.373 -21.857 1.00 . A A . 10 PHE O 1 1 15 3237 1 1 11 LEU C C 12.817 4.025 -21.839 1.00 . A A . 11 LEU C 1 1 15 3238 1 1 11 LEU CA C 12.819 3.295 -20.501 1.00 . A A . 11 LEU CA 1 1 15 3239 1 1 11 LEU CB C 13.424 1.900 -20.668 1.00 . A A . 11 LEU CB 1 1 15 3240 1 1 11 LEU CD1 C 15.296 0.279 -20.279 1.00 . A A . 11 LEU CD1 1 1 15 3241 1 1 11 LEU CD2 C 15.798 2.598 -21.074 1.00 . A A . 11 LEU CD2 1 1 15 3242 1 1 11 LEU CG C 14.877 1.740 -20.218 1.00 . A A . 11 LEU CG 1 1 15 3243 1 1 11 LEU H H 11.304 3.475 -19.034 1.00 . A A . 11 LEU H 1 1 15 3244 1 1 11 LEU HA H 13.417 3.856 -19.799 1.00 . A A . 11 LEU HA 1 1 15 3245 1 1 11 LEU HB2 H 12.823 1.208 -20.098 1.00 . A A . 11 LEU HB2 1 1 15 3246 1 1 11 LEU HB3 H 13.371 1.641 -21.717 1.00 . A A . 11 LEU HB3 1 1 15 3247 1 1 11 LEU HD11 H 15.631 -0.040 -19.303 1.00 . A A . 11 LEU HD11 1 1 15 3248 1 1 11 LEU HD12 H 14.456 -0.324 -20.587 1.00 . A A . 11 LEU HD12 1 1 15 3249 1 1 11 LEU HD13 H 16.101 0.165 -20.990 1.00 . A A . 11 LEU HD13 1 1 15 3250 1 1 11 LEU HD21 H 16.741 2.732 -20.564 1.00 . A A . 11 LEU HD21 1 1 15 3251 1 1 11 LEU HD22 H 15.967 2.109 -22.022 1.00 . A A . 11 LEU HD22 1 1 15 3252 1 1 11 LEU HD23 H 15.339 3.561 -21.242 1.00 . A A . 11 LEU HD23 1 1 15 3253 1 1 11 LEU HG H 14.967 2.070 -19.193 1.00 . A A . 11 LEU HG 1 1 15 3254 1 1 11 LEU N N 11.468 3.197 -19.959 1.00 . A A . 11 LEU N 1 1 15 3255 1 1 11 LEU O O 11.997 4.912 -22.073 1.00 . A A . 11 LEU O 1 1 16 3256 1 1 1 LYS C C 3.140 1.637 -5.780 1.00 . A A . 1 LYS C 1 1 16 3257 1 1 1 LYS CA C 2.080 1.307 -6.825 1.00 . A A . 1 LYS CA 1 1 16 3258 1 1 1 LYS CB C 0.687 1.393 -6.198 1.00 . A A . 1 LYS CB 1 1 16 3259 1 1 1 LYS CD C -0.569 -0.751 -5.825 1.00 . A A . 1 LYS CD 1 1 16 3260 1 1 1 LYS CE C -2.018 -0.400 -5.522 1.00 . A A . 1 LYS CE 1 1 16 3261 1 1 1 LYS CG C 0.387 0.266 -5.225 1.00 . A A . 1 LYS CG 1 1 16 3262 1 1 1 LYS H1 H 3.139 -0.206 -7.861 1.00 . A A . 1 LYS H1 1 1 16 3263 1 1 1 LYS HA H 2.148 2.024 -7.629 1.00 . A A . 1 LYS HA 1 1 16 3264 1 1 1 LYS HB2 H 0.600 2.330 -5.669 1.00 . A A . 1 LYS HB2 1 1 16 3265 1 1 1 LYS HB3 H -0.052 1.365 -6.986 1.00 . A A . 1 LYS HB3 1 1 16 3266 1 1 1 LYS HD2 H -0.433 -0.772 -6.896 1.00 . A A . 1 LYS HD2 1 1 16 3267 1 1 1 LYS HD3 H -0.350 -1.726 -5.413 1.00 . A A . 1 LYS HD3 1 1 16 3268 1 1 1 LYS HE2 H -2.497 -1.258 -5.077 1.00 . A A . 1 LYS HE2 1 1 16 3269 1 1 1 LYS HE3 H -2.037 0.425 -4.825 1.00 . A A . 1 LYS HE3 1 1 16 3270 1 1 1 LYS HG2 H 1.311 -0.232 -4.969 1.00 . A A . 1 LYS HG2 1 1 16 3271 1 1 1 LYS HG3 H -0.058 0.682 -4.332 1.00 . A A . 1 LYS HG3 1 1 16 3272 1 1 1 LYS HZ1 H -2.135 -0.055 -7.579 1.00 . A A . 1 LYS HZ1 1 1 16 3273 1 1 1 LYS HZ2 H -3.563 -0.660 -6.904 1.00 . A A . 1 LYS HZ2 1 1 16 3274 1 1 1 LYS HZ3 H -3.129 0.957 -6.657 1.00 . A A . 1 LYS HZ3 1 1 16 3275 1 1 1 LYS N N 2.300 -0.020 -7.388 1.00 . A A . 1 LYS N 1 1 16 3276 1 1 1 LYS NZ N -2.764 -0.012 -6.752 1.00 . A A . 1 LYS NZ 1 1 16 3277 1 1 1 LYS O O 3.987 0.805 -5.455 1.00 . A A . 1 LYS O 1 1 16 3278 1 1 2 PHE C C 5.468 3.256 -4.791 1.00 . A A . 2 PHE C 1 1 16 3279 1 1 2 PHE CA C 4.044 3.297 -4.246 1.00 . A A . 2 PHE CA 1 1 16 3280 1 1 2 PHE CB C 3.938 2.421 -2.996 1.00 . A A . 2 PHE CB 1 1 16 3281 1 1 2 PHE CD1 C 3.477 3.325 -0.701 1.00 . A A . 2 PHE CD1 1 1 16 3282 1 1 2 PHE CD2 C 1.657 3.132 -2.230 1.00 . A A . 2 PHE CD2 1 1 16 3283 1 1 2 PHE CE1 C 2.622 3.832 0.259 1.00 . A A . 2 PHE CE1 1 1 16 3284 1 1 2 PHE CE2 C 0.797 3.638 -1.274 1.00 . A A . 2 PHE CE2 1 1 16 3285 1 1 2 PHE CG C 3.006 2.970 -1.955 1.00 . A A . 2 PHE CG 1 1 16 3286 1 1 2 PHE CZ C 1.280 3.987 -0.027 1.00 . A A . 2 PHE CZ 1 1 16 3287 1 1 2 PHE H H 2.389 3.476 -5.554 1.00 . A A . 2 PHE H 1 1 16 3288 1 1 2 PHE HA H 3.801 4.315 -3.982 1.00 . A A . 2 PHE HA 1 1 16 3289 1 1 2 PHE HB2 H 3.579 1.443 -3.280 1.00 . A A . 2 PHE HB2 1 1 16 3290 1 1 2 PHE HB3 H 4.917 2.324 -2.550 1.00 . A A . 2 PHE HB3 1 1 16 3291 1 1 2 PHE HD1 H 4.528 3.203 -0.476 1.00 . A A . 2 PHE HD1 1 1 16 3292 1 1 2 PHE HD2 H 1.278 2.858 -3.203 1.00 . A A . 2 PHE HD2 1 1 16 3293 1 1 2 PHE HE1 H 3.003 4.104 1.232 1.00 . A A . 2 PHE HE1 1 1 16 3294 1 1 2 PHE HE2 H -0.252 3.758 -1.500 1.00 . A A . 2 PHE HE2 1 1 16 3295 1 1 2 PHE HZ H 0.610 4.383 0.721 1.00 . A A . 2 PHE HZ 1 1 16 3296 1 1 2 PHE N N 3.087 2.857 -5.255 1.00 . A A . 2 PHE N 1 1 16 3297 1 1 2 PHE O O 5.699 2.841 -5.927 1.00 . A A . 2 PHE O 1 1 16 3298 1 1 3 LYS C C 8.003 4.412 -5.710 1.00 . A A . 3 LYS C 1 1 16 3299 1 1 3 LYS CA C 7.824 3.703 -4.371 1.00 . A A . 3 LYS CA 1 1 16 3300 1 1 3 LYS CB C 8.363 2.274 -4.463 1.00 . A A . 3 LYS CB 1 1 16 3301 1 1 3 LYS CD C 8.514 1.922 -1.980 1.00 . A A . 3 LYS CD 1 1 16 3302 1 1 3 LYS CE C 7.415 2.496 -1.099 1.00 . A A . 3 LYS CE 1 1 16 3303 1 1 3 LYS CG C 7.957 1.395 -3.292 1.00 . A A . 3 LYS CG 1 1 16 3304 1 1 3 LYS H H 6.175 4.009 -3.079 1.00 . A A . 3 LYS H 1 1 16 3305 1 1 3 LYS HA H 8.378 4.240 -3.617 1.00 . A A . 3 LYS HA 1 1 16 3306 1 1 3 LYS HB2 H 7.994 1.820 -5.371 1.00 . A A . 3 LYS HB2 1 1 16 3307 1 1 3 LYS HB3 H 9.442 2.311 -4.501 1.00 . A A . 3 LYS HB3 1 1 16 3308 1 1 3 LYS HD2 H 8.997 1.113 -1.453 1.00 . A A . 3 LYS HD2 1 1 16 3309 1 1 3 LYS HD3 H 9.236 2.698 -2.191 1.00 . A A . 3 LYS HD3 1 1 16 3310 1 1 3 LYS HE2 H 7.292 3.542 -1.334 1.00 . A A . 3 LYS HE2 1 1 16 3311 1 1 3 LYS HE3 H 6.494 1.970 -1.306 1.00 . A A . 3 LYS HE3 1 1 16 3312 1 1 3 LYS HG2 H 6.879 1.369 -3.229 1.00 . A A . 3 LYS HG2 1 1 16 3313 1 1 3 LYS HG3 H 8.334 0.395 -3.457 1.00 . A A . 3 LYS HG3 1 1 16 3314 1 1 3 LYS HZ1 H 7.265 1.518 0.741 1.00 . A A . 3 LYS HZ1 1 1 16 3315 1 1 3 LYS HZ2 H 8.763 2.259 0.479 1.00 . A A . 3 LYS HZ2 1 1 16 3316 1 1 3 LYS HZ3 H 7.411 3.199 0.868 1.00 . A A . 3 LYS HZ3 1 1 16 3317 1 1 3 LYS N N 6.421 3.690 -3.974 1.00 . A A . 3 LYS N 1 1 16 3318 1 1 3 LYS NZ N 7.736 2.358 0.349 1.00 . A A . 3 LYS NZ 1 1 16 3319 1 1 3 LYS O O 8.168 3.769 -6.748 1.00 . A A . 3 LYS O 1 1 16 3320 1 1 4 LYS C C 7.135 6.108 -7.962 1.00 . A A . 4 LYS C 1 1 16 3321 1 1 4 LYS CA C 8.133 6.537 -6.891 1.00 . A A . 4 LYS CA 1 1 16 3322 1 1 4 LYS CB C 9.560 6.404 -7.427 1.00 . A A . 4 LYS CB 1 1 16 3323 1 1 4 LYS CD C 10.786 8.587 -7.224 1.00 . A A . 4 LYS CD 1 1 16 3324 1 1 4 LYS CE C 12.141 9.162 -6.841 1.00 . A A . 4 LYS CE 1 1 16 3325 1 1 4 LYS CG C 10.583 7.201 -6.636 1.00 . A A . 4 LYS CG 1 1 16 3326 1 1 4 LYS H H 7.837 6.195 -4.823 1.00 . A A . 4 LYS H 1 1 16 3327 1 1 4 LYS HA H 7.948 7.569 -6.636 1.00 . A A . 4 LYS HA 1 1 16 3328 1 1 4 LYS HB2 H 9.847 5.363 -7.400 1.00 . A A . 4 LYS HB2 1 1 16 3329 1 1 4 LYS HB3 H 9.581 6.748 -8.451 1.00 . A A . 4 LYS HB3 1 1 16 3330 1 1 4 LYS HD2 H 10.726 8.525 -8.300 1.00 . A A . 4 LYS HD2 1 1 16 3331 1 1 4 LYS HD3 H 10.009 9.242 -6.856 1.00 . A A . 4 LYS HD3 1 1 16 3332 1 1 4 LYS HE2 H 12.195 10.183 -7.186 1.00 . A A . 4 LYS HE2 1 1 16 3333 1 1 4 LYS HE3 H 12.235 9.141 -5.765 1.00 . A A . 4 LYS HE3 1 1 16 3334 1 1 4 LYS HG2 H 10.239 7.301 -5.617 1.00 . A A . 4 LYS HG2 1 1 16 3335 1 1 4 LYS HG3 H 11.526 6.672 -6.649 1.00 . A A . 4 LYS HG3 1 1 16 3336 1 1 4 LYS HZ1 H 12.942 7.909 -8.308 1.00 . A A . 4 LYS HZ1 1 1 16 3337 1 1 4 LYS HZ2 H 14.049 9.025 -7.681 1.00 . A A . 4 LYS HZ2 1 1 16 3338 1 1 4 LYS HZ3 H 13.603 7.672 -6.768 1.00 . A A . 4 LYS HZ3 1 1 16 3339 1 1 4 LYS N N 7.971 5.740 -5.681 1.00 . A A . 4 LYS N 1 1 16 3340 1 1 4 LYS NZ N 13.262 8.388 -7.442 1.00 . A A . 4 LYS NZ 1 1 16 3341 1 1 4 LYS O O 6.285 5.250 -7.725 1.00 . A A . 4 LYS O 1 1 16 3342 1 1 5 VAL C C 6.882 5.207 -11.055 1.00 . A A . 5 VAL C 1 1 16 3343 1 1 5 VAL CA C 6.353 6.389 -10.250 1.00 . A A . 5 VAL CA 1 1 16 3344 1 1 5 VAL CB C 6.170 7.595 -11.190 1.00 . A A . 5 VAL CB 1 1 16 3345 1 1 5 VAL CG1 C 5.094 7.305 -12.227 1.00 . A A . 5 VAL CG1 1 1 16 3346 1 1 5 VAL CG2 C 5.830 8.845 -10.393 1.00 . A A . 5 VAL CG2 1 1 16 3347 1 1 5 VAL H H 7.942 7.387 -9.270 1.00 . A A . 5 VAL H 1 1 16 3348 1 1 5 VAL HA H 5.389 6.130 -9.839 1.00 . A A . 5 VAL HA 1 1 16 3349 1 1 5 VAL HB H 7.101 7.767 -11.709 1.00 . A A . 5 VAL HB 1 1 16 3350 1 1 5 VAL HG11 H 5.548 7.228 -13.204 1.00 . A A . 5 VAL HG11 1 1 16 3351 1 1 5 VAL HG12 H 4.602 6.375 -11.984 1.00 . A A . 5 VAL HG12 1 1 16 3352 1 1 5 VAL HG13 H 4.371 8.107 -12.228 1.00 . A A . 5 VAL HG13 1 1 16 3353 1 1 5 VAL HG21 H 5.135 8.592 -9.606 1.00 . A A . 5 VAL HG21 1 1 16 3354 1 1 5 VAL HG22 H 6.731 9.252 -9.960 1.00 . A A . 5 VAL HG22 1 1 16 3355 1 1 5 VAL HG23 H 5.381 9.578 -11.046 1.00 . A A . 5 VAL HG23 1 1 16 3356 1 1 5 VAL N N 7.245 6.710 -9.142 1.00 . A A . 5 VAL N 1 1 16 3357 1 1 5 VAL O O 8.075 5.127 -11.349 1.00 . A A . 5 VAL O 1 1 16 3358 1 1 6 ILE C C 6.991 3.509 -13.513 1.00 . A A . 6 ILE C 1 1 16 3359 1 1 6 ILE CA C 6.362 3.114 -12.181 1.00 . A A . 6 ILE CA 1 1 16 3360 1 1 6 ILE CB C 5.148 2.205 -12.449 1.00 . A A . 6 ILE CB 1 1 16 3361 1 1 6 ILE CD1 C 3.330 0.837 -11.308 1.00 . A A . 6 ILE CD1 1 1 16 3362 1 1 6 ILE CG1 C 4.541 1.727 -11.129 1.00 . A A . 6 ILE CG1 1 1 16 3363 1 1 6 ILE CG2 C 5.554 1.020 -13.312 1.00 . A A . 6 ILE CG2 1 1 16 3364 1 1 6 ILE H H 5.050 4.411 -11.144 1.00 . A A . 6 ILE H 1 1 16 3365 1 1 6 ILE HA H 7.085 2.555 -11.605 1.00 . A A . 6 ILE HA 1 1 16 3366 1 1 6 ILE HB H 4.410 2.778 -12.990 1.00 . A A . 6 ILE HB 1 1 16 3367 1 1 6 ILE HD11 H 2.585 1.356 -11.893 1.00 . A A . 6 ILE HD11 1 1 16 3368 1 1 6 ILE HD12 H 3.622 -0.069 -11.819 1.00 . A A . 6 ILE HD12 1 1 16 3369 1 1 6 ILE HD13 H 2.920 0.588 -10.340 1.00 . A A . 6 ILE HD13 1 1 16 3370 1 1 6 ILE HG12 H 5.283 1.169 -10.580 1.00 . A A . 6 ILE HG12 1 1 16 3371 1 1 6 ILE HG13 H 4.239 2.586 -10.548 1.00 . A A . 6 ILE HG13 1 1 16 3372 1 1 6 ILE HG21 H 4.706 0.365 -13.446 1.00 . A A . 6 ILE HG21 1 1 16 3373 1 1 6 ILE HG22 H 5.891 1.375 -14.275 1.00 . A A . 6 ILE HG22 1 1 16 3374 1 1 6 ILE HG23 H 6.353 0.479 -12.828 1.00 . A A . 6 ILE HG23 1 1 16 3375 1 1 6 ILE N N 5.986 4.291 -11.408 1.00 . A A . 6 ILE N 1 1 16 3376 1 1 6 ILE O O 7.730 2.731 -14.117 1.00 . A A . 6 ILE O 1 1 16 3377 1 1 7 TRP C C 8.749 5.057 -15.272 1.00 . A A . 7 TRP C 1 1 16 3378 1 1 7 TRP CA C 7.234 5.221 -15.225 1.00 . A A . 7 TRP CA 1 1 16 3379 1 1 7 TRP CB C 6.861 6.693 -15.415 1.00 . A A . 7 TRP CB 1 1 16 3380 1 1 7 TRP CD1 C 8.210 8.514 -16.612 1.00 . A A . 7 TRP CD1 1 1 16 3381 1 1 7 TRP CD2 C 7.592 6.811 -17.928 1.00 . A A . 7 TRP CD2 1 1 16 3382 1 1 7 TRP CE2 C 8.320 7.735 -18.702 1.00 . A A . 7 TRP CE2 1 1 16 3383 1 1 7 TRP CE3 C 7.101 5.656 -18.544 1.00 . A A . 7 TRP CE3 1 1 16 3384 1 1 7 TRP CG C 7.533 7.328 -16.594 1.00 . A A . 7 TRP CG 1 1 16 3385 1 1 7 TRP CH2 C 8.075 6.401 -20.635 1.00 . A A . 7 TRP CH2 1 1 16 3386 1 1 7 TRP CZ2 C 8.567 7.540 -20.058 1.00 . A A . 7 TRP CZ2 1 1 16 3387 1 1 7 TRP CZ3 C 7.347 5.463 -19.890 1.00 . A A . 7 TRP CZ3 1 1 16 3388 1 1 7 TRP H H 6.101 5.297 -13.437 1.00 . A A . 7 TRP H 1 1 16 3389 1 1 7 TRP HA H 6.795 4.642 -16.024 1.00 . A A . 7 TRP HA 1 1 16 3390 1 1 7 TRP HB2 H 5.794 6.772 -15.557 1.00 . A A . 7 TRP HB2 1 1 16 3391 1 1 7 TRP HB3 H 7.146 7.245 -14.531 1.00 . A A . 7 TRP HB3 1 1 16 3392 1 1 7 TRP HD1 H 8.342 9.151 -15.751 1.00 . A A . 7 TRP HD1 1 1 16 3393 1 1 7 TRP HE1 H 9.203 9.554 -18.143 1.00 . A A . 7 TRP HE1 1 1 16 3394 1 1 7 TRP HE3 H 6.538 4.922 -17.987 1.00 . A A . 7 TRP HE3 1 1 16 3395 1 1 7 TRP HH2 H 8.243 6.209 -21.684 1.00 . A A . 7 TRP HH2 1 1 16 3396 1 1 7 TRP HZ2 H 9.127 8.252 -20.646 1.00 . A A . 7 TRP HZ2 1 1 16 3397 1 1 7 TRP HZ3 H 6.975 4.577 -20.383 1.00 . A A . 7 TRP HZ3 1 1 16 3398 1 1 7 TRP N N 6.695 4.722 -13.964 1.00 . A A . 7 TRP N 1 1 16 3399 1 1 7 TRP NE1 N 8.685 8.766 -17.876 1.00 . A A . 7 TRP NE1 1 1 16 3400 1 1 7 TRP O O 9.320 4.781 -16.327 1.00 . A A . 7 TRP O 1 1 16 3401 1 1 8 LYS C C 11.305 3.757 -14.597 1.00 . A A . 8 LYS C 1 1 16 3402 1 1 8 LYS CA C 10.844 5.097 -14.034 1.00 . A A . 8 LYS CA 1 1 16 3403 1 1 8 LYS CB C 11.300 5.236 -12.580 1.00 . A A . 8 LYS CB 1 1 16 3404 1 1 8 LYS CD C 10.744 4.548 -10.228 1.00 . A A . 8 LYS CD 1 1 16 3405 1 1 8 LYS CE C 12.127 4.639 -9.602 1.00 . A A . 8 LYS CE 1 1 16 3406 1 1 8 LYS CG C 10.819 4.110 -11.681 1.00 . A A . 8 LYS CG 1 1 16 3407 1 1 8 LYS H H 8.883 5.447 -13.316 1.00 . A A . 8 LYS H 1 1 16 3408 1 1 8 LYS HA H 11.286 5.891 -14.618 1.00 . A A . 8 LYS HA 1 1 16 3409 1 1 8 LYS HB2 H 12.379 5.253 -12.553 1.00 . A A . 8 LYS HB2 1 1 16 3410 1 1 8 LYS HB3 H 10.924 6.169 -12.185 1.00 . A A . 8 LYS HB3 1 1 16 3411 1 1 8 LYS HD2 H 10.275 5.519 -10.178 1.00 . A A . 8 LYS HD2 1 1 16 3412 1 1 8 LYS HD3 H 10.154 3.832 -9.675 1.00 . A A . 8 LYS HD3 1 1 16 3413 1 1 8 LYS HE2 H 12.092 4.196 -8.618 1.00 . A A . 8 LYS HE2 1 1 16 3414 1 1 8 LYS HE3 H 12.824 4.090 -10.219 1.00 . A A . 8 LYS HE3 1 1 16 3415 1 1 8 LYS HG2 H 9.835 3.800 -12.003 1.00 . A A . 8 LYS HG2 1 1 16 3416 1 1 8 LYS HG3 H 11.505 3.279 -11.763 1.00 . A A . 8 LYS HG3 1 1 16 3417 1 1 8 LYS HZ1 H 13.356 6.116 -8.781 1.00 . A A . 8 LYS HZ1 1 1 16 3418 1 1 8 LYS HZ2 H 12.947 6.387 -10.400 1.00 . A A . 8 LYS HZ2 1 1 16 3419 1 1 8 LYS HZ3 H 11.805 6.660 -9.183 1.00 . A A . 8 LYS HZ3 1 1 16 3420 1 1 8 LYS N N 9.395 5.228 -14.124 1.00 . A A . 8 LYS N 1 1 16 3421 1 1 8 LYS NZ N 12.591 6.049 -9.483 1.00 . A A . 8 LYS NZ 1 1 16 3422 1 1 8 LYS O O 12.371 3.662 -15.206 1.00 . A A . 8 LYS O 1 1 16 3423 1 1 9 SER C C 10.370 1.209 -16.322 1.00 . A A . 9 SER C 1 1 16 3424 1 1 9 SER CA C 10.822 1.387 -14.875 1.00 . A A . 9 SER CA 1 1 16 3425 1 1 9 SER CB C 10.167 0.326 -13.990 1.00 . A A . 9 SER CB 1 1 16 3426 1 1 9 SER H H 9.659 2.862 -13.898 1.00 . A A . 9 SER H 1 1 16 3427 1 1 9 SER HA H 11.895 1.271 -14.829 1.00 . A A . 9 SER HA 1 1 16 3428 1 1 9 SER HB2 H 10.294 0.597 -12.953 1.00 . A A . 9 SER HB2 1 1 16 3429 1 1 9 SER HB3 H 9.113 0.269 -14.221 1.00 . A A . 9 SER HB3 1 1 16 3430 1 1 9 SER HG H 11.029 -1.317 -13.362 1.00 . A A . 9 SER HG 1 1 16 3431 1 1 9 SER N N 10.495 2.723 -14.390 1.00 . A A . 9 SER N 1 1 16 3432 1 1 9 SER O O 11.062 0.587 -17.128 1.00 . A A . 9 SER O 1 1 16 3433 1 1 9 SER OG O 10.751 -0.948 -14.203 1.00 . A A . 9 SER OG 1 1 16 3434 1 1 10 PHE C C 9.632 2.234 -19.016 1.00 . A A . 10 PHE C 1 1 16 3435 1 1 10 PHE CA C 8.658 1.661 -17.991 1.00 . A A . 10 PHE CA 1 1 16 3436 1 1 10 PHE CB C 7.319 2.397 -18.077 1.00 . A A . 10 PHE CB 1 1 16 3437 1 1 10 PHE CD1 C 6.129 0.629 -16.753 1.00 . A A . 10 PHE CD1 1 1 16 3438 1 1 10 PHE CD2 C 5.019 1.569 -18.642 1.00 . A A . 10 PHE CD2 1 1 16 3439 1 1 10 PHE CE1 C 5.038 -0.185 -16.512 1.00 . A A . 10 PHE CE1 1 1 16 3440 1 1 10 PHE CE2 C 3.925 0.758 -18.406 1.00 . A A . 10 PHE CE2 1 1 16 3441 1 1 10 PHE CG C 6.132 1.514 -17.819 1.00 . A A . 10 PHE CG 1 1 16 3442 1 1 10 PHE CZ C 3.935 -0.121 -17.341 1.00 . A A . 10 PHE CZ 1 1 16 3443 1 1 10 PHE H H 8.698 2.243 -15.956 1.00 . A A . 10 PHE H 1 1 16 3444 1 1 10 PHE HA H 8.499 0.616 -18.208 1.00 . A A . 10 PHE HA 1 1 16 3445 1 1 10 PHE HB2 H 7.306 3.192 -17.346 1.00 . A A . 10 PHE HB2 1 1 16 3446 1 1 10 PHE HB3 H 7.212 2.820 -19.064 1.00 . A A . 10 PHE HB3 1 1 16 3447 1 1 10 PHE HD1 H 6.992 0.578 -16.104 1.00 . A A . 10 PHE HD1 1 1 16 3448 1 1 10 PHE HD2 H 5.010 2.255 -19.476 1.00 . A A . 10 PHE HD2 1 1 16 3449 1 1 10 PHE HE1 H 5.049 -0.871 -15.678 1.00 . A A . 10 PHE HE1 1 1 16 3450 1 1 10 PHE HE2 H 3.064 0.810 -19.055 1.00 . A A . 10 PHE HE2 1 1 16 3451 1 1 10 PHE HZ H 3.081 -0.755 -17.154 1.00 . A A . 10 PHE HZ 1 1 16 3452 1 1 10 PHE N N 9.204 1.759 -16.643 1.00 . A A . 10 PHE N 1 1 16 3453 1 1 10 PHE O O 9.743 1.729 -20.134 1.00 . A A . 10 PHE O 1 1 16 3454 1 1 11 LEU C C 12.713 3.415 -19.247 1.00 . A A . 11 LEU C 1 1 16 3455 1 1 11 LEU CA C 11.303 3.934 -19.511 1.00 . A A . 11 LEU CA 1 1 16 3456 1 1 11 LEU CB C 11.263 5.451 -19.325 1.00 . A A . 11 LEU CB 1 1 16 3457 1 1 11 LEU CD1 C 13.089 5.968 -20.963 1.00 . A A . 11 LEU CD1 1 1 16 3458 1 1 11 LEU CD2 C 12.416 7.676 -19.264 1.00 . A A . 11 LEU CD2 1 1 16 3459 1 1 11 LEU CG C 12.583 6.190 -19.546 1.00 . A A . 11 LEU CG 1 1 16 3460 1 1 11 LEU H H 10.206 3.647 -17.724 1.00 . A A . 11 LEU H 1 1 16 3461 1 1 11 LEU HA H 11.030 3.696 -20.528 1.00 . A A . 11 LEU HA 1 1 16 3462 1 1 11 LEU HB2 H 10.540 5.851 -20.020 1.00 . A A . 11 LEU HB2 1 1 16 3463 1 1 11 LEU HB3 H 10.935 5.651 -18.314 1.00 . A A . 11 LEU HB3 1 1 16 3464 1 1 11 LEU HD11 H 12.506 6.562 -21.650 1.00 . A A . 11 LEU HD11 1 1 16 3465 1 1 11 LEU HD12 H 14.127 6.260 -21.024 1.00 . A A . 11 LEU HD12 1 1 16 3466 1 1 11 LEU HD13 H 12.993 4.923 -21.219 1.00 . A A . 11 LEU HD13 1 1 16 3467 1 1 11 LEU HD21 H 13.380 8.162 -19.309 1.00 . A A . 11 LEU HD21 1 1 16 3468 1 1 11 LEU HD22 H 11.760 8.111 -20.003 1.00 . A A . 11 LEU HD22 1 1 16 3469 1 1 11 LEU HD23 H 11.990 7.811 -18.281 1.00 . A A . 11 LEU HD23 1 1 16 3470 1 1 11 LEU HG H 13.325 5.801 -18.862 1.00 . A A . 11 LEU HG 1 1 16 3471 1 1 11 LEU N N 10.337 3.290 -18.627 1.00 . A A . 11 LEU N 1 1 16 3472 1 1 11 LEU O O 12.966 2.762 -18.235 1.00 . A A . 11 LEU O 1 1 17 3473 1 1 1 LYS C C 2.046 1.611 -1.449 1.00 . A A . 1 LYS C 1 1 17 3474 1 1 1 LYS CA C 1.150 1.818 -0.232 1.00 . A A . 1 LYS CA 1 1 17 3475 1 1 1 LYS CB C -0.239 1.237 -0.503 1.00 . A A . 1 LYS CB 1 1 17 3476 1 1 1 LYS CD C -2.085 1.966 1.037 1.00 . A A . 1 LYS CD 1 1 17 3477 1 1 1 LYS CE C -2.949 1.581 2.228 1.00 . A A . 1 LYS CE 1 1 17 3478 1 1 1 LYS CG C -1.021 0.917 0.759 1.00 . A A . 1 LYS CG 1 1 17 3479 1 1 1 LYS H1 H 0.190 3.591 0.413 1.00 . A A . 1 LYS H1 1 1 17 3480 1 1 1 LYS HA H 1.586 1.307 0.613 1.00 . A A . 1 LYS HA 1 1 17 3481 1 1 1 LYS HB2 H -0.807 1.950 -1.083 1.00 . A A . 1 LYS HB2 1 1 17 3482 1 1 1 LYS HB3 H -0.130 0.327 -1.075 1.00 . A A . 1 LYS HB3 1 1 17 3483 1 1 1 LYS HD2 H -1.603 2.909 1.246 1.00 . A A . 1 LYS HD2 1 1 17 3484 1 1 1 LYS HD3 H -2.715 2.067 0.164 1.00 . A A . 1 LYS HD3 1 1 17 3485 1 1 1 LYS HE2 H -2.336 1.060 2.948 1.00 . A A . 1 LYS HE2 1 1 17 3486 1 1 1 LYS HE3 H -3.343 2.482 2.676 1.00 . A A . 1 LYS HE3 1 1 17 3487 1 1 1 LYS HG2 H -1.501 -0.044 0.640 1.00 . A A . 1 LYS HG2 1 1 17 3488 1 1 1 LYS HG3 H -0.338 0.879 1.595 1.00 . A A . 1 LYS HG3 1 1 17 3489 1 1 1 LYS HZ1 H -4.986 1.200 1.965 1.00 . A A . 1 LYS HZ1 1 1 17 3490 1 1 1 LYS HZ2 H -3.992 0.433 0.830 1.00 . A A . 1 LYS HZ2 1 1 17 3491 1 1 1 LYS HZ3 H -4.086 -0.162 2.411 1.00 . A A . 1 LYS HZ3 1 1 17 3492 1 1 1 LYS N N 1.049 3.234 0.105 1.00 . A A . 1 LYS N 1 1 17 3493 1 1 1 LYS NZ N -4.083 0.701 1.831 1.00 . A A . 1 LYS NZ 1 1 17 3494 1 1 1 LYS O O 2.832 0.665 -1.499 1.00 . A A . 1 LYS O 1 1 17 3495 1 1 2 PHE C C 3.532 3.694 -3.853 1.00 . A A . 2 PHE C 1 1 17 3496 1 1 2 PHE CA C 2.723 2.417 -3.643 1.00 . A A . 2 PHE CA 1 1 17 3497 1 1 2 PHE CB C 1.822 2.166 -4.854 1.00 . A A . 2 PHE CB 1 1 17 3498 1 1 2 PHE CD1 C 1.405 -0.293 -5.128 1.00 . A A . 2 PHE CD1 1 1 17 3499 1 1 2 PHE CD2 C -0.316 1.048 -4.166 1.00 . A A . 2 PHE CD2 1 1 17 3500 1 1 2 PHE CE1 C 0.608 -1.415 -5.000 1.00 . A A . 2 PHE CE1 1 1 17 3501 1 1 2 PHE CE2 C -1.117 -0.071 -4.034 1.00 . A A . 2 PHE CE2 1 1 17 3502 1 1 2 PHE CG C 0.953 0.949 -4.713 1.00 . A A . 2 PHE CG 1 1 17 3503 1 1 2 PHE CZ C -0.655 -1.303 -4.453 1.00 . A A . 2 PHE CZ 1 1 17 3504 1 1 2 PHE H H 1.279 3.235 -2.328 1.00 . A A . 2 PHE H 1 1 17 3505 1 1 2 PHE HA H 3.404 1.587 -3.534 1.00 . A A . 2 PHE HA 1 1 17 3506 1 1 2 PHE HB2 H 1.176 3.020 -4.997 1.00 . A A . 2 PHE HB2 1 1 17 3507 1 1 2 PHE HB3 H 2.438 2.036 -5.731 1.00 . A A . 2 PHE HB3 1 1 17 3508 1 1 2 PHE HD1 H 2.394 -0.381 -5.557 1.00 . A A . 2 PHE HD1 1 1 17 3509 1 1 2 PHE HD2 H -0.679 2.011 -3.839 1.00 . A A . 2 PHE HD2 1 1 17 3510 1 1 2 PHE HE1 H 0.973 -2.377 -5.328 1.00 . A A . 2 PHE HE1 1 1 17 3511 1 1 2 PHE HE2 H -2.105 0.019 -3.607 1.00 . A A . 2 PHE HE2 1 1 17 3512 1 1 2 PHE HZ H -1.279 -2.179 -4.350 1.00 . A A . 2 PHE HZ 1 1 17 3513 1 1 2 PHE N N 1.923 2.502 -2.427 1.00 . A A . 2 PHE N 1 1 17 3514 1 1 2 PHE O O 2.980 4.748 -4.171 1.00 . A A . 2 PHE O 1 1 17 3515 1 1 3 LYS C C 6.799 4.446 -4.893 1.00 . A A . 3 LYS C 1 1 17 3516 1 1 3 LYS CA C 5.732 4.736 -3.842 1.00 . A A . 3 LYS CA 1 1 17 3517 1 1 3 LYS CB C 6.396 5.094 -2.511 1.00 . A A . 3 LYS CB 1 1 17 3518 1 1 3 LYS CD C 8.597 4.104 -1.816 1.00 . A A . 3 LYS CD 1 1 17 3519 1 1 3 LYS CE C 9.323 2.778 -1.986 1.00 . A A . 3 LYS CE 1 1 17 3520 1 1 3 LYS CG C 7.089 3.920 -1.841 1.00 . A A . 3 LYS CG 1 1 17 3521 1 1 3 LYS H H 5.226 2.724 -3.420 1.00 . A A . 3 LYS H 1 1 17 3522 1 1 3 LYS HA H 5.135 5.572 -4.174 1.00 . A A . 3 LYS HA 1 1 17 3523 1 1 3 LYS HB2 H 7.129 5.868 -2.685 1.00 . A A . 3 LYS HB2 1 1 17 3524 1 1 3 LYS HB3 H 5.641 5.472 -1.836 1.00 . A A . 3 LYS HB3 1 1 17 3525 1 1 3 LYS HD2 H 8.884 4.764 -2.621 1.00 . A A . 3 LYS HD2 1 1 17 3526 1 1 3 LYS HD3 H 8.882 4.542 -0.870 1.00 . A A . 3 LYS HD3 1 1 17 3527 1 1 3 LYS HE2 H 8.638 2.060 -2.409 1.00 . A A . 3 LYS HE2 1 1 17 3528 1 1 3 LYS HE3 H 10.155 2.922 -2.659 1.00 . A A . 3 LYS HE3 1 1 17 3529 1 1 3 LYS HG2 H 6.731 3.833 -0.826 1.00 . A A . 3 LYS HG2 1 1 17 3530 1 1 3 LYS HG3 H 6.855 3.017 -2.387 1.00 . A A . 3 LYS HG3 1 1 17 3531 1 1 3 LYS HZ1 H 10.609 2.857 -0.341 1.00 . A A . 3 LYS HZ1 1 1 17 3532 1 1 3 LYS HZ2 H 9.072 2.249 0.019 1.00 . A A . 3 LYS HZ2 1 1 17 3533 1 1 3 LYS HZ3 H 10.190 1.286 -0.809 1.00 . A A . 3 LYS HZ3 1 1 17 3534 1 1 3 LYS N N 4.844 3.592 -3.673 1.00 . A A . 3 LYS N 1 1 17 3535 1 1 3 LYS NZ N 9.834 2.256 -0.688 1.00 . A A . 3 LYS NZ 1 1 17 3536 1 1 3 LYS O O 7.961 4.819 -4.732 1.00 . A A . 3 LYS O 1 1 17 3537 1 1 4 LYS C C 6.800 3.957 -8.387 1.00 . A A . 4 LYS C 1 1 17 3538 1 1 4 LYS CA C 7.318 3.441 -7.048 1.00 . A A . 4 LYS CA 1 1 17 3539 1 1 4 LYS CB C 7.520 1.925 -7.118 1.00 . A A . 4 LYS CB 1 1 17 3540 1 1 4 LYS CD C 6.216 -0.112 -6.442 1.00 . A A . 4 LYS CD 1 1 17 3541 1 1 4 LYS CE C 4.997 -0.972 -6.736 1.00 . A A . 4 LYS CE 1 1 17 3542 1 1 4 LYS CG C 6.228 1.147 -7.293 1.00 . A A . 4 LYS CG 1 1 17 3543 1 1 4 LYS H H 5.457 3.508 -6.040 1.00 . A A . 4 LYS H 1 1 17 3544 1 1 4 LYS HA H 8.265 3.913 -6.836 1.00 . A A . 4 LYS HA 1 1 17 3545 1 1 4 LYS HB2 H 8.168 1.699 -7.951 1.00 . A A . 4 LYS HB2 1 1 17 3546 1 1 4 LYS HB3 H 7.994 1.595 -6.204 1.00 . A A . 4 LYS HB3 1 1 17 3547 1 1 4 LYS HD2 H 7.106 -0.686 -6.650 1.00 . A A . 4 LYS HD2 1 1 17 3548 1 1 4 LYS HD3 H 6.203 0.170 -5.398 1.00 . A A . 4 LYS HD3 1 1 17 3549 1 1 4 LYS HE2 H 4.825 -1.630 -5.898 1.00 . A A . 4 LYS HE2 1 1 17 3550 1 1 4 LYS HE3 H 4.140 -0.327 -6.868 1.00 . A A . 4 LYS HE3 1 1 17 3551 1 1 4 LYS HG2 H 5.398 1.773 -7.001 1.00 . A A . 4 LYS HG2 1 1 17 3552 1 1 4 LYS HG3 H 6.124 0.869 -8.332 1.00 . A A . 4 LYS HG3 1 1 17 3553 1 1 4 LYS HZ1 H 4.306 -1.790 -8.530 1.00 . A A . 4 LYS HZ1 1 1 17 3554 1 1 4 LYS HZ2 H 5.953 -1.401 -8.543 1.00 . A A . 4 LYS HZ2 1 1 17 3555 1 1 4 LYS HZ3 H 5.414 -2.772 -7.711 1.00 . A A . 4 LYS HZ3 1 1 17 3556 1 1 4 LYS N N 6.397 3.779 -5.969 1.00 . A A . 4 LYS N 1 1 17 3557 1 1 4 LYS NZ N 5.180 -1.791 -7.966 1.00 . A A . 4 LYS NZ 1 1 17 3558 1 1 4 LYS O O 5.602 3.899 -8.665 1.00 . A A . 4 LYS O 1 1 17 3559 1 1 5 VAL C C 7.690 3.991 -11.629 1.00 . A A . 5 VAL C 1 1 17 3560 1 1 5 VAL CA C 7.346 4.985 -10.525 1.00 . A A . 5 VAL CA 1 1 17 3561 1 1 5 VAL CB C 8.056 6.321 -10.812 1.00 . A A . 5 VAL CB 1 1 17 3562 1 1 5 VAL CG1 C 7.574 6.910 -12.129 1.00 . A A . 5 VAL CG1 1 1 17 3563 1 1 5 VAL CG2 C 7.834 7.299 -9.668 1.00 . A A . 5 VAL CG2 1 1 17 3564 1 1 5 VAL H H 8.650 4.480 -8.936 1.00 . A A . 5 VAL H 1 1 17 3565 1 1 5 VAL HA H 6.280 5.160 -10.530 1.00 . A A . 5 VAL HA 1 1 17 3566 1 1 5 VAL HB H 9.116 6.132 -10.896 1.00 . A A . 5 VAL HB 1 1 17 3567 1 1 5 VAL HG11 H 6.624 6.469 -12.394 1.00 . A A . 5 VAL HG11 1 1 17 3568 1 1 5 VAL HG12 H 7.458 7.979 -12.025 1.00 . A A . 5 VAL HG12 1 1 17 3569 1 1 5 VAL HG13 H 8.296 6.700 -12.904 1.00 . A A . 5 VAL HG13 1 1 17 3570 1 1 5 VAL HG21 H 6.817 7.216 -9.316 1.00 . A A . 5 VAL HG21 1 1 17 3571 1 1 5 VAL HG22 H 8.515 7.070 -8.862 1.00 . A A . 5 VAL HG22 1 1 17 3572 1 1 5 VAL HG23 H 8.014 8.306 -10.015 1.00 . A A . 5 VAL HG23 1 1 17 3573 1 1 5 VAL N N 7.711 4.461 -9.214 1.00 . A A . 5 VAL N 1 1 17 3574 1 1 5 VAL O O 8.731 3.334 -11.584 1.00 . A A . 5 VAL O 1 1 17 3575 1 1 6 ILE C C 7.651 3.696 -14.923 1.00 . A A . 6 ILE C 1 1 17 3576 1 1 6 ILE CA C 7.021 2.975 -13.736 1.00 . A A . 6 ILE CA 1 1 17 3577 1 1 6 ILE CB C 5.702 2.322 -14.187 1.00 . A A . 6 ILE CB 1 1 17 3578 1 1 6 ILE CD1 C 3.771 0.862 -13.398 1.00 . A A . 6 ILE CD1 1 1 17 3579 1 1 6 ILE CG1 C 5.085 1.521 -13.038 1.00 . A A . 6 ILE CG1 1 1 17 3580 1 1 6 ILE CG2 C 5.939 1.428 -15.395 1.00 . A A . 6 ILE CG2 1 1 17 3581 1 1 6 ILE H H 6.000 4.437 -12.598 1.00 . A A . 6 ILE H 1 1 17 3582 1 1 6 ILE HA H 7.692 2.194 -13.406 1.00 . A A . 6 ILE HA 1 1 17 3583 1 1 6 ILE HB H 5.019 3.106 -14.477 1.00 . A A . 6 ILE HB 1 1 17 3584 1 1 6 ILE HD11 H 3.939 0.119 -14.162 1.00 . A A . 6 ILE HD11 1 1 17 3585 1 1 6 ILE HD12 H 3.354 0.390 -12.521 1.00 . A A . 6 ILE HD12 1 1 17 3586 1 1 6 ILE HD13 H 3.083 1.609 -13.766 1.00 . A A . 6 ILE HD13 1 1 17 3587 1 1 6 ILE HG12 H 5.772 0.747 -12.737 1.00 . A A . 6 ILE HG12 1 1 17 3588 1 1 6 ILE HG13 H 4.907 2.183 -12.203 1.00 . A A . 6 ILE HG13 1 1 17 3589 1 1 6 ILE HG21 H 6.277 2.029 -16.226 1.00 . A A . 6 ILE HG21 1 1 17 3590 1 1 6 ILE HG22 H 6.690 0.690 -15.155 1.00 . A A . 6 ILE HG22 1 1 17 3591 1 1 6 ILE HG23 H 5.018 0.931 -15.661 1.00 . A A . 6 ILE HG23 1 1 17 3592 1 1 6 ILE N N 6.810 3.887 -12.619 1.00 . A A . 6 ILE N 1 1 17 3593 1 1 6 ILE O O 8.268 3.071 -15.785 1.00 . A A . 6 ILE O 1 1 17 3594 1 1 7 TRP C C 9.539 5.561 -16.204 1.00 . A A . 7 TRP C 1 1 17 3595 1 1 7 TRP CA C 8.045 5.821 -16.041 1.00 . A A . 7 TRP CA 1 1 17 3596 1 1 7 TRP CB C 7.800 7.307 -15.773 1.00 . A A . 7 TRP CB 1 1 17 3597 1 1 7 TRP CD1 C 9.275 9.290 -16.452 1.00 . A A . 7 TRP CD1 1 1 17 3598 1 1 7 TRP CD2 C 8.470 8.108 -18.176 1.00 . A A . 7 TRP CD2 1 1 17 3599 1 1 7 TRP CE2 C 9.258 9.161 -18.681 1.00 . A A . 7 TRP CE2 1 1 17 3600 1 1 7 TRP CE3 C 7.861 7.230 -19.077 1.00 . A A . 7 TRP CE3 1 1 17 3601 1 1 7 TRP CG C 8.494 8.208 -16.748 1.00 . A A . 7 TRP CG 1 1 17 3602 1 1 7 TRP CH2 C 8.841 8.483 -20.905 1.00 . A A . 7 TRP CH2 1 1 17 3603 1 1 7 TRP CZ2 C 9.449 9.358 -20.046 1.00 . A A . 7 TRP CZ2 1 1 17 3604 1 1 7 TRP CZ3 C 8.052 7.427 -20.431 1.00 . A A . 7 TRP CZ3 1 1 17 3605 1 1 7 TRP H H 6.988 5.455 -14.243 1.00 . A A . 7 TRP H 1 1 17 3606 1 1 7 TRP HA H 7.541 5.541 -16.954 1.00 . A A . 7 TRP HA 1 1 17 3607 1 1 7 TRP HB2 H 6.740 7.506 -15.831 1.00 . A A . 7 TRP HB2 1 1 17 3608 1 1 7 TRP HB3 H 8.155 7.549 -14.782 1.00 . A A . 7 TRP HB3 1 1 17 3609 1 1 7 TRP HD1 H 9.487 9.630 -15.450 1.00 . A A . 7 TRP HD1 1 1 17 3610 1 1 7 TRP HE1 H 10.316 10.656 -17.660 1.00 . A A . 7 TRP HE1 1 1 17 3611 1 1 7 TRP HE3 H 7.249 6.410 -18.731 1.00 . A A . 7 TRP HE3 1 1 17 3612 1 1 7 TRP HH2 H 8.962 8.599 -21.971 1.00 . A A . 7 TRP HH2 1 1 17 3613 1 1 7 TRP HZ2 H 10.055 10.166 -20.428 1.00 . A A . 7 TRP HZ2 1 1 17 3614 1 1 7 TRP HZ3 H 7.588 6.759 -21.142 1.00 . A A . 7 TRP HZ3 1 1 17 3615 1 1 7 TRP N N 7.491 5.014 -14.960 1.00 . A A . 7 TRP N 1 1 17 3616 1 1 7 TRP NE1 N 9.736 9.867 -17.610 1.00 . A A . 7 TRP NE1 1 1 17 3617 1 1 7 TRP O O 10.063 5.569 -17.318 1.00 . A A . 7 TRP O 1 1 17 3618 1 1 8 LYS C C 11.954 3.741 -15.799 1.00 . A A . 8 LYS C 1 1 17 3619 1 1 8 LYS CA C 11.654 5.065 -15.105 1.00 . A A . 8 LYS CA 1 1 17 3620 1 1 8 LYS CB C 12.207 5.042 -13.678 1.00 . A A . 8 LYS CB 1 1 17 3621 1 1 8 LYS CD C 11.994 2.660 -12.912 1.00 . A A . 8 LYS CD 1 1 17 3622 1 1 8 LYS CE C 12.269 2.016 -11.562 1.00 . A A . 8 LYS CE 1 1 17 3623 1 1 8 LYS CG C 11.477 4.080 -12.758 1.00 . A A . 8 LYS CG 1 1 17 3624 1 1 8 LYS H H 9.746 5.336 -14.228 1.00 . A A . 8 LYS H 1 1 17 3625 1 1 8 LYS HA H 12.131 5.862 -15.655 1.00 . A A . 8 LYS HA 1 1 17 3626 1 1 8 LYS HB2 H 13.248 4.755 -13.713 1.00 . A A . 8 LYS HB2 1 1 17 3627 1 1 8 LYS HB3 H 12.131 6.036 -13.260 1.00 . A A . 8 LYS HB3 1 1 17 3628 1 1 8 LYS HD2 H 11.254 2.071 -13.435 1.00 . A A . 8 LYS HD2 1 1 17 3629 1 1 8 LYS HD3 H 12.911 2.680 -13.485 1.00 . A A . 8 LYS HD3 1 1 17 3630 1 1 8 LYS HE2 H 12.487 0.971 -11.713 1.00 . A A . 8 LYS HE2 1 1 17 3631 1 1 8 LYS HE3 H 13.123 2.501 -11.114 1.00 . A A . 8 LYS HE3 1 1 17 3632 1 1 8 LYS HG2 H 11.621 4.395 -11.735 1.00 . A A . 8 LYS HG2 1 1 17 3633 1 1 8 LYS HG3 H 10.423 4.098 -12.997 1.00 . A A . 8 LYS HG3 1 1 17 3634 1 1 8 LYS HZ1 H 10.276 2.499 -11.159 1.00 . A A . 8 LYS HZ1 1 1 17 3635 1 1 8 LYS HZ2 H 10.870 1.212 -10.235 1.00 . A A . 8 LYS HZ2 1 1 17 3636 1 1 8 LYS HZ3 H 11.328 2.798 -9.868 1.00 . A A . 8 LYS HZ3 1 1 17 3637 1 1 8 LYS N N 10.220 5.329 -15.086 1.00 . A A . 8 LYS N 1 1 17 3638 1 1 8 LYS NZ N 11.104 2.140 -10.641 1.00 . A A . 8 LYS NZ 1 1 17 3639 1 1 8 LYS O O 13.029 3.557 -16.369 1.00 . A A . 8 LYS O 1 1 17 3640 1 1 9 SER C C 10.893 1.587 -17.871 1.00 . A A . 9 SER C 1 1 17 3641 1 1 9 SER CA C 11.159 1.512 -16.371 1.00 . A A . 9 SER CA 1 1 17 3642 1 1 9 SER CB C 10.216 0.495 -15.724 1.00 . A A . 9 SER CB 1 1 17 3643 1 1 9 SER H H 10.160 3.026 -15.279 1.00 . A A . 9 SER H 1 1 17 3644 1 1 9 SER HA H 12.179 1.195 -16.213 1.00 . A A . 9 SER HA 1 1 17 3645 1 1 9 SER HB2 H 10.495 0.355 -14.691 1.00 . A A . 9 SER HB2 1 1 17 3646 1 1 9 SER HB3 H 9.202 0.865 -15.776 1.00 . A A . 9 SER HB3 1 1 17 3647 1 1 9 SER HG H 11.171 -1.106 -16.325 1.00 . A A . 9 SER HG 1 1 17 3648 1 1 9 SER N N 10.996 2.821 -15.748 1.00 . A A . 9 SER N 1 1 17 3649 1 1 9 SER O O 11.544 0.905 -18.663 1.00 . A A . 9 SER O 1 1 17 3650 1 1 9 SER OG O 10.280 -0.755 -16.389 1.00 . A A . 9 SER OG 1 1 17 3651 1 1 10 PHE C C 10.614 3.440 -20.385 1.00 . A A . 10 PHE C 1 1 17 3652 1 1 10 PHE CA C 9.579 2.585 -19.660 1.00 . A A . 10 PHE CA 1 1 17 3653 1 1 10 PHE CB C 8.194 3.224 -19.788 1.00 . A A . 10 PHE CB 1 1 17 3654 1 1 10 PHE CD1 C 6.969 1.358 -18.642 1.00 . A A . 10 PHE CD1 1 1 17 3655 1 1 10 PHE CD2 C 6.108 2.177 -20.709 1.00 . A A . 10 PHE CD2 1 1 17 3656 1 1 10 PHE CE1 C 5.933 0.445 -18.568 1.00 . A A . 10 PHE CE1 1 1 17 3657 1 1 10 PHE CE2 C 5.070 1.266 -20.641 1.00 . A A . 10 PHE CE2 1 1 17 3658 1 1 10 PHE CG C 7.068 2.233 -19.711 1.00 . A A . 10 PHE CG 1 1 17 3659 1 1 10 PHE CZ C 4.984 0.399 -19.569 1.00 . A A . 10 PHE CZ 1 1 17 3660 1 1 10 PHE H H 9.449 2.937 -17.576 1.00 . A A . 10 PHE H 1 1 17 3661 1 1 10 PHE HA H 9.557 1.606 -20.112 1.00 . A A . 10 PHE HA 1 1 17 3662 1 1 10 PHE HB2 H 8.060 3.939 -18.990 1.00 . A A . 10 PHE HB2 1 1 17 3663 1 1 10 PHE HB3 H 8.127 3.732 -20.737 1.00 . A A . 10 PHE HB3 1 1 17 3664 1 1 10 PHE HD1 H 7.712 1.393 -17.857 1.00 . A A . 10 PHE HD1 1 1 17 3665 1 1 10 PHE HD2 H 6.175 2.854 -21.548 1.00 . A A . 10 PHE HD2 1 1 17 3666 1 1 10 PHE HE1 H 5.869 -0.232 -17.729 1.00 . A A . 10 PHE HE1 1 1 17 3667 1 1 10 PHE HE2 H 4.329 1.232 -21.425 1.00 . A A . 10 PHE HE2 1 1 17 3668 1 1 10 PHE HZ H 4.174 -0.313 -19.513 1.00 . A A . 10 PHE HZ 1 1 17 3669 1 1 10 PHE N N 9.932 2.421 -18.255 1.00 . A A . 10 PHE N 1 1 17 3670 1 1 10 PHE O O 10.932 3.196 -21.550 1.00 . A A . 10 PHE O 1 1 17 3671 1 1 11 LEU C C 13.290 4.543 -20.870 1.00 . A A . 11 LEU C 1 1 17 3672 1 1 11 LEU CA C 12.136 5.336 -20.264 1.00 . A A . 11 LEU CA 1 1 17 3673 1 1 11 LEU CB C 12.667 6.296 -19.198 1.00 . A A . 11 LEU CB 1 1 17 3674 1 1 11 LEU CD1 C 13.406 8.586 -18.498 1.00 . A A . 11 LEU CD1 1 1 17 3675 1 1 11 LEU CD2 C 13.575 7.900 -20.897 1.00 . A A . 11 LEU CD2 1 1 17 3676 1 1 11 LEU CG C 12.774 7.764 -19.610 1.00 . A A . 11 LEU CG 1 1 17 3677 1 1 11 LEU H H 10.845 4.587 -18.764 1.00 . A A . 11 LEU H 1 1 17 3678 1 1 11 LEU HA H 11.659 5.907 -21.046 1.00 . A A . 11 LEU HA 1 1 17 3679 1 1 11 LEU HB2 H 12.008 6.239 -18.345 1.00 . A A . 11 LEU HB2 1 1 17 3680 1 1 11 LEU HB3 H 13.653 5.959 -18.911 1.00 . A A . 11 LEU HB3 1 1 17 3681 1 1 11 LEU HD11 H 14.229 8.035 -18.066 1.00 . A A . 11 LEU HD11 1 1 17 3682 1 1 11 LEU HD12 H 13.771 9.519 -18.902 1.00 . A A . 11 LEU HD12 1 1 17 3683 1 1 11 LEU HD13 H 12.669 8.788 -17.735 1.00 . A A . 11 LEU HD13 1 1 17 3684 1 1 11 LEU HD21 H 14.266 8.724 -20.806 1.00 . A A . 11 LEU HD21 1 1 17 3685 1 1 11 LEU HD22 H 14.124 6.987 -21.077 1.00 . A A . 11 LEU HD22 1 1 17 3686 1 1 11 LEU HD23 H 12.902 8.083 -21.722 1.00 . A A . 11 LEU HD23 1 1 17 3687 1 1 11 LEU HG H 11.782 8.155 -19.790 1.00 . A A . 11 LEU HG 1 1 17 3688 1 1 11 LEU N N 11.137 4.443 -19.688 1.00 . A A . 11 LEU N 1 1 17 3689 1 1 11 LEU O O 13.664 4.755 -22.023 1.00 . A A . 11 LEU O 1 1 18 3690 1 1 1 LYS C C 4.495 1.121 -2.977 1.00 . A A . 1 LYS C 1 1 18 3691 1 1 1 LYS CA C 4.468 -0.396 -2.818 1.00 . A A . 1 LYS CA 1 1 18 3692 1 1 1 LYS CB C 5.677 -0.856 -2.000 1.00 . A A . 1 LYS CB 1 1 18 3693 1 1 1 LYS CD C 6.289 -2.724 -0.436 1.00 . A A . 1 LYS CD 1 1 18 3694 1 1 1 LYS CE C 6.970 -4.084 -0.449 1.00 . A A . 1 LYS CE 1 1 18 3695 1 1 1 LYS CG C 5.745 -2.361 -1.807 1.00 . A A . 1 LYS CG 1 1 18 3696 1 1 1 LYS H1 H 4.562 -0.514 -4.929 1.00 . A A . 1 LYS H1 1 1 18 3697 1 1 1 LYS HA H 3.564 -0.675 -2.297 1.00 . A A . 1 LYS HA 1 1 18 3698 1 1 1 LYS HB2 H 6.578 -0.537 -2.502 1.00 . A A . 1 LYS HB2 1 1 18 3699 1 1 1 LYS HB3 H 5.635 -0.391 -1.025 1.00 . A A . 1 LYS HB3 1 1 18 3700 1 1 1 LYS HD2 H 7.008 -1.977 -0.134 1.00 . A A . 1 LYS HD2 1 1 18 3701 1 1 1 LYS HD3 H 5.472 -2.746 0.271 1.00 . A A . 1 LYS HD3 1 1 18 3702 1 1 1 LYS HE2 H 7.405 -4.244 -1.423 1.00 . A A . 1 LYS HE2 1 1 18 3703 1 1 1 LYS HE3 H 7.750 -4.088 0.298 1.00 . A A . 1 LYS HE3 1 1 18 3704 1 1 1 LYS HG2 H 4.751 -2.773 -1.909 1.00 . A A . 1 LYS HG2 1 1 18 3705 1 1 1 LYS HG3 H 6.390 -2.782 -2.565 1.00 . A A . 1 LYS HG3 1 1 18 3706 1 1 1 LYS HZ1 H 5.064 -4.798 0.018 1.00 . A A . 1 LYS HZ1 1 1 18 3707 1 1 1 LYS HZ2 H 5.964 -5.840 -0.965 1.00 . A A . 1 LYS HZ2 1 1 18 3708 1 1 1 LYS HZ3 H 6.321 -5.714 0.684 1.00 . A A . 1 LYS HZ3 1 1 18 3709 1 1 1 LYS N N 4.457 -1.055 -4.118 1.00 . A A . 1 LYS N 1 1 18 3710 1 1 1 LYS NZ N 6.013 -5.186 -0.158 1.00 . A A . 1 LYS NZ 1 1 18 3711 1 1 1 LYS O O 5.443 1.680 -3.529 1.00 . A A . 1 LYS O 1 1 18 3712 1 1 2 PHE C C 3.343 3.691 -4.033 1.00 . A A . 2 PHE C 1 1 18 3713 1 1 2 PHE CA C 3.356 3.234 -2.577 1.00 . A A . 2 PHE CA 1 1 18 3714 1 1 2 PHE CB C 4.523 3.888 -1.836 1.00 . A A . 2 PHE CB 1 1 18 3715 1 1 2 PHE CD1 C 4.062 5.777 -0.250 1.00 . A A . 2 PHE CD1 1 1 18 3716 1 1 2 PHE CD2 C 3.894 3.544 0.569 1.00 . A A . 2 PHE CD2 1 1 18 3717 1 1 2 PHE CE1 C 3.721 6.264 0.998 1.00 . A A . 2 PHE CE1 1 1 18 3718 1 1 2 PHE CE2 C 3.552 4.025 1.818 1.00 . A A . 2 PHE CE2 1 1 18 3719 1 1 2 PHE CG C 4.152 4.414 -0.478 1.00 . A A . 2 PHE CG 1 1 18 3720 1 1 2 PHE CZ C 3.467 5.387 2.034 1.00 . A A . 2 PHE CZ 1 1 18 3721 1 1 2 PHE H H 2.726 1.280 -2.061 1.00 . A A . 2 PHE H 1 1 18 3722 1 1 2 PHE HA H 2.430 3.534 -2.110 1.00 . A A . 2 PHE HA 1 1 18 3723 1 1 2 PHE HB2 H 5.311 3.161 -1.706 1.00 . A A . 2 PHE HB2 1 1 18 3724 1 1 2 PHE HB3 H 4.895 4.715 -2.423 1.00 . A A . 2 PHE HB3 1 1 18 3725 1 1 2 PHE HD1 H 4.262 6.465 -1.060 1.00 . A A . 2 PHE HD1 1 1 18 3726 1 1 2 PHE HD2 H 3.962 2.479 0.402 1.00 . A A . 2 PHE HD2 1 1 18 3727 1 1 2 PHE HE1 H 3.655 7.329 1.163 1.00 . A A . 2 PHE HE1 1 1 18 3728 1 1 2 PHE HE2 H 3.354 3.337 2.627 1.00 . A A . 2 PHE HE2 1 1 18 3729 1 1 2 PHE HZ H 3.199 5.765 3.009 1.00 . A A . 2 PHE HZ 1 1 18 3730 1 1 2 PHE N N 3.451 1.781 -2.489 1.00 . A A . 2 PHE N 1 1 18 3731 1 1 2 PHE O O 3.505 2.886 -4.950 1.00 . A A . 2 PHE O 1 1 18 3732 1 1 3 LYS C C 4.525 5.750 -6.125 1.00 . A A . 3 LYS C 1 1 18 3733 1 1 3 LYS CA C 3.114 5.556 -5.580 1.00 . A A . 3 LYS CA 1 1 18 3734 1 1 3 LYS CB C 2.371 6.894 -5.573 1.00 . A A . 3 LYS CB 1 1 18 3735 1 1 3 LYS CD C 0.389 8.069 -4.572 1.00 . A A . 3 LYS CD 1 1 18 3736 1 1 3 LYS CE C -0.039 7.874 -3.126 1.00 . A A . 3 LYS CE 1 1 18 3737 1 1 3 LYS CG C 0.909 6.776 -5.178 1.00 . A A . 3 LYS CG 1 1 18 3738 1 1 3 LYS H H 3.025 5.581 -3.465 1.00 . A A . 3 LYS H 1 1 18 3739 1 1 3 LYS HA H 2.586 4.865 -6.219 1.00 . A A . 3 LYS HA 1 1 18 3740 1 1 3 LYS HB2 H 2.858 7.559 -4.875 1.00 . A A . 3 LYS HB2 1 1 18 3741 1 1 3 LYS HB3 H 2.421 7.326 -6.562 1.00 . A A . 3 LYS HB3 1 1 18 3742 1 1 3 LYS HD2 H 1.170 8.813 -4.607 1.00 . A A . 3 LYS HD2 1 1 18 3743 1 1 3 LYS HD3 H -0.461 8.409 -5.147 1.00 . A A . 3 LYS HD3 1 1 18 3744 1 1 3 LYS HE2 H 0.595 7.127 -2.673 1.00 . A A . 3 LYS HE2 1 1 18 3745 1 1 3 LYS HE3 H 0.077 8.811 -2.601 1.00 . A A . 3 LYS HE3 1 1 18 3746 1 1 3 LYS HG2 H 0.326 6.542 -6.056 1.00 . A A . 3 LYS HG2 1 1 18 3747 1 1 3 LYS HG3 H 0.805 5.982 -4.452 1.00 . A A . 3 LYS HG3 1 1 18 3748 1 1 3 LYS HZ1 H -2.093 8.253 -3.083 1.00 . A A . 3 LYS HZ1 1 1 18 3749 1 1 3 LYS HZ2 H -1.685 6.774 -3.794 1.00 . A A . 3 LYS HZ2 1 1 18 3750 1 1 3 LYS HZ3 H -1.617 6.951 -2.113 1.00 . A A . 3 LYS HZ3 1 1 18 3751 1 1 3 LYS N N 3.148 4.989 -4.237 1.00 . A A . 3 LYS N 1 1 18 3752 1 1 3 LYS NZ N -1.458 7.432 -3.022 1.00 . A A . 3 LYS NZ 1 1 18 3753 1 1 3 LYS O O 4.978 6.878 -6.318 1.00 . A A . 3 LYS O 1 1 18 3754 1 1 4 LYS C C 6.612 5.398 -8.249 1.00 . A A . 4 LYS C 1 1 18 3755 1 1 4 LYS CA C 6.575 4.689 -6.899 1.00 . A A . 4 LYS CA 1 1 18 3756 1 1 4 LYS CB C 7.138 3.273 -7.040 1.00 . A A . 4 LYS CB 1 1 18 3757 1 1 4 LYS CD C 8.866 3.058 -5.229 1.00 . A A . 4 LYS CD 1 1 18 3758 1 1 4 LYS CE C 9.974 2.331 -5.976 1.00 . A A . 4 LYS CE 1 1 18 3759 1 1 4 LYS CG C 7.492 2.625 -5.713 1.00 . A A . 4 LYS CG 1 1 18 3760 1 1 4 LYS H H 4.800 3.771 -6.199 1.00 . A A . 4 LYS H 1 1 18 3761 1 1 4 LYS HA H 7.183 5.241 -6.199 1.00 . A A . 4 LYS HA 1 1 18 3762 1 1 4 LYS HB2 H 6.404 2.654 -7.535 1.00 . A A . 4 LYS HB2 1 1 18 3763 1 1 4 LYS HB3 H 8.031 3.312 -7.647 1.00 . A A . 4 LYS HB3 1 1 18 3764 1 1 4 LYS HD2 H 8.977 4.120 -5.390 1.00 . A A . 4 LYS HD2 1 1 18 3765 1 1 4 LYS HD3 H 8.952 2.841 -4.174 1.00 . A A . 4 LYS HD3 1 1 18 3766 1 1 4 LYS HE2 H 9.896 2.564 -7.027 1.00 . A A . 4 LYS HE2 1 1 18 3767 1 1 4 LYS HE3 H 10.928 2.674 -5.601 1.00 . A A . 4 LYS HE3 1 1 18 3768 1 1 4 LYS HG2 H 6.757 2.910 -4.975 1.00 . A A . 4 LYS HG2 1 1 18 3769 1 1 4 LYS HG3 H 7.485 1.551 -5.834 1.00 . A A . 4 LYS HG3 1 1 18 3770 1 1 4 LYS HZ1 H 9.590 0.405 -6.688 1.00 . A A . 4 LYS HZ1 1 1 18 3771 1 1 4 LYS HZ2 H 10.814 0.473 -5.522 1.00 . A A . 4 LYS HZ2 1 1 18 3772 1 1 4 LYS HZ3 H 9.194 0.625 -5.058 1.00 . A A . 4 LYS HZ3 1 1 18 3773 1 1 4 LYS N N 5.216 4.642 -6.373 1.00 . A A . 4 LYS N 1 1 18 3774 1 1 4 LYS NZ N 9.887 0.855 -5.799 1.00 . A A . 4 LYS NZ 1 1 18 3775 1 1 4 LYS O O 5.576 5.799 -8.780 1.00 . A A . 4 LYS O 1 1 18 3776 1 1 5 VAL C C 7.672 5.256 -11.239 1.00 . A A . 5 VAL C 1 1 18 3777 1 1 5 VAL CA C 7.984 6.208 -10.090 1.00 . A A . 5 VAL CA 1 1 18 3778 1 1 5 VAL CB C 9.417 6.747 -10.259 1.00 . A A . 5 VAL CB 1 1 18 3779 1 1 5 VAL CG1 C 9.548 7.516 -11.564 1.00 . A A . 5 VAL CG1 1 1 18 3780 1 1 5 VAL CG2 C 9.800 7.621 -9.074 1.00 . A A . 5 VAL CG2 1 1 18 3781 1 1 5 VAL H H 8.601 5.209 -8.329 1.00 . A A . 5 VAL H 1 1 18 3782 1 1 5 VAL HA H 7.300 7.044 -10.132 1.00 . A A . 5 VAL HA 1 1 18 3783 1 1 5 VAL HB H 10.094 5.906 -10.292 1.00 . A A . 5 VAL HB 1 1 18 3784 1 1 5 VAL HG11 H 9.950 6.866 -12.326 1.00 . A A . 5 VAL HG11 1 1 18 3785 1 1 5 VAL HG12 H 8.575 7.872 -11.871 1.00 . A A . 5 VAL HG12 1 1 18 3786 1 1 5 VAL HG13 H 10.210 8.357 -11.421 1.00 . A A . 5 VAL HG13 1 1 18 3787 1 1 5 VAL HG21 H 10.525 8.357 -9.389 1.00 . A A . 5 VAL HG21 1 1 18 3788 1 1 5 VAL HG22 H 8.920 8.121 -8.697 1.00 . A A . 5 VAL HG22 1 1 18 3789 1 1 5 VAL HG23 H 10.226 7.006 -8.295 1.00 . A A . 5 VAL HG23 1 1 18 3790 1 1 5 VAL N N 7.812 5.549 -8.800 1.00 . A A . 5 VAL N 1 1 18 3791 1 1 5 VAL O O 8.001 4.071 -11.183 1.00 . A A . 5 VAL O 1 1 18 3792 1 1 6 ILE C C 7.737 5.098 -14.536 1.00 . A A . 6 ILE C 1 1 18 3793 1 1 6 ILE CA C 6.680 4.979 -13.443 1.00 . A A . 6 ILE CA 1 1 18 3794 1 1 6 ILE CB C 5.314 5.396 -14.019 1.00 . A A . 6 ILE CB 1 1 18 3795 1 1 6 ILE CD1 C 2.842 5.618 -13.455 1.00 . A A . 6 ILE CD1 1 1 18 3796 1 1 6 ILE CG1 C 4.216 5.211 -12.970 1.00 . A A . 6 ILE CG1 1 1 18 3797 1 1 6 ILE CG2 C 4.999 4.591 -15.271 1.00 . A A . 6 ILE CG2 1 1 18 3798 1 1 6 ILE H H 6.799 6.733 -12.265 1.00 . A A . 6 ILE H 1 1 18 3799 1 1 6 ILE HA H 6.617 3.948 -13.129 1.00 . A A . 6 ILE HA 1 1 18 3800 1 1 6 ILE HB H 5.367 6.438 -14.295 1.00 . A A . 6 ILE HB 1 1 18 3801 1 1 6 ILE HD11 H 2.868 6.644 -13.789 1.00 . A A . 6 ILE HD11 1 1 18 3802 1 1 6 ILE HD12 H 2.546 4.979 -14.274 1.00 . A A . 6 ILE HD12 1 1 18 3803 1 1 6 ILE HD13 H 2.131 5.520 -12.648 1.00 . A A . 6 ILE HD13 1 1 18 3804 1 1 6 ILE HG12 H 4.172 4.172 -12.683 1.00 . A A . 6 ILE HG12 1 1 18 3805 1 1 6 ILE HG13 H 4.453 5.810 -12.102 1.00 . A A . 6 ILE HG13 1 1 18 3806 1 1 6 ILE HG21 H 5.031 3.537 -15.038 1.00 . A A . 6 ILE HG21 1 1 18 3807 1 1 6 ILE HG22 H 4.014 4.851 -15.628 1.00 . A A . 6 ILE HG22 1 1 18 3808 1 1 6 ILE HG23 H 5.729 4.813 -16.035 1.00 . A A . 6 ILE HG23 1 1 18 3809 1 1 6 ILE N N 7.035 5.782 -12.280 1.00 . A A . 6 ILE N 1 1 18 3810 1 1 6 ILE O O 7.851 4.229 -15.401 1.00 . A A . 6 ILE O 1 1 18 3811 1 1 7 TRP C C 10.497 5.209 -15.563 1.00 . A A . 7 TRP C 1 1 18 3812 1 1 7 TRP CA C 9.560 6.408 -15.475 1.00 . A A . 7 TRP CA 1 1 18 3813 1 1 7 TRP CB C 10.353 7.667 -15.119 1.00 . A A . 7 TRP CB 1 1 18 3814 1 1 7 TRP CD1 C 12.832 8.139 -15.567 1.00 . A A . 7 TRP CD1 1 1 18 3815 1 1 7 TRP CD2 C 11.605 7.831 -17.415 1.00 . A A . 7 TRP CD2 1 1 18 3816 1 1 7 TRP CE2 C 12.938 8.080 -17.797 1.00 . A A . 7 TRP CE2 1 1 18 3817 1 1 7 TRP CE3 C 10.651 7.605 -18.410 1.00 . A A . 7 TRP CE3 1 1 18 3818 1 1 7 TRP CG C 11.560 7.873 -15.985 1.00 . A A . 7 TRP CG 1 1 18 3819 1 1 7 TRP CH2 C 12.382 7.886 -20.084 1.00 . A A . 7 TRP CH2 1 1 18 3820 1 1 7 TRP CZ2 C 13.337 8.110 -19.130 1.00 . A A . 7 TRP CZ2 1 1 18 3821 1 1 7 TRP CZ3 C 11.048 7.635 -19.734 1.00 . A A . 7 TRP CZ3 1 1 18 3822 1 1 7 TRP H H 8.371 6.834 -13.775 1.00 . A A . 7 TRP H 1 1 18 3823 1 1 7 TRP HA H 9.086 6.551 -16.435 1.00 . A A . 7 TRP HA 1 1 18 3824 1 1 7 TRP HB2 H 9.714 8.530 -15.228 1.00 . A A . 7 TRP HB2 1 1 18 3825 1 1 7 TRP HB3 H 10.686 7.596 -14.094 1.00 . A A . 7 TRP HB3 1 1 18 3826 1 1 7 TRP HD1 H 13.125 8.236 -14.532 1.00 . A A . 7 TRP HD1 1 1 18 3827 1 1 7 TRP HE1 H 14.627 8.456 -16.610 1.00 . A A . 7 TRP HE1 1 1 18 3828 1 1 7 TRP HE3 H 9.618 7.410 -18.160 1.00 . A A . 7 TRP HE3 1 1 18 3829 1 1 7 TRP HH2 H 12.647 7.900 -21.130 1.00 . A A . 7 TRP HH2 1 1 18 3830 1 1 7 TRP HZ2 H 14.361 8.301 -19.416 1.00 . A A . 7 TRP HZ2 1 1 18 3831 1 1 7 TRP HZ3 H 10.325 7.464 -20.517 1.00 . A A . 7 TRP HZ3 1 1 18 3832 1 1 7 TRP N N 8.510 6.177 -14.489 1.00 . A A . 7 TRP N 1 1 18 3833 1 1 7 TRP NE1 N 13.666 8.266 -16.651 1.00 . A A . 7 TRP NE1 1 1 18 3834 1 1 7 TRP O O 10.991 4.872 -16.639 1.00 . A A . 7 TRP O 1 1 18 3835 1 1 8 LYS C C 11.022 2.239 -15.156 1.00 . A A . 8 LYS C 1 1 18 3836 1 1 8 LYS CA C 11.617 3.405 -14.373 1.00 . A A . 8 LYS CA 1 1 18 3837 1 1 8 LYS CB C 11.859 2.987 -12.920 1.00 . A A . 8 LYS CB 1 1 18 3838 1 1 8 LYS CD C 10.017 1.370 -12.373 1.00 . A A . 8 LYS CD 1 1 18 3839 1 1 8 LYS CE C 9.636 0.688 -11.068 1.00 . A A . 8 LYS CE 1 1 18 3840 1 1 8 LYS CG C 10.581 2.760 -12.132 1.00 . A A . 8 LYS CG 1 1 18 3841 1 1 8 LYS H H 10.316 4.885 -13.599 1.00 . A A . 8 LYS H 1 1 18 3842 1 1 8 LYS HA H 12.560 3.680 -14.821 1.00 . A A . 8 LYS HA 1 1 18 3843 1 1 8 LYS HB2 H 12.430 2.071 -12.912 1.00 . A A . 8 LYS HB2 1 1 18 3844 1 1 8 LYS HB3 H 12.429 3.761 -12.426 1.00 . A A . 8 LYS HB3 1 1 18 3845 1 1 8 LYS HD2 H 9.136 1.451 -12.994 1.00 . A A . 8 LYS HD2 1 1 18 3846 1 1 8 LYS HD3 H 10.761 0.772 -12.879 1.00 . A A . 8 LYS HD3 1 1 18 3847 1 1 8 LYS HE2 H 9.101 -0.221 -11.295 1.00 . A A . 8 LYS HE2 1 1 18 3848 1 1 8 LYS HE3 H 10.540 0.449 -10.526 1.00 . A A . 8 LYS HE3 1 1 18 3849 1 1 8 LYS HG2 H 10.793 2.872 -11.079 1.00 . A A . 8 LYS HG2 1 1 18 3850 1 1 8 LYS HG3 H 9.848 3.494 -12.434 1.00 . A A . 8 LYS HG3 1 1 18 3851 1 1 8 LYS HZ1 H 9.312 2.395 -9.908 1.00 . A A . 8 LYS HZ1 1 1 18 3852 1 1 8 LYS HZ2 H 7.944 1.872 -10.755 1.00 . A A . 8 LYS HZ2 1 1 18 3853 1 1 8 LYS HZ3 H 8.458 1.034 -9.378 1.00 . A A . 8 LYS HZ3 1 1 18 3854 1 1 8 LYS N N 10.740 4.568 -14.425 1.00 . A A . 8 LYS N 1 1 18 3855 1 1 8 LYS NZ N 8.777 1.558 -10.218 1.00 . A A . 8 LYS NZ 1 1 18 3856 1 1 8 LYS O O 11.749 1.386 -15.665 1.00 . A A . 8 LYS O 1 1 18 3857 1 1 9 SER C C 9.052 1.389 -17.473 1.00 . A A . 9 SER C 1 1 18 3858 1 1 9 SER CA C 9.004 1.147 -15.967 1.00 . A A . 9 SER CA 1 1 18 3859 1 1 9 SER CB C 7.550 1.050 -15.501 1.00 . A A . 9 SER CB 1 1 18 3860 1 1 9 SER H H 9.172 2.918 -14.820 1.00 . A A . 9 SER H 1 1 18 3861 1 1 9 SER HA H 9.506 0.216 -15.748 1.00 . A A . 9 SER HA 1 1 18 3862 1 1 9 SER HB2 H 7.330 1.876 -14.842 1.00 . A A . 9 SER HB2 1 1 18 3863 1 1 9 SER HB3 H 6.896 1.092 -16.361 1.00 . A A . 9 SER HB3 1 1 18 3864 1 1 9 SER HG H 7.681 -0.101 -13.922 1.00 . A A . 9 SER HG 1 1 18 3865 1 1 9 SER N N 9.696 2.209 -15.248 1.00 . A A . 9 SER N 1 1 18 3866 1 1 9 SER O O 9.159 0.449 -18.261 1.00 . A A . 9 SER O 1 1 18 3867 1 1 9 SER OG O 7.316 -0.163 -14.808 1.00 . A A . 9 SER OG 1 1 18 3868 1 1 10 PHE C C 10.433 2.979 -19.816 1.00 . A A . 10 PHE C 1 1 18 3869 1 1 10 PHE CA C 9.007 3.023 -19.276 1.00 . A A . 10 PHE CA 1 1 18 3870 1 1 10 PHE CB C 8.417 4.421 -19.475 1.00 . A A . 10 PHE CB 1 1 18 3871 1 1 10 PHE CD1 C 6.139 3.835 -18.601 1.00 . A A . 10 PHE CD1 1 1 18 3872 1 1 10 PHE CD2 C 6.290 5.034 -20.657 1.00 . A A . 10 PHE CD2 1 1 18 3873 1 1 10 PHE CE1 C 4.760 3.842 -18.694 1.00 . A A . 10 PHE CE1 1 1 18 3874 1 1 10 PHE CE2 C 4.911 5.044 -20.755 1.00 . A A . 10 PHE CE2 1 1 18 3875 1 1 10 PHE CG C 6.919 4.430 -19.580 1.00 . A A . 10 PHE CG 1 1 18 3876 1 1 10 PHE CZ C 4.145 4.447 -19.773 1.00 . A A . 10 PHE CZ 1 1 18 3877 1 1 10 PHE H H 8.889 3.361 -17.189 1.00 . A A . 10 PHE H 1 1 18 3878 1 1 10 PHE HA H 8.407 2.308 -19.818 1.00 . A A . 10 PHE HA 1 1 18 3879 1 1 10 PHE HB2 H 8.694 5.044 -18.638 1.00 . A A . 10 PHE HB2 1 1 18 3880 1 1 10 PHE HB3 H 8.817 4.847 -20.383 1.00 . A A . 10 PHE HB3 1 1 18 3881 1 1 10 PHE HD1 H 6.619 3.361 -17.756 1.00 . A A . 10 PHE HD1 1 1 18 3882 1 1 10 PHE HD2 H 6.887 5.501 -21.426 1.00 . A A . 10 PHE HD2 1 1 18 3883 1 1 10 PHE HE1 H 4.164 3.373 -17.925 1.00 . A A . 10 PHE HE1 1 1 18 3884 1 1 10 PHE HE2 H 4.433 5.518 -21.600 1.00 . A A . 10 PHE HE2 1 1 18 3885 1 1 10 PHE HZ H 3.068 4.454 -19.847 1.00 . A A . 10 PHE HZ 1 1 18 3886 1 1 10 PHE N N 8.973 2.656 -17.865 1.00 . A A . 10 PHE N 1 1 18 3887 1 1 10 PHE O O 10.663 2.602 -20.965 1.00 . A A . 10 PHE O 1 1 18 3888 1 1 11 LEU C C 13.211 2.015 -19.922 1.00 . A A . 11 LEU C 1 1 18 3889 1 1 11 LEU CA C 12.793 3.374 -19.370 1.00 . A A . 11 LEU CA 1 1 18 3890 1 1 11 LEU CB C 13.674 3.745 -18.176 1.00 . A A . 11 LEU CB 1 1 18 3891 1 1 11 LEU CD1 C 15.652 4.950 -17.216 1.00 . A A . 11 LEU CD1 1 1 18 3892 1 1 11 LEU CD2 C 15.625 4.328 -19.638 1.00 . A A . 11 LEU CD2 1 1 18 3893 1 1 11 LEU CG C 14.782 4.763 -18.449 1.00 . A A . 11 LEU CG 1 1 18 3894 1 1 11 LEU H H 11.144 3.658 -18.075 1.00 . A A . 11 LEU H 1 1 18 3895 1 1 11 LEU HA H 12.918 4.117 -20.143 1.00 . A A . 11 LEU HA 1 1 18 3896 1 1 11 LEU HB2 H 13.035 4.151 -17.406 1.00 . A A . 11 LEU HB2 1 1 18 3897 1 1 11 LEU HB3 H 14.139 2.839 -17.814 1.00 . A A . 11 LEU HB3 1 1 18 3898 1 1 11 LEU HD11 H 16.496 4.278 -17.266 1.00 . A A . 11 LEU HD11 1 1 18 3899 1 1 11 LEU HD12 H 16.005 5.970 -17.175 1.00 . A A . 11 LEU HD12 1 1 18 3900 1 1 11 LEU HD13 H 15.072 4.734 -16.330 1.00 . A A . 11 LEU HD13 1 1 18 3901 1 1 11 LEU HD21 H 16.607 4.772 -19.565 1.00 . A A . 11 LEU HD21 1 1 18 3902 1 1 11 LEU HD22 H 15.717 3.252 -19.640 1.00 . A A . 11 LEU HD22 1 1 18 3903 1 1 11 LEU HD23 H 15.151 4.650 -20.553 1.00 . A A . 11 LEU HD23 1 1 18 3904 1 1 11 LEU HG H 14.333 5.718 -18.688 1.00 . A A . 11 LEU HG 1 1 18 3905 1 1 11 LEU N N 11.388 3.368 -18.978 1.00 . A A . 11 LEU N 1 1 18 3906 1 1 11 LEU O O 13.905 1.931 -20.934 1.00 . A A . 11 LEU O 1 1 19 3907 1 1 1 LYS C C 2.545 3.786 -2.377 1.00 . A A . 1 LYS C 1 1 19 3908 1 1 1 LYS CA C 2.313 3.583 -0.883 1.00 . A A . 1 LYS CA 1 1 19 3909 1 1 1 LYS CB C 1.831 4.889 -0.248 1.00 . A A . 1 LYS CB 1 1 19 3910 1 1 1 LYS CD C 0.320 5.983 1.434 1.00 . A A . 1 LYS CD 1 1 19 3911 1 1 1 LYS CE C 0.136 6.022 2.944 1.00 . A A . 1 LYS CE 1 1 19 3912 1 1 1 LYS CG C 0.969 4.685 0.986 1.00 . A A . 1 LYS CG 1 1 19 3913 1 1 1 LYS H1 H 3.760 3.476 0.659 1.00 . A A . 1 LYS H1 1 1 19 3914 1 1 1 LYS HA H 1.555 2.826 -0.748 1.00 . A A . 1 LYS HA 1 1 19 3915 1 1 1 LYS HB2 H 2.691 5.478 0.033 1.00 . A A . 1 LYS HB2 1 1 19 3916 1 1 1 LYS HB3 H 1.253 5.438 -0.978 1.00 . A A . 1 LYS HB3 1 1 19 3917 1 1 1 LYS HD2 H 0.947 6.811 1.139 1.00 . A A . 1 LYS HD2 1 1 19 3918 1 1 1 LYS HD3 H -0.647 6.074 0.960 1.00 . A A . 1 LYS HD3 1 1 19 3919 1 1 1 LYS HE2 H 0.973 5.524 3.408 1.00 . A A . 1 LYS HE2 1 1 19 3920 1 1 1 LYS HE3 H 0.108 7.053 3.263 1.00 . A A . 1 LYS HE3 1 1 19 3921 1 1 1 LYS HG2 H 0.195 3.967 0.758 1.00 . A A . 1 LYS HG2 1 1 19 3922 1 1 1 LYS HG3 H 1.589 4.307 1.787 1.00 . A A . 1 LYS HG3 1 1 19 3923 1 1 1 LYS HZ1 H -1.213 4.427 2.893 1.00 . A A . 1 LYS HZ1 1 1 19 3924 1 1 1 LYS HZ2 H -1.121 5.200 4.396 1.00 . A A . 1 LYS HZ2 1 1 19 3925 1 1 1 LYS HZ3 H -1.945 5.937 3.114 1.00 . A A . 1 LYS HZ3 1 1 19 3926 1 1 1 LYS N N 3.530 3.121 -0.226 1.00 . A A . 1 LYS N 1 1 19 3927 1 1 1 LYS NZ N -1.124 5.349 3.366 1.00 . A A . 1 LYS NZ 1 1 19 3928 1 1 1 LYS O O 3.674 4.004 -2.815 1.00 . A A . 1 LYS O 1 1 19 3929 1 1 2 PHE C C 2.499 2.865 -5.216 1.00 . A A . 2 PHE C 1 1 19 3930 1 1 2 PHE CA C 1.555 3.892 -4.598 1.00 . A A . 2 PHE CA 1 1 19 3931 1 1 2 PHE CB C 2.034 5.307 -4.932 1.00 . A A . 2 PHE CB 1 1 19 3932 1 1 2 PHE CD1 C 0.650 6.790 -6.408 1.00 . A A . 2 PHE CD1 1 1 19 3933 1 1 2 PHE CD2 C 0.125 6.697 -4.084 1.00 . A A . 2 PHE CD2 1 1 19 3934 1 1 2 PHE CE1 C -0.380 7.690 -6.609 1.00 . A A . 2 PHE CE1 1 1 19 3935 1 1 2 PHE CE2 C -0.907 7.595 -4.279 1.00 . A A . 2 PHE CE2 1 1 19 3936 1 1 2 PHE CG C 0.914 6.284 -5.146 1.00 . A A . 2 PHE CG 1 1 19 3937 1 1 2 PHE CZ C -1.159 8.093 -5.542 1.00 . A A . 2 PHE CZ 1 1 19 3938 1 1 2 PHE H H 0.595 3.539 -2.744 1.00 . A A . 2 PHE H 1 1 19 3939 1 1 2 PHE HA H 0.568 3.750 -5.008 1.00 . A A . 2 PHE HA 1 1 19 3940 1 1 2 PHE HB2 H 2.644 5.674 -4.120 1.00 . A A . 2 PHE HB2 1 1 19 3941 1 1 2 PHE HB3 H 2.626 5.275 -5.835 1.00 . A A . 2 PHE HB3 1 1 19 3942 1 1 2 PHE HD1 H 1.260 6.475 -7.244 1.00 . A A . 2 PHE HD1 1 1 19 3943 1 1 2 PHE HD2 H 0.321 6.309 -3.095 1.00 . A A . 2 PHE HD2 1 1 19 3944 1 1 2 PHE HE1 H -0.574 8.077 -7.598 1.00 . A A . 2 PHE HE1 1 1 19 3945 1 1 2 PHE HE2 H -1.514 7.910 -3.443 1.00 . A A . 2 PHE HE2 1 1 19 3946 1 1 2 PHE HZ H -1.965 8.795 -5.696 1.00 . A A . 2 PHE HZ 1 1 19 3947 1 1 2 PHE N N 1.469 3.715 -3.153 1.00 . A A . 2 PHE N 1 1 19 3948 1 1 2 PHE O O 3.106 2.058 -4.511 1.00 . A A . 2 PHE O 1 1 19 3949 1 1 3 LYS C C 4.198 2.674 -8.406 1.00 . A A . 3 LYS C 1 1 19 3950 1 1 3 LYS CA C 3.485 1.972 -7.255 1.00 . A A . 3 LYS CA 1 1 19 3951 1 1 3 LYS CB C 2.674 0.789 -7.788 1.00 . A A . 3 LYS CB 1 1 19 3952 1 1 3 LYS CD C 0.187 1.139 -7.756 1.00 . A A . 3 LYS CD 1 1 19 3953 1 1 3 LYS CE C -0.760 2.280 -8.092 1.00 . A A . 3 LYS CE 1 1 19 3954 1 1 3 LYS CG C 1.454 1.202 -8.593 1.00 . A A . 3 LYS CG 1 1 19 3955 1 1 3 LYS H H 2.107 3.565 -7.047 1.00 . A A . 3 LYS H 1 1 19 3956 1 1 3 LYS HA H 4.225 1.606 -6.559 1.00 . A A . 3 LYS HA 1 1 19 3957 1 1 3 LYS HB2 H 3.311 0.188 -8.421 1.00 . A A . 3 LYS HB2 1 1 19 3958 1 1 3 LYS HB3 H 2.343 0.190 -6.952 1.00 . A A . 3 LYS HB3 1 1 19 3959 1 1 3 LYS HD2 H -0.314 0.202 -7.946 1.00 . A A . 3 LYS HD2 1 1 19 3960 1 1 3 LYS HD3 H 0.454 1.200 -6.710 1.00 . A A . 3 LYS HD3 1 1 19 3961 1 1 3 LYS HE2 H -1.428 2.435 -7.259 1.00 . A A . 3 LYS HE2 1 1 19 3962 1 1 3 LYS HE3 H -0.180 3.175 -8.259 1.00 . A A . 3 LYS HE3 1 1 19 3963 1 1 3 LYS HG2 H 1.590 2.213 -8.944 1.00 . A A . 3 LYS HG2 1 1 19 3964 1 1 3 LYS HG3 H 1.349 0.536 -9.438 1.00 . A A . 3 LYS HG3 1 1 19 3965 1 1 3 LYS HZ1 H -2.437 2.560 -9.307 1.00 . A A . 3 LYS HZ1 1 1 19 3966 1 1 3 LYS HZ2 H -1.018 2.221 -10.165 1.00 . A A . 3 LYS HZ2 1 1 19 3967 1 1 3 LYS HZ3 H -1.823 0.984 -9.339 1.00 . A A . 3 LYS HZ3 1 1 19 3968 1 1 3 LYS N N 2.616 2.899 -6.539 1.00 . A A . 3 LYS N 1 1 19 3969 1 1 3 LYS NZ N -1.566 1.991 -9.311 1.00 . A A . 3 LYS NZ 1 1 19 3970 1 1 3 LYS O O 3.955 2.374 -9.576 1.00 . A A . 3 LYS O 1 1 19 3971 1 1 4 LYS C C 7.330 4.108 -8.923 1.00 . A A . 4 LYS C 1 1 19 3972 1 1 4 LYS CA C 5.831 4.351 -9.074 1.00 . A A . 4 LYS CA 1 1 19 3973 1 1 4 LYS CB C 5.533 5.848 -8.960 1.00 . A A . 4 LYS CB 1 1 19 3974 1 1 4 LYS CD C 5.388 7.881 -7.492 1.00 . A A . 4 LYS CD 1 1 19 3975 1 1 4 LYS CE C 6.623 8.760 -7.619 1.00 . A A . 4 LYS CE 1 1 19 3976 1 1 4 LYS CG C 5.745 6.406 -7.563 1.00 . A A . 4 LYS CG 1 1 19 3977 1 1 4 LYS H H 5.231 3.803 -7.119 1.00 . A A . 4 LYS H 1 1 19 3978 1 1 4 LYS HA H 5.518 4.003 -10.046 1.00 . A A . 4 LYS HA 1 1 19 3979 1 1 4 LYS HB2 H 6.177 6.384 -9.641 1.00 . A A . 4 LYS HB2 1 1 19 3980 1 1 4 LYS HB3 H 4.504 6.020 -9.241 1.00 . A A . 4 LYS HB3 1 1 19 3981 1 1 4 LYS HD2 H 4.708 8.118 -8.297 1.00 . A A . 4 LYS HD2 1 1 19 3982 1 1 4 LYS HD3 H 4.909 8.081 -6.544 1.00 . A A . 4 LYS HD3 1 1 19 3983 1 1 4 LYS HE2 H 7.220 8.403 -8.443 1.00 . A A . 4 LYS HE2 1 1 19 3984 1 1 4 LYS HE3 H 6.308 9.774 -7.816 1.00 . A A . 4 LYS HE3 1 1 19 3985 1 1 4 LYS HG2 H 5.122 5.862 -6.870 1.00 . A A . 4 LYS HG2 1 1 19 3986 1 1 4 LYS HG3 H 6.784 6.283 -7.290 1.00 . A A . 4 LYS HG3 1 1 19 3987 1 1 4 LYS HZ1 H 7.579 9.710 -6.023 1.00 . A A . 4 LYS HZ1 1 1 19 3988 1 1 4 LYS HZ2 H 6.974 8.176 -5.644 1.00 . A A . 4 LYS HZ2 1 1 19 3989 1 1 4 LYS HZ3 H 8.379 8.325 -6.575 1.00 . A A . 4 LYS HZ3 1 1 19 3990 1 1 4 LYS N N 5.080 3.608 -8.069 1.00 . A A . 4 LYS N 1 1 19 3991 1 1 4 LYS NZ N 7.446 8.741 -6.378 1.00 . A A . 4 LYS NZ 1 1 19 3992 1 1 4 LYS O O 8.102 5.042 -8.708 1.00 . A A . 4 LYS O 1 1 19 3993 1 1 5 VAL C C 9.868 2.650 -10.248 1.00 . A A . 5 VAL C 1 1 19 3994 1 1 5 VAL CA C 9.141 2.482 -8.919 1.00 . A A . 5 VAL CA 1 1 19 3995 1 1 5 VAL CB C 9.304 1.027 -8.438 1.00 . A A . 5 VAL CB 1 1 19 3996 1 1 5 VAL CG1 C 10.761 0.729 -8.122 1.00 . A A . 5 VAL CG1 1 1 19 3997 1 1 5 VAL CG2 C 8.423 0.766 -7.226 1.00 . A A . 5 VAL CG2 1 1 19 3998 1 1 5 VAL H H 7.072 2.146 -9.211 1.00 . A A . 5 VAL H 1 1 19 3999 1 1 5 VAL HA H 9.594 3.134 -8.187 1.00 . A A . 5 VAL HA 1 1 19 4000 1 1 5 VAL HB H 8.989 0.369 -9.234 1.00 . A A . 5 VAL HB 1 1 19 4001 1 1 5 VAL HG11 H 11.326 1.650 -8.124 1.00 . A A . 5 VAL HG11 1 1 19 4002 1 1 5 VAL HG12 H 10.831 0.265 -7.150 1.00 . A A . 5 VAL HG12 1 1 19 4003 1 1 5 VAL HG13 H 11.162 0.060 -8.870 1.00 . A A . 5 VAL HG13 1 1 19 4004 1 1 5 VAL HG21 H 7.384 0.848 -7.511 1.00 . A A . 5 VAL HG21 1 1 19 4005 1 1 5 VAL HG22 H 8.615 -0.227 -6.848 1.00 . A A . 5 VAL HG22 1 1 19 4006 1 1 5 VAL HG23 H 8.643 1.493 -6.457 1.00 . A A . 5 VAL HG23 1 1 19 4007 1 1 5 VAL N N 7.735 2.847 -9.040 1.00 . A A . 5 VAL N 1 1 19 4008 1 1 5 VAL O O 9.556 1.973 -11.228 1.00 . A A . 5 VAL O 1 1 19 4009 1 1 6 ILE C C 10.741 4.423 -12.574 1.00 . A A . 6 ILE C 1 1 19 4010 1 1 6 ILE CA C 11.613 3.812 -11.483 1.00 . A A . 6 ILE CA 1 1 19 4011 1 1 6 ILE CB C 12.260 2.522 -12.021 1.00 . A A . 6 ILE CB 1 1 19 4012 1 1 6 ILE CD1 C 13.658 0.506 -11.345 1.00 . A A . 6 ILE CD1 1 1 19 4013 1 1 6 ILE CG1 C 12.942 1.756 -10.886 1.00 . A A . 6 ILE CG1 1 1 19 4014 1 1 6 ILE CG2 C 13.259 2.850 -13.121 1.00 . A A . 6 ILE CG2 1 1 19 4015 1 1 6 ILE H H 11.041 4.064 -9.461 1.00 . A A . 6 ILE H 1 1 19 4016 1 1 6 ILE HA H 12.400 4.509 -11.233 1.00 . A A . 6 ILE HA 1 1 19 4017 1 1 6 ILE HB H 11.483 1.906 -12.446 1.00 . A A . 6 ILE HB 1 1 19 4018 1 1 6 ILE HD11 H 12.947 -0.172 -11.794 1.00 . A A . 6 ILE HD11 1 1 19 4019 1 1 6 ILE HD12 H 14.412 0.770 -12.073 1.00 . A A . 6 ILE HD12 1 1 19 4020 1 1 6 ILE HD13 H 14.127 0.027 -10.498 1.00 . A A . 6 ILE HD13 1 1 19 4021 1 1 6 ILE HG12 H 13.667 2.398 -10.411 1.00 . A A . 6 ILE HG12 1 1 19 4022 1 1 6 ILE HG13 H 12.196 1.464 -10.160 1.00 . A A . 6 ILE HG13 1 1 19 4023 1 1 6 ILE HG21 H 13.387 1.988 -13.759 1.00 . A A . 6 ILE HG21 1 1 19 4024 1 1 6 ILE HG22 H 12.891 3.680 -13.706 1.00 . A A . 6 ILE HG22 1 1 19 4025 1 1 6 ILE HG23 H 14.208 3.114 -12.678 1.00 . A A . 6 ILE HG23 1 1 19 4026 1 1 6 ILE N N 10.840 3.556 -10.274 1.00 . A A . 6 ILE N 1 1 19 4027 1 1 6 ILE O O 9.734 3.841 -12.977 1.00 . A A . 6 ILE O 1 1 19 4028 1 1 7 TRP C C 10.741 5.731 -15.472 1.00 . A A . 7 TRP C 1 1 19 4029 1 1 7 TRP CA C 10.390 6.289 -14.097 1.00 . A A . 7 TRP CA 1 1 19 4030 1 1 7 TRP CB C 10.679 7.790 -14.052 1.00 . A A . 7 TRP CB 1 1 19 4031 1 1 7 TRP CD1 C 10.810 9.442 -16.007 1.00 . A A . 7 TRP CD1 1 1 19 4032 1 1 7 TRP CD2 C 8.822 8.434 -15.785 1.00 . A A . 7 TRP CD2 1 1 19 4033 1 1 7 TRP CE2 C 8.762 9.309 -16.887 1.00 . A A . 7 TRP CE2 1 1 19 4034 1 1 7 TRP CE3 C 7.687 7.689 -15.454 1.00 . A A . 7 TRP CE3 1 1 19 4035 1 1 7 TRP CG C 10.141 8.534 -15.237 1.00 . A A . 7 TRP CG 1 1 19 4036 1 1 7 TRP CH2 C 6.514 8.718 -17.309 1.00 . A A . 7 TRP CH2 1 1 19 4037 1 1 7 TRP CZ2 C 7.611 9.459 -17.656 1.00 . A A . 7 TRP CZ2 1 1 19 4038 1 1 7 TRP CZ3 C 6.546 7.839 -16.218 1.00 . A A . 7 TRP CZ3 1 1 19 4039 1 1 7 TRP H H 11.947 6.013 -12.688 1.00 . A A . 7 TRP H 1 1 19 4040 1 1 7 TRP HA H 9.338 6.128 -13.914 1.00 . A A . 7 TRP HA 1 1 19 4041 1 1 7 TRP HB2 H 10.232 8.210 -13.164 1.00 . A A . 7 TRP HB2 1 1 19 4042 1 1 7 TRP HB3 H 11.748 7.942 -14.019 1.00 . A A . 7 TRP HB3 1 1 19 4043 1 1 7 TRP HD1 H 11.835 9.738 -15.846 1.00 . A A . 7 TRP HD1 1 1 19 4044 1 1 7 TRP HE1 H 10.236 10.572 -17.682 1.00 . A A . 7 TRP HE1 1 1 19 4045 1 1 7 TRP HE3 H 7.692 7.007 -14.616 1.00 . A A . 7 TRP HE3 1 1 19 4046 1 1 7 TRP HH2 H 5.601 8.803 -17.877 1.00 . A A . 7 TRP HH2 1 1 19 4047 1 1 7 TRP HZ2 H 7.571 10.132 -18.501 1.00 . A A . 7 TRP HZ2 1 1 19 4048 1 1 7 TRP HZ3 H 5.659 7.272 -15.976 1.00 . A A . 7 TRP HZ3 1 1 19 4049 1 1 7 TRP N N 11.135 5.599 -13.050 1.00 . A A . 7 TRP N 1 1 19 4050 1 1 7 TRP NE1 N 9.986 9.913 -17.001 1.00 . A A . 7 TRP NE1 1 1 19 4051 1 1 7 TRP O O 9.859 5.361 -16.247 1.00 . A A . 7 TRP O 1 1 19 4052 1 1 8 LYS C C 11.924 3.776 -17.327 1.00 . A A . 8 LYS C 1 1 19 4053 1 1 8 LYS CA C 12.503 5.160 -17.051 1.00 . A A . 8 LYS CA 1 1 19 4054 1 1 8 LYS CB C 14.032 5.098 -17.071 1.00 . A A . 8 LYS CB 1 1 19 4055 1 1 8 LYS CD C 15.952 4.307 -15.659 1.00 . A A . 8 LYS CD 1 1 19 4056 1 1 8 LYS CE C 17.056 4.283 -16.706 1.00 . A A . 8 LYS CE 1 1 19 4057 1 1 8 LYS CG C 14.605 3.948 -16.262 1.00 . A A . 8 LYS CG 1 1 19 4058 1 1 8 LYS H H 12.691 5.984 -15.110 1.00 . A A . 8 LYS H 1 1 19 4059 1 1 8 LYS HA H 12.169 5.838 -17.823 1.00 . A A . 8 LYS HA 1 1 19 4060 1 1 8 LYS HB2 H 14.363 4.992 -18.094 1.00 . A A . 8 LYS HB2 1 1 19 4061 1 1 8 LYS HB3 H 14.423 6.023 -16.670 1.00 . A A . 8 LYS HB3 1 1 19 4062 1 1 8 LYS HD2 H 15.895 5.299 -15.235 1.00 . A A . 8 LYS HD2 1 1 19 4063 1 1 8 LYS HD3 H 16.190 3.595 -14.881 1.00 . A A . 8 LYS HD3 1 1 19 4064 1 1 8 LYS HE2 H 17.914 3.776 -16.293 1.00 . A A . 8 LYS HE2 1 1 19 4065 1 1 8 LYS HE3 H 16.701 3.743 -17.571 1.00 . A A . 8 LYS HE3 1 1 19 4066 1 1 8 LYS HG2 H 13.919 3.704 -15.464 1.00 . A A . 8 LYS HG2 1 1 19 4067 1 1 8 LYS HG3 H 14.727 3.090 -16.909 1.00 . A A . 8 LYS HG3 1 1 19 4068 1 1 8 LYS HZ1 H 18.459 5.818 -16.898 1.00 . A A . 8 LYS HZ1 1 1 19 4069 1 1 8 LYS HZ2 H 17.316 5.774 -18.145 1.00 . A A . 8 LYS HZ2 1 1 19 4070 1 1 8 LYS HZ3 H 16.882 6.363 -16.619 1.00 . A A . 8 LYS HZ3 1 1 19 4071 1 1 8 LYS N N 12.035 5.674 -15.770 1.00 . A A . 8 LYS N 1 1 19 4072 1 1 8 LYS NZ N 17.456 5.656 -17.121 1.00 . A A . 8 LYS NZ 1 1 19 4073 1 1 8 LYS O O 11.669 3.418 -18.477 1.00 . A A . 8 LYS O 1 1 19 4074 1 1 9 SER C C 9.737 1.702 -16.914 1.00 . A A . 9 SER C 1 1 19 4075 1 1 9 SER CA C 11.171 1.658 -16.394 1.00 . A A . 9 SER CA 1 1 19 4076 1 1 9 SER CB C 11.215 0.936 -15.046 1.00 . A A . 9 SER CB 1 1 19 4077 1 1 9 SER H H 11.942 3.346 -15.375 1.00 . A A . 9 SER H 1 1 19 4078 1 1 9 SER HA H 11.782 1.118 -17.102 1.00 . A A . 9 SER HA 1 1 19 4079 1 1 9 SER HB2 H 12.241 0.717 -14.791 1.00 . A A . 9 SER HB2 1 1 19 4080 1 1 9 SER HB3 H 10.783 1.571 -14.287 1.00 . A A . 9 SER HB3 1 1 19 4081 1 1 9 SER HG H 10.209 -0.522 -14.209 1.00 . A A . 9 SER HG 1 1 19 4082 1 1 9 SER N N 11.718 3.004 -16.266 1.00 . A A . 9 SER N 1 1 19 4083 1 1 9 SER O O 9.317 0.838 -17.683 1.00 . A A . 9 SER O 1 1 19 4084 1 1 9 SER OG O 10.488 -0.280 -15.095 1.00 . A A . 9 SER OG 1 1 19 4085 1 1 10 PHE C C 7.519 3.602 -18.245 1.00 . A A . 10 PHE C 1 1 19 4086 1 1 10 PHE CA C 7.603 2.872 -16.907 1.00 . A A . 10 PHE CA 1 1 19 4087 1 1 10 PHE CB C 6.810 3.638 -15.846 1.00 . A A . 10 PHE CB 1 1 19 4088 1 1 10 PHE CD1 C 7.284 2.093 -13.926 1.00 . A A . 10 PHE CD1 1 1 19 4089 1 1 10 PHE CD2 C 5.015 2.659 -14.392 1.00 . A A . 10 PHE CD2 1 1 19 4090 1 1 10 PHE CE1 C 6.873 1.302 -12.869 1.00 . A A . 10 PHE CE1 1 1 19 4091 1 1 10 PHE CE2 C 4.598 1.870 -13.336 1.00 . A A . 10 PHE CE2 1 1 19 4092 1 1 10 PHE CG C 6.361 2.779 -14.698 1.00 . A A . 10 PHE CG 1 1 19 4093 1 1 10 PHE CZ C 5.528 1.190 -12.575 1.00 . A A . 10 PHE CZ 1 1 19 4094 1 1 10 PHE H H 9.382 3.372 -15.874 1.00 . A A . 10 PHE H 1 1 19 4095 1 1 10 PHE HA H 7.178 1.887 -17.020 1.00 . A A . 10 PHE HA 1 1 19 4096 1 1 10 PHE HB2 H 7.428 4.428 -15.446 1.00 . A A . 10 PHE HB2 1 1 19 4097 1 1 10 PHE HB3 H 5.933 4.069 -16.303 1.00 . A A . 10 PHE HB3 1 1 19 4098 1 1 10 PHE HD1 H 8.336 2.180 -14.156 1.00 . A A . 10 PHE HD1 1 1 19 4099 1 1 10 PHE HD2 H 4.286 3.189 -14.987 1.00 . A A . 10 PHE HD2 1 1 19 4100 1 1 10 PHE HE1 H 7.603 0.772 -12.276 1.00 . A A . 10 PHE HE1 1 1 19 4101 1 1 10 PHE HE2 H 3.546 1.784 -13.108 1.00 . A A . 10 PHE HE2 1 1 19 4102 1 1 10 PHE HZ H 5.206 0.573 -11.749 1.00 . A A . 10 PHE HZ 1 1 19 4103 1 1 10 PHE N N 8.991 2.715 -16.487 1.00 . A A . 10 PHE N 1 1 19 4104 1 1 10 PHE O O 6.661 3.301 -19.076 1.00 . A A . 10 PHE O 1 1 19 4105 1 1 11 LEU C C 8.468 4.416 -20.899 1.00 . A A . 11 LEU C 1 1 19 4106 1 1 11 LEU CA C 8.444 5.335 -19.682 1.00 . A A . 11 LEU CA 1 1 19 4107 1 1 11 LEU CB C 9.664 6.258 -19.701 1.00 . A A . 11 LEU CB 1 1 19 4108 1 1 11 LEU CD1 C 10.649 8.548 -19.968 1.00 . A A . 11 LEU CD1 1 1 19 4109 1 1 11 LEU CD2 C 9.046 7.672 -21.677 1.00 . A A . 11 LEU CD2 1 1 19 4110 1 1 11 LEU CG C 9.420 7.682 -20.202 1.00 . A A . 11 LEU CG 1 1 19 4111 1 1 11 LEU H H 9.074 4.755 -17.746 1.00 . A A . 11 LEU H 1 1 19 4112 1 1 11 LEU HA H 7.548 5.936 -19.717 1.00 . A A . 11 LEU HA 1 1 19 4113 1 1 11 LEU HB2 H 10.045 6.323 -18.694 1.00 . A A . 11 LEU HB2 1 1 19 4114 1 1 11 LEU HB3 H 10.410 5.805 -20.338 1.00 . A A . 11 LEU HB3 1 1 19 4115 1 1 11 LEU HD11 H 11.486 8.139 -20.514 1.00 . A A . 11 LEU HD11 1 1 19 4116 1 1 11 LEU HD12 H 10.452 9.553 -20.311 1.00 . A A . 11 LEU HD12 1 1 19 4117 1 1 11 LEU HD13 H 10.881 8.566 -18.913 1.00 . A A . 11 LEU HD13 1 1 19 4118 1 1 11 LEU HD21 H 9.872 8.050 -22.261 1.00 . A A . 11 LEU HD21 1 1 19 4119 1 1 11 LEU HD22 H 8.820 6.662 -21.984 1.00 . A A . 11 LEU HD22 1 1 19 4120 1 1 11 LEU HD23 H 8.179 8.297 -21.832 1.00 . A A . 11 LEU HD23 1 1 19 4121 1 1 11 LEU HG H 8.598 8.115 -19.650 1.00 . A A . 11 LEU HG 1 1 19 4122 1 1 11 LEU N N 8.415 4.562 -18.445 1.00 . A A . 11 LEU N 1 1 19 4123 1 1 11 LEU O O 7.609 4.508 -21.776 1.00 . A A . 11 LEU O 1 1 20 4124 1 1 1 LYS C C 2.424 0.148 -4.029 1.00 . A A . 1 LYS C 1 1 20 4125 1 1 1 LYS CA C 1.749 -0.600 -2.884 1.00 . A A . 1 LYS CA 1 1 20 4126 1 1 1 LYS CB C 2.565 -0.431 -1.600 1.00 . A A . 1 LYS CB 1 1 20 4127 1 1 1 LYS CD C 2.195 0.059 0.836 1.00 . A A . 1 LYS CD 1 1 20 4128 1 1 1 LYS CE C 3.325 0.860 1.465 1.00 . A A . 1 LYS CE 1 1 20 4129 1 1 1 LYS CG C 1.923 0.505 -0.590 1.00 . A A . 1 LYS CG 1 1 20 4130 1 1 1 LYS H1 H 1.491 -2.284 -4.141 1.00 . A A . 1 LYS H1 1 1 20 4131 1 1 1 LYS HA H 0.764 -0.188 -2.731 1.00 . A A . 1 LYS HA 1 1 20 4132 1 1 1 LYS HB2 H 2.687 -1.398 -1.135 1.00 . A A . 1 LYS HB2 1 1 20 4133 1 1 1 LYS HB3 H 3.538 -0.038 -1.855 1.00 . A A . 1 LYS HB3 1 1 20 4134 1 1 1 LYS HD2 H 1.300 0.197 1.425 1.00 . A A . 1 LYS HD2 1 1 20 4135 1 1 1 LYS HD3 H 2.467 -0.988 0.831 1.00 . A A . 1 LYS HD3 1 1 20 4136 1 1 1 LYS HE2 H 4.237 0.288 1.393 1.00 . A A . 1 LYS HE2 1 1 20 4137 1 1 1 LYS HE3 H 3.437 1.786 0.922 1.00 . A A . 1 LYS HE3 1 1 20 4138 1 1 1 LYS HG2 H 2.324 1.498 -0.728 1.00 . A A . 1 LYS HG2 1 1 20 4139 1 1 1 LYS HG3 H 0.855 0.520 -0.756 1.00 . A A . 1 LYS HG3 1 1 20 4140 1 1 1 LYS HZ1 H 3.953 1.242 3.421 1.00 . A A . 1 LYS HZ1 1 1 20 4141 1 1 1 LYS HZ2 H 2.543 2.067 2.980 1.00 . A A . 1 LYS HZ2 1 1 20 4142 1 1 1 LYS HZ3 H 2.482 0.411 3.323 1.00 . A A . 1 LYS HZ3 1 1 20 4143 1 1 1 LYS N N 1.599 -2.015 -3.204 1.00 . A A . 1 LYS N 1 1 20 4144 1 1 1 LYS NZ N 3.057 1.166 2.898 1.00 . A A . 1 LYS NZ 1 1 20 4145 1 1 1 LYS O O 3.101 -0.453 -4.863 1.00 . A A . 1 LYS O 1 1 20 4146 1 1 2 PHE C C 4.281 2.620 -4.782 1.00 . A A . 2 PHE C 1 1 20 4147 1 1 2 PHE CA C 2.826 2.294 -5.106 1.00 . A A . 2 PHE CA 1 1 20 4148 1 1 2 PHE CB C 2.026 3.587 -5.271 1.00 . A A . 2 PHE CB 1 1 20 4149 1 1 2 PHE CD1 C 1.117 4.412 -7.460 1.00 . A A . 2 PHE CD1 1 1 20 4150 1 1 2 PHE CD2 C -0.004 2.609 -6.375 1.00 . A A . 2 PHE CD2 1 1 20 4151 1 1 2 PHE CE1 C 0.199 4.366 -8.492 1.00 . A A . 2 PHE CE1 1 1 20 4152 1 1 2 PHE CE2 C -0.925 2.558 -7.405 1.00 . A A . 2 PHE CE2 1 1 20 4153 1 1 2 PHE CG C 1.026 3.535 -6.391 1.00 . A A . 2 PHE CG 1 1 20 4154 1 1 2 PHE CZ C -0.824 3.438 -8.464 1.00 . A A . 2 PHE CZ 1 1 20 4155 1 1 2 PHE H H 1.684 1.885 -3.370 1.00 . A A . 2 PHE H 1 1 20 4156 1 1 2 PHE HA H 2.791 1.738 -6.030 1.00 . A A . 2 PHE HA 1 1 20 4157 1 1 2 PHE HB2 H 1.488 3.790 -4.357 1.00 . A A . 2 PHE HB2 1 1 20 4158 1 1 2 PHE HB3 H 2.707 4.400 -5.471 1.00 . A A . 2 PHE HB3 1 1 20 4159 1 1 2 PHE HD1 H 1.917 5.139 -7.483 1.00 . A A . 2 PHE HD1 1 1 20 4160 1 1 2 PHE HD2 H -0.085 1.920 -5.547 1.00 . A A . 2 PHE HD2 1 1 20 4161 1 1 2 PHE HE1 H 0.281 5.056 -9.319 1.00 . A A . 2 PHE HE1 1 1 20 4162 1 1 2 PHE HE2 H -1.723 1.831 -7.380 1.00 . A A . 2 PHE HE2 1 1 20 4163 1 1 2 PHE HZ H -1.542 3.400 -9.270 1.00 . A A . 2 PHE HZ 1 1 20 4164 1 1 2 PHE N N 2.235 1.463 -4.063 1.00 . A A . 2 PHE N 1 1 20 4165 1 1 2 PHE O O 4.661 2.726 -3.616 1.00 . A A . 2 PHE O 1 1 20 4166 1 1 3 LYS C C 6.866 4.385 -6.380 1.00 . A A . 3 LYS C 1 1 20 4167 1 1 3 LYS CA C 6.504 3.094 -5.652 1.00 . A A . 3 LYS CA 1 1 20 4168 1 1 3 LYS CB C 7.370 1.944 -6.171 1.00 . A A . 3 LYS CB 1 1 20 4169 1 1 3 LYS CD C 6.088 0.201 -7.447 1.00 . A A . 3 LYS CD 1 1 20 4170 1 1 3 LYS CE C 5.165 0.072 -8.649 1.00 . A A . 3 LYS CE 1 1 20 4171 1 1 3 LYS CG C 6.958 1.443 -7.544 1.00 . A A . 3 LYS CG 1 1 20 4172 1 1 3 LYS H H 4.729 2.682 -6.729 1.00 . A A . 3 LYS H 1 1 20 4173 1 1 3 LYS HA H 6.690 3.226 -4.597 1.00 . A A . 3 LYS HA 1 1 20 4174 1 1 3 LYS HB2 H 8.396 2.277 -6.225 1.00 . A A . 3 LYS HB2 1 1 20 4175 1 1 3 LYS HB3 H 7.306 1.119 -5.476 1.00 . A A . 3 LYS HB3 1 1 20 4176 1 1 3 LYS HD2 H 6.723 -0.671 -7.400 1.00 . A A . 3 LYS HD2 1 1 20 4177 1 1 3 LYS HD3 H 5.489 0.262 -6.549 1.00 . A A . 3 LYS HD3 1 1 20 4178 1 1 3 LYS HE2 H 4.203 0.488 -8.395 1.00 . A A . 3 LYS HE2 1 1 20 4179 1 1 3 LYS HE3 H 5.590 0.625 -9.474 1.00 . A A . 3 LYS HE3 1 1 20 4180 1 1 3 LYS HG2 H 6.403 2.220 -8.049 1.00 . A A . 3 LYS HG2 1 1 20 4181 1 1 3 LYS HG3 H 7.847 1.205 -8.112 1.00 . A A . 3 LYS HG3 1 1 20 4182 1 1 3 LYS HZ1 H 5.556 -1.551 -9.906 1.00 . A A . 3 LYS HZ1 1 1 20 4183 1 1 3 LYS HZ2 H 5.286 -1.983 -8.293 1.00 . A A . 3 LYS HZ2 1 1 20 4184 1 1 3 LYS HZ3 H 3.985 -1.534 -9.277 1.00 . A A . 3 LYS HZ3 1 1 20 4185 1 1 3 LYS N N 5.091 2.779 -5.823 1.00 . A A . 3 LYS N 1 1 20 4186 1 1 3 LYS NZ N 4.986 -1.348 -9.060 1.00 . A A . 3 LYS NZ 1 1 20 4187 1 1 3 LYS O O 7.791 4.414 -7.192 1.00 . A A . 3 LYS O 1 1 20 4188 1 1 4 LYS C C 6.366 6.629 -8.229 1.00 . A A . 4 LYS C 1 1 20 4189 1 1 4 LYS CA C 6.375 6.746 -6.708 1.00 . A A . 4 LYS CA 1 1 20 4190 1 1 4 LYS CB C 7.716 7.317 -6.238 1.00 . A A . 4 LYS CB 1 1 20 4191 1 1 4 LYS CD C 7.361 9.368 -4.832 1.00 . A A . 4 LYS CD 1 1 20 4192 1 1 4 LYS CE C 8.006 10.077 -3.651 1.00 . A A . 4 LYS CE 1 1 20 4193 1 1 4 LYS CG C 7.676 7.881 -4.829 1.00 . A A . 4 LYS CG 1 1 20 4194 1 1 4 LYS H H 5.406 5.365 -5.429 1.00 . A A . 4 LYS H 1 1 20 4195 1 1 4 LYS HA H 5.584 7.415 -6.405 1.00 . A A . 4 LYS HA 1 1 20 4196 1 1 4 LYS HB2 H 8.457 6.532 -6.269 1.00 . A A . 4 LYS HB2 1 1 20 4197 1 1 4 LYS HB3 H 8.012 8.108 -6.912 1.00 . A A . 4 LYS HB3 1 1 20 4198 1 1 4 LYS HD2 H 7.735 9.804 -5.747 1.00 . A A . 4 LYS HD2 1 1 20 4199 1 1 4 LYS HD3 H 6.290 9.501 -4.780 1.00 . A A . 4 LYS HD3 1 1 20 4200 1 1 4 LYS HE2 H 7.685 11.107 -3.648 1.00 . A A . 4 LYS HE2 1 1 20 4201 1 1 4 LYS HE3 H 7.683 9.596 -2.740 1.00 . A A . 4 LYS HE3 1 1 20 4202 1 1 4 LYS HG2 H 6.914 7.365 -4.265 1.00 . A A . 4 LYS HG2 1 1 20 4203 1 1 4 LYS HG3 H 8.639 7.728 -4.362 1.00 . A A . 4 LYS HG3 1 1 20 4204 1 1 4 LYS HZ1 H 9.888 10.976 -3.532 1.00 . A A . 4 LYS HZ1 1 1 20 4205 1 1 4 LYS HZ2 H 9.864 9.364 -3.016 1.00 . A A . 4 LYS HZ2 1 1 20 4206 1 1 4 LYS HZ3 H 9.797 9.725 -4.668 1.00 . A A . 4 LYS HZ3 1 1 20 4207 1 1 4 LYS N N 6.131 5.451 -6.084 1.00 . A A . 4 LYS N 1 1 20 4208 1 1 4 LYS NZ N 9.493 10.032 -3.722 1.00 . A A . 4 LYS NZ 1 1 20 4209 1 1 4 LYS O O 6.098 5.559 -8.777 1.00 . A A . 4 LYS O 1 1 20 4210 1 1 5 VAL C C 8.117 7.657 -10.887 1.00 . A A . 5 VAL C 1 1 20 4211 1 1 5 VAL CA C 6.688 7.754 -10.363 1.00 . A A . 5 VAL CA 1 1 20 4212 1 1 5 VAL CB C 6.035 9.033 -10.919 1.00 . A A . 5 VAL CB 1 1 20 4213 1 1 5 VAL CG1 C 6.079 9.037 -12.440 1.00 . A A . 5 VAL CG1 1 1 20 4214 1 1 5 VAL CG2 C 4.604 9.160 -10.419 1.00 . A A . 5 VAL CG2 1 1 20 4215 1 1 5 VAL H H 6.866 8.556 -8.412 1.00 . A A . 5 VAL H 1 1 20 4216 1 1 5 VAL HA H 6.126 6.903 -10.719 1.00 . A A . 5 VAL HA 1 1 20 4217 1 1 5 VAL HB H 6.595 9.884 -10.562 1.00 . A A . 5 VAL HB 1 1 20 4218 1 1 5 VAL HG11 H 5.589 8.152 -12.817 1.00 . A A . 5 VAL HG11 1 1 20 4219 1 1 5 VAL HG12 H 5.573 9.915 -12.812 1.00 . A A . 5 VAL HG12 1 1 20 4220 1 1 5 VAL HG13 H 7.108 9.047 -12.770 1.00 . A A . 5 VAL HG13 1 1 20 4221 1 1 5 VAL HG21 H 4.035 9.769 -11.107 1.00 . A A . 5 VAL HG21 1 1 20 4222 1 1 5 VAL HG22 H 4.157 8.179 -10.353 1.00 . A A . 5 VAL HG22 1 1 20 4223 1 1 5 VAL HG23 H 4.603 9.622 -9.443 1.00 . A A . 5 VAL HG23 1 1 20 4224 1 1 5 VAL N N 6.661 7.734 -8.905 1.00 . A A . 5 VAL N 1 1 20 4225 1 1 5 VAL O O 8.985 8.439 -10.499 1.00 . A A . 5 VAL O 1 1 20 4226 1 1 6 ILE C C 9.578 6.020 -13.795 1.00 . A A . 6 ILE C 1 1 20 4227 1 1 6 ILE CA C 9.676 6.495 -12.349 1.00 . A A . 6 ILE CA 1 1 20 4228 1 1 6 ILE CB C 10.498 5.475 -11.539 1.00 . A A . 6 ILE CB 1 1 20 4229 1 1 6 ILE CD1 C 10.679 4.357 -9.260 1.00 . A A . 6 ILE CD1 1 1 20 4230 1 1 6 ILE CG1 C 9.856 5.243 -10.170 1.00 . A A . 6 ILE CG1 1 1 20 4231 1 1 6 ILE CG2 C 11.933 5.955 -11.384 1.00 . A A . 6 ILE CG2 1 1 20 4232 1 1 6 ILE H H 7.620 6.102 -12.040 1.00 . A A . 6 ILE H 1 1 20 4233 1 1 6 ILE HA H 10.194 7.443 -12.327 1.00 . A A . 6 ILE HA 1 1 20 4234 1 1 6 ILE HB H 10.512 4.544 -12.085 1.00 . A A . 6 ILE HB 1 1 20 4235 1 1 6 ILE HD11 H 10.839 3.401 -9.736 1.00 . A A . 6 ILE HD11 1 1 20 4236 1 1 6 ILE HD12 H 11.632 4.827 -9.065 1.00 . A A . 6 ILE HD12 1 1 20 4237 1 1 6 ILE HD13 H 10.153 4.211 -8.328 1.00 . A A . 6 ILE HD13 1 1 20 4238 1 1 6 ILE HG12 H 9.724 6.192 -9.676 1.00 . A A . 6 ILE HG12 1 1 20 4239 1 1 6 ILE HG13 H 8.892 4.775 -10.307 1.00 . A A . 6 ILE HG13 1 1 20 4240 1 1 6 ILE HG21 H 12.195 6.583 -12.223 1.00 . A A . 6 ILE HG21 1 1 20 4241 1 1 6 ILE HG22 H 12.027 6.519 -10.468 1.00 . A A . 6 ILE HG22 1 1 20 4242 1 1 6 ILE HG23 H 12.596 5.103 -11.351 1.00 . A A . 6 ILE HG23 1 1 20 4243 1 1 6 ILE N N 8.353 6.693 -11.770 1.00 . A A . 6 ILE N 1 1 20 4244 1 1 6 ILE O O 9.283 4.854 -14.057 1.00 . A A . 6 ILE O 1 1 20 4245 1 1 7 TRP C C 10.701 5.440 -16.478 1.00 . A A . 7 TRP C 1 1 20 4246 1 1 7 TRP CA C 9.772 6.603 -16.149 1.00 . A A . 7 TRP CA 1 1 20 4247 1 1 7 TRP CB C 10.145 7.825 -16.990 1.00 . A A . 7 TRP CB 1 1 20 4248 1 1 7 TRP CD1 C 11.340 7.877 -19.257 1.00 . A A . 7 TRP CD1 1 1 20 4249 1 1 7 TRP CD2 C 9.382 6.789 -19.273 1.00 . A A . 7 TRP CD2 1 1 20 4250 1 1 7 TRP CE2 C 9.932 6.744 -20.569 1.00 . A A . 7 TRP CE2 1 1 20 4251 1 1 7 TRP CE3 C 8.152 6.168 -19.041 1.00 . A A . 7 TRP CE3 1 1 20 4252 1 1 7 TRP CG C 10.299 7.517 -18.449 1.00 . A A . 7 TRP CG 1 1 20 4253 1 1 7 TRP CH2 C 8.088 5.506 -21.372 1.00 . A A . 7 TRP CH2 1 1 20 4254 1 1 7 TRP CZ2 C 9.291 6.105 -21.627 1.00 . A A . 7 TRP CZ2 1 1 20 4255 1 1 7 TRP CZ3 C 7.518 5.534 -20.092 1.00 . A A . 7 TRP CZ3 1 1 20 4256 1 1 7 TRP H H 10.060 7.843 -14.457 1.00 . A A . 7 TRP H 1 1 20 4257 1 1 7 TRP HA H 8.757 6.314 -16.381 1.00 . A A . 7 TRP HA 1 1 20 4258 1 1 7 TRP HB2 H 9.374 8.574 -16.887 1.00 . A A . 7 TRP HB2 1 1 20 4259 1 1 7 TRP HB3 H 11.082 8.226 -16.632 1.00 . A A . 7 TRP HB3 1 1 20 4260 1 1 7 TRP HD1 H 12.198 8.442 -18.927 1.00 . A A . 7 TRP HD1 1 1 20 4261 1 1 7 TRP HE1 H 11.730 7.546 -21.294 1.00 . A A . 7 TRP HE1 1 1 20 4262 1 1 7 TRP HE3 H 7.696 6.179 -18.062 1.00 . A A . 7 TRP HE3 1 1 20 4263 1 1 7 TRP HH2 H 7.557 4.999 -22.163 1.00 . A A . 7 TRP HH2 1 1 20 4264 1 1 7 TRP HZ2 H 9.718 6.074 -22.619 1.00 . A A . 7 TRP HZ2 1 1 20 4265 1 1 7 TRP HZ3 H 6.566 5.049 -19.932 1.00 . A A . 7 TRP HZ3 1 1 20 4266 1 1 7 TRP N N 9.830 6.930 -14.729 1.00 . A A . 7 TRP N 1 1 20 4267 1 1 7 TRP NE1 N 11.125 7.416 -20.533 1.00 . A A . 7 TRP NE1 1 1 20 4268 1 1 7 TRP O O 10.397 4.613 -17.338 1.00 . A A . 7 TRP O 1 1 20 4269 1 1 8 LYS C C 12.160 2.948 -15.867 1.00 . A A . 8 LYS C 1 1 20 4270 1 1 8 LYS CA C 12.811 4.320 -16.008 1.00 . A A . 8 LYS CA 1 1 20 4271 1 1 8 LYS CB C 13.970 4.452 -15.017 1.00 . A A . 8 LYS CB 1 1 20 4272 1 1 8 LYS CD C 14.332 6.658 -13.874 1.00 . A A . 8 LYS CD 1 1 20 4273 1 1 8 LYS CE C 15.231 7.883 -13.793 1.00 . A A . 8 LYS CE 1 1 20 4274 1 1 8 LYS CG C 14.672 5.797 -15.078 1.00 . A A . 8 LYS CG 1 1 20 4275 1 1 8 LYS H H 12.023 6.072 -15.118 1.00 . A A . 8 LYS H 1 1 20 4276 1 1 8 LYS HA H 13.194 4.422 -17.012 1.00 . A A . 8 LYS HA 1 1 20 4277 1 1 8 LYS HB2 H 13.589 4.312 -14.016 1.00 . A A . 8 LYS HB2 1 1 20 4278 1 1 8 LYS HB3 H 14.696 3.680 -15.227 1.00 . A A . 8 LYS HB3 1 1 20 4279 1 1 8 LYS HD2 H 13.306 6.984 -13.953 1.00 . A A . 8 LYS HD2 1 1 20 4280 1 1 8 LYS HD3 H 14.457 6.071 -12.975 1.00 . A A . 8 LYS HD3 1 1 20 4281 1 1 8 LYS HE2 H 15.965 7.724 -13.018 1.00 . A A . 8 LYS HE2 1 1 20 4282 1 1 8 LYS HE3 H 15.731 8.009 -14.742 1.00 . A A . 8 LYS HE3 1 1 20 4283 1 1 8 LYS HG2 H 15.740 5.634 -15.101 1.00 . A A . 8 LYS HG2 1 1 20 4284 1 1 8 LYS HG3 H 14.365 6.313 -15.977 1.00 . A A . 8 LYS HG3 1 1 20 4285 1 1 8 LYS HZ1 H 15.087 9.841 -13.078 1.00 . A A . 8 LYS HZ1 1 1 20 4286 1 1 8 LYS HZ2 H 14.028 9.497 -14.352 1.00 . A A . 8 LYS HZ2 1 1 20 4287 1 1 8 LYS HZ3 H 13.704 8.906 -12.800 1.00 . A A . 8 LYS HZ3 1 1 20 4288 1 1 8 LYS N N 11.836 5.383 -15.790 1.00 . A A . 8 LYS N 1 1 20 4289 1 1 8 LYS NZ N 14.458 9.118 -13.484 1.00 . A A . 8 LYS NZ 1 1 20 4290 1 1 8 LYS O O 12.427 2.040 -16.654 1.00 . A A . 8 LYS O 1 1 20 4291 1 1 9 SER C C 9.457 1.357 -15.587 1.00 . A A . 9 SER C 1 1 20 4292 1 1 9 SER CA C 10.617 1.542 -14.614 1.00 . A A . 9 SER CA 1 1 20 4293 1 1 9 SER CB C 10.105 1.488 -13.174 1.00 . A A . 9 SER CB 1 1 20 4294 1 1 9 SER H H 11.134 3.566 -14.266 1.00 . A A . 9 SER H 1 1 20 4295 1 1 9 SER HA H 11.328 0.743 -14.765 1.00 . A A . 9 SER HA 1 1 20 4296 1 1 9 SER HB2 H 9.497 2.358 -12.978 1.00 . A A . 9 SER HB2 1 1 20 4297 1 1 9 SER HB3 H 9.510 0.595 -13.040 1.00 . A A . 9 SER HB3 1 1 20 4298 1 1 9 SER HG H 11.095 2.201 -11.642 1.00 . A A . 9 SER HG 1 1 20 4299 1 1 9 SER N N 11.305 2.804 -14.860 1.00 . A A . 9 SER N 1 1 20 4300 1 1 9 SER O O 9.163 0.241 -16.016 1.00 . A A . 9 SER O 1 1 20 4301 1 1 9 SER OG O 11.179 1.464 -12.251 1.00 . A A . 9 SER OG 1 1 20 4302 1 1 10 PHE C C 8.070 1.778 -18.176 1.00 . A A . 10 PHE C 1 1 20 4303 1 1 10 PHE CA C 7.670 2.422 -16.852 1.00 . A A . 10 PHE CA 1 1 20 4304 1 1 10 PHE CB C 7.138 3.835 -17.099 1.00 . A A . 10 PHE CB 1 1 20 4305 1 1 10 PHE CD1 C 6.170 4.208 -14.814 1.00 . A A . 10 PHE CD1 1 1 20 4306 1 1 10 PHE CD2 C 4.774 4.582 -16.711 1.00 . A A . 10 PHE CD2 1 1 20 4307 1 1 10 PHE CE1 C 5.129 4.559 -13.975 1.00 . A A . 10 PHE CE1 1 1 20 4308 1 1 10 PHE CE2 C 3.730 4.934 -15.877 1.00 . A A . 10 PHE CE2 1 1 20 4309 1 1 10 PHE CG C 6.005 4.216 -16.190 1.00 . A A . 10 PHE CG 1 1 20 4310 1 1 10 PHE CZ C 3.907 4.921 -14.507 1.00 . A A . 10 PHE CZ 1 1 20 4311 1 1 10 PHE H H 9.082 3.321 -15.555 1.00 . A A . 10 PHE H 1 1 20 4312 1 1 10 PHE HA H 6.893 1.828 -16.397 1.00 . A A . 10 PHE HA 1 1 20 4313 1 1 10 PHE HB2 H 7.937 4.544 -16.948 1.00 . A A . 10 PHE HB2 1 1 20 4314 1 1 10 PHE HB3 H 6.786 3.906 -18.117 1.00 . A A . 10 PHE HB3 1 1 20 4315 1 1 10 PHE HD1 H 7.126 3.924 -14.397 1.00 . A A . 10 PHE HD1 1 1 20 4316 1 1 10 PHE HD2 H 4.633 4.591 -17.782 1.00 . A A . 10 PHE HD2 1 1 20 4317 1 1 10 PHE HE1 H 5.272 4.547 -12.904 1.00 . A A . 10 PHE HE1 1 1 20 4318 1 1 10 PHE HE2 H 2.776 5.217 -16.295 1.00 . A A . 10 PHE HE2 1 1 20 4319 1 1 10 PHE HZ H 3.093 5.196 -13.853 1.00 . A A . 10 PHE HZ 1 1 20 4320 1 1 10 PHE N N 8.800 2.460 -15.931 1.00 . A A . 10 PHE N 1 1 20 4321 1 1 10 PHE O O 7.240 1.183 -18.866 1.00 . A A . 10 PHE O 1 1 20 4322 1 1 11 LEU C C 9.432 -0.126 -19.914 1.00 . A A . 11 LEU C 1 1 20 4323 1 1 11 LEU CA C 9.857 1.331 -19.767 1.00 . A A . 11 LEU CA 1 1 20 4324 1 1 11 LEU CB C 11.383 1.436 -19.809 1.00 . A A . 11 LEU CB 1 1 20 4325 1 1 11 LEU CD1 C 11.860 2.043 -22.194 1.00 . A A . 11 LEU CD1 1 1 20 4326 1 1 11 LEU CD2 C 11.237 3.825 -20.553 1.00 . A A . 11 LEU CD2 1 1 20 4327 1 1 11 LEU CG C 11.957 2.499 -20.746 1.00 . A A . 11 LEU CG 1 1 20 4328 1 1 11 LEU H H 9.959 2.385 -17.935 1.00 . A A . 11 LEU H 1 1 20 4329 1 1 11 LEU HA H 9.443 1.899 -20.587 1.00 . A A . 11 LEU HA 1 1 20 4330 1 1 11 LEU HB2 H 11.726 1.656 -18.810 1.00 . A A . 11 LEU HB2 1 1 20 4331 1 1 11 LEU HB3 H 11.771 0.476 -20.118 1.00 . A A . 11 LEU HB3 1 1 20 4332 1 1 11 LEU HD11 H 12.229 1.032 -22.278 1.00 . A A . 11 LEU HD11 1 1 20 4333 1 1 11 LEU HD12 H 10.829 2.078 -22.514 1.00 . A A . 11 LEU HD12 1 1 20 4334 1 1 11 LEU HD13 H 12.452 2.696 -22.817 1.00 . A A . 11 LEU HD13 1 1 20 4335 1 1 11 LEU HD21 H 11.760 4.601 -21.094 1.00 . A A . 11 LEU HD21 1 1 20 4336 1 1 11 LEU HD22 H 10.227 3.745 -20.927 1.00 . A A . 11 LEU HD22 1 1 20 4337 1 1 11 LEU HD23 H 11.214 4.073 -19.502 1.00 . A A . 11 LEU HD23 1 1 20 4338 1 1 11 LEU HG H 13.003 2.648 -20.514 1.00 . A A . 11 LEU HG 1 1 20 4339 1 1 11 LEU N N 9.346 1.901 -18.525 1.00 . A A . 11 LEU N 1 1 20 4340 1 1 11 LEU O O 8.535 -0.446 -20.694 1.00 . A A . 11 LEU O 1 1 stop_ save_
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