NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
622352 | 5ykk | 36124 | cing | 4-filtered-FRED | STAR | entry | full | 149 |
data_FRED_restraints_with_modified_coordinates_PDB_code_5ykk # This FRED archive file contains, for PDB entry <5ykk>: # # - 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_5ykk _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 5ykk _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 2143.71 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 $Andersonin_Y1__AY1_ A . 1 1 stop_ save_ save_Andersonin_Y1__AY1_ _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Andersonin Y1 AY1 " _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code FLPKLFAKITKKNMAHIR _Entity.Number_of_monomers 18 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 PHE . 1 1 2 LEU . 1 1 3 PRO . 1 1 4 LYS . 1 1 5 LEU . 1 1 6 PHE . 1 1 7 ALA . 1 1 8 LYS . 1 1 9 ILE . 1 1 10 THR . 1 1 11 LYS . 1 1 12 LYS . 1 1 13 ASN . 1 1 14 MET . 1 1 15 ALA . 1 1 16 HIS . 1 1 17 ILE . 1 1 18 ARG . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID PHE 1 1 1 1 LEU 2 2 1 1 PRO 3 3 1 1 LYS 4 4 1 1 LEU 5 5 1 1 PHE 6 6 1 1 ALA 7 7 1 1 LYS 8 8 1 1 ILE 9 9 1 1 THR 10 10 1 1 LYS 11 11 1 1 LYS 12 12 1 1 ASN 13 13 1 1 MET 14 14 1 1 ALA 15 15 1 1 HIS 16 16 1 1 ILE 17 17 1 1 ARG 18 18 1 1 stop_ save_ save_DYANA/DIANA_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 1 PHE QB . 1 PHE QB 1 1 1 1 2 1 1 2 LEU H . 2 LEU H 1 1 2 1 1 1 1 2 LEU H . 2 LEU H 1 1 2 1 2 1 1 2 LEU QB . 2 LEU QB 1 1 3 1 1 1 1 2 LEU H . 2 LEU H 1 1 3 1 2 1 1 2 LEU QD . 2 LEU QQD 1 1 4 1 1 1 1 2 LEU HA . 2 LEU HA 1 1 4 1 2 1 1 3 PRO QD . 3 PRO QD 1 1 5 1 1 1 1 4 LYS H . 4 LYS H 1 1 5 1 2 1 1 4 LYS QB . 4 LYS QB 1 1 6 1 1 1 1 4 LYS H . 4 LYS H 1 1 6 1 2 1 1 4 LYS QD . 4 LYS QD 1 1 7 1 1 1 1 4 LYS H . 4 LYS H 1 1 7 1 2 1 1 4 LYS QG . 4 LYS QG 1 1 8 1 1 1 1 4 LYS H . 4 LYS H 1 1 8 1 2 1 1 5 LEU H . 5 LEU H 1 1 9 1 1 1 1 4 LYS HA . 4 LYS HA 1 1 9 1 2 1 1 5 LEU H . 5 LEU H 1 1 10 1 1 1 1 4 LYS HA . 4 LYS HA 1 1 10 1 2 1 1 6 PHE H . 6 PHE H 1 1 11 1 1 1 1 4 LYS HA . 4 LYS HA 1 1 11 1 2 1 1 7 ALA H . 7 ALA H 1 1 12 1 1 1 1 4 LYS HA . 4 LYS HA 1 1 12 1 2 1 1 8 LYS H . 8 LYS H 1 1 13 1 1 1 1 4 LYS QB . 4 LYS QB 1 1 13 1 2 1 1 5 LEU H . 5 LEU H 1 1 14 1 1 1 1 4 LYS QB . 4 LYS QB 1 1 14 1 2 1 1 7 ALA H . 7 ALA H 1 1 15 1 1 1 1 4 LYS HB2 . 4 LYS HB2 1 1 15 1 2 1 1 7 ALA H . 7 ALA H 1 1 16 1 1 1 1 4 LYS HB3 . 4 LYS HB3 1 1 16 1 2 1 1 7 ALA H . 7 ALA H 1 1 17 1 1 1 1 4 LYS QD . 4 LYS QD 1 1 17 1 2 1 1 8 LYS H . 8 LYS H 1 1 18 1 1 1 1 4 LYS QG . 4 LYS QG 1 1 18 1 2 1 1 5 LEU H . 5 LEU H 1 1 19 1 1 1 1 4 LYS QG . 4 LYS QG 1 1 19 1 2 1 1 8 LYS H . 8 LYS H 1 1 20 1 1 1 1 5 LEU H . 5 LEU H 1 1 20 1 2 1 1 5 LEU HB2 . 5 LEU HB2 1 1 21 1 1 1 1 5 LEU H . 5 LEU H 1 1 21 1 2 1 1 5 LEU HB3 . 5 LEU HB3 1 1 22 1 1 1 1 5 LEU H . 5 LEU H 1 1 22 1 2 1 1 5 LEU MD1 . 5 LEU QD1 1 1 23 1 1 1 1 5 LEU H . 5 LEU H 1 1 23 1 2 1 1 5 LEU HG . 5 LEU HG 1 1 24 1 1 1 1 6 PHE H . 6 PHE H 1 1 24 1 2 1 1 6 PHE HB2 . 6 PHE HB2 1 1 25 1 1 1 1 6 PHE H . 6 PHE H 1 1 25 1 2 1 1 7 ALA H . 7 ALA H 1 1 26 1 1 1 1 6 PHE HA . 6 PHE HA 1 1 26 1 2 1 1 7 ALA H . 7 ALA H 1 1 27 1 1 1 1 6 PHE HA . 6 PHE HA 1 1 27 1 2 1 1 9 ILE H . 9 ILE H 1 1 28 1 1 1 1 6 PHE HA . 6 PHE HA 1 1 28 1 2 1 1 10 THR H . 10 THR H 1 1 29 1 1 1 1 6 PHE HB2 . 6 PHE HB2 1 1 29 1 2 1 1 7 ALA H . 7 ALA H 1 1 30 1 1 1 1 6 PHE HB3 . 6 PHE HB3 1 1 30 1 2 1 1 7 ALA H . 7 ALA H 1 1 31 1 1 1 1 6 PHE HD1 . 6 PHE HD1 1 1 31 1 2 1 1 9 ILE MD . 9 ILE HD1 1 1 32 1 1 1 1 6 PHE HD1 . 6 PHE HD1 1 1 32 1 2 1 1 9 ILE HG12 . 9 ILE HG12 1 1 33 1 1 1 1 6 PHE HD1 . 6 PHE HD1 1 1 33 1 2 1 1 9 ILE HG13 . 9 ILE HG13 1 1 34 1 1 1 1 6 PHE HD1 . 6 PHE HD1 1 1 34 1 2 1 1 9 ILE MG . 9 ILE HG2 1 1 35 1 1 1 1 6 PHE HD1 . 6 PHE HD1 1 1 35 1 2 1 1 10 THR MG . 10 THR QG2 1 1 36 1 1 1 1 6 PHE HD2 . 6 PHE HD2 1 1 36 1 2 1 1 9 ILE MD . 9 ILE HD1 1 1 37 1 1 1 1 6 PHE HD2 . 6 PHE HD2 1 1 37 1 2 1 1 9 ILE HG12 . 9 ILE HG12 1 1 38 1 1 1 1 6 PHE HD2 . 6 PHE HD2 1 1 38 1 2 1 1 9 ILE HG13 . 9 ILE HG13 1 1 39 1 1 1 1 6 PHE HD2 . 6 PHE HD2 1 1 39 1 2 1 1 9 ILE MG . 9 ILE HG2 1 1 40 1 1 1 1 6 PHE HD2 . 6 PHE HD2 1 1 40 1 2 1 1 10 THR MG . 10 THR QG2 1 1 41 1 1 1 1 7 ALA H . 7 ALA H 1 1 41 1 2 1 1 7 ALA MB . 7 ALA QB 1 1 42 1 1 1 1 7 ALA H . 7 ALA H 1 1 42 1 2 1 1 8 LYS H . 8 LYS H 1 1 43 1 1 1 1 7 ALA HA . 7 ALA HA 1 1 43 1 2 1 1 8 LYS H . 8 LYS H 1 1 44 1 1 1 1 7 ALA MB . 7 ALA QB 1 1 44 1 2 1 1 8 LYS H . 8 LYS H 1 1 45 1 1 1 1 8 LYS H . 8 LYS H 1 1 45 1 2 1 1 8 LYS HB2 . 8 LYS HB2 1 1 46 1 1 1 1 8 LYS H . 8 LYS H 1 1 46 1 2 1 1 8 LYS HB3 . 8 LYS HB3 1 1 47 1 1 1 1 8 LYS H . 8 LYS H 1 1 47 1 2 1 1 8 LYS QD . 8 LYS QD 1 1 48 1 1 1 1 8 LYS H . 8 LYS H 1 1 48 1 2 1 1 8 LYS HG2 . 8 LYS HG2 1 1 49 1 1 1 1 8 LYS H . 8 LYS H 1 1 49 1 2 1 1 8 LYS HG3 . 8 LYS HG3 1 1 50 1 1 1 1 8 LYS H . 8 LYS H 1 1 50 1 2 1 1 9 ILE H . 9 ILE H 1 1 51 1 1 1 1 8 LYS HA . 8 LYS HA 1 1 51 1 2 1 1 9 ILE H . 9 ILE H 1 1 52 1 1 1 1 8 LYS HB2 . 8 LYS HB2 1 1 52 1 2 1 1 9 ILE H . 9 ILE H 1 1 53 1 1 1 1 8 LYS HB3 . 8 LYS HB3 1 1 53 1 2 1 1 9 ILE H . 9 ILE H 1 1 54 1 1 1 1 8 LYS QD . 8 LYS QD 1 1 54 1 2 1 1 9 ILE H . 9 ILE H 1 1 55 1 1 1 1 8 LYS HG2 . 8 LYS HG2 1 1 55 1 2 1 1 9 ILE H . 9 ILE H 1 1 56 1 1 1 1 8 LYS HG3 . 8 LYS HG3 1 1 56 1 2 1 1 9 ILE H . 9 ILE H 1 1 57 1 1 1 1 9 ILE H . 9 ILE H 1 1 57 1 2 1 1 9 ILE HB . 9 ILE HB 1 1 58 1 1 1 1 9 ILE H . 9 ILE H 1 1 58 1 2 1 1 9 ILE MD . 9 ILE HD1 1 1 59 1 1 1 1 9 ILE H . 9 ILE H 1 1 59 1 2 1 1 9 ILE HG12 . 9 ILE HG12 1 1 60 1 1 1 1 9 ILE H . 9 ILE H 1 1 60 1 2 1 1 9 ILE HG13 . 9 ILE HG13 1 1 61 1 1 1 1 9 ILE H . 9 ILE H 1 1 61 1 2 1 1 9 ILE MG . 9 ILE HG2 1 1 62 1 1 1 1 9 ILE H . 9 ILE H 1 1 62 1 2 1 1 10 THR H . 10 THR H 1 1 63 1 1 1 1 9 ILE HA . 9 ILE HA 1 1 63 1 2 1 1 10 THR H . 10 THR H 1 1 64 1 1 1 1 9 ILE HB . 9 ILE HB 1 1 64 1 2 1 1 10 THR H . 10 THR H 1 1 65 1 1 1 1 9 ILE MD . 9 ILE HD1 1 1 65 1 2 1 1 10 THR H . 10 THR H 1 1 66 1 1 1 1 9 ILE HG12 . 9 ILE HG12 1 1 66 1 2 1 1 10 THR H . 10 THR H 1 1 67 1 1 1 1 9 ILE HG13 . 9 ILE HG13 1 1 67 1 2 1 1 10 THR H . 10 THR H 1 1 68 1 1 1 1 9 ILE MG . 9 ILE HG2 1 1 68 1 2 1 1 10 THR H . 10 THR H 1 1 69 1 1 1 1 10 THR H . 10 THR H 1 1 69 1 2 1 1 10 THR HB . 10 THR HB 1 1 70 1 1 1 1 10 THR H . 10 THR H 1 1 70 1 2 1 1 10 THR MG . 10 THR QG2 1 1 71 1 1 1 1 10 THR HA . 10 THR HA 1 1 71 1 2 1 1 11 LYS H . 11 LYS H 1 1 72 1 1 1 1 10 THR HB . 10 THR HB 1 1 72 1 2 1 1 11 LYS H . 11 LYS H 1 1 73 1 1 1 1 10 THR MG . 10 THR QG2 1 1 73 1 2 1 1 11 LYS H . 11 LYS H 1 1 74 1 1 1 1 11 LYS H . 11 LYS H 1 1 74 1 2 1 1 11 LYS QB . 11 LYS QB 1 1 75 1 1 1 1 11 LYS H . 11 LYS H 1 1 75 1 2 1 1 11 LYS QD . 11 LYS QD 1 1 76 1 1 1 1 11 LYS H . 11 LYS H 1 1 76 1 2 1 1 11 LYS QG . 11 LYS QG 1 1 77 1 1 1 1 11 LYS H . 11 LYS H 1 1 77 1 2 1 1 12 LYS H . 12 LYS H 1 1 78 1 1 1 1 11 LYS HA . 11 LYS HA 1 1 78 1 2 1 1 12 LYS H . 12 LYS H 1 1 79 1 1 1 1 11 LYS QB . 11 LYS QB 1 1 79 1 2 1 1 12 LYS H . 12 LYS H 1 1 80 1 1 1 1 11 LYS QD . 11 LYS QD 1 1 80 1 2 1 1 12 LYS H . 12 LYS H 1 1 81 1 1 1 1 11 LYS QG . 11 LYS QG 1 1 81 1 2 1 1 12 LYS H . 12 LYS H 1 1 82 1 1 1 1 12 LYS H . 12 LYS H 1 1 82 1 2 1 1 12 LYS QB . 12 LYS QB 1 1 83 1 1 1 1 12 LYS H . 12 LYS H 1 1 83 1 2 1 1 12 LYS QD . 12 LYS QD 1 1 84 1 1 1 1 12 LYS H . 12 LYS H 1 1 84 1 2 1 1 12 LYS QG . 12 LYS QG 1 1 85 1 1 1 1 12 LYS H . 12 LYS H 1 1 85 1 2 1 1 13 ASN H . 13 ASN H 1 1 86 1 1 1 1 12 LYS HA . 12 LYS HA 1 1 86 1 2 1 1 13 ASN H . 13 ASN H 1 1 87 1 1 1 1 12 LYS HB2 . 12 LYS HB2 1 1 87 1 2 1 1 13 ASN H . 13 ASN H 1 1 88 1 1 1 1 12 LYS HB3 . 12 LYS HB3 1 1 88 1 2 1 1 13 ASN H . 13 ASN H 1 1 89 1 1 1 1 12 LYS QD . 12 LYS QD 1 1 89 1 2 1 1 13 ASN H . 13 ASN H 1 1 90 1 1 1 1 12 LYS HG2 . 12 LYS HG2 1 1 90 1 2 1 1 13 ASN H . 13 ASN H 1 1 91 1 1 1 1 12 LYS HG3 . 12 LYS HG3 1 1 91 1 2 1 1 13 ASN H . 13 ASN H 1 1 92 1 1 1 1 13 ASN H . 13 ASN H 1 1 92 1 2 1 1 13 ASN HB2 . 13 ASN HB2 1 1 93 1 1 1 1 13 ASN H . 13 ASN H 1 1 93 1 2 1 1 13 ASN HB3 . 13 ASN HB3 1 1 94 1 1 1 1 13 ASN H . 13 ASN H 1 1 94 1 2 1 1 14 MET H . 14 MET H 1 1 95 1 1 1 1 13 ASN HA . 13 ASN HA 1 1 95 1 2 1 1 14 MET H . 14 MET H 1 1 96 1 1 1 1 13 ASN HB2 . 13 ASN HB2 1 1 96 1 2 1 1 14 MET H . 14 MET H 1 1 97 1 1 1 1 13 ASN HB3 . 13 ASN HB3 1 1 97 1 2 1 1 14 MET H . 14 MET H 1 1 98 1 1 1 1 14 MET H . 14 MET H 1 1 98 1 2 1 1 15 ALA H . 15 ALA H 1 1 99 1 1 1 1 14 MET HA . 14 MET HA 1 1 99 1 2 1 1 15 ALA H . 15 ALA H 1 1 100 1 1 1 1 14 MET HA . 14 MET HA 1 1 100 1 2 1 1 16 HIS H . 16 HIS H 1 1 101 1 1 1 1 14 MET HB2 . 14 MET HB2 1 1 101 1 2 1 1 15 ALA H . 15 ALA H 1 1 102 1 1 1 1 14 MET HB2 . 14 MET HB2 1 1 102 1 2 1 1 17 ILE MD . 17 ILE HD1 1 1 103 1 1 1 1 14 MET HB3 . 14 MET HB3 1 1 103 1 2 1 1 15 ALA H . 15 ALA H 1 1 104 1 1 1 1 14 MET HB3 . 14 MET HB3 1 1 104 1 2 1 1 17 ILE MG . 17 ILE HG2 1 1 105 1 1 1 1 14 MET HG2 . 14 MET HG2 1 1 105 1 2 1 1 15 ALA H . 15 ALA H 1 1 106 1 1 1 1 14 MET HG2 . 14 MET HG2 1 1 106 1 2 1 1 17 ILE MD . 17 ILE HD1 1 1 107 1 1 1 1 14 MET HG3 . 14 MET HG3 1 1 107 1 2 1 1 15 ALA H . 15 ALA H 1 1 108 1 1 1 1 14 MET HG3 . 14 MET HG3 1 1 108 1 2 1 1 17 ILE MG . 17 ILE HG2 1 1 109 1 1 1 1 15 ALA H . 15 ALA H 1 1 109 1 2 1 1 16 HIS H . 16 HIS H 1 1 110 1 1 1 1 15 ALA HA . 15 ALA HA 1 1 110 1 2 1 1 16 HIS H . 16 HIS H 1 1 111 1 1 1 1 15 ALA MB . 15 ALA QB 1 1 111 1 2 1 1 16 HIS H . 16 HIS H 1 1 112 1 1 1 1 16 HIS H . 16 HIS H 1 1 112 1 2 1 1 17 ILE H . 17 ILE H 1 1 113 1 1 1 1 16 HIS HA . 16 HIS HA 1 1 113 1 2 1 1 17 ILE H . 17 ILE H 1 1 114 1 1 1 1 16 HIS HB2 . 16 HIS HB2 1 1 114 1 2 1 1 17 ILE H . 17 ILE H 1 1 115 1 1 1 1 16 HIS HB3 . 16 HIS HB3 1 1 115 1 2 1 1 17 ILE H . 17 ILE H 1 1 116 1 1 1 1 17 ILE H . 17 ILE H 1 1 116 1 2 1 1 18 ARG H . 18 ARG H 1 1 117 1 1 1 1 17 ILE HA . 17 ILE HA 1 1 117 1 2 1 1 18 ARG H . 18 ARG H 1 1 118 1 1 1 1 17 ILE HB . 17 ILE HB 1 1 118 1 2 1 1 18 ARG H . 18 ARG H 1 1 119 1 1 1 1 17 ILE MD . 17 ILE HD1 1 1 119 1 2 1 1 18 ARG H . 18 ARG H 1 1 120 1 1 1 1 17 ILE HG12 . 17 ILE HG12 1 1 120 1 2 1 1 18 ARG H . 18 ARG H 1 1 121 1 1 1 1 17 ILE HG13 . 17 ILE HG13 1 1 121 1 2 1 1 18 ARG H . 18 ARG H 1 1 122 1 1 1 1 17 ILE MG . 17 ILE HG2 1 1 122 1 2 1 1 18 ARG H . 18 ARG 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 . . . . . . . 3.5 1 1 2 1 . . . . . . . 3.5 1 1 3 1 . . . . . . . 3.8 1 1 4 1 . . . . . . . 3.5 1 1 5 1 . . . . . . . 3.5 1 1 6 1 . . . . . . . 3.7 1 1 7 1 . . . . . . . 3.5 1 1 8 1 . . . . . . . 3.5 1 1 9 1 . . . . . . . 2.9 1 1 10 1 . . . . . . . 4.2 1 1 11 1 . . . . . . . 3.5 1 1 12 1 . . . . . . . 3.8 1 1 13 1 . . . . . . . 3.9 1 1 14 1 . . . . . . . 3.5 1 1 15 1 . . . . . . . 3.8 1 1 16 1 . . . . . . . 3.8 1 1 17 1 . . . . . . . 4.2 1 1 18 1 . . . . . . . 4.0 1 1 19 1 . . . . . . . 4.5 1 1 20 1 . . . . . . . 3.5 1 1 21 1 . . . . . . . 3.5 1 1 22 1 . . . . . . . 4.2 1 1 23 1 . . . . . . . 4.0 1 1 24 1 . . . . . . . 3.5 1 1 25 1 . . . . . . . 3.5 1 1 26 1 . . . . . . . 3.2 1 1 27 1 . . . . . . . 4.0 1 1 28 1 . . . . . . . 4.0 1 1 29 1 . . . . . . . 3.8 1 1 30 1 . . . . . . . 3.5 1 1 31 1 . . . . . . . 4.2 1 1 32 1 . . . . . . . 4.5 1 1 33 1 . . . . . . . 4.5 1 1 34 1 . . . . . . . 5.2 1 1 35 1 . . . . . . . 4.0 1 1 36 1 . . . . . . . 4.2 1 1 37 1 . . . . . . . 4.0 1 1 38 1 . . . . . . . 4.0 1 1 39 1 . . . . . . . 4.0 1 1 40 1 . . . . . . . 4.5 1 1 41 1 . . . . . . . 3.5 1 1 42 1 . . . . . . . 2.8 1 1 43 1 . . . . . . . 3.4 1 1 44 1 . . . . . . . 3.5 1 1 45 1 . . . . . . . 3.5 1 1 46 1 . . . . . . . 3.5 1 1 47 1 . . . . . . . 4.0 1 1 48 1 . . . . . . . 3.5 1 1 49 1 . . . . . . . 3.5 1 1 50 1 . . . . . . . 2.8 1 1 51 1 . . . . . . . 3.4 1 1 52 1 . . . . . . . 3.8 1 1 53 1 . . . . . . . 4.0 1 1 54 1 . . . . . . . 3.8 1 1 55 1 . . . . . . . 3.5 1 1 56 1 . . . . . . . 3.5 1 1 57 1 . . . . . . . 3.5 1 1 58 1 . . . . . . . 4.0 1 1 59 1 . . . . . . . 4.0 1 1 60 1 . . . . . . . 4.0 1 1 61 1 . . . . . . . 4.5 1 1 62 1 . . . . . . . 3.0 1 1 63 1 . . . . . . . 3.5 1 1 64 1 . . . . . . . 4.0 1 1 65 1 . . . . . . . 4.5 1 1 66 1 . . . . . . . 4.0 1 1 67 1 . . . . . . . 4.0 1 1 68 1 . . . . . . . 4.5 1 1 69 1 . . . . . . . 3.5 1 1 70 1 . . . . . . . 3.8 1 1 71 1 . . . . . . . 2.8 1 1 72 1 . . . . . . . 3.5 1 1 73 1 . . . . . . . 3.8 1 1 74 1 . . . . . . . 3.5 1 1 75 1 . . . . . . . 4.0 1 1 76 1 . . . . . . . 3.8 1 1 77 1 . . . . . . . 2.8 1 1 78 1 . . . . . . . 3.0 1 1 79 1 . . . . . . . 3.8 1 1 80 1 . . . . . . . 4.0 1 1 81 1 . . . . . . . 3.8 1 1 82 1 . . . . . . . 3.5 1 1 83 1 . . . . . . . 4.0 1 1 84 1 . . . . . . . 3.8 1 1 85 1 . . . . . . . 2.8 1 1 86 1 . . . . . . . 3.5 1 1 87 1 . . . . . . . 3.5 1 1 88 1 . . . . . . . 3.5 1 1 89 1 . . . . . . . 4.0 1 1 90 1 . . . . . . . 4.0 1 1 91 1 . . . . . . . 4.0 1 1 92 1 . . . . . . . 3.5 1 1 93 1 . . . . . . . 3.5 1 1 94 1 . . . . . . . 2.8 1 1 95 1 . . . . . . . 3.4 1 1 96 1 . . . . . . . 3.5 1 1 97 1 . . . . . . . 3.5 1 1 98 1 . . . . . . . 2.8 1 1 99 1 . . . . . . . 3.5 1 1 100 1 . . . . . . . 4.2 1 1 101 1 . . . . . . . 3.5 1 1 102 1 . . . . . . . 4.5 1 1 103 1 . . . . . . . 3.5 1 1 104 1 . . . . . . . 4.5 1 1 105 1 . . . . . . . 4.0 1 1 106 1 . . . . . . . 4.0 1 1 107 1 . . . . . . . 4.0 1 1 108 1 . . . . . . . 4.0 1 1 109 1 . . . . . . . 2.8 1 1 110 1 . . . . . . . 3.45 1 1 111 1 . . . . . . . 3.5 1 1 112 1 . . . . . . . 2.8 1 1 113 1 . . . . . . . 3.3 1 1 114 1 . . . . . . . 3.5 1 1 115 1 . . . . . . . 3.5 1 1 116 1 . . . . . . . 2.8 1 1 117 1 . . . . . . . 3.5 1 1 118 1 . . . . . . . 3.7 1 1 119 1 . . . . . . . 4.0 1 1 120 1 . . . . . . . 3.5 1 1 121 1 . . . . . . . 3.5 1 1 122 1 . . . . . . . 3.7 1 1 stop_ save_ save_DYANA/DIANA_dihedral_4 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 PHI 1 1 3 PRO C 1 1 4 LYS N 1 1 4 LYS CA 1 1 4 LYS C -120.0 -30.0 . 4 LYS . . 4 LYS . . 4 LYS . . 4 LYS . 1 1 2 PSI 1 1 4 LYS N 1 1 4 LYS CA 1 1 4 LYS C 1 1 5 LEU N -120.0 120.0 . 4 LYS . . 4 LYS . . 4 LYS . . 4 LYS . 1 1 3 PHI 1 1 4 LYS C 1 1 5 LEU N 1 1 5 LEU CA 1 1 5 LEU C -120.0 -30.0 . 5 LEU . . 5 LEU . . 5 LEU . . 5 LEU . 1 1 4 PSI 1 1 5 LEU N 1 1 5 LEU CA 1 1 5 LEU C 1 1 6 PHE N -120.0 120.0 . 5 LEU . . 5 LEU . . 5 LEU . . 5 LEU . 1 1 5 PHI 1 1 5 LEU C 1 1 6 PHE N 1 1 6 PHE CA 1 1 6 PHE C -120.0 -30.0 . 6 PHE . . 6 PHE . . 6 PHE . . 6 PHE . 1 1 6 PSI 1 1 6 PHE N 1 1 6 PHE CA 1 1 6 PHE C 1 1 7 ALA N -120.0 120.0 . 6 PHE . . 6 PHE . . 6 PHE . . 6 PHE . 1 1 7 PHI 1 1 6 PHE C 1 1 7 ALA N 1 1 7 ALA CA 1 1 7 ALA C -120.0 -30.0 . 7 ALA . . 7 ALA . . 7 ALA . . 7 ALA . 1 1 8 PSI 1 1 7 ALA N 1 1 7 ALA CA 1 1 7 ALA C 1 1 8 LYS N -120.0 120.0 . 7 ALA . . 7 ALA . . 7 ALA . . 7 ALA . 1 1 9 PHI 1 1 7 ALA C 1 1 8 LYS N 1 1 8 LYS CA 1 1 8 LYS C -120.0 -30.0 . 8 LYS . . 8 LYS . . 8 LYS . . 8 LYS . 1 1 10 PSI 1 1 8 LYS N 1 1 8 LYS CA 1 1 8 LYS C 1 1 9 ILE N -120.0 120.0 . 8 LYS . . 8 LYS . . 8 LYS . . 8 LYS . 1 1 11 PHI 1 1 8 LYS C 1 1 9 ILE N 1 1 9 ILE CA 1 1 9 ILE C -120.0 -30.0 . 9 ILE . . 9 ILE . . 9 ILE . . 9 ILE . 1 1 12 PSI 1 1 9 ILE N 1 1 9 ILE CA 1 1 9 ILE C 1 1 10 THR N -120.0 120.0 . 9 ILE . . 9 ILE . . 9 ILE . . 9 ILE . 1 1 13 PHI 1 1 9 ILE C 1 1 10 THR N 1 1 10 THR CA 1 1 10 THR C -120.0 -30.0 . 10 THR . . 10 THR . . 10 THR . . 10 THR . 1 1 14 PSI 1 1 10 THR N 1 1 10 THR CA 1 1 10 THR C 1 1 11 LYS N -120.0 120.0 . 10 THR . . 10 THR . . 10 THR . . 10 THR . 1 1 15 PHI 1 1 10 THR C 1 1 11 LYS N 1 1 11 LYS CA 1 1 11 LYS C -120.0 -30.0 . 11 LYS . . 11 LYS . . 11 LYS . . 11 LYS . 1 1 16 PSI 1 1 11 LYS N 1 1 11 LYS CA 1 1 11 LYS C 1 1 12 LYS N -120.0 120.0 . 11 LYS . . 11 LYS . . 11 LYS . . 11 LYS . 1 1 17 PHI 1 1 11 LYS C 1 1 12 LYS N 1 1 12 LYS CA 1 1 12 LYS C -120.0 -30.0 . 12 LYS . . 12 LYS . . 12 LYS . . 12 LYS . 1 1 18 PSI 1 1 12 LYS N 1 1 12 LYS CA 1 1 12 LYS C 1 1 13 ASN N -120.0 120.0 . 12 LYS . . 12 LYS . . 12 LYS . . 12 LYS . 1 1 19 PHI 1 1 12 LYS C 1 1 13 ASN N 1 1 13 ASN CA 1 1 13 ASN C -120.0 -30.0 . 13 ASN . . 13 ASN . . 13 ASN . . 13 ASN . 1 1 20 PSI 1 1 13 ASN N 1 1 13 ASN CA 1 1 13 ASN C 1 1 14 MET N -120.0 120.0 . 13 ASN . . 13 ASN . . 13 ASN . . 13 ASN . 1 1 21 PHI 1 1 13 ASN C 1 1 14 MET N 1 1 14 MET CA 1 1 14 MET C -120.0 -30.0 . 14 MET . . 14 MET . . 14 MET . . 14 MET . 1 1 22 PSI 1 1 14 MET N 1 1 14 MET CA 1 1 14 MET C 1 1 15 ALA N -120.0 120.0 . 14 MET . . 14 MET . . 14 MET . . 14 MET . 1 1 23 PHI 1 1 14 MET C 1 1 15 ALA N 1 1 15 ALA CA 1 1 15 ALA C -120.0 -30.0 . 15 ALA . . 15 ALA . . 15 ALA . . 15 ALA . 1 1 24 PSI 1 1 15 ALA N 1 1 15 ALA CA 1 1 15 ALA C 1 1 16 HIS N -120.0 120.0 . 15 ALA . . 15 ALA . . 15 ALA . . 15 ALA . 1 1 25 PHI 1 1 15 ALA C 1 1 16 HIS N 1 1 16 HIS CA 1 1 16 HIS C -120.0 -30.0 . 16 HIS . . 16 HIS . . 16 HIS . . 16 HIS . 1 1 26 PSI 1 1 16 HIS N 1 1 16 HIS CA 1 1 16 HIS C 1 1 17 ILE N -120.0 120.0 . 16 HIS . . 16 HIS . . 16 HIS . . 16 HIS . 1 1 27 PHI 1 1 16 HIS C 1 1 17 ILE N 1 1 17 ILE CA 1 1 17 ILE C -120.0 -30.0 . 17 ILE . . 17 ILE . . 17 ILE . . 17 ILE . 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 PHE C C 4.547 0.621 -3.631 1.00 . A A . 1 PHE C 1 1 1 2 1 1 1 PHE CA C 4.245 1.110 -5.045 1.00 . A A . 1 PHE CA 1 1 1 3 1 1 1 PHE CB C 3.571 2.482 -4.990 1.00 . A A . 1 PHE CB 1 1 1 4 1 1 1 PHE CD1 C 3.227 3.927 -7.013 1.00 . A A . 1 PHE CD1 1 1 1 5 1 1 1 PHE CD2 C 5.398 3.854 -6.029 1.00 . A A . 1 PHE CD2 1 1 1 6 1 1 1 PHE CE1 C 3.688 4.809 -7.972 1.00 . A A . 1 PHE CE1 1 1 1 7 1 1 1 PHE CE2 C 5.864 4.735 -6.985 1.00 . A A . 1 PHE CE2 1 1 1 8 1 1 1 PHE CG C 4.075 3.440 -6.031 1.00 . A A . 1 PHE CG 1 1 1 9 1 1 1 PHE CZ C 5.008 5.213 -7.959 1.00 . A A . 1 PHE CZ 1 1 1 10 1 1 1 PHE H1 H 2.432 0.322 -5.804 1.00 . A A . 1 PHE H1 1 1 1 11 1 1 1 PHE HA H 5.173 1.195 -5.589 1.00 . A A . 1 PHE HA 1 1 1 12 1 1 1 PHE HB2 H 2.509 2.360 -5.139 1.00 . A A . 1 PHE HB2 1 1 1 13 1 1 1 PHE HB3 H 3.746 2.922 -4.020 1.00 . A A . 1 PHE HB3 1 1 1 14 1 1 1 PHE HD1 H 2.193 3.611 -7.024 1.00 . A A . 1 PHE HD1 1 1 1 15 1 1 1 PHE HD2 H 6.069 3.481 -5.269 1.00 . A A . 1 PHE HD2 1 1 1 16 1 1 1 PHE HE1 H 3.016 5.179 -8.732 1.00 . A A . 1 PHE HE1 1 1 1 17 1 1 1 PHE HE2 H 6.897 5.050 -6.973 1.00 . A A . 1 PHE HE2 1 1 1 18 1 1 1 PHE HZ H 5.370 5.902 -8.707 1.00 . A A . 1 PHE HZ 1 1 1 19 1 1 1 PHE N N 3.398 0.158 -5.754 1.00 . A A . 1 PHE N 1 1 1 20 1 1 1 PHE O O 3.738 -0.076 -3.017 1.00 . A A . 1 PHE O 1 1 1 21 1 1 2 LEU C C 6.071 1.774 -0.818 1.00 . A A . 2 LEU C 1 1 1 22 1 1 2 LEU CA C 6.126 0.591 -1.779 1.00 . A A . 2 LEU CA 1 1 1 23 1 1 2 LEU CB C 7.540 0.009 -1.810 1.00 . A A . 2 LEU CB 1 1 1 24 1 1 2 LEU CD1 C 7.323 -2.023 -3.261 1.00 . A A . 2 LEU CD1 1 1 1 25 1 1 2 LEU CD2 C 9.020 -1.977 -1.424 1.00 . A A . 2 LEU CD2 1 1 1 26 1 1 2 LEU CG C 7.638 -1.516 -1.862 1.00 . A A . 2 LEU CG 1 1 1 27 1 1 2 LEU H H 6.318 1.547 -3.658 1.00 . A A . 2 LEU H 1 1 1 28 1 1 2 LEU HA H 5.440 -0.169 -1.436 1.00 . A A . 2 LEU HA 1 1 1 29 1 1 2 LEU HB2 H 8.041 0.403 -2.681 1.00 . A A . 2 LEU HB2 1 1 1 30 1 1 2 LEU HB3 H 8.054 0.344 -0.920 1.00 . A A . 2 LEU HB3 1 1 1 31 1 1 2 LEU HD11 H 6.271 -1.889 -3.464 1.00 . A A . 2 LEU HD11 1 1 1 32 1 1 2 LEU HD12 H 7.573 -3.071 -3.329 1.00 . A A . 2 LEU HD12 1 1 1 33 1 1 2 LEU HD13 H 7.903 -1.468 -3.984 1.00 . A A . 2 LEU HD13 1 1 1 34 1 1 2 LEU HD21 H 8.945 -2.486 -0.475 1.00 . A A . 2 LEU HD21 1 1 1 35 1 1 2 LEU HD22 H 9.671 -1.120 -1.323 1.00 . A A . 2 LEU HD22 1 1 1 36 1 1 2 LEU HD23 H 9.425 -2.652 -2.164 1.00 . A A . 2 LEU HD23 1 1 1 37 1 1 2 LEU HG H 6.912 -1.940 -1.183 1.00 . A A . 2 LEU HG 1 1 1 38 1 1 2 LEU N N 5.716 0.991 -3.121 1.00 . A A . 2 LEU N 1 1 1 39 1 1 2 LEU O O 6.067 2.936 -1.224 1.00 . A A . 2 LEU O 1 1 1 40 1 1 3 PRO C C 7.285 3.272 1.655 1.00 . A A . 3 PRO C 1 1 1 41 1 1 3 PRO CA C 5.977 2.498 1.536 1.00 . A A . 3 PRO CA 1 1 1 42 1 1 3 PRO CB C 5.715 1.690 2.809 1.00 . A A . 3 PRO CB 1 1 1 43 1 1 3 PRO CD C 6.031 0.109 1.044 1.00 . A A . 3 PRO CD 1 1 1 44 1 1 3 PRO CG C 6.253 0.333 2.515 1.00 . A A . 3 PRO CG 1 1 1 45 1 1 3 PRO HA H 5.164 3.190 1.373 1.00 . A A . 3 PRO HA 1 1 1 46 1 1 3 PRO HB2 H 6.230 2.149 3.642 1.00 . A A . 3 PRO HB2 1 1 1 47 1 1 3 PRO HB3 H 4.654 1.659 3.009 1.00 . A A . 3 PRO HB3 1 1 1 48 1 1 3 PRO HD2 H 6.836 -0.476 0.626 1.00 . A A . 3 PRO HD2 1 1 1 49 1 1 3 PRO HD3 H 5.081 -0.376 0.876 1.00 . A A . 3 PRO HD3 1 1 1 50 1 1 3 PRO HG2 H 7.307 0.298 2.745 1.00 . A A . 3 PRO HG2 1 1 1 51 1 1 3 PRO HG3 H 5.717 -0.407 3.091 1.00 . A A . 3 PRO HG3 1 1 1 52 1 1 3 PRO N N 6.029 1.473 0.489 1.00 . A A . 3 PRO N 1 1 1 53 1 1 3 PRO O O 8.362 2.737 1.391 1.00 . A A . 3 PRO O 1 1 1 54 1 1 4 LYS C C 8.510 5.843 3.659 1.00 . A A . 4 LYS C 1 1 1 55 1 1 4 LYS CA C 8.360 5.384 2.213 1.00 . A A . 4 LYS CA 1 1 1 56 1 1 4 LYS CB C 8.264 6.599 1.288 1.00 . A A . 4 LYS CB 1 1 1 57 1 1 4 LYS CD C 6.702 8.362 0.416 1.00 . A A . 4 LYS CD 1 1 1 58 1 1 4 LYS CE C 7.624 8.703 -0.744 1.00 . A A . 4 LYS CE 1 1 1 59 1 1 4 LYS CG C 6.848 6.909 0.836 1.00 . A A . 4 LYS CG 1 1 1 60 1 1 4 LYS H H 6.298 4.905 2.252 1.00 . A A . 4 LYS H 1 1 1 61 1 1 4 LYS HA H 9.228 4.802 1.941 1.00 . A A . 4 LYS HA 1 1 1 62 1 1 4 LYS HB2 H 8.652 7.463 1.807 1.00 . A A . 4 LYS HB2 1 1 1 63 1 1 4 LYS HB3 H 8.867 6.417 0.410 1.00 . A A . 4 LYS HB3 1 1 1 64 1 1 4 LYS HD2 H 5.681 8.540 0.113 1.00 . A A . 4 LYS HD2 1 1 1 65 1 1 4 LYS HD3 H 6.945 8.997 1.257 1.00 . A A . 4 LYS HD3 1 1 1 66 1 1 4 LYS HE2 H 8.607 8.918 -0.354 1.00 . A A . 4 LYS HE2 1 1 1 67 1 1 4 LYS HE3 H 7.679 7.851 -1.405 1.00 . A A . 4 LYS HE3 1 1 1 68 1 1 4 LYS HG2 H 6.600 6.277 -0.004 1.00 . A A . 4 LYS HG2 1 1 1 69 1 1 4 LYS HG3 H 6.167 6.709 1.652 1.00 . A A . 4 LYS HG3 1 1 1 70 1 1 4 LYS HZ1 H 6.634 9.569 -2.366 1.00 . A A . 4 LYS HZ1 1 1 1 71 1 1 4 LYS HZ2 H 7.941 10.480 -1.796 1.00 . A A . 4 LYS HZ2 1 1 1 72 1 1 4 LYS HZ3 H 6.490 10.447 -0.927 1.00 . A A . 4 LYS HZ3 1 1 1 73 1 1 4 LYS N N 7.185 4.535 2.056 1.00 . A A . 4 LYS N 1 1 1 74 1 1 4 LYS NZ N 7.138 9.883 -1.511 1.00 . A A . 4 LYS NZ 1 1 1 75 1 1 4 LYS O O 8.877 6.990 3.923 1.00 . A A . 4 LYS O 1 1 1 76 1 1 5 LEU C C 9.619 6.017 6.311 1.00 . A A . 5 LEU C 1 1 1 77 1 1 5 LEU CA C 8.331 5.256 6.015 1.00 . A A . 5 LEU CA 1 1 1 78 1 1 5 LEU CB C 8.281 3.972 6.845 1.00 . A A . 5 LEU CB 1 1 1 79 1 1 5 LEU CD1 C 6.527 2.284 7.441 1.00 . A A . 5 LEU CD1 1 1 1 80 1 1 5 LEU CD2 C 7.177 4.045 9.094 1.00 . A A . 5 LEU CD2 1 1 1 81 1 1 5 LEU CG C 6.987 3.723 7.619 1.00 . A A . 5 LEU CG 1 1 1 82 1 1 5 LEU H H 7.939 4.046 4.323 1.00 . A A . 5 LEU H 1 1 1 83 1 1 5 LEU HA H 7.489 5.879 6.280 1.00 . A A . 5 LEU HA 1 1 1 84 1 1 5 LEU HB2 H 8.431 3.139 6.175 1.00 . A A . 5 LEU HB2 1 1 1 85 1 1 5 LEU HB3 H 9.093 4.009 7.558 1.00 . A A . 5 LEU HB3 1 1 1 86 1 1 5 LEU HD11 H 5.777 2.239 6.666 1.00 . A A . 5 LEU HD11 1 1 1 87 1 1 5 LEU HD12 H 6.107 1.923 8.369 1.00 . A A . 5 LEU HD12 1 1 1 88 1 1 5 LEU HD13 H 7.370 1.668 7.164 1.00 . A A . 5 LEU HD13 1 1 1 89 1 1 5 LEU HD21 H 7.830 3.311 9.541 1.00 . A A . 5 LEU HD21 1 1 1 90 1 1 5 LEU HD22 H 6.219 4.026 9.594 1.00 . A A . 5 LEU HD22 1 1 1 91 1 1 5 LEU HD23 H 7.616 5.026 9.195 1.00 . A A . 5 LEU HD23 1 1 1 92 1 1 5 LEU HG H 6.212 4.370 7.232 1.00 . A A . 5 LEU HG 1 1 1 93 1 1 5 LEU N N 8.226 4.943 4.594 1.00 . A A . 5 LEU N 1 1 1 94 1 1 5 LEU O O 9.629 6.953 7.112 1.00 . A A . 5 LEU O 1 1 1 95 1 1 6 PHE C C 12.542 6.788 4.529 1.00 . A A . 6 PHE C 1 1 1 96 1 1 6 PHE CA C 11.997 6.257 5.852 1.00 . A A . 6 PHE CA 1 1 1 97 1 1 6 PHE CB C 12.994 5.274 6.469 1.00 . A A . 6 PHE CB 1 1 1 98 1 1 6 PHE CD1 C 15.273 6.122 7.086 1.00 . A A . 6 PHE CD1 1 1 1 99 1 1 6 PHE CD2 C 13.520 6.310 8.692 1.00 . A A . 6 PHE CD2 1 1 1 100 1 1 6 PHE CE1 C 16.154 6.713 7.973 1.00 . A A . 6 PHE CE1 1 1 1 101 1 1 6 PHE CE2 C 14.396 6.902 9.583 1.00 . A A . 6 PHE CE2 1 1 1 102 1 1 6 PHE CG C 13.948 5.915 7.435 1.00 . A A . 6 PHE CG 1 1 1 103 1 1 6 PHE CZ C 15.715 7.102 9.223 1.00 . A A . 6 PHE CZ 1 1 1 104 1 1 6 PHE H H 10.632 4.860 5.034 1.00 . A A . 6 PHE H 1 1 1 105 1 1 6 PHE HA H 11.856 7.085 6.528 1.00 . A A . 6 PHE HA 1 1 1 106 1 1 6 PHE HB2 H 12.450 4.507 7.000 1.00 . A A . 6 PHE HB2 1 1 1 107 1 1 6 PHE HB3 H 13.573 4.818 5.681 1.00 . A A . 6 PHE HB3 1 1 1 108 1 1 6 PHE HD1 H 15.617 5.818 6.108 1.00 . A A . 6 PHE HD1 1 1 1 109 1 1 6 PHE HD2 H 12.490 6.154 8.976 1.00 . A A . 6 PHE HD2 1 1 1 110 1 1 6 PHE HE1 H 17.184 6.868 7.688 1.00 . A A . 6 PHE HE1 1 1 1 111 1 1 6 PHE HE2 H 14.051 7.205 10.560 1.00 . A A . 6 PHE HE2 1 1 1 112 1 1 6 PHE HZ H 16.401 7.564 9.917 1.00 . A A . 6 PHE HZ 1 1 1 113 1 1 6 PHE N N 10.703 5.612 5.659 1.00 . A A . 6 PHE N 1 1 1 114 1 1 6 PHE O O 13.530 7.521 4.502 1.00 . A A . 6 PHE O 1 1 1 115 1 1 7 ALA C C 12.029 8.336 1.908 1.00 . A A . 7 ALA C 1 1 1 116 1 1 7 ALA CA C 12.308 6.850 2.108 1.00 . A A . 7 ALA CA 1 1 1 117 1 1 7 ALA CB C 11.605 6.031 1.035 1.00 . A A . 7 ALA CB 1 1 1 118 1 1 7 ALA H H 11.109 5.826 3.519 1.00 . A A . 7 ALA H 1 1 1 119 1 1 7 ALA HA H 13.371 6.678 2.019 1.00 . A A . 7 ALA HA 1 1 1 120 1 1 7 ALA HB1 H 12.327 5.709 0.299 1.00 . A A . 7 ALA HB1 1 1 1 121 1 1 7 ALA HB2 H 11.141 5.168 1.488 1.00 . A A . 7 ALA HB2 1 1 1 122 1 1 7 ALA HB3 H 10.850 6.637 0.557 1.00 . A A . 7 ALA HB3 1 1 1 123 1 1 7 ALA N N 11.890 6.412 3.434 1.00 . A A . 7 ALA N 1 1 1 124 1 1 7 ALA O O 12.722 9.012 1.147 1.00 . A A . 7 ALA O 1 1 1 125 1 1 8 LYS C C 11.412 11.086 3.510 1.00 . A A . 8 LYS C 1 1 1 126 1 1 8 LYS CA C 10.640 10.247 2.497 1.00 . A A . 8 LYS CA 1 1 1 127 1 1 8 LYS CB C 9.136 10.416 2.718 1.00 . A A . 8 LYS CB 1 1 1 128 1 1 8 LYS CD C 7.273 9.386 4.052 1.00 . A A . 8 LYS CD 1 1 1 129 1 1 8 LYS CE C 6.238 10.425 3.649 1.00 . A A . 8 LYS CE 1 1 1 130 1 1 8 LYS CG C 8.671 9.980 4.097 1.00 . A A . 8 LYS CG 1 1 1 131 1 1 8 LYS H H 10.496 8.252 3.188 1.00 . A A . 8 LYS H 1 1 1 132 1 1 8 LYS HA H 10.890 10.586 1.503 1.00 . A A . 8 LYS HA 1 1 1 133 1 1 8 LYS HB2 H 8.880 11.458 2.588 1.00 . A A . 8 LYS HB2 1 1 1 134 1 1 8 LYS HB3 H 8.607 9.829 1.981 1.00 . A A . 8 LYS HB3 1 1 1 135 1 1 8 LYS HD2 H 7.256 8.581 3.332 1.00 . A A . 8 LYS HD2 1 1 1 136 1 1 8 LYS HD3 H 7.023 9.002 5.030 1.00 . A A . 8 LYS HD3 1 1 1 137 1 1 8 LYS HE2 H 6.714 11.393 3.614 1.00 . A A . 8 LYS HE2 1 1 1 138 1 1 8 LYS HE3 H 5.859 10.175 2.669 1.00 . A A . 8 LYS HE3 1 1 1 139 1 1 8 LYS HG2 H 9.354 9.236 4.479 1.00 . A A . 8 LYS HG2 1 1 1 140 1 1 8 LYS HG3 H 8.666 10.838 4.753 1.00 . A A . 8 LYS HG3 1 1 1 141 1 1 8 LYS HZ1 H 4.760 11.455 4.705 1.00 . A A . 8 LYS HZ1 1 1 1 142 1 1 8 LYS HZ2 H 5.408 10.138 5.544 1.00 . A A . 8 LYS HZ2 1 1 1 143 1 1 8 LYS HZ3 H 4.321 9.879 4.274 1.00 . A A . 8 LYS HZ3 1 1 1 144 1 1 8 LYS N N 11.011 8.840 2.597 1.00 . A A . 8 LYS N 1 1 1 145 1 1 8 LYS NZ N 5.102 10.478 4.610 1.00 . A A . 8 LYS NZ 1 1 1 146 1 1 8 LYS O O 11.829 12.206 3.213 1.00 . A A . 8 LYS O 1 1 1 147 1 1 9 ILE C C 13.794 11.401 5.402 1.00 . A A . 9 ILE C 1 1 1 148 1 1 9 ILE CA C 12.321 11.236 5.762 1.00 . A A . 9 ILE CA 1 1 1 149 1 1 9 ILE CB C 12.213 10.492 7.106 1.00 . A A . 9 ILE CB 1 1 1 150 1 1 9 ILE CD1 C 14.550 9.735 7.772 1.00 . A A . 9 ILE CD1 1 1 1 151 1 1 9 ILE CG1 C 13.222 9.343 7.161 1.00 . A A . 9 ILE CG1 1 1 1 152 1 1 9 ILE CG2 C 10.798 9.971 7.310 1.00 . A A . 9 ILE CG2 1 1 1 153 1 1 9 ILE H H 11.241 9.643 4.883 1.00 . A A . 9 ILE H 1 1 1 154 1 1 9 ILE HA H 11.878 12.215 5.878 1.00 . A A . 9 ILE HA 1 1 1 155 1 1 9 ILE HB H 12.430 11.192 7.898 1.00 . A A . 9 ILE HB 1 1 1 156 1 1 9 ILE HD11 H 14.549 9.489 8.823 1.00 . A A . 9 ILE HD11 1 1 1 157 1 1 9 ILE HD12 H 15.346 9.200 7.276 1.00 . A A . 9 ILE HD12 1 1 1 158 1 1 9 ILE HD13 H 14.701 10.798 7.652 1.00 . A A . 9 ILE HD13 1 1 1 159 1 1 9 ILE HG12 H 12.811 8.539 7.750 1.00 . A A . 9 ILE HG12 1 1 1 160 1 1 9 ILE HG13 H 13.409 8.990 6.157 1.00 . A A . 9 ILE HG13 1 1 1 161 1 1 9 ILE HG21 H 10.768 8.914 7.089 1.00 . A A . 9 ILE HG21 1 1 1 162 1 1 9 ILE HG22 H 10.500 10.132 8.335 1.00 . A A . 9 ILE HG22 1 1 1 163 1 1 9 ILE HG23 H 10.122 10.496 6.651 1.00 . A A . 9 ILE HG23 1 1 1 164 1 1 9 ILE N N 11.598 10.538 4.706 1.00 . A A . 9 ILE N 1 1 1 165 1 1 9 ILE O O 14.455 12.336 5.856 1.00 . A A . 9 ILE O 1 1 1 166 1 1 10 THR C C 15.882 11.454 2.963 1.00 . A A . 10 THR C 1 1 1 167 1 1 10 THR CA C 15.698 10.530 4.161 1.00 . A A . 10 THR CA 1 1 1 168 1 1 10 THR CB C 16.219 9.127 3.798 1.00 . A A . 10 THR CB 1 1 1 169 1 1 10 THR CG2 C 16.403 8.278 5.047 1.00 . A A . 10 THR CG2 1 1 1 170 1 1 10 THR H H 13.727 9.765 4.255 1.00 . A A . 10 THR H 1 1 1 171 1 1 10 THR HA H 16.285 10.906 4.987 1.00 . A A . 10 THR HA 1 1 1 172 1 1 10 THR HB H 17.177 9.231 3.308 1.00 . A A . 10 THR HB 1 1 1 173 1 1 10 THR HG1 H 15.682 7.649 2.608 1.00 . A A . 10 THR HG1 1 1 1 174 1 1 10 THR HG21 H 17.121 8.749 5.701 1.00 . A A . 10 THR HG21 1 1 1 175 1 1 10 THR HG22 H 16.760 7.298 4.766 1.00 . A A . 10 THR HG22 1 1 1 176 1 1 10 THR HG23 H 15.457 8.183 5.559 1.00 . A A . 10 THR HG23 1 1 1 177 1 1 10 THR N N 14.304 10.486 4.583 1.00 . A A . 10 THR N 1 1 1 178 1 1 10 THR O O 15.284 11.245 1.907 1.00 . A A . 10 THR O 1 1 1 179 1 1 10 THR OG1 O 15.305 8.481 2.905 1.00 . A A . 10 THR OG1 1 1 1 180 1 1 11 LYS C C 18.462 13.464 1.717 1.00 . A A . 11 LYS C 1 1 1 181 1 1 11 LYS CA C 16.977 13.433 2.064 1.00 . A A . 11 LYS CA 1 1 1 182 1 1 11 LYS CB C 16.509 14.831 2.475 1.00 . A A . 11 LYS CB 1 1 1 183 1 1 11 LYS CD C 16.024 14.807 4.939 1.00 . A A . 11 LYS CD 1 1 1 184 1 1 11 LYS CE C 16.096 15.717 6.156 1.00 . A A . 11 LYS CE 1 1 1 185 1 1 11 LYS CG C 16.989 15.252 3.853 1.00 . A A . 11 LYS CG 1 1 1 186 1 1 11 LYS H H 17.160 12.591 3.997 1.00 . A A . 11 LYS H 1 1 1 187 1 1 11 LYS HA H 16.423 13.119 1.193 1.00 . A A . 11 LYS HA 1 1 1 188 1 1 11 LYS HB2 H 16.877 15.547 1.755 1.00 . A A . 11 LYS HB2 1 1 1 189 1 1 11 LYS HB3 H 15.429 14.852 2.471 1.00 . A A . 11 LYS HB3 1 1 1 190 1 1 11 LYS HD2 H 15.018 14.830 4.547 1.00 . A A . 11 LYS HD2 1 1 1 191 1 1 11 LYS HD3 H 16.273 13.799 5.239 1.00 . A A . 11 LYS HD3 1 1 1 192 1 1 11 LYS HE2 H 16.989 15.480 6.714 1.00 . A A . 11 LYS HE2 1 1 1 193 1 1 11 LYS HE3 H 16.144 16.743 5.820 1.00 . A A . 11 LYS HE3 1 1 1 194 1 1 11 LYS HG2 H 17.955 14.806 4.040 1.00 . A A . 11 LYS HG2 1 1 1 195 1 1 11 LYS HG3 H 17.076 16.329 3.881 1.00 . A A . 11 LYS HG3 1 1 1 196 1 1 11 LYS HZ1 H 15.218 15.450 8.032 1.00 . A A . 11 LYS HZ1 1 1 1 197 1 1 11 LYS HZ2 H 14.375 14.706 6.769 1.00 . A A . 11 LYS HZ2 1 1 1 198 1 1 11 LYS HZ3 H 14.291 16.383 6.968 1.00 . A A . 11 LYS HZ3 1 1 1 199 1 1 11 LYS N N 16.713 12.477 3.132 1.00 . A A . 11 LYS N 1 1 1 200 1 1 11 LYS NZ N 14.912 15.553 7.043 1.00 . A A . 11 LYS NZ 1 1 1 201 1 1 11 LYS O O 18.946 14.412 1.098 1.00 . A A . 11 LYS O 1 1 1 202 1 1 12 LYS C C 20.923 11.100 0.996 1.00 . A A . 12 LYS C 1 1 1 203 1 1 12 LYS CA C 20.610 12.327 1.848 1.00 . A A . 12 LYS CA 1 1 1 204 1 1 12 LYS CB C 21.395 12.264 3.160 1.00 . A A . 12 LYS CB 1 1 1 205 1 1 12 LYS CD C 21.473 11.155 5.412 1.00 . A A . 12 LYS CD 1 1 1 206 1 1 12 LYS CE C 22.236 12.241 6.156 1.00 . A A . 12 LYS CE 1 1 1 207 1 1 12 LYS CG C 20.582 11.741 4.331 1.00 . A A . 12 LYS CG 1 1 1 208 1 1 12 LYS H H 18.738 11.696 2.608 1.00 . A A . 12 LYS H 1 1 1 209 1 1 12 LYS HA H 20.904 13.212 1.304 1.00 . A A . 12 LYS HA 1 1 1 210 1 1 12 LYS HB2 H 22.249 11.616 3.024 1.00 . A A . 12 LYS HB2 1 1 1 211 1 1 12 LYS HB3 H 21.744 13.257 3.405 1.00 . A A . 12 LYS HB3 1 1 1 212 1 1 12 LYS HD2 H 20.861 10.614 6.118 1.00 . A A . 12 LYS HD2 1 1 1 213 1 1 12 LYS HD3 H 22.182 10.478 4.955 1.00 . A A . 12 LYS HD3 1 1 1 214 1 1 12 LYS HE2 H 21.812 13.200 5.900 1.00 . A A . 12 LYS HE2 1 1 1 215 1 1 12 LYS HE3 H 22.133 12.073 7.217 1.00 . A A . 12 LYS HE3 1 1 1 216 1 1 12 LYS HG2 H 20.011 12.555 4.753 1.00 . A A . 12 LYS HG2 1 1 1 217 1 1 12 LYS HG3 H 19.909 10.973 3.976 1.00 . A A . 12 LYS HG3 1 1 1 218 1 1 12 LYS HZ1 H 24.242 12.624 6.593 1.00 . A A . 12 LYS HZ1 1 1 1 219 1 1 12 LYS HZ2 H 23.846 12.830 4.962 1.00 . A A . 12 LYS HZ2 1 1 1 220 1 1 12 LYS HZ3 H 24.003 11.273 5.604 1.00 . A A . 12 LYS HZ3 1 1 1 221 1 1 12 LYS N N 19.181 12.421 2.118 1.00 . A A . 12 LYS N 1 1 1 222 1 1 12 LYS NZ N 23.683 12.242 5.804 1.00 . A A . 12 LYS NZ 1 1 1 223 1 1 12 LYS O O 21.149 11.210 -0.208 1.00 . A A . 12 LYS O 1 1 1 224 1 1 13 ASN C C 20.347 8.549 -0.315 1.00 . A A . 13 ASN C 1 1 1 225 1 1 13 ASN CA C 21.218 8.685 0.931 1.00 . A A . 13 ASN CA 1 1 1 226 1 1 13 ASN CB C 20.989 7.491 1.859 1.00 . A A . 13 ASN CB 1 1 1 227 1 1 13 ASN CG C 22.267 6.726 2.144 1.00 . A A . 13 ASN CG 1 1 1 228 1 1 13 ASN H H 20.747 9.908 2.592 1.00 . A A . 13 ASN H 1 1 1 229 1 1 13 ASN HA H 22.255 8.702 0.631 1.00 . A A . 13 ASN HA 1 1 1 230 1 1 13 ASN HB2 H 20.587 7.844 2.798 1.00 . A A . 13 ASN HB2 1 1 1 231 1 1 13 ASN HB3 H 20.282 6.816 1.401 1.00 . A A . 13 ASN HB3 1 1 1 232 1 1 13 ASN HD21 H 21.623 5.194 1.053 1.00 . A A . 13 ASN HD21 1 1 1 233 1 1 13 ASN HD22 H 23.184 5.002 1.769 1.00 . A A . 13 ASN HD22 1 1 1 234 1 1 13 ASN N N 20.934 9.932 1.631 1.00 . A A . 13 ASN N 1 1 1 235 1 1 13 ASN ND2 N 22.368 5.519 1.600 1.00 . A A . 13 ASN ND2 1 1 1 236 1 1 13 ASN O O 20.741 7.916 -1.293 1.00 . A A . 13 ASN O 1 1 1 237 1 1 13 ASN OD1 O 23.153 7.215 2.845 1.00 . A A . 13 ASN OD1 1 1 1 238 1 1 14 MET C C 18.863 9.711 -2.643 1.00 . A A . 14 MET C 1 1 1 239 1 1 14 MET CA C 18.236 9.097 -1.395 1.00 . A A . 14 MET CA 1 1 1 240 1 1 14 MET CB C 16.938 9.830 -1.049 1.00 . A A . 14 MET CB 1 1 1 241 1 1 14 MET CE C 13.088 9.225 -2.326 1.00 . A A . 14 MET CE 1 1 1 242 1 1 14 MET CG C 15.821 9.592 -2.052 1.00 . A A . 14 MET CG 1 1 1 243 1 1 14 MET H H 18.904 9.640 0.539 1.00 . A A . 14 MET H 1 1 1 244 1 1 14 MET HA H 18.013 8.060 -1.592 1.00 . A A . 14 MET HA 1 1 1 245 1 1 14 MET HB2 H 16.599 9.497 -0.080 1.00 . A A . 14 MET HB2 1 1 1 246 1 1 14 MET HB3 H 17.136 10.890 -1.009 1.00 . A A . 14 MET HB3 1 1 1 247 1 1 14 MET HE1 H 12.380 8.427 -2.489 1.00 . A A . 14 MET HE1 1 1 1 248 1 1 14 MET HE2 H 12.607 10.028 -1.787 1.00 . A A . 14 MET HE2 1 1 1 249 1 1 14 MET HE3 H 13.443 9.592 -3.278 1.00 . A A . 14 MET HE3 1 1 1 250 1 1 14 MET HG2 H 15.428 10.548 -2.367 1.00 . A A . 14 MET HG2 1 1 1 251 1 1 14 MET HG3 H 16.229 9.074 -2.908 1.00 . A A . 14 MET HG3 1 1 1 252 1 1 14 MET N N 19.162 9.150 -0.270 1.00 . A A . 14 MET N 1 1 1 253 1 1 14 MET O O 18.901 9.084 -3.702 1.00 . A A . 14 MET O 1 1 1 254 1 1 14 MET SD S 14.472 8.610 -1.370 1.00 . A A . 14 MET SD 1 1 1 255 1 1 15 ALA C C 21.378 11.093 -3.900 1.00 . A A . 15 ALA C 1 1 1 256 1 1 15 ALA CA C 19.979 11.636 -3.629 1.00 . A A . 15 ALA CA 1 1 1 257 1 1 15 ALA CB C 20.035 13.131 -3.353 1.00 . A A . 15 ALA CB 1 1 1 258 1 1 15 ALA H H 19.293 11.387 -1.642 1.00 . A A . 15 ALA H 1 1 1 259 1 1 15 ALA HA H 19.366 11.479 -4.505 1.00 . A A . 15 ALA HA 1 1 1 260 1 1 15 ALA HB1 H 20.952 13.536 -3.757 1.00 . A A . 15 ALA HB1 1 1 1 261 1 1 15 ALA HB2 H 19.191 13.615 -3.820 1.00 . A A . 15 ALA HB2 1 1 1 262 1 1 15 ALA HB3 H 20.005 13.302 -2.287 1.00 . A A . 15 ALA HB3 1 1 1 263 1 1 15 ALA N N 19.353 10.939 -2.512 1.00 . A A . 15 ALA N 1 1 1 264 1 1 15 ALA O O 22.069 11.555 -4.808 1.00 . A A . 15 ALA O 1 1 1 265 1 1 16 HIS C C 23.000 8.131 -3.921 1.00 . A A . 16 HIS C 1 1 1 266 1 1 16 HIS CA C 23.107 9.503 -3.261 1.00 . A A . 16 HIS CA 1 1 1 267 1 1 16 HIS CB C 23.796 9.375 -1.902 1.00 . A A . 16 HIS CB 1 1 1 268 1 1 16 HIS CD2 C 26.144 10.300 -2.504 1.00 . A A . 16 HIS CD2 1 1 1 269 1 1 16 HIS CE1 C 26.325 11.782 -0.898 1.00 . A A . 16 HIS CE1 1 1 1 270 1 1 16 HIS CG C 25.012 10.239 -1.764 1.00 . A A . 16 HIS CG 1 1 1 271 1 1 16 HIS H H 21.193 9.783 -2.401 1.00 . A A . 16 HIS H 1 1 1 272 1 1 16 HIS HA H 23.697 10.148 -3.895 1.00 . A A . 16 HIS HA 1 1 1 273 1 1 16 HIS HB2 H 23.100 9.655 -1.126 1.00 . A A . 16 HIS HB2 1 1 1 274 1 1 16 HIS HB3 H 24.099 8.348 -1.754 1.00 . A A . 16 HIS HB3 1 1 1 275 1 1 16 HIS HD1 H 24.501 11.376 -0.065 1.00 . A A . 16 HIS HD1 1 1 1 276 1 1 16 HIS HD2 H 26.375 9.700 -3.373 1.00 . A A . 16 HIS HD2 1 1 1 277 1 1 16 HIS HE1 H 26.710 12.563 -0.260 1.00 . A A . 16 HIS HE1 1 1 1 278 1 1 16 HIS N N 21.790 10.109 -3.106 1.00 . A A . 16 HIS N 1 1 1 279 1 1 16 HIS ND1 N 25.157 11.179 -0.765 1.00 . A A . 16 HIS ND1 1 1 1 280 1 1 16 HIS NE2 N 26.943 11.266 -1.945 1.00 . A A . 16 HIS NE2 1 1 1 281 1 1 16 HIS O O 23.986 7.599 -4.432 1.00 . A A . 16 HIS O 1 1 1 282 1 1 17 ILE C C 22.064 6.211 -5.943 1.00 . A A . 17 ILE C 1 1 1 283 1 1 17 ILE CA C 21.563 6.256 -4.503 1.00 . A A . 17 ILE CA 1 1 1 284 1 1 17 ILE CB C 20.068 5.887 -4.480 1.00 . A A . 17 ILE CB 1 1 1 285 1 1 17 ILE CD1 C 17.794 6.809 -5.154 1.00 . A A . 17 ILE CD1 1 1 1 286 1 1 17 ILE CG1 C 19.281 6.793 -5.429 1.00 . A A . 17 ILE CG1 1 1 1 287 1 1 17 ILE CG2 C 19.520 5.990 -3.064 1.00 . A A . 17 ILE CG2 1 1 1 288 1 1 17 ILE H H 21.052 8.039 -3.484 1.00 . A A . 17 ILE H 1 1 1 289 1 1 17 ILE HA H 22.104 5.523 -3.922 1.00 . A A . 17 ILE HA 1 1 1 290 1 1 17 ILE HB H 19.968 4.863 -4.805 1.00 . A A . 17 ILE HB 1 1 1 291 1 1 17 ILE HD11 H 17.288 7.351 -5.940 1.00 . A A . 17 ILE HD11 1 1 1 292 1 1 17 ILE HD12 H 17.423 5.796 -5.117 1.00 . A A . 17 ILE HD12 1 1 1 293 1 1 17 ILE HD13 H 17.608 7.295 -4.207 1.00 . A A . 17 ILE HD13 1 1 1 294 1 1 17 ILE HG12 H 19.646 7.804 -5.337 1.00 . A A . 17 ILE HG12 1 1 1 295 1 1 17 ILE HG13 H 19.429 6.452 -6.444 1.00 . A A . 17 ILE HG13 1 1 1 296 1 1 17 ILE HG21 H 19.303 7.023 -2.837 1.00 . A A . 17 ILE HG21 1 1 1 297 1 1 17 ILE HG22 H 18.613 5.408 -2.987 1.00 . A A . 17 ILE HG22 1 1 1 298 1 1 17 ILE HG23 H 20.251 5.613 -2.366 1.00 . A A . 17 ILE HG23 1 1 1 299 1 1 17 ILE N N 21.798 7.565 -3.906 1.00 . A A . 17 ILE N 1 1 1 300 1 1 17 ILE O O 22.634 5.212 -6.382 1.00 . A A . 17 ILE O 1 1 1 301 1 1 18 ARG C C 22.858 8.763 -8.370 1.00 . A A . 18 ARG C 1 1 1 302 1 1 18 ARG CA C 22.277 7.386 -8.064 1.00 . A A . 18 ARG CA 1 1 1 303 1 1 18 ARG CB C 21.103 7.096 -9.001 1.00 . A A . 18 ARG CB 1 1 1 304 1 1 18 ARG CD C 20.198 5.641 -10.839 1.00 . A A . 18 ARG CD 1 1 1 305 1 1 18 ARG CG C 21.202 5.751 -9.703 1.00 . A A . 18 ARG CG 1 1 1 306 1 1 18 ARG CZ C 19.365 3.945 -12.413 1.00 . A A . 18 ARG CZ 1 1 1 307 1 1 18 ARG H H 21.387 8.065 -6.268 1.00 . A A . 18 ARG H 1 1 1 308 1 1 18 ARG HA H 23.044 6.642 -8.221 1.00 . A A . 18 ARG HA 1 1 1 309 1 1 18 ARG HB2 H 20.188 7.112 -8.429 1.00 . A A . 18 ARG HB2 1 1 1 310 1 1 18 ARG HB3 H 21.061 7.868 -9.754 1.00 . A A . 18 ARG HB3 1 1 1 311 1 1 18 ARG HD2 H 19.217 5.888 -10.461 1.00 . A A . 18 ARG HD2 1 1 1 312 1 1 18 ARG HD3 H 20.472 6.343 -11.613 1.00 . A A . 18 ARG HD3 1 1 1 313 1 1 18 ARG HE H 20.760 3.624 -11.024 1.00 . A A . 18 ARG HE 1 1 1 314 1 1 18 ARG HG2 H 22.198 5.637 -10.105 1.00 . A A . 18 ARG HG2 1 1 1 315 1 1 18 ARG HG3 H 21.009 4.967 -8.986 1.00 . A A . 18 ARG HG3 1 1 1 316 1 1 18 ARG HH11 H 18.524 5.772 -12.607 1.00 . A A . 18 ARG HH11 1 1 1 317 1 1 18 ARG HH12 H 17.946 4.567 -13.711 1.00 . A A . 18 ARG HH12 1 1 1 318 1 1 18 ARG HH21 H 20.008 2.030 -12.471 1.00 . A A . 18 ARG HH21 1 1 1 319 1 1 18 ARG HH22 H 18.790 2.439 -13.632 1.00 . A A . 18 ARG HH22 1 1 1 320 1 1 18 ARG N N 21.847 7.300 -6.673 1.00 . A A . 18 ARG N 1 1 1 321 1 1 18 ARG NE N 20.161 4.297 -11.409 1.00 . A A . 18 ARG NE 1 1 1 322 1 1 18 ARG NH1 N 18.544 4.834 -12.954 1.00 . A A . 18 ARG NH1 1 1 1 323 1 1 18 ARG NH2 N 19.390 2.703 -12.877 1.00 . A A . 18 ARG NH2 1 1 1 324 1 1 18 ARG O O 23.377 9.000 -9.461 1.00 . A A . 18 ARG O 1 1 2 325 1 1 1 PHE C C 4.662 -0.002 -3.101 1.00 . A A . 1 PHE C 1 1 2 326 1 1 1 PHE CA C 5.038 -0.634 -4.438 1.00 . A A . 1 PHE CA 1 1 2 327 1 1 1 PHE CB C 5.337 -2.122 -4.246 1.00 . A A . 1 PHE CB 1 1 2 328 1 1 1 PHE CD1 C 4.333 -3.574 -6.029 1.00 . A A . 1 PHE CD1 1 1 2 329 1 1 1 PHE CD2 C 3.148 -3.319 -3.975 1.00 . A A . 1 PHE CD2 1 1 2 330 1 1 1 PHE CE1 C 3.335 -4.404 -6.505 1.00 . A A . 1 PHE CE1 1 1 2 331 1 1 1 PHE CE2 C 2.148 -4.149 -4.446 1.00 . A A . 1 PHE CE2 1 1 2 332 1 1 1 PHE CG C 4.251 -3.023 -4.760 1.00 . A A . 1 PHE CG 1 1 2 333 1 1 1 PHE CZ C 2.241 -4.691 -5.713 1.00 . A A . 1 PHE CZ 1 1 2 334 1 1 1 PHE H1 H 6.159 1.013 -5.156 1.00 . A A . 1 PHE H1 1 1 2 335 1 1 1 PHE HA H 4.208 -0.528 -5.119 1.00 . A A . 1 PHE HA 1 1 2 336 1 1 1 PHE HB2 H 6.248 -2.370 -4.769 1.00 . A A . 1 PHE HB2 1 1 2 337 1 1 1 PHE HB3 H 5.465 -2.323 -3.193 1.00 . A A . 1 PHE HB3 1 1 2 338 1 1 1 PHE HD1 H 5.188 -3.349 -6.650 1.00 . A A . 1 PHE HD1 1 1 2 339 1 1 1 PHE HD2 H 3.074 -2.896 -2.984 1.00 . A A . 1 PHE HD2 1 1 2 340 1 1 1 PHE HE1 H 3.411 -4.825 -7.497 1.00 . A A . 1 PHE HE1 1 1 2 341 1 1 1 PHE HE2 H 1.294 -4.372 -3.825 1.00 . A A . 1 PHE HE2 1 1 2 342 1 1 1 PHE HZ H 1.461 -5.339 -6.083 1.00 . A A . 1 PHE HZ 1 1 2 343 1 1 1 PHE N N 6.188 0.041 -5.027 1.00 . A A . 1 PHE N 1 1 2 344 1 1 1 PHE O O 3.514 0.389 -2.887 1.00 . A A . 1 PHE O 1 1 2 345 1 1 2 LEU C C 5.568 2.195 -0.929 1.00 . A A . 2 LEU C 1 1 2 346 1 1 2 LEU CA C 5.410 0.678 -0.887 1.00 . A A . 2 LEU CA 1 1 2 347 1 1 2 LEU CB C 6.382 0.081 0.132 1.00 . A A . 2 LEU CB 1 1 2 348 1 1 2 LEU CD1 C 5.760 -2.341 0.310 1.00 . A A . 2 LEU CD1 1 1 2 349 1 1 2 LEU CD2 C 6.644 -1.130 2.312 1.00 . A A . 2 LEU CD2 1 1 2 350 1 1 2 LEU CG C 5.814 -1.009 1.042 1.00 . A A . 2 LEU CG 1 1 2 351 1 1 2 LEU H H 6.531 -0.235 -2.432 1.00 . A A . 2 LEU H 1 1 2 352 1 1 2 LEU HA H 4.399 0.442 -0.590 1.00 . A A . 2 LEU HA 1 1 2 353 1 1 2 LEU HB2 H 7.212 -0.343 -0.412 1.00 . A A . 2 LEU HB2 1 1 2 354 1 1 2 LEU HB3 H 6.738 0.885 0.760 1.00 . A A . 2 LEU HB3 1 1 2 355 1 1 2 LEU HD11 H 5.024 -2.289 -0.478 1.00 . A A . 2 LEU HD11 1 1 2 356 1 1 2 LEU HD12 H 5.489 -3.123 1.004 1.00 . A A . 2 LEU HD12 1 1 2 357 1 1 2 LEU HD13 H 6.729 -2.558 -0.115 1.00 . A A . 2 LEU HD13 1 1 2 358 1 1 2 LEU HD21 H 7.288 -0.267 2.403 1.00 . A A . 2 LEU HD21 1 1 2 359 1 1 2 LEU HD22 H 7.247 -2.025 2.264 1.00 . A A . 2 LEU HD22 1 1 2 360 1 1 2 LEU HD23 H 5.988 -1.182 3.167 1.00 . A A . 2 LEU HD23 1 1 2 361 1 1 2 LEU HG H 4.805 -0.743 1.325 1.00 . A A . 2 LEU HG 1 1 2 362 1 1 2 LEU N N 5.637 0.094 -2.204 1.00 . A A . 2 LEU N 1 1 2 363 1 1 2 LEU O O 6.179 2.755 -1.840 1.00 . A A . 2 LEU O 1 1 2 364 1 1 3 PRO C C 6.483 4.831 0.502 1.00 . A A . 3 PRO C 1 1 2 365 1 1 3 PRO CA C 5.076 4.337 0.184 1.00 . A A . 3 PRO CA 1 1 2 366 1 1 3 PRO CB C 4.123 4.656 1.339 1.00 . A A . 3 PRO CB 1 1 2 367 1 1 3 PRO CD C 4.265 2.274 1.201 1.00 . A A . 3 PRO CD 1 1 2 368 1 1 3 PRO CG C 4.101 3.416 2.165 1.00 . A A . 3 PRO CG 1 1 2 369 1 1 3 PRO HA H 4.723 4.815 -0.718 1.00 . A A . 3 PRO HA 1 1 2 370 1 1 3 PRO HB2 H 4.503 5.499 1.900 1.00 . A A . 3 PRO HB2 1 1 2 371 1 1 3 PRO HB3 H 3.144 4.889 0.949 1.00 . A A . 3 PRO HB3 1 1 2 372 1 1 3 PRO HD2 H 4.833 1.476 1.655 1.00 . A A . 3 PRO HD2 1 1 2 373 1 1 3 PRO HD3 H 3.301 1.915 0.873 1.00 . A A . 3 PRO HD3 1 1 2 374 1 1 3 PRO HG2 H 4.916 3.431 2.872 1.00 . A A . 3 PRO HG2 1 1 2 375 1 1 3 PRO HG3 H 3.155 3.337 2.681 1.00 . A A . 3 PRO HG3 1 1 2 376 1 1 3 PRO N N 5.008 2.877 0.081 1.00 . A A . 3 PRO N 1 1 2 377 1 1 3 PRO O O 7.440 4.057 0.496 1.00 . A A . 3 PRO O 1 1 2 378 1 1 4 LYS C C 7.967 7.091 2.580 1.00 . A A . 4 LYS C 1 1 2 379 1 1 4 LYS CA C 7.892 6.724 1.101 1.00 . A A . 4 LYS CA 1 1 2 380 1 1 4 LYS CB C 8.129 7.968 0.243 1.00 . A A . 4 LYS CB 1 1 2 381 1 1 4 LYS CD C 7.127 9.869 -1.059 1.00 . A A . 4 LYS CD 1 1 2 382 1 1 4 LYS CE C 6.753 11.210 -0.446 1.00 . A A . 4 LYS CE 1 1 2 383 1 1 4 LYS CG C 6.856 8.723 -0.098 1.00 . A A . 4 LYS CG 1 1 2 384 1 1 4 LYS H H 5.802 6.692 0.767 1.00 . A A . 4 LYS H 1 1 2 385 1 1 4 LYS HA H 8.659 5.996 0.884 1.00 . A A . 4 LYS HA 1 1 2 386 1 1 4 LYS HB2 H 8.787 8.638 0.776 1.00 . A A . 4 LYS HB2 1 1 2 387 1 1 4 LYS HB3 H 8.604 7.669 -0.680 1.00 . A A . 4 LYS HB3 1 1 2 388 1 1 4 LYS HD2 H 8.178 9.879 -1.305 1.00 . A A . 4 LYS HD2 1 1 2 389 1 1 4 LYS HD3 H 6.546 9.719 -1.958 1.00 . A A . 4 LYS HD3 1 1 2 390 1 1 4 LYS HE2 H 5.739 11.449 -0.727 1.00 . A A . 4 LYS HE2 1 1 2 391 1 1 4 LYS HE3 H 6.819 11.130 0.629 1.00 . A A . 4 LYS HE3 1 1 2 392 1 1 4 LYS HG2 H 6.156 8.041 -0.558 1.00 . A A . 4 LYS HG2 1 1 2 393 1 1 4 LYS HG3 H 6.429 9.121 0.811 1.00 . A A . 4 LYS HG3 1 1 2 394 1 1 4 LYS HZ1 H 8.626 12.124 -0.582 1.00 . A A . 4 LYS HZ1 1 1 2 395 1 1 4 LYS HZ2 H 7.334 13.214 -0.527 1.00 . A A . 4 LYS HZ2 1 1 2 396 1 1 4 LYS HZ3 H 7.652 12.351 -1.947 1.00 . A A . 4 LYS HZ3 1 1 2 397 1 1 4 LYS N N 6.602 6.125 0.779 1.00 . A A . 4 LYS N 1 1 2 398 1 1 4 LYS NZ N 7.654 12.301 -0.908 1.00 . A A . 4 LYS NZ 1 1 2 399 1 1 4 LYS O O 8.493 8.144 2.943 1.00 . A A . 4 LYS O 1 1 2 400 1 1 5 LEU C C 8.819 6.932 5.335 1.00 . A A . 5 LEU C 1 1 2 401 1 1 5 LEU CA C 7.450 6.447 4.870 1.00 . A A . 5 LEU CA 1 1 2 402 1 1 5 LEU CB C 7.070 5.166 5.614 1.00 . A A . 5 LEU CB 1 1 2 403 1 1 5 LEU CD1 C 7.787 3.066 6.780 1.00 . A A . 5 LEU CD1 1 1 2 404 1 1 5 LEU CD2 C 8.457 3.465 4.404 1.00 . A A . 5 LEU CD2 1 1 2 405 1 1 5 LEU CG C 8.173 4.116 5.749 1.00 . A A . 5 LEU CG 1 1 2 406 1 1 5 LEU H H 7.036 5.394 3.081 1.00 . A A . 5 LEU H 1 1 2 407 1 1 5 LEU HA H 6.718 7.211 5.087 1.00 . A A . 5 LEU HA 1 1 2 408 1 1 5 LEU HB2 H 6.754 5.443 6.608 1.00 . A A . 5 LEU HB2 1 1 2 409 1 1 5 LEU HB3 H 6.242 4.712 5.088 1.00 . A A . 5 LEU HB3 1 1 2 410 1 1 5 LEU HD11 H 6.833 2.636 6.517 1.00 . A A . 5 LEU HD11 1 1 2 411 1 1 5 LEU HD12 H 7.718 3.527 7.755 1.00 . A A . 5 LEU HD12 1 1 2 412 1 1 5 LEU HD13 H 8.539 2.290 6.802 1.00 . A A . 5 LEU HD13 1 1 2 413 1 1 5 LEU HD21 H 9.373 3.866 3.997 1.00 . A A . 5 LEU HD21 1 1 2 414 1 1 5 LEU HD22 H 7.642 3.670 3.725 1.00 . A A . 5 LEU HD22 1 1 2 415 1 1 5 LEU HD23 H 8.558 2.397 4.534 1.00 . A A . 5 LEU HD23 1 1 2 416 1 1 5 LEU HG H 9.080 4.597 6.087 1.00 . A A . 5 LEU HG 1 1 2 417 1 1 5 LEU N N 7.441 6.215 3.429 1.00 . A A . 5 LEU N 1 1 2 418 1 1 5 LEU O O 8.922 7.752 6.247 1.00 . A A . 5 LEU O 1 1 2 419 1 1 6 PHE C C 11.972 7.348 3.830 1.00 . A A . 6 PHE C 1 1 2 420 1 1 6 PHE CA C 11.233 6.802 5.048 1.00 . A A . 6 PHE CA 1 1 2 421 1 1 6 PHE CB C 11.990 5.603 5.623 1.00 . A A . 6 PHE CB 1 1 2 422 1 1 6 PHE CD1 C 14.349 5.950 6.403 1.00 . A A . 6 PHE CD1 1 1 2 423 1 1 6 PHE CD2 C 12.576 6.354 7.945 1.00 . A A . 6 PHE CD2 1 1 2 424 1 1 6 PHE CE1 C 15.274 6.294 7.371 1.00 . A A . 6 PHE CE1 1 1 2 425 1 1 6 PHE CE2 C 13.496 6.699 8.917 1.00 . A A . 6 PHE CE2 1 1 2 426 1 1 6 PHE CG C 12.992 5.977 6.678 1.00 . A A . 6 PHE CG 1 1 2 427 1 1 6 PHE CZ C 14.846 6.668 8.630 1.00 . A A . 6 PHE CZ 1 1 2 428 1 1 6 PHE H H 9.723 5.770 3.981 1.00 . A A . 6 PHE H 1 1 2 429 1 1 6 PHE HA H 11.179 7.576 5.798 1.00 . A A . 6 PHE HA 1 1 2 430 1 1 6 PHE HB2 H 11.282 4.919 6.067 1.00 . A A . 6 PHE HB2 1 1 2 431 1 1 6 PHE HB3 H 12.517 5.103 4.825 1.00 . A A . 6 PHE HB3 1 1 2 432 1 1 6 PHE HD1 H 14.685 5.658 5.418 1.00 . A A . 6 PHE HD1 1 1 2 433 1 1 6 PHE HD2 H 11.520 6.378 8.171 1.00 . A A . 6 PHE HD2 1 1 2 434 1 1 6 PHE HE1 H 16.329 6.268 7.143 1.00 . A A . 6 PHE HE1 1 1 2 435 1 1 6 PHE HE2 H 13.159 6.990 9.901 1.00 . A A . 6 PHE HE2 1 1 2 436 1 1 6 PHE HZ H 15.567 6.937 9.388 1.00 . A A . 6 PHE HZ 1 1 2 437 1 1 6 PHE N N 9.869 6.420 4.700 1.00 . A A . 6 PHE N 1 1 2 438 1 1 6 PHE O O 13.065 7.901 3.950 1.00 . A A . 6 PHE O 1 1 2 439 1 1 7 ALA C C 11.928 9.185 1.338 1.00 . A A . 7 ALA C 1 1 2 440 1 1 7 ALA CA C 11.968 7.663 1.417 1.00 . A A . 7 ALA CA 1 1 2 441 1 1 7 ALA CB C 11.257 7.052 0.218 1.00 . A A . 7 ALA CB 1 1 2 442 1 1 7 ALA H H 10.498 6.737 2.626 1.00 . A A . 7 ALA H 1 1 2 443 1 1 7 ALA HA H 12.998 7.338 1.398 1.00 . A A . 7 ALA HA 1 1 2 444 1 1 7 ALA HB1 H 10.668 7.811 -0.276 1.00 . A A . 7 ALA HB1 1 1 2 445 1 1 7 ALA HB2 H 11.989 6.658 -0.471 1.00 . A A . 7 ALA HB2 1 1 2 446 1 1 7 ALA HB3 H 10.610 6.254 0.552 1.00 . A A . 7 ALA HB3 1 1 2 447 1 1 7 ALA N N 11.368 7.186 2.657 1.00 . A A . 7 ALA N 1 1 2 448 1 1 7 ALA O O 12.797 9.809 0.729 1.00 . A A . 7 ALA O 1 1 2 449 1 1 8 LYS C C 11.544 11.859 3.105 1.00 . A A . 8 LYS C 1 1 2 450 1 1 8 LYS CA C 10.759 11.229 1.958 1.00 . A A . 8 LYS CA 1 1 2 451 1 1 8 LYS CB C 9.280 11.605 2.071 1.00 . A A . 8 LYS CB 1 1 2 452 1 1 8 LYS CD C 7.929 12.132 4.122 1.00 . A A . 8 LYS CD 1 1 2 453 1 1 8 LYS CE C 6.680 12.656 3.430 1.00 . A A . 8 LYS CE 1 1 2 454 1 1 8 LYS CG C 8.601 11.040 3.306 1.00 . A A . 8 LYS CG 1 1 2 455 1 1 8 LYS H H 10.251 9.228 2.426 1.00 . A A . 8 LYS H 1 1 2 456 1 1 8 LYS HA H 11.147 11.604 1.023 1.00 . A A . 8 LYS HA 1 1 2 457 1 1 8 LYS HB2 H 9.196 12.682 2.100 1.00 . A A . 8 LYS HB2 1 1 2 458 1 1 8 LYS HB3 H 8.760 11.236 1.199 1.00 . A A . 8 LYS HB3 1 1 2 459 1 1 8 LYS HD2 H 7.652 11.730 5.085 1.00 . A A . 8 LYS HD2 1 1 2 460 1 1 8 LYS HD3 H 8.625 12.948 4.257 1.00 . A A . 8 LYS HD3 1 1 2 461 1 1 8 LYS HE2 H 6.863 13.669 3.105 1.00 . A A . 8 LYS HE2 1 1 2 462 1 1 8 LYS HE3 H 6.472 12.034 2.572 1.00 . A A . 8 LYS HE3 1 1 2 463 1 1 8 LYS HG2 H 7.854 10.324 2.999 1.00 . A A . 8 LYS HG2 1 1 2 464 1 1 8 LYS HG3 H 9.342 10.549 3.920 1.00 . A A . 8 LYS HG3 1 1 2 465 1 1 8 LYS HZ1 H 4.713 12.126 3.890 1.00 . A A . 8 LYS HZ1 1 1 2 466 1 1 8 LYS HZ2 H 5.189 13.617 4.533 1.00 . A A . 8 LYS HZ2 1 1 2 467 1 1 8 LYS HZ3 H 5.740 12.179 5.234 1.00 . A A . 8 LYS HZ3 1 1 2 468 1 1 8 LYS N N 10.913 9.779 1.957 1.00 . A A . 8 LYS N 1 1 2 469 1 1 8 LYS NZ N 5.498 12.644 4.335 1.00 . A A . 8 LYS NZ 1 1 2 470 1 1 8 LYS O O 12.054 12.973 2.982 1.00 . A A . 8 LYS O 1 1 2 471 1 1 9 ILE C C 13.869 11.567 5.159 1.00 . A A . 9 ILE C 1 1 2 472 1 1 9 ILE CA C 12.362 11.626 5.384 1.00 . A A . 9 ILE CA 1 1 2 473 1 1 9 ILE CB C 12.010 10.815 6.645 1.00 . A A . 9 ILE CB 1 1 2 474 1 1 9 ILE CD1 C 14.148 9.721 7.488 1.00 . A A . 9 ILE CD1 1 1 2 475 1 1 9 ILE CG1 C 12.860 9.545 6.714 1.00 . A A . 9 ILE CG1 1 1 2 476 1 1 9 ILE CG2 C 10.529 10.469 6.656 1.00 . A A . 9 ILE CG2 1 1 2 477 1 1 9 ILE H H 11.209 10.258 4.254 1.00 . A A . 9 ILE H 1 1 2 478 1 1 9 ILE HA H 12.073 12.654 5.549 1.00 . A A . 9 ILE HA 1 1 2 479 1 1 9 ILE HB H 12.219 11.427 7.509 1.00 . A A . 9 ILE HB 1 1 2 480 1 1 9 ILE HD11 H 14.013 9.367 8.499 1.00 . A A . 9 ILE HD11 1 1 2 481 1 1 9 ILE HD12 H 14.935 9.157 7.010 1.00 . A A . 9 ILE HD12 1 1 2 482 1 1 9 ILE HD13 H 14.416 10.768 7.507 1.00 . A A . 9 ILE HD13 1 1 2 483 1 1 9 ILE HG12 H 12.290 8.764 7.193 1.00 . A A . 9 ILE HG12 1 1 2 484 1 1 9 ILE HG13 H 13.114 9.236 5.711 1.00 . A A . 9 ILE HG13 1 1 2 485 1 1 9 ILE HG21 H 9.992 11.166 6.030 1.00 . A A . 9 ILE HG21 1 1 2 486 1 1 9 ILE HG22 H 10.390 9.467 6.279 1.00 . A A . 9 ILE HG22 1 1 2 487 1 1 9 ILE HG23 H 10.152 10.529 7.666 1.00 . A A . 9 ILE HG23 1 1 2 488 1 1 9 ILE N N 11.637 11.138 4.217 1.00 . A A . 9 ILE N 1 1 2 489 1 1 9 ILE O O 14.627 12.337 5.751 1.00 . A A . 9 ILE O 1 1 2 490 1 1 10 THR C C 16.157 11.467 2.910 1.00 . A A . 10 THR C 1 1 2 491 1 1 10 THR CA C 15.714 10.490 3.994 1.00 . A A . 10 THR CA 1 1 2 492 1 1 10 THR CB C 16.032 9.054 3.536 1.00 . A A . 10 THR CB 1 1 2 493 1 1 10 THR CG2 C 15.992 8.090 4.712 1.00 . A A . 10 THR CG2 1 1 2 494 1 1 10 THR H H 13.645 10.067 3.858 1.00 . A A . 10 THR H 1 1 2 495 1 1 10 THR HA H 16.274 10.691 4.896 1.00 . A A . 10 THR HA 1 1 2 496 1 1 10 THR HB H 17.026 9.040 3.112 1.00 . A A . 10 THR HB 1 1 2 497 1 1 10 THR HG1 H 14.868 9.385 1.979 1.00 . A A . 10 THR HG1 1 1 2 498 1 1 10 THR HG21 H 16.727 8.386 5.446 1.00 . A A . 10 THR HG21 1 1 2 499 1 1 10 THR HG22 H 16.211 7.091 4.366 1.00 . A A . 10 THR HG22 1 1 2 500 1 1 10 THR HG23 H 15.010 8.110 5.160 1.00 . A A . 10 THR HG23 1 1 2 501 1 1 10 THR N N 14.298 10.650 4.298 1.00 . A A . 10 THR N 1 1 2 502 1 1 10 THR O O 15.637 11.450 1.795 1.00 . A A . 10 THR O 1 1 2 503 1 1 10 THR OG1 O 15.092 8.638 2.539 1.00 . A A . 10 THR OG1 1 1 2 504 1 1 11 LYS C C 19.133 13.107 2.075 1.00 . A A . 11 LYS C 1 1 2 505 1 1 11 LYS CA C 17.637 13.301 2.300 1.00 . A A . 11 LYS CA 1 1 2 506 1 1 11 LYS CB C 17.367 14.718 2.809 1.00 . A A . 11 LYS CB 1 1 2 507 1 1 11 LYS CD C 19.176 14.941 4.537 1.00 . A A . 11 LYS CD 1 1 2 508 1 1 11 LYS CE C 19.508 15.713 5.805 1.00 . A A . 11 LYS CE 1 1 2 509 1 1 11 LYS CG C 17.678 14.905 4.284 1.00 . A A . 11 LYS CG 1 1 2 510 1 1 11 LYS H H 17.497 12.282 4.150 1.00 . A A . 11 LYS H 1 1 2 511 1 1 11 LYS HA H 17.123 13.160 1.361 1.00 . A A . 11 LYS HA 1 1 2 512 1 1 11 LYS HB2 H 17.971 15.412 2.244 1.00 . A A . 11 LYS HB2 1 1 2 513 1 1 11 LYS HB3 H 16.323 14.951 2.651 1.00 . A A . 11 LYS HB3 1 1 2 514 1 1 11 LYS HD2 H 19.540 13.930 4.640 1.00 . A A . 11 LYS HD2 1 1 2 515 1 1 11 LYS HD3 H 19.663 15.417 3.698 1.00 . A A . 11 LYS HD3 1 1 2 516 1 1 11 LYS HE2 H 20.031 16.618 5.533 1.00 . A A . 11 LYS HE2 1 1 2 517 1 1 11 LYS HE3 H 18.587 15.968 6.308 1.00 . A A . 11 LYS HE3 1 1 2 518 1 1 11 LYS HG2 H 17.245 15.835 4.620 1.00 . A A . 11 LYS HG2 1 1 2 519 1 1 11 LYS HG3 H 17.248 14.084 4.840 1.00 . A A . 11 LYS HG3 1 1 2 520 1 1 11 LYS HZ1 H 20.964 14.265 6.189 1.00 . A A . 11 LYS HZ1 1 1 2 521 1 1 11 LYS HZ2 H 19.768 14.367 7.380 1.00 . A A . 11 LYS HZ2 1 1 2 522 1 1 11 LYS HZ3 H 20.971 15.552 7.287 1.00 . A A . 11 LYS HZ3 1 1 2 523 1 1 11 LYS N N 17.122 12.317 3.245 1.00 . A A . 11 LYS N 1 1 2 524 1 1 11 LYS NZ N 20.363 14.919 6.730 1.00 . A A . 11 LYS NZ 1 1 2 525 1 1 11 LYS O O 19.821 14.007 1.592 1.00 . A A . 11 LYS O 1 1 2 526 1 1 12 LYS C C 21.233 10.418 1.332 1.00 . A A . 12 LYS C 1 1 2 527 1 1 12 LYS CA C 21.046 11.613 2.262 1.00 . A A . 12 LYS CA 1 1 2 528 1 1 12 LYS CB C 21.688 11.321 3.620 1.00 . A A . 12 LYS CB 1 1 2 529 1 1 12 LYS CD C 21.379 10.045 5.761 1.00 . A A . 12 LYS CD 1 1 2 530 1 1 12 LYS CE C 20.677 10.207 7.101 1.00 . A A . 12 LYS CE 1 1 2 531 1 1 12 LYS CG C 20.697 10.857 4.673 1.00 . A A . 12 LYS CG 1 1 2 532 1 1 12 LYS H H 19.034 11.249 2.807 1.00 . A A . 12 LYS H 1 1 2 533 1 1 12 LYS HA H 21.528 12.474 1.823 1.00 . A A . 12 LYS HA 1 1 2 534 1 1 12 LYS HB2 H 22.435 10.552 3.494 1.00 . A A . 12 LYS HB2 1 1 2 535 1 1 12 LYS HB3 H 22.167 12.221 3.979 1.00 . A A . 12 LYS HB3 1 1 2 536 1 1 12 LYS HD2 H 21.363 9.002 5.484 1.00 . A A . 12 LYS HD2 1 1 2 537 1 1 12 LYS HD3 H 22.403 10.378 5.858 1.00 . A A . 12 LYS HD3 1 1 2 538 1 1 12 LYS HE2 H 21.351 10.695 7.789 1.00 . A A . 12 LYS HE2 1 1 2 539 1 1 12 LYS HE3 H 19.800 10.821 6.961 1.00 . A A . 12 LYS HE3 1 1 2 540 1 1 12 LYS HG2 H 20.231 11.722 5.123 1.00 . A A . 12 LYS HG2 1 1 2 541 1 1 12 LYS HG3 H 19.942 10.245 4.200 1.00 . A A . 12 LYS HG3 1 1 2 542 1 1 12 LYS HZ1 H 20.815 8.128 7.239 1.00 . A A . 12 LYS HZ1 1 1 2 543 1 1 12 LYS HZ2 H 19.255 8.729 7.493 1.00 . A A . 12 LYS HZ2 1 1 2 544 1 1 12 LYS HZ3 H 20.429 8.887 8.701 1.00 . A A . 12 LYS HZ3 1 1 2 545 1 1 12 LYS N N 19.632 11.927 2.427 1.00 . A A . 12 LYS N 1 1 2 546 1 1 12 LYS NZ N 20.265 8.896 7.674 1.00 . A A . 12 LYS NZ 1 1 2 547 1 1 12 LYS O O 21.578 10.578 0.162 1.00 . A A . 12 LYS O 1 1 2 548 1 1 13 ASN C C 20.363 8.096 -0.229 1.00 . A A . 13 ASN C 1 1 2 549 1 1 13 ASN CA C 21.144 7.999 1.078 1.00 . A A . 13 ASN CA 1 1 2 550 1 1 13 ASN CB C 20.661 6.792 1.885 1.00 . A A . 13 ASN CB 1 1 2 551 1 1 13 ASN CG C 21.781 5.816 2.192 1.00 . A A . 13 ASN CG 1 1 2 552 1 1 13 ASN H H 20.730 9.157 2.801 1.00 . A A . 13 ASN H 1 1 2 553 1 1 13 ASN HA H 22.192 7.872 0.850 1.00 . A A . 13 ASN HA 1 1 2 554 1 1 13 ASN HB2 H 20.244 7.136 2.821 1.00 . A A . 13 ASN HB2 1 1 2 555 1 1 13 ASN HB3 H 19.899 6.273 1.325 1.00 . A A . 13 ASN HB3 1 1 2 556 1 1 13 ASN HD21 H 22.280 6.858 3.810 1.00 . A A . 13 ASN HD21 1 1 2 557 1 1 13 ASN HD22 H 23.236 5.453 3.497 1.00 . A A . 13 ASN HD22 1 1 2 558 1 1 13 ASN N N 21.002 9.221 1.861 1.00 . A A . 13 ASN N 1 1 2 559 1 1 13 ASN ND2 N 22.505 6.068 3.276 1.00 . A A . 13 ASN ND2 1 1 2 560 1 1 13 ASN O O 20.723 7.472 -1.227 1.00 . A A . 13 ASN O 1 1 2 561 1 1 13 ASN OD1 O 21.992 4.847 1.462 1.00 . A A . 13 ASN OD1 1 1 2 562 1 1 14 MET C C 19.276 9.643 -2.552 1.00 . A A . 14 MET C 1 1 2 563 1 1 14 MET CA C 18.462 9.064 -1.399 1.00 . A A . 14 MET CA 1 1 2 564 1 1 14 MET CB C 17.279 9.982 -1.084 1.00 . A A . 14 MET CB 1 1 2 565 1 1 14 MET CE C 15.079 7.494 -1.884 1.00 . A A . 14 MET CE 1 1 2 566 1 1 14 MET CG C 16.219 10.003 -2.173 1.00 . A A . 14 MET CG 1 1 2 567 1 1 14 MET H H 19.056 9.355 0.611 1.00 . A A . 14 MET H 1 1 2 568 1 1 14 MET HA H 18.086 8.095 -1.691 1.00 . A A . 14 MET HA 1 1 2 569 1 1 14 MET HB2 H 16.815 9.649 -0.167 1.00 . A A . 14 MET HB2 1 1 2 570 1 1 14 MET HB3 H 17.645 10.988 -0.948 1.00 . A A . 14 MET HB3 1 1 2 571 1 1 14 MET HE1 H 15.621 7.368 -2.809 1.00 . A A . 14 MET HE1 1 1 2 572 1 1 14 MET HE2 H 15.689 7.156 -1.060 1.00 . A A . 14 MET HE2 1 1 2 573 1 1 14 MET HE3 H 14.167 6.915 -1.919 1.00 . A A . 14 MET HE3 1 1 2 574 1 1 14 MET HG2 H 16.015 11.030 -2.439 1.00 . A A . 14 MET HG2 1 1 2 575 1 1 14 MET HG3 H 16.600 9.479 -3.037 1.00 . A A . 14 MET HG3 1 1 2 576 1 1 14 MET N N 19.293 8.883 -0.215 1.00 . A A . 14 MET N 1 1 2 577 1 1 14 MET O O 19.293 9.090 -3.651 1.00 . A A . 14 MET O 1 1 2 578 1 1 14 MET SD S 14.677 9.225 -1.657 1.00 . A A . 14 MET SD 1 1 2 579 1 1 15 ALA C C 22.075 10.657 -3.527 1.00 . A A . 15 ALA C 1 1 2 580 1 1 15 ALA CA C 20.767 11.411 -3.308 1.00 . A A . 15 ALA CA 1 1 2 581 1 1 15 ALA CB C 21.047 12.853 -2.913 1.00 . A A . 15 ALA CB 1 1 2 582 1 1 15 ALA H H 19.896 11.152 -1.396 1.00 . A A . 15 ALA H 1 1 2 583 1 1 15 ALA HA H 20.208 11.418 -4.232 1.00 . A A . 15 ALA HA 1 1 2 584 1 1 15 ALA HB1 H 21.718 13.299 -3.634 1.00 . A A . 15 ALA HB1 1 1 2 585 1 1 15 ALA HB2 H 20.121 13.407 -2.893 1.00 . A A . 15 ALA HB2 1 1 2 586 1 1 15 ALA HB3 H 21.503 12.877 -1.934 1.00 . A A . 15 ALA HB3 1 1 2 587 1 1 15 ALA N N 19.950 10.759 -2.292 1.00 . A A . 15 ALA N 1 1 2 588 1 1 15 ALA O O 22.902 11.054 -4.348 1.00 . A A . 15 ALA O 1 1 2 589 1 1 16 HIS C C 23.185 7.471 -3.672 1.00 . A A . 16 HIS C 1 1 2 590 1 1 16 HIS CA C 23.464 8.758 -2.901 1.00 . A A . 16 HIS CA 1 1 2 591 1 1 16 HIS CB C 24.014 8.427 -1.514 1.00 . A A . 16 HIS CB 1 1 2 592 1 1 16 HIS CD2 C 26.544 8.508 -0.949 1.00 . A A . 16 HIS CD2 1 1 2 593 1 1 16 HIS CE1 C 26.799 10.686 -0.930 1.00 . A A . 16 HIS CE1 1 1 2 594 1 1 16 HIS CG C 25.341 9.061 -1.228 1.00 . A A . 16 HIS CG 1 1 2 595 1 1 16 HIS H H 21.561 9.302 -2.150 1.00 . A A . 16 HIS H 1 1 2 596 1 1 16 HIS HA H 24.199 9.334 -3.442 1.00 . A A . 16 HIS HA 1 1 2 597 1 1 16 HIS HB2 H 23.315 8.770 -0.765 1.00 . A A . 16 HIS HB2 1 1 2 598 1 1 16 HIS HB3 H 24.131 7.356 -1.426 1.00 . A A . 16 HIS HB3 1 1 2 599 1 1 16 HIS HD1 H 24.846 11.104 -1.374 1.00 . A A . 16 HIS HD1 1 1 2 600 1 1 16 HIS HD2 H 26.765 7.452 -0.882 1.00 . A A . 16 HIS HD2 1 1 2 601 1 1 16 HIS HE1 H 27.239 11.668 -0.848 1.00 . A A . 16 HIS HE1 1 1 2 602 1 1 16 HIS N N 22.256 9.568 -2.787 1.00 . A A . 16 HIS N 1 1 2 603 1 1 16 HIS ND1 N 25.533 10.426 -1.208 1.00 . A A . 16 HIS ND1 1 1 2 604 1 1 16 HIS NE2 N 27.433 9.539 -0.768 1.00 . A A . 16 HIS NE2 1 1 2 605 1 1 16 HIS O O 24.106 6.814 -4.156 1.00 . A A . 16 HIS O 1 1 2 606 1 1 17 ILE C C 22.106 5.874 -5.894 1.00 . A A . 17 ILE C 1 1 2 607 1 1 17 ILE CA C 21.509 5.909 -4.491 1.00 . A A . 17 ILE CA 1 1 2 608 1 1 17 ILE CB C 19.976 5.798 -4.595 1.00 . A A . 17 ILE CB 1 1 2 609 1 1 17 ILE CD1 C 17.945 7.135 -5.346 1.00 . A A . 17 ILE CD1 1 1 2 610 1 1 17 ILE CG1 C 19.426 6.885 -5.521 1.00 . A A . 17 ILE CG1 1 1 2 611 1 1 17 ILE CG2 C 19.343 5.900 -3.216 1.00 . A A . 17 ILE CG2 1 1 2 612 1 1 17 ILE H H 21.219 7.682 -3.372 1.00 . A A . 17 ILE H 1 1 2 613 1 1 17 ILE HA H 21.875 5.059 -3.934 1.00 . A A . 17 ILE HA 1 1 2 614 1 1 17 ILE HB H 19.735 4.829 -5.005 1.00 . A A . 17 ILE HB 1 1 2 615 1 1 17 ILE HD11 H 17.598 7.805 -6.119 1.00 . A A . 17 ILE HD11 1 1 2 616 1 1 17 ILE HD12 H 17.410 6.200 -5.412 1.00 . A A . 17 ILE HD12 1 1 2 617 1 1 17 ILE HD13 H 17.768 7.583 -4.378 1.00 . A A . 17 ILE HD13 1 1 2 618 1 1 17 ILE HG12 H 19.944 7.811 -5.327 1.00 . A A . 17 ILE HG12 1 1 2 619 1 1 17 ILE HG13 H 19.594 6.591 -6.548 1.00 . A A . 17 ILE HG13 1 1 2 620 1 1 17 ILE HG21 H 19.948 5.361 -2.501 1.00 . A A . 17 ILE HG21 1 1 2 621 1 1 17 ILE HG22 H 19.282 6.938 -2.924 1.00 . A A . 17 ILE HG22 1 1 2 622 1 1 17 ILE HG23 H 18.352 5.474 -3.242 1.00 . A A . 17 ILE HG23 1 1 2 623 1 1 17 ILE N N 21.908 7.117 -3.780 1.00 . A A . 17 ILE N 1 1 2 624 1 1 17 ILE O O 22.537 4.824 -6.370 1.00 . A A . 17 ILE O 1 1 2 625 1 1 18 ARG C C 23.844 8.112 -7.939 1.00 . A A . 18 ARG C 1 1 2 626 1 1 18 ARG CA C 22.676 7.132 -7.898 1.00 . A A . 18 ARG CA 1 1 2 627 1 1 18 ARG CB C 21.589 7.576 -8.878 1.00 . A A . 18 ARG CB 1 1 2 628 1 1 18 ARG CD C 21.346 7.104 -11.335 1.00 . A A . 18 ARG CD 1 1 2 629 1 1 18 ARG CG C 22.113 7.877 -10.273 1.00 . A A . 18 ARG CG 1 1 2 630 1 1 18 ARG CZ C 19.301 7.340 -12.679 1.00 . A A . 18 ARG CZ 1 1 2 631 1 1 18 ARG H H 21.772 7.833 -6.117 1.00 . A A . 18 ARG H 1 1 2 632 1 1 18 ARG HA H 23.031 6.154 -8.187 1.00 . A A . 18 ARG HA 1 1 2 633 1 1 18 ARG HB2 H 20.849 6.793 -8.957 1.00 . A A . 18 ARG HB2 1 1 2 634 1 1 18 ARG HB3 H 21.117 8.468 -8.494 1.00 . A A . 18 ARG HB3 1 1 2 635 1 1 18 ARG HD2 H 21.989 6.960 -12.191 1.00 . A A . 18 ARG HD2 1 1 2 636 1 1 18 ARG HD3 H 21.067 6.143 -10.930 1.00 . A A . 18 ARG HD3 1 1 2 637 1 1 18 ARG HE H 19.947 8.672 -11.342 1.00 . A A . 18 ARG HE 1 1 2 638 1 1 18 ARG HG2 H 22.007 8.934 -10.467 1.00 . A A . 18 ARG HG2 1 1 2 639 1 1 18 ARG HG3 H 23.156 7.602 -10.322 1.00 . A A . 18 ARG HG3 1 1 2 640 1 1 18 ARG HH11 H 20.346 5.644 -13.012 1.00 . A A . 18 ARG HH11 1 1 2 641 1 1 18 ARG HH12 H 18.902 5.823 -13.953 1.00 . A A . 18 ARG HH12 1 1 2 642 1 1 18 ARG HH21 H 18.044 8.919 -12.574 1.00 . A A . 18 ARG HH21 1 1 2 643 1 1 18 ARG HH22 H 17.594 7.687 -13.704 1.00 . A A . 18 ARG HH22 1 1 2 644 1 1 18 ARG N N 22.130 7.030 -6.550 1.00 . A A . 18 ARG N 1 1 2 645 1 1 18 ARG NE N 20.140 7.808 -11.761 1.00 . A A . 18 ARG NE 1 1 2 646 1 1 18 ARG NH1 N 19.536 6.173 -13.263 1.00 . A A . 18 ARG NH1 1 1 2 647 1 1 18 ARG NH2 N 18.224 8.039 -13.013 1.00 . A A . 18 ARG NH2 1 1 2 648 1 1 18 ARG O O 24.976 7.758 -7.607 1.00 . A A . 18 ARG O 1 1 3 649 1 1 1 PHE C C 3.202 1.047 -1.198 1.00 . A A . 1 PHE C 1 1 3 650 1 1 1 PHE CA C 2.093 0.000 -1.242 1.00 . A A . 1 PHE CA 1 1 3 651 1 1 1 PHE CB C 1.171 0.266 -2.433 1.00 . A A . 1 PHE CB 1 1 3 652 1 1 1 PHE CD1 C 0.857 2.708 -2.921 1.00 . A A . 1 PHE CD1 1 1 3 653 1 1 1 PHE CD2 C -0.789 1.595 -1.604 1.00 . A A . 1 PHE CD2 1 1 3 654 1 1 1 PHE CE1 C 0.148 3.889 -2.817 1.00 . A A . 1 PHE CE1 1 1 3 655 1 1 1 PHE CE2 C -1.504 2.773 -1.496 1.00 . A A . 1 PHE CE2 1 1 3 656 1 1 1 PHE CG C 0.398 1.549 -2.317 1.00 . A A . 1 PHE CG 1 1 3 657 1 1 1 PHE CZ C -1.034 3.922 -2.103 1.00 . A A . 1 PHE CZ 1 1 3 658 1 1 1 PHE H1 H 1.807 0.001 0.856 1.00 . A A . 1 PHE H1 1 1 3 659 1 1 1 PHE HA H 2.540 -0.976 -1.355 1.00 . A A . 1 PHE HA 1 1 3 660 1 1 1 PHE HB2 H 1.764 0.318 -3.334 1.00 . A A . 1 PHE HB2 1 1 3 661 1 1 1 PHE HB3 H 0.463 -0.544 -2.519 1.00 . A A . 1 PHE HB3 1 1 3 662 1 1 1 PHE HD1 H 1.782 2.683 -3.480 1.00 . A A . 1 PHE HD1 1 1 3 663 1 1 1 PHE HD2 H -1.158 0.698 -1.128 1.00 . A A . 1 PHE HD2 1 1 3 664 1 1 1 PHE HE1 H 0.518 4.785 -3.292 1.00 . A A . 1 PHE HE1 1 1 3 665 1 1 1 PHE HE2 H -2.427 2.796 -0.937 1.00 . A A . 1 PHE HE2 1 1 3 666 1 1 1 PHE HZ H -1.590 4.844 -2.020 1.00 . A A . 1 PHE HZ 1 1 3 667 1 1 1 PHE N N 1.329 0.000 0.000 1.00 . A A . 1 PHE N 1 1 3 668 1 1 1 PHE O O 3.026 2.131 -0.640 1.00 . A A . 1 PHE O 1 1 3 669 1 1 2 LEU C C 5.924 1.993 -0.405 1.00 . A A . 2 LEU C 1 1 3 670 1 1 2 LEU CA C 5.484 1.626 -1.818 1.00 . A A . 2 LEU CA 1 1 3 671 1 1 2 LEU CB C 5.129 2.893 -2.599 1.00 . A A . 2 LEU CB 1 1 3 672 1 1 2 LEU CD1 C 4.375 2.086 -4.849 1.00 . A A . 2 LEU CD1 1 1 3 673 1 1 2 LEU CD2 C 5.549 4.284 -4.642 1.00 . A A . 2 LEU CD2 1 1 3 674 1 1 2 LEU CG C 5.440 2.868 -4.096 1.00 . A A . 2 LEU CG 1 1 3 675 1 1 2 LEU H H 4.425 -0.162 -2.217 1.00 . A A . 2 LEU H 1 1 3 676 1 1 2 LEU HA H 6.298 1.122 -2.317 1.00 . A A . 2 LEU HA 1 1 3 677 1 1 2 LEU HB2 H 4.070 3.067 -2.484 1.00 . A A . 2 LEU HB2 1 1 3 678 1 1 2 LEU HB3 H 5.677 3.715 -2.160 1.00 . A A . 2 LEU HB3 1 1 3 679 1 1 2 LEU HD11 H 3.927 1.360 -4.188 1.00 . A A . 2 LEU HD11 1 1 3 680 1 1 2 LEU HD12 H 4.828 1.578 -5.688 1.00 . A A . 2 LEU HD12 1 1 3 681 1 1 2 LEU HD13 H 3.615 2.765 -5.207 1.00 . A A . 2 LEU HD13 1 1 3 682 1 1 2 LEU HD21 H 4.820 4.425 -5.426 1.00 . A A . 2 LEU HD21 1 1 3 683 1 1 2 LEU HD22 H 6.541 4.441 -5.040 1.00 . A A . 2 LEU HD22 1 1 3 684 1 1 2 LEU HD23 H 5.364 4.992 -3.847 1.00 . A A . 2 LEU HD23 1 1 3 685 1 1 2 LEU HG H 6.389 2.374 -4.252 1.00 . A A . 2 LEU HG 1 1 3 686 1 1 2 LEU N N 4.345 0.715 -1.789 1.00 . A A . 2 LEU N 1 1 3 687 1 1 2 LEU O O 5.730 3.116 0.061 1.00 . A A . 2 LEU O 1 1 3 688 1 1 3 PRO C C 8.219 2.157 1.726 1.00 . A A . 3 PRO C 1 1 3 689 1 1 3 PRO CA C 7.016 1.222 1.665 1.00 . A A . 3 PRO CA 1 1 3 690 1 1 3 PRO CB C 7.412 -0.188 2.109 1.00 . A A . 3 PRO CB 1 1 3 691 1 1 3 PRO CD C 6.797 -0.338 -0.196 1.00 . A A . 3 PRO CD 1 1 3 692 1 1 3 PRO CG C 7.720 -0.911 0.843 1.00 . A A . 3 PRO CG 1 1 3 693 1 1 3 PRO HA H 6.236 1.598 2.311 1.00 . A A . 3 PRO HA 1 1 3 694 1 1 3 PRO HB2 H 8.277 -0.136 2.756 1.00 . A A . 3 PRO HB2 1 1 3 695 1 1 3 PRO HB3 H 6.590 -0.648 2.636 1.00 . A A . 3 PRO HB3 1 1 3 696 1 1 3 PRO HD2 H 7.282 -0.313 -1.160 1.00 . A A . 3 PRO HD2 1 1 3 697 1 1 3 PRO HD3 H 5.883 -0.913 -0.247 1.00 . A A . 3 PRO HD3 1 1 3 698 1 1 3 PRO HG2 H 8.749 -0.741 0.565 1.00 . A A . 3 PRO HG2 1 1 3 699 1 1 3 PRO HG3 H 7.534 -1.967 0.969 1.00 . A A . 3 PRO HG3 1 1 3 700 1 1 3 PRO N N 6.533 1.024 0.296 1.00 . A A . 3 PRO N 1 1 3 701 1 1 3 PRO O O 9.364 1.720 1.616 1.00 . A A . 3 PRO O 1 1 3 702 1 1 4 LYS C C 8.998 5.149 3.335 1.00 . A A . 4 LYS C 1 1 3 703 1 1 4 LYS CA C 9.012 4.445 1.981 1.00 . A A . 4 LYS CA 1 1 3 704 1 1 4 LYS CB C 8.856 5.473 0.858 1.00 . A A . 4 LYS CB 1 1 3 705 1 1 4 LYS CD C 7.174 6.935 -0.300 1.00 . A A . 4 LYS CD 1 1 3 706 1 1 4 LYS CE C 8.108 7.211 -1.468 1.00 . A A . 4 LYS CE 1 1 3 707 1 1 4 LYS CG C 7.440 5.572 0.317 1.00 . A A . 4 LYS CG 1 1 3 708 1 1 4 LYS H H 7.017 3.734 1.985 1.00 . A A . 4 LYS H 1 1 3 709 1 1 4 LYS HA H 9.956 3.935 1.863 1.00 . A A . 4 LYS HA 1 1 3 710 1 1 4 LYS HB2 H 9.145 6.444 1.233 1.00 . A A . 4 LYS HB2 1 1 3 711 1 1 4 LYS HB3 H 9.512 5.200 0.044 1.00 . A A . 4 LYS HB3 1 1 3 712 1 1 4 LYS HD2 H 6.154 6.967 -0.654 1.00 . A A . 4 LYS HD2 1 1 3 713 1 1 4 LYS HD3 H 7.319 7.696 0.454 1.00 . A A . 4 LYS HD3 1 1 3 714 1 1 4 LYS HE2 H 9.087 7.447 -1.080 1.00 . A A . 4 LYS HE2 1 1 3 715 1 1 4 LYS HE3 H 8.167 6.324 -2.081 1.00 . A A . 4 LYS HE3 1 1 3 716 1 1 4 LYS HG2 H 7.299 4.814 -0.439 1.00 . A A . 4 LYS HG2 1 1 3 717 1 1 4 LYS HG3 H 6.743 5.410 1.126 1.00 . A A . 4 LYS HG3 1 1 3 718 1 1 4 LYS HZ1 H 7.211 9.083 -1.699 1.00 . A A . 4 LYS HZ1 1 1 3 719 1 1 4 LYS HZ2 H 6.912 8.018 -2.978 1.00 . A A . 4 LYS HZ2 1 1 3 720 1 1 4 LYS HZ3 H 8.425 8.760 -2.833 1.00 . A A . 4 LYS HZ3 1 1 3 721 1 1 4 LYS N N 7.951 3.447 1.904 1.00 . A A . 4 LYS N 1 1 3 722 1 1 4 LYS NZ N 7.631 8.348 -2.303 1.00 . A A . 4 LYS NZ 1 1 3 723 1 1 4 LYS O O 9.274 6.346 3.426 1.00 . A A . 4 LYS O 1 1 3 724 1 1 5 LEU C C 9.832 5.852 5.995 1.00 . A A . 5 LEU C 1 1 3 725 1 1 5 LEU CA C 8.629 4.951 5.733 1.00 . A A . 5 LEU CA 1 1 3 726 1 1 5 LEU CB C 8.588 3.823 6.765 1.00 . A A . 5 LEU CB 1 1 3 727 1 1 5 LEU CD1 C 6.976 2.333 7.976 1.00 . A A . 5 LEU CD1 1 1 3 728 1 1 5 LEU CD2 C 7.578 4.563 8.936 1.00 . A A . 5 LEU CD2 1 1 3 729 1 1 5 LEU CG C 7.347 3.773 7.656 1.00 . A A . 5 LEU CG 1 1 3 730 1 1 5 LEU H H 8.467 3.451 4.248 1.00 . A A . 5 LEU H 1 1 3 731 1 1 5 LEU HA H 7.728 5.539 5.818 1.00 . A A . 5 LEU HA 1 1 3 732 1 1 5 LEU HB2 H 8.651 2.886 6.233 1.00 . A A . 5 LEU HB2 1 1 3 733 1 1 5 LEU HB3 H 9.453 3.930 7.405 1.00 . A A . 5 LEU HB3 1 1 3 734 1 1 5 LEU HD11 H 6.627 2.269 8.995 1.00 . A A . 5 LEU HD11 1 1 3 735 1 1 5 LEU HD12 H 7.844 1.702 7.852 1.00 . A A . 5 LEU HD12 1 1 3 736 1 1 5 LEU HD13 H 6.195 2.006 7.306 1.00 . A A . 5 LEU HD13 1 1 3 737 1 1 5 LEU HD21 H 8.444 5.198 8.816 1.00 . A A . 5 LEU HD21 1 1 3 738 1 1 5 LEU HD22 H 7.744 3.879 9.756 1.00 . A A . 5 LEU HD22 1 1 3 739 1 1 5 LEU HD23 H 6.711 5.172 9.145 1.00 . A A . 5 LEU HD23 1 1 3 740 1 1 5 LEU HG H 6.516 4.223 7.130 1.00 . A A . 5 LEU HG 1 1 3 741 1 1 5 LEU N N 8.677 4.399 4.383 1.00 . A A . 5 LEU N 1 1 3 742 1 1 5 LEU O O 9.712 6.889 6.649 1.00 . A A . 5 LEU O 1 1 3 743 1 1 6 PHE C C 12.818 6.602 4.307 1.00 . A A . 6 PHE C 1 1 3 744 1 1 6 PHE CA C 12.213 6.224 5.656 1.00 . A A . 6 PHE CA 1 1 3 745 1 1 6 PHE CB C 13.229 5.428 6.478 1.00 . A A . 6 PHE CB 1 1 3 746 1 1 6 PHE CD1 C 15.389 6.532 7.117 1.00 . A A . 6 PHE CD1 1 1 3 747 1 1 6 PHE CD2 C 13.501 6.828 8.542 1.00 . A A . 6 PHE CD2 1 1 3 748 1 1 6 PHE CE1 C 16.153 7.316 7.961 1.00 . A A . 6 PHE CE1 1 1 3 749 1 1 6 PHE CE2 C 14.259 7.614 9.389 1.00 . A A . 6 PHE CE2 1 1 3 750 1 1 6 PHE CG C 14.056 6.280 7.397 1.00 . A A . 6 PHE CG 1 1 3 751 1 1 6 PHE CZ C 15.588 7.857 9.099 1.00 . A A . 6 PHE CZ 1 1 3 752 1 1 6 PHE H H 11.020 4.616 4.967 1.00 . A A . 6 PHE H 1 1 3 753 1 1 6 PHE HA H 11.960 7.127 6.190 1.00 . A A . 6 PHE HA 1 1 3 754 1 1 6 PHE HB2 H 12.704 4.702 7.082 1.00 . A A . 6 PHE HB2 1 1 3 755 1 1 6 PHE HB3 H 13.900 4.913 5.807 1.00 . A A . 6 PHE HB3 1 1 3 756 1 1 6 PHE HD1 H 15.833 6.109 6.227 1.00 . A A . 6 PHE HD1 1 1 3 757 1 1 6 PHE HD2 H 12.462 6.638 8.771 1.00 . A A . 6 PHE HD2 1 1 3 758 1 1 6 PHE HE1 H 17.192 7.504 7.731 1.00 . A A . 6 PHE HE1 1 1 3 759 1 1 6 PHE HE2 H 13.815 8.035 10.279 1.00 . A A . 6 PHE HE2 1 1 3 760 1 1 6 PHE HZ H 16.183 8.470 9.759 1.00 . A A . 6 PHE HZ 1 1 3 761 1 1 6 PHE N N 10.989 5.451 5.479 1.00 . A A . 6 PHE N 1 1 3 762 1 1 6 PHE O O 13.756 7.395 4.236 1.00 . A A . 6 PHE O 1 1 3 763 1 1 7 ALA C C 12.361 7.708 1.445 1.00 . A A . 7 ALA C 1 1 3 764 1 1 7 ALA CA C 12.757 6.305 1.893 1.00 . A A . 7 ALA CA 1 1 3 765 1 1 7 ALA CB C 12.223 5.267 0.917 1.00 . A A . 7 ALA CB 1 1 3 766 1 1 7 ALA H H 11.527 5.404 3.361 1.00 . A A . 7 ALA H 1 1 3 767 1 1 7 ALA HA H 13.835 6.233 1.904 1.00 . A A . 7 ALA HA 1 1 3 768 1 1 7 ALA HB1 H 11.421 5.699 0.336 1.00 . A A . 7 ALA HB1 1 1 3 769 1 1 7 ALA HB2 H 13.018 4.953 0.256 1.00 . A A . 7 ALA HB2 1 1 3 770 1 1 7 ALA HB3 H 11.852 4.415 1.465 1.00 . A A . 7 ALA HB3 1 1 3 771 1 1 7 ALA N N 12.273 6.028 3.240 1.00 . A A . 7 ALA N 1 1 3 772 1 1 7 ALA O O 13.046 8.329 0.633 1.00 . A A . 7 ALA O 1 1 3 773 1 1 8 LYS C C 11.364 10.589 2.558 1.00 . A A . 8 LYS C 1 1 3 774 1 1 8 LYS CA C 10.761 9.533 1.636 1.00 . A A . 8 LYS CA 1 1 3 775 1 1 8 LYS CB C 9.234 9.577 1.724 1.00 . A A . 8 LYS CB 1 1 3 776 1 1 8 LYS CD C 7.773 10.258 3.650 1.00 . A A . 8 LYS CD 1 1 3 777 1 1 8 LYS CE C 6.417 10.248 2.962 1.00 . A A . 8 LYS CE 1 1 3 778 1 1 8 LYS CG C 8.691 9.186 3.088 1.00 . A A . 8 LYS CG 1 1 3 779 1 1 8 LYS H H 10.745 7.660 2.622 1.00 . A A . 8 LYS H 1 1 3 780 1 1 8 LYS HA H 11.061 9.745 0.621 1.00 . A A . 8 LYS HA 1 1 3 781 1 1 8 LYS HB2 H 8.901 10.580 1.500 1.00 . A A . 8 LYS HB2 1 1 3 782 1 1 8 LYS HB3 H 8.824 8.899 0.989 1.00 . A A . 8 LYS HB3 1 1 3 783 1 1 8 LYS HD2 H 7.630 10.080 4.706 1.00 . A A . 8 LYS HD2 1 1 3 784 1 1 8 LYS HD3 H 8.233 11.226 3.506 1.00 . A A . 8 LYS HD3 1 1 3 785 1 1 8 LYS HE2 H 6.543 10.579 1.943 1.00 . A A . 8 LYS HE2 1 1 3 786 1 1 8 LYS HE3 H 6.033 9.239 2.968 1.00 . A A . 8 LYS HE3 1 1 3 787 1 1 8 LYS HG2 H 8.136 8.265 2.994 1.00 . A A . 8 LYS HG2 1 1 3 788 1 1 8 LYS HG3 H 9.520 9.042 3.766 1.00 . A A . 8 LYS HG3 1 1 3 789 1 1 8 LYS HZ1 H 5.867 12.079 3.805 1.00 . A A . 8 LYS HZ1 1 1 3 790 1 1 8 LYS HZ2 H 5.168 10.738 4.564 1.00 . A A . 8 LYS HZ2 1 1 3 791 1 1 8 LYS HZ3 H 4.589 11.255 3.061 1.00 . A A . 8 LYS HZ3 1 1 3 792 1 1 8 LYS N N 11.249 8.203 1.980 1.00 . A A . 8 LYS N 1 1 3 793 1 1 8 LYS NZ N 5.442 11.143 3.645 1.00 . A A . 8 LYS NZ 1 1 3 794 1 1 8 LYS O O 11.605 11.723 2.143 1.00 . A A . 8 LYS O 1 1 3 795 1 1 9 ILE C C 13.665 11.355 4.512 1.00 . A A . 9 ILE C 1 1 3 796 1 1 9 ILE CA C 12.183 11.121 4.786 1.00 . A A . 9 ILE CA 1 1 3 797 1 1 9 ILE CB C 12.015 10.589 6.221 1.00 . A A . 9 ILE CB 1 1 3 798 1 1 9 ILE CD1 C 14.340 10.200 7.180 1.00 . A A . 9 ILE CD1 1 1 3 799 1 1 9 ILE CG1 C 13.117 9.577 6.545 1.00 . A A . 9 ILE CG1 1 1 3 800 1 1 9 ILE CG2 C 10.642 9.958 6.394 1.00 . A A . 9 ILE CG2 1 1 3 801 1 1 9 ILE H H 11.392 9.291 4.078 1.00 . A A . 9 ILE H 1 1 3 802 1 1 9 ILE HA H 11.661 12.064 4.709 1.00 . A A . 9 ILE HA 1 1 3 803 1 1 9 ILE HB H 12.090 11.423 6.902 1.00 . A A . 9 ILE HB 1 1 3 804 1 1 9 ILE HD11 H 14.351 11.261 6.979 1.00 . A A . 9 ILE HD11 1 1 3 805 1 1 9 ILE HD12 H 14.316 10.035 8.247 1.00 . A A . 9 ILE HD12 1 1 3 806 1 1 9 ILE HD13 H 15.230 9.747 6.766 1.00 . A A . 9 ILE HD13 1 1 3 807 1 1 9 ILE HG12 H 12.729 8.839 7.228 1.00 . A A . 9 ILE HG12 1 1 3 808 1 1 9 ILE HG13 H 13.427 9.090 5.632 1.00 . A A . 9 ILE HG13 1 1 3 809 1 1 9 ILE HG21 H 10.726 8.884 6.315 1.00 . A A . 9 ILE HG21 1 1 3 810 1 1 9 ILE HG22 H 10.247 10.217 7.366 1.00 . A A . 9 ILE HG22 1 1 3 811 1 1 9 ILE HG23 H 9.977 10.324 5.626 1.00 . A A . 9 ILE HG23 1 1 3 812 1 1 9 ILE N N 11.606 10.208 3.807 1.00 . A A . 9 ILE N 1 1 3 813 1 1 9 ILE O O 14.215 12.401 4.858 1.00 . A A . 9 ILE O 1 1 3 814 1 1 10 THR C C 15.942 11.209 2.249 1.00 . A A . 10 THR C 1 1 3 815 1 1 10 THR CA C 15.726 10.472 3.566 1.00 . A A . 10 THR CA 1 1 3 816 1 1 10 THR CB C 16.379 9.080 3.474 1.00 . A A . 10 THR CB 1 1 3 817 1 1 10 THR CG2 C 16.522 8.457 4.855 1.00 . A A . 10 THR CG2 1 1 3 818 1 1 10 THR H H 13.815 9.564 3.637 1.00 . A A . 10 THR H 1 1 3 819 1 1 10 THR HA H 16.210 11.022 4.359 1.00 . A A . 10 THR HA 1 1 3 820 1 1 10 THR HB H 17.363 9.188 3.041 1.00 . A A . 10 THR HB 1 1 3 821 1 1 10 THR HG1 H 16.108 7.450 2.397 1.00 . A A . 10 THR HG1 1 1 3 822 1 1 10 THR HG21 H 17.142 9.090 5.473 1.00 . A A . 10 THR HG21 1 1 3 823 1 1 10 THR HG22 H 16.978 7.483 4.765 1.00 . A A . 10 THR HG22 1 1 3 824 1 1 10 THR HG23 H 15.546 8.358 5.307 1.00 . A A . 10 THR HG23 1 1 3 825 1 1 10 THR N N 14.308 10.374 3.887 1.00 . A A . 10 THR N 1 1 3 826 1 1 10 THR O O 15.454 10.786 1.201 1.00 . A A . 10 THR O 1 1 3 827 1 1 10 THR OG1 O 15.592 8.224 2.638 1.00 . A A . 10 THR OG1 1 1 3 828 1 1 11 LYS C C 18.462 13.217 0.882 1.00 . A A . 11 LYS C 1 1 3 829 1 1 11 LYS CA C 16.960 13.112 1.121 1.00 . A A . 11 LYS CA 1 1 3 830 1 1 11 LYS CB C 16.356 14.511 1.265 1.00 . A A . 11 LYS CB 1 1 3 831 1 1 11 LYS CD C 15.647 14.825 3.654 1.00 . A A . 11 LYS CD 1 1 3 832 1 1 11 LYS CE C 15.555 15.905 4.721 1.00 . A A . 11 LYS CE 1 1 3 833 1 1 11 LYS CG C 16.675 15.177 2.592 1.00 . A A . 11 LYS CG 1 1 3 834 1 1 11 LYS H H 17.038 12.601 3.175 1.00 . A A . 11 LYS H 1 1 3 835 1 1 11 LYS HA H 16.506 12.618 0.275 1.00 . A A . 11 LYS HA 1 1 3 836 1 1 11 LYS HB2 H 16.736 15.137 0.471 1.00 . A A . 11 LYS HB2 1 1 3 837 1 1 11 LYS HB3 H 15.282 14.438 1.171 1.00 . A A . 11 LYS HB3 1 1 3 838 1 1 11 LYS HD2 H 14.680 14.715 3.185 1.00 . A A . 11 LYS HD2 1 1 3 839 1 1 11 LYS HD3 H 15.930 13.892 4.121 1.00 . A A . 11 LYS HD3 1 1 3 840 1 1 11 LYS HE2 H 15.000 15.516 5.561 1.00 . A A . 11 LYS HE2 1 1 3 841 1 1 11 LYS HE3 H 16.554 16.164 5.039 1.00 . A A . 11 LYS HE3 1 1 3 842 1 1 11 LYS HG2 H 17.648 14.848 2.926 1.00 . A A . 11 LYS HG2 1 1 3 843 1 1 11 LYS HG3 H 16.683 16.249 2.453 1.00 . A A . 11 LYS HG3 1 1 3 844 1 1 11 LYS HZ1 H 14.044 16.865 3.645 1.00 . A A . 11 LYS HZ1 1 1 3 845 1 1 11 LYS HZ2 H 15.526 17.681 3.622 1.00 . A A . 11 LYS HZ2 1 1 3 846 1 1 11 LYS HZ3 H 14.561 17.719 5.011 1.00 . A A . 11 LYS HZ3 1 1 3 847 1 1 11 LYS N N 16.677 12.315 2.309 1.00 . A A . 11 LYS N 1 1 3 848 1 1 11 LYS NZ N 14.874 17.128 4.215 1.00 . A A . 11 LYS NZ 1 1 3 849 1 1 11 LYS O O 18.925 14.089 0.147 1.00 . A A . 11 LYS O 1 1 3 850 1 1 12 LYS C C 21.148 10.989 0.766 1.00 . A A . 12 LYS C 1 1 3 851 1 1 12 LYS CA C 20.671 12.311 1.359 1.00 . A A . 12 LYS CA 1 1 3 852 1 1 12 LYS CB C 21.343 12.546 2.714 1.00 . A A . 12 LYS CB 1 1 3 853 1 1 12 LYS CD C 21.312 11.847 5.127 1.00 . A A . 12 LYS CD 1 1 3 854 1 1 12 LYS CE C 20.481 11.905 6.399 1.00 . A A . 12 LYS CE 1 1 3 855 1 1 12 LYS CG C 20.474 12.161 3.899 1.00 . A A . 12 LYS CG 1 1 3 856 1 1 12 LYS H H 18.793 11.650 2.079 1.00 . A A . 12 LYS H 1 1 3 857 1 1 12 LYS HA H 20.942 13.112 0.689 1.00 . A A . 12 LYS HA 1 1 3 858 1 1 12 LYS HB2 H 22.252 11.964 2.757 1.00 . A A . 12 LYS HB2 1 1 3 859 1 1 12 LYS HB3 H 21.591 13.593 2.802 1.00 . A A . 12 LYS HB3 1 1 3 860 1 1 12 LYS HD2 H 21.726 10.854 5.026 1.00 . A A . 12 LYS HD2 1 1 3 861 1 1 12 LYS HD3 H 22.115 12.567 5.198 1.00 . A A . 12 LYS HD3 1 1 3 862 1 1 12 LYS HE2 H 21.147 11.977 7.246 1.00 . A A . 12 LYS HE2 1 1 3 863 1 1 12 LYS HE3 H 19.851 12.782 6.362 1.00 . A A . 12 LYS HE3 1 1 3 864 1 1 12 LYS HG2 H 19.811 12.981 4.129 1.00 . A A . 12 LYS HG2 1 1 3 865 1 1 12 LYS HG3 H 19.892 11.288 3.639 1.00 . A A . 12 LYS HG3 1 1 3 866 1 1 12 LYS HZ1 H 18.919 10.658 5.793 1.00 . A A . 12 LYS HZ1 1 1 3 867 1 1 12 LYS HZ2 H 19.126 10.731 7.470 1.00 . A A . 12 LYS HZ2 1 1 3 868 1 1 12 LYS HZ3 H 20.207 9.838 6.523 1.00 . A A . 12 LYS HZ3 1 1 3 869 1 1 12 LYS N N 19.220 12.321 1.506 1.00 . A A . 12 LYS N 1 1 3 870 1 1 12 LYS NZ N 19.623 10.698 6.557 1.00 . A A . 12 LYS NZ 1 1 3 871 1 1 12 LYS O O 21.464 10.909 -0.420 1.00 . A A . 12 LYS O 1 1 3 872 1 1 13 ASN C C 20.878 8.205 -0.098 1.00 . A A . 13 ASN C 1 1 3 873 1 1 13 ASN CA C 21.634 8.636 1.155 1.00 . A A . 13 ASN CA 1 1 3 874 1 1 13 ASN CB C 21.428 7.606 2.268 1.00 . A A . 13 ASN CB 1 1 3 875 1 1 13 ASN CG C 22.735 7.164 2.895 1.00 . A A . 13 ASN CG 1 1 3 876 1 1 13 ASN H H 20.931 10.080 2.534 1.00 . A A . 13 ASN H 1 1 3 877 1 1 13 ASN HA H 22.687 8.697 0.924 1.00 . A A . 13 ASN HA 1 1 3 878 1 1 13 ASN HB2 H 20.808 8.039 3.040 1.00 . A A . 13 ASN HB2 1 1 3 879 1 1 13 ASN HB3 H 20.933 6.738 1.860 1.00 . A A . 13 ASN HB3 1 1 3 880 1 1 13 ASN HD21 H 23.108 5.978 1.343 1.00 . A A . 13 ASN HD21 1 1 3 881 1 1 13 ASN HD22 H 24.305 5.983 2.589 1.00 . A A . 13 ASN HD22 1 1 3 882 1 1 13 ASN N N 21.196 9.954 1.599 1.00 . A A . 13 ASN N 1 1 3 883 1 1 13 ASN ND2 N 23.456 6.287 2.206 1.00 . A A . 13 ASN ND2 1 1 3 884 1 1 13 ASN O O 21.397 7.447 -0.918 1.00 . A A . 13 ASN O 1 1 3 885 1 1 13 ASN OD1 O 23.093 7.605 3.987 1.00 . A A . 13 ASN OD1 1 1 3 886 1 1 14 MET C C 19.499 8.800 -2.691 1.00 . A A . 14 MET C 1 1 3 887 1 1 14 MET CA C 18.825 8.362 -1.395 1.00 . A A . 14 MET CA 1 1 3 888 1 1 14 MET CB C 17.450 9.022 -1.273 1.00 . A A . 14 MET CB 1 1 3 889 1 1 14 MET CE C 14.905 6.247 -2.737 1.00 . A A . 14 MET CE 1 1 3 890 1 1 14 MET CG C 16.438 8.511 -2.285 1.00 . A A . 14 MET CG 1 1 3 891 1 1 14 MET H H 19.292 9.295 0.447 1.00 . A A . 14 MET H 1 1 3 892 1 1 14 MET HA H 18.699 7.289 -1.414 1.00 . A A . 14 MET HA 1 1 3 893 1 1 14 MET HB2 H 17.062 8.837 -0.283 1.00 . A A . 14 MET HB2 1 1 3 894 1 1 14 MET HB3 H 17.561 10.087 -1.414 1.00 . A A . 14 MET HB3 1 1 3 895 1 1 14 MET HE1 H 14.529 6.671 -3.656 1.00 . A A . 14 MET HE1 1 1 3 896 1 1 14 MET HE2 H 15.855 5.768 -2.924 1.00 . A A . 14 MET HE2 1 1 3 897 1 1 14 MET HE3 H 14.201 5.517 -2.363 1.00 . A A . 14 MET HE3 1 1 3 898 1 1 14 MET HG2 H 15.998 9.356 -2.793 1.00 . A A . 14 MET HG2 1 1 3 899 1 1 14 MET HG3 H 16.952 7.889 -3.004 1.00 . A A . 14 MET HG3 1 1 3 900 1 1 14 MET N N 19.651 8.695 -0.240 1.00 . A A . 14 MET N 1 1 3 901 1 1 14 MET O O 19.670 8.003 -3.613 1.00 . A A . 14 MET O 1 1 3 902 1 1 14 MET SD S 15.120 7.545 -1.523 1.00 . A A . 14 MET SD 1 1 3 903 1 1 15 ALA C C 21.991 10.163 -4.013 1.00 . A A . 15 ALA C 1 1 3 904 1 1 15 ALA CA C 20.537 10.616 -3.936 1.00 . A A . 15 ALA CA 1 1 3 905 1 1 15 ALA CB C 20.454 12.135 -3.934 1.00 . A A . 15 ALA CB 1 1 3 906 1 1 15 ALA H H 19.716 10.658 -1.986 1.00 . A A . 15 ALA H 1 1 3 907 1 1 15 ALA HA H 20.010 10.252 -4.807 1.00 . A A . 15 ALA HA 1 1 3 908 1 1 15 ALA HB1 H 21.040 12.527 -4.753 1.00 . A A . 15 ALA HB1 1 1 3 909 1 1 15 ALA HB2 H 19.425 12.439 -4.048 1.00 . A A . 15 ALA HB2 1 1 3 910 1 1 15 ALA HB3 H 20.841 12.515 -3.000 1.00 . A A . 15 ALA HB3 1 1 3 911 1 1 15 ALA N N 19.880 10.072 -2.754 1.00 . A A . 15 ALA N 1 1 3 912 1 1 15 ALA O O 22.714 10.520 -4.943 1.00 . A A . 15 ALA O 1 1 3 913 1 1 16 HIS C C 23.835 7.403 -3.390 1.00 . A A . 16 HIS C 1 1 3 914 1 1 16 HIS CA C 23.782 8.873 -2.985 1.00 . A A . 16 HIS CA 1 1 3 915 1 1 16 HIS CB C 24.368 9.050 -1.584 1.00 . A A . 16 HIS CB 1 1 3 916 1 1 16 HIS CD2 C 26.761 9.957 -2.008 1.00 . A A . 16 HIS CD2 1 1 3 917 1 1 16 HIS CE1 C 26.545 11.904 -1.024 1.00 . A A . 16 HIS CE1 1 1 3 918 1 1 16 HIS CG C 25.498 10.031 -1.527 1.00 . A A . 16 HIS CG 1 1 3 919 1 1 16 HIS H H 21.790 9.125 -2.316 1.00 . A A . 16 HIS H 1 1 3 920 1 1 16 HIS HA H 24.368 9.448 -3.686 1.00 . A A . 16 HIS HA 1 1 3 921 1 1 16 HIS HB2 H 23.593 9.398 -0.918 1.00 . A A . 16 HIS HB2 1 1 3 922 1 1 16 HIS HB3 H 24.737 8.097 -1.233 1.00 . A A . 16 HIS HB3 1 1 3 923 1 1 16 HIS HD1 H 24.597 11.615 -0.469 1.00 . A A . 16 HIS HD1 1 1 3 924 1 1 16 HIS HD2 H 27.194 9.127 -2.549 1.00 . A A . 16 HIS HD2 1 1 3 925 1 1 16 HIS HE1 H 26.758 12.890 -0.639 1.00 . A A . 16 HIS HE1 1 1 3 926 1 1 16 HIS N N 22.413 9.375 -3.029 1.00 . A A . 16 HIS N 1 1 3 927 1 1 16 HIS ND1 N 25.395 11.263 -0.915 1.00 . A A . 16 HIS ND1 1 1 3 928 1 1 16 HIS NE2 N 27.391 11.133 -1.683 1.00 . A A . 16 HIS NE2 1 1 3 929 1 1 16 HIS O O 24.897 6.882 -3.731 1.00 . A A . 16 HIS O 1 1 3 930 1 1 17 ILE C C 23.216 5.081 -5.085 1.00 . A A . 17 ILE C 1 1 3 931 1 1 17 ILE CA C 22.600 5.333 -3.713 1.00 . A A . 17 ILE CA 1 1 3 932 1 1 17 ILE CB C 21.141 4.839 -3.719 1.00 . A A . 17 ILE CB 1 1 3 933 1 1 17 ILE CD1 C 18.863 5.418 -4.696 1.00 . A A . 17 ILE CD1 1 1 3 934 1 1 17 ILE CG1 C 20.365 5.488 -4.866 1.00 . A A . 17 ILE CG1 1 1 3 935 1 1 17 ILE CG2 C 20.475 5.138 -2.385 1.00 . A A . 17 ILE CG2 1 1 3 936 1 1 17 ILE H H 21.871 7.212 -3.070 1.00 . A A . 17 ILE H 1 1 3 937 1 1 17 ILE HA H 23.148 4.765 -2.975 1.00 . A A . 17 ILE HA 1 1 3 938 1 1 17 ILE HB H 21.147 3.768 -3.859 1.00 . A A . 17 ILE HB 1 1 3 939 1 1 17 ILE HD11 H 18.381 5.765 -5.598 1.00 . A A . 17 ILE HD11 1 1 3 940 1 1 17 ILE HD12 H 18.570 4.398 -4.499 1.00 . A A . 17 ILE HD12 1 1 3 941 1 1 17 ILE HD13 H 18.565 6.044 -3.867 1.00 . A A . 17 ILE HD13 1 1 3 942 1 1 17 ILE HG12 H 20.641 6.529 -4.936 1.00 . A A . 17 ILE HG12 1 1 3 943 1 1 17 ILE HG13 H 20.618 4.990 -5.791 1.00 . A A . 17 ILE HG13 1 1 3 944 1 1 17 ILE HG21 H 21.177 4.960 -1.584 1.00 . A A . 17 ILE HG21 1 1 3 945 1 1 17 ILE HG22 H 20.161 6.171 -2.364 1.00 . A A . 17 ILE HG22 1 1 3 946 1 1 17 ILE HG23 H 19.615 4.497 -2.259 1.00 . A A . 17 ILE HG23 1 1 3 947 1 1 17 ILE N N 22.684 6.742 -3.350 1.00 . A A . 17 ILE N 1 1 3 948 1 1 17 ILE O O 23.896 4.076 -5.297 1.00 . A A . 17 ILE O 1 1 3 949 1 1 18 ARG C C 24.724 6.779 -7.554 1.00 . A A . 18 ARG C 1 1 3 950 1 1 18 ARG CA C 23.506 5.879 -7.366 1.00 . A A . 18 ARG CA 1 1 3 951 1 1 18 ARG CB C 22.431 6.235 -8.394 1.00 . A A . 18 ARG CB 1 1 3 952 1 1 18 ARG CD C 21.430 8.284 -9.451 1.00 . A A . 18 ARG CD 1 1 3 953 1 1 18 ARG CG C 21.775 7.584 -8.146 1.00 . A A . 18 ARG CG 1 1 3 954 1 1 18 ARG CZ C 22.361 10.038 -10.901 1.00 . A A . 18 ARG CZ 1 1 3 955 1 1 18 ARG H H 22.426 6.779 -5.784 1.00 . A A . 18 ARG H 1 1 3 956 1 1 18 ARG HA H 23.806 4.852 -7.513 1.00 . A A . 18 ARG HA 1 1 3 957 1 1 18 ARG HB2 H 22.880 6.253 -9.376 1.00 . A A . 18 ARG HB2 1 1 3 958 1 1 18 ARG HB3 H 21.663 5.477 -8.371 1.00 . A A . 18 ARG HB3 1 1 3 959 1 1 18 ARG HD2 H 21.286 7.537 -10.218 1.00 . A A . 18 ARG HD2 1 1 3 960 1 1 18 ARG HD3 H 20.515 8.840 -9.315 1.00 . A A . 18 ARG HD3 1 1 3 961 1 1 18 ARG HE H 23.324 9.191 -9.373 1.00 . A A . 18 ARG HE 1 1 3 962 1 1 18 ARG HG2 H 20.868 7.435 -7.580 1.00 . A A . 18 ARG HG2 1 1 3 963 1 1 18 ARG HG3 H 22.455 8.206 -7.583 1.00 . A A . 18 ARG HG3 1 1 3 964 1 1 18 ARG HH11 H 20.477 9.469 -11.357 1.00 . A A . 18 ARG HH11 1 1 3 965 1 1 18 ARG HH12 H 21.146 10.705 -12.371 1.00 . A A . 18 ARG HH12 1 1 3 966 1 1 18 ARG HH21 H 24.215 10.818 -10.701 1.00 . A A . 18 ARG HH21 1 1 3 967 1 1 18 ARG HH22 H 23.272 11.471 -11.997 1.00 . A A . 18 ARG HH22 1 1 3 968 1 1 18 ARG N N 22.975 6.001 -6.014 1.00 . A A . 18 ARG N 1 1 3 969 1 1 18 ARG NE N 22.484 9.201 -9.876 1.00 . A A . 18 ARG NE 1 1 3 970 1 1 18 ARG NH1 N 21.236 10.073 -11.601 1.00 . A A . 18 ARG NH1 1 1 3 971 1 1 18 ARG NH2 N 23.366 10.842 -11.226 1.00 . A A . 18 ARG NH2 1 1 3 972 1 1 18 ARG O O 25.831 6.438 -7.138 1.00 . A A . 18 ARG O 1 1 4 973 1 1 1 PHE C C 4.353 -1.052 -1.360 1.00 . A A . 1 PHE C 1 1 4 974 1 1 1 PHE CA C 2.943 -1.532 -1.692 1.00 . A A . 1 PHE CA 1 1 4 975 1 1 1 PHE CB C 1.997 -1.211 -0.533 1.00 . A A . 1 PHE CB 1 1 4 976 1 1 1 PHE CD1 C -0.118 -1.105 -1.878 1.00 . A A . 1 PHE CD1 1 1 4 977 1 1 1 PHE CD2 C -0.072 -2.504 0.052 1.00 . A A . 1 PHE CD2 1 1 4 978 1 1 1 PHE CE1 C -1.428 -1.475 -2.120 1.00 . A A . 1 PHE CE1 1 1 4 979 1 1 1 PHE CE2 C -1.381 -2.878 -0.184 1.00 . A A . 1 PHE CE2 1 1 4 980 1 1 1 PHE CG C 0.574 -1.615 -0.792 1.00 . A A . 1 PHE CG 1 1 4 981 1 1 1 PHE CZ C -2.061 -2.362 -1.271 1.00 . A A . 1 PHE CZ 1 1 4 982 1 1 1 PHE H1 H 2.861 -3.268 -2.901 1.00 . A A . 1 PHE H1 1 1 4 983 1 1 1 PHE HA H 2.601 -1.020 -2.578 1.00 . A A . 1 PHE HA 1 1 4 984 1 1 1 PHE HB2 H 2.333 -1.731 0.351 1.00 . A A . 1 PHE HB2 1 1 4 985 1 1 1 PHE HB3 H 2.013 -0.147 -0.349 1.00 . A A . 1 PHE HB3 1 1 4 986 1 1 1 PHE HD1 H 0.376 -0.411 -2.543 1.00 . A A . 1 PHE HD1 1 1 4 987 1 1 1 PHE HD2 H 0.457 -2.908 0.903 1.00 . A A . 1 PHE HD2 1 1 4 988 1 1 1 PHE HE1 H -1.956 -1.070 -2.970 1.00 . A A . 1 PHE HE1 1 1 4 989 1 1 1 PHE HE2 H -1.874 -3.572 0.481 1.00 . A A . 1 PHE HE2 1 1 4 990 1 1 1 PHE HZ H -3.083 -2.653 -1.457 1.00 . A A . 1 PHE HZ 1 1 4 991 1 1 1 PHE N N 2.934 -2.963 -1.972 1.00 . A A . 1 PHE N 1 1 4 992 1 1 1 PHE O O 4.991 -1.555 -0.433 1.00 . A A . 1 PHE O 1 1 4 993 1 1 2 LEU C C 6.098 1.946 -1.529 1.00 . A A . 2 LEU C 1 1 4 994 1 1 2 LEU CA C 6.170 0.472 -1.911 1.00 . A A . 2 LEU CA 1 1 4 995 1 1 2 LEU CB C 7.019 0.300 -3.172 1.00 . A A . 2 LEU CB 1 1 4 996 1 1 2 LEU CD1 C 8.808 -1.180 -2.228 1.00 . A A . 2 LEU CD1 1 1 4 997 1 1 2 LEU CD2 C 6.765 -2.192 -3.256 1.00 . A A . 2 LEU CD2 1 1 4 998 1 1 2 LEU CG C 7.751 -1.035 -3.312 1.00 . A A . 2 LEU CG 1 1 4 999 1 1 2 LEU H H 4.280 0.283 -2.845 1.00 . A A . 2 LEU H 1 1 4 1000 1 1 2 LEU HA H 6.628 -0.076 -1.101 1.00 . A A . 2 LEU HA 1 1 4 1001 1 1 2 LEU HB2 H 6.369 0.412 -4.026 1.00 . A A . 2 LEU HB2 1 1 4 1002 1 1 2 LEU HB3 H 7.759 1.087 -3.180 1.00 . A A . 2 LEU HB3 1 1 4 1003 1 1 2 LEU HD11 H 9.060 -0.206 -1.838 1.00 . A A . 2 LEU HD11 1 1 4 1004 1 1 2 LEU HD12 H 9.691 -1.640 -2.647 1.00 . A A . 2 LEU HD12 1 1 4 1005 1 1 2 LEU HD13 H 8.423 -1.800 -1.431 1.00 . A A . 2 LEU HD13 1 1 4 1006 1 1 2 LEU HD21 H 7.204 -3.061 -3.724 1.00 . A A . 2 LEU HD21 1 1 4 1007 1 1 2 LEU HD22 H 5.860 -1.920 -3.781 1.00 . A A . 2 LEU HD22 1 1 4 1008 1 1 2 LEU HD23 H 6.531 -2.417 -2.226 1.00 . A A . 2 LEU HD23 1 1 4 1009 1 1 2 LEU HG H 8.250 -1.066 -4.271 1.00 . A A . 2 LEU HG 1 1 4 1010 1 1 2 LEU N N 4.835 -0.077 -2.123 1.00 . A A . 2 LEU N 1 1 4 1011 1 1 2 LEU O O 6.424 2.834 -2.318 1.00 . A A . 2 LEU O 1 1 4 1012 1 1 3 PRO C C 6.899 4.240 0.454 1.00 . A A . 3 PRO C 1 1 4 1013 1 1 3 PRO CA C 5.542 3.583 0.227 1.00 . A A . 3 PRO CA 1 1 4 1014 1 1 3 PRO CB C 4.810 3.395 1.558 1.00 . A A . 3 PRO CB 1 1 4 1015 1 1 3 PRO CD C 5.259 1.208 0.705 1.00 . A A . 3 PRO CD 1 1 4 1016 1 1 3 PRO CG C 5.133 2.002 1.976 1.00 . A A . 3 PRO CG 1 1 4 1017 1 1 3 PRO HA H 4.948 4.203 -0.428 1.00 . A A . 3 PRO HA 1 1 4 1018 1 1 3 PRO HB2 H 5.172 4.118 2.276 1.00 . A A . 3 PRO HB2 1 1 4 1019 1 1 3 PRO HB3 H 3.748 3.527 1.411 1.00 . A A . 3 PRO HB3 1 1 4 1020 1 1 3 PRO HD2 H 6.015 0.445 0.810 1.00 . A A . 3 PRO HD2 1 1 4 1021 1 1 3 PRO HD3 H 4.309 0.767 0.440 1.00 . A A . 3 PRO HD3 1 1 4 1022 1 1 3 PRO HG2 H 6.065 1.989 2.520 1.00 . A A . 3 PRO HG2 1 1 4 1023 1 1 3 PRO HG3 H 4.334 1.608 2.586 1.00 . A A . 3 PRO HG3 1 1 4 1024 1 1 3 PRO N N 5.664 2.216 -0.289 1.00 . A A . 3 PRO N 1 1 4 1025 1 1 3 PRO O O 7.943 3.632 0.215 1.00 . A A . 3 PRO O 1 1 4 1026 1 1 4 LYS C C 8.212 6.602 2.654 1.00 . A A . 4 LYS C 1 1 4 1027 1 1 4 LYS CA C 8.107 6.225 1.179 1.00 . A A . 4 LYS CA 1 1 4 1028 1 1 4 LYS CB C 8.161 7.486 0.315 1.00 . A A . 4 LYS CB 1 1 4 1029 1 1 4 LYS CD C 6.798 9.457 -0.440 1.00 . A A . 4 LYS CD 1 1 4 1030 1 1 4 LYS CE C 7.780 9.806 -1.548 1.00 . A A . 4 LYS CE 1 1 4 1031 1 1 4 LYS CG C 6.796 7.966 -0.147 1.00 . A A . 4 LYS CG 1 1 4 1032 1 1 4 LYS H H 6.015 5.916 1.090 1.00 . A A . 4 LYS H 1 1 4 1033 1 1 4 LYS HA H 8.940 5.587 0.923 1.00 . A A . 4 LYS HA 1 1 4 1034 1 1 4 LYS HB2 H 8.625 8.279 0.883 1.00 . A A . 4 LYS HB2 1 1 4 1035 1 1 4 LYS HB3 H 8.762 7.283 -0.560 1.00 . A A . 4 LYS HB3 1 1 4 1036 1 1 4 LYS HD2 H 5.807 9.757 -0.745 1.00 . A A . 4 LYS HD2 1 1 4 1037 1 1 4 LYS HD3 H 7.078 9.991 0.458 1.00 . A A . 4 LYS HD3 1 1 4 1038 1 1 4 LYS HE2 H 8.782 9.608 -1.199 1.00 . A A . 4 LYS HE2 1 1 4 1039 1 1 4 LYS HE3 H 7.569 9.185 -2.406 1.00 . A A . 4 LYS HE3 1 1 4 1040 1 1 4 LYS HG2 H 6.522 7.434 -1.046 1.00 . A A . 4 LYS HG2 1 1 4 1041 1 1 4 LYS HG3 H 6.072 7.762 0.629 1.00 . A A . 4 LYS HG3 1 1 4 1042 1 1 4 LYS HZ1 H 8.513 11.510 -2.507 1.00 . A A . 4 LYS HZ1 1 1 4 1043 1 1 4 LYS HZ2 H 7.630 11.841 -1.103 1.00 . A A . 4 LYS HZ2 1 1 4 1044 1 1 4 LYS HZ3 H 6.825 11.389 -2.521 1.00 . A A . 4 LYS HZ3 1 1 4 1045 1 1 4 LYS N N 6.879 5.485 0.918 1.00 . A A . 4 LYS N 1 1 4 1046 1 1 4 LYS NZ N 7.680 11.237 -1.948 1.00 . A A . 4 LYS NZ 1 1 4 1047 1 1 4 LYS O O 8.709 7.676 2.997 1.00 . A A . 4 LYS O 1 1 4 1048 1 1 5 LEU C C 9.134 6.531 5.376 1.00 . A A . 5 LEU C 1 1 4 1049 1 1 5 LEU CA C 7.786 5.951 4.960 1.00 . A A . 5 LEU CA 1 1 4 1050 1 1 5 LEU CB C 7.521 4.651 5.721 1.00 . A A . 5 LEU CB 1 1 4 1051 1 1 5 LEU CD1 C 5.427 3.537 6.532 1.00 . A A . 5 LEU CD1 1 1 4 1052 1 1 5 LEU CD2 C 6.953 4.664 8.163 1.00 . A A . 5 LEU CD2 1 1 4 1053 1 1 5 LEU CG C 6.390 4.694 6.749 1.00 . A A . 5 LEU CG 1 1 4 1054 1 1 5 LEU H H 7.360 4.875 3.189 1.00 . A A . 5 LEU H 1 1 4 1055 1 1 5 LEU HA H 7.012 6.664 5.201 1.00 . A A . 5 LEU HA 1 1 4 1056 1 1 5 LEU HB2 H 7.281 3.888 4.997 1.00 . A A . 5 LEU HB2 1 1 4 1057 1 1 5 LEU HB3 H 8.430 4.380 6.239 1.00 . A A . 5 LEU HB3 1 1 4 1058 1 1 5 LEU HD11 H 4.993 3.610 5.547 1.00 . A A . 5 LEU HD11 1 1 4 1059 1 1 5 LEU HD12 H 4.644 3.576 7.275 1.00 . A A . 5 LEU HD12 1 1 4 1060 1 1 5 LEU HD13 H 5.961 2.602 6.623 1.00 . A A . 5 LEU HD13 1 1 4 1061 1 1 5 LEU HD21 H 6.863 3.665 8.564 1.00 . A A . 5 LEU HD21 1 1 4 1062 1 1 5 LEU HD22 H 6.400 5.352 8.785 1.00 . A A . 5 LEU HD22 1 1 4 1063 1 1 5 LEU HD23 H 7.993 4.952 8.142 1.00 . A A . 5 LEU HD23 1 1 4 1064 1 1 5 LEU HG H 5.837 5.615 6.628 1.00 . A A . 5 LEU HG 1 1 4 1065 1 1 5 LEU N N 7.744 5.712 3.522 1.00 . A A . 5 LEU N 1 1 4 1066 1 1 5 LEU O O 9.207 7.400 6.245 1.00 . A A . 5 LEU O 1 1 4 1067 1 1 6 PHE C C 12.227 7.064 3.802 1.00 . A A . 6 PHE C 1 1 4 1068 1 1 6 PHE CA C 11.547 6.516 5.053 1.00 . A A . 6 PHE CA 1 1 4 1069 1 1 6 PHE CB C 12.384 5.382 5.648 1.00 . A A . 6 PHE CB 1 1 4 1070 1 1 6 PHE CD1 C 14.708 5.894 6.446 1.00 . A A . 6 PHE CD1 1 1 4 1071 1 1 6 PHE CD2 C 12.893 6.215 7.959 1.00 . A A . 6 PHE CD2 1 1 4 1072 1 1 6 PHE CE1 C 15.597 6.315 7.417 1.00 . A A . 6 PHE CE1 1 1 4 1073 1 1 6 PHE CE2 C 13.778 6.637 8.934 1.00 . A A . 6 PHE CE2 1 1 4 1074 1 1 6 PHE CG C 13.348 5.840 6.705 1.00 . A A . 6 PHE CG 1 1 4 1075 1 1 6 PHE CZ C 15.131 6.686 8.663 1.00 . A A . 6 PHE CZ 1 1 4 1076 1 1 6 PHE H H 10.079 5.353 4.065 1.00 . A A . 6 PHE H 1 1 4 1077 1 1 6 PHE HA H 11.463 7.310 5.779 1.00 . A A . 6 PHE HA 1 1 4 1078 1 1 6 PHE HB2 H 11.725 4.653 6.094 1.00 . A A . 6 PHE HB2 1 1 4 1079 1 1 6 PHE HB3 H 12.953 4.913 4.859 1.00 . A A . 6 PHE HB3 1 1 4 1080 1 1 6 PHE HD1 H 15.073 5.603 5.471 1.00 . A A . 6 PHE HD1 1 1 4 1081 1 1 6 PHE HD2 H 11.835 6.177 8.173 1.00 . A A . 6 PHE HD2 1 1 4 1082 1 1 6 PHE HE1 H 16.655 6.351 7.201 1.00 . A A . 6 PHE HE1 1 1 4 1083 1 1 6 PHE HE2 H 13.411 6.927 9.907 1.00 . A A . 6 PHE HE2 1 1 4 1084 1 1 6 PHE HZ H 15.824 7.016 9.422 1.00 . A A . 6 PHE HZ 1 1 4 1085 1 1 6 PHE N N 10.200 6.045 4.749 1.00 . A A . 6 PHE N 1 1 4 1086 1 1 6 PHE O O 13.299 7.662 3.877 1.00 . A A . 6 PHE O 1 1 4 1087 1 1 7 ALA C C 12.019 8.841 1.268 1.00 . A A . 7 ALA C 1 1 4 1088 1 1 7 ALA CA C 12.137 7.326 1.384 1.00 . A A . 7 ALA CA 1 1 4 1089 1 1 7 ALA CB C 11.428 6.648 0.221 1.00 . A A . 7 ALA CB 1 1 4 1090 1 1 7 ALA H H 10.743 6.369 2.656 1.00 . A A . 7 ALA H 1 1 4 1091 1 1 7 ALA HA H 13.182 7.052 1.345 1.00 . A A . 7 ALA HA 1 1 4 1092 1 1 7 ALA HB1 H 10.728 7.340 -0.225 1.00 . A A . 7 ALA HB1 1 1 4 1093 1 1 7 ALA HB2 H 12.156 6.346 -0.517 1.00 . A A . 7 ALA HB2 1 1 4 1094 1 1 7 ALA HB3 H 10.897 5.780 0.580 1.00 . A A . 7 ALA HB3 1 1 4 1095 1 1 7 ALA N N 11.595 6.853 2.652 1.00 . A A . 7 ALA N 1 1 4 1096 1 1 7 ALA O O 12.819 9.487 0.590 1.00 . A A . 7 ALA O 1 1 4 1097 1 1 8 LYS C C 11.573 11.539 3.016 1.00 . A A . 8 LYS C 1 1 4 1098 1 1 8 LYS CA C 10.792 10.845 1.904 1.00 . A A . 8 LYS CA 1 1 4 1099 1 1 8 LYS CB C 9.300 11.153 2.046 1.00 . A A . 8 LYS CB 1 1 4 1100 1 1 8 LYS CD C 7.972 11.652 4.120 1.00 . A A . 8 LYS CD 1 1 4 1101 1 1 8 LYS CE C 6.642 12.041 3.493 1.00 . A A . 8 LYS CE 1 1 4 1102 1 1 8 LYS CG C 8.678 10.579 3.308 1.00 . A A . 8 LYS CG 1 1 4 1103 1 1 8 LYS H H 10.411 8.837 2.455 1.00 . A A . 8 LYS H 1 1 4 1104 1 1 8 LYS HA H 11.138 11.216 0.951 1.00 . A A . 8 LYS HA 1 1 4 1105 1 1 8 LYS HB2 H 9.165 12.225 2.059 1.00 . A A . 8 LYS HB2 1 1 4 1106 1 1 8 LYS HB3 H 8.777 10.744 1.194 1.00 . A A . 8 LYS HB3 1 1 4 1107 1 1 8 LYS HD2 H 7.791 11.277 5.116 1.00 . A A . 8 LYS HD2 1 1 4 1108 1 1 8 LYS HD3 H 8.605 12.526 4.172 1.00 . A A . 8 LYS HD3 1 1 4 1109 1 1 8 LYS HE2 H 6.341 11.264 2.808 1.00 . A A . 8 LYS HE2 1 1 4 1110 1 1 8 LYS HE3 H 5.904 12.137 4.276 1.00 . A A . 8 LYS HE3 1 1 4 1111 1 1 8 LYS HG2 H 7.959 9.821 3.031 1.00 . A A . 8 LYS HG2 1 1 4 1112 1 1 8 LYS HG3 H 9.456 10.136 3.912 1.00 . A A . 8 LYS HG3 1 1 4 1113 1 1 8 LYS HZ1 H 5.840 13.855 2.839 1.00 . A A . 8 LYS HZ1 1 1 4 1114 1 1 8 LYS HZ2 H 6.923 13.152 1.746 1.00 . A A . 8 LYS HZ2 1 1 4 1115 1 1 8 LYS HZ3 H 7.504 13.912 3.142 1.00 . A A . 8 LYS HZ3 1 1 4 1116 1 1 8 LYS N N 11.016 9.405 1.932 1.00 . A A . 8 LYS N 1 1 4 1117 1 1 8 LYS NZ N 6.734 13.330 2.753 1.00 . A A . 8 LYS NZ 1 1 4 1118 1 1 8 LYS O O 12.029 12.671 2.853 1.00 . A A . 8 LYS O 1 1 4 1119 1 1 9 ILE C C 13.956 11.409 5.018 1.00 . A A . 9 ILE C 1 1 4 1120 1 1 9 ILE CA C 12.454 11.402 5.279 1.00 . A A . 9 ILE CA 1 1 4 1121 1 1 9 ILE CB C 12.172 10.606 6.567 1.00 . A A . 9 ILE CB 1 1 4 1122 1 1 9 ILE CD1 C 14.371 9.587 7.345 1.00 . A A . 9 ILE CD1 1 1 4 1123 1 1 9 ILE CG1 C 13.059 9.360 6.627 1.00 . A A . 9 ILE CG1 1 1 4 1124 1 1 9 ILE CG2 C 10.702 10.220 6.641 1.00 . A A . 9 ILE CG2 1 1 4 1125 1 1 9 ILE H H 11.339 9.954 4.212 1.00 . A A . 9 ILE H 1 1 4 1126 1 1 9 ILE HA H 12.120 12.419 5.428 1.00 . A A . 9 ILE HA 1 1 4 1127 1 1 9 ILE HB H 12.396 11.239 7.412 1.00 . A A . 9 ILE HB 1 1 4 1128 1 1 9 ILE HD11 H 15.160 9.061 6.828 1.00 . A A . 9 ILE HD11 1 1 4 1129 1 1 9 ILE HD12 H 14.594 10.643 7.365 1.00 . A A . 9 ILE HD12 1 1 4 1130 1 1 9 ILE HD13 H 14.296 9.216 8.357 1.00 . A A . 9 ILE HD13 1 1 4 1131 1 1 9 ILE HG12 H 12.531 8.574 7.143 1.00 . A A . 9 ILE HG12 1 1 4 1132 1 1 9 ILE HG13 H 13.282 9.038 5.620 1.00 . A A . 9 ILE HG13 1 1 4 1133 1 1 9 ILE HG21 H 10.128 10.866 5.993 1.00 . A A . 9 ILE HG21 1 1 4 1134 1 1 9 ILE HG22 H 10.583 9.195 6.322 1.00 . A A . 9 ILE HG22 1 1 4 1135 1 1 9 ILE HG23 H 10.352 10.325 7.657 1.00 . A A . 9 ILE HG23 1 1 4 1136 1 1 9 ILE N N 11.725 10.852 4.143 1.00 . A A . 9 ILE N 1 1 4 1137 1 1 9 ILE O O 14.690 12.231 5.568 1.00 . A A . 9 ILE O 1 1 4 1138 1 1 10 THR C C 16.189 11.345 2.708 1.00 . A A . 10 THR C 1 1 4 1139 1 1 10 THR CA C 15.823 10.388 3.836 1.00 . A A . 10 THR CA 1 1 4 1140 1 1 10 THR CB C 16.202 8.954 3.421 1.00 . A A . 10 THR CB 1 1 4 1141 1 1 10 THR CG2 C 16.209 8.026 4.627 1.00 . A A . 10 THR CG2 1 1 4 1142 1 1 10 THR H H 13.774 9.861 3.766 1.00 . A A . 10 THR H 1 1 4 1143 1 1 10 THR HA H 16.394 10.649 4.716 1.00 . A A . 10 THR HA 1 1 4 1144 1 1 10 THR HB H 17.194 8.970 2.992 1.00 . A A . 10 THR HB 1 1 4 1145 1 1 10 THR HG1 H 15.257 9.068 1.694 1.00 . A A . 10 THR HG1 1 1 4 1146 1 1 10 THR HG21 H 15.227 8.013 5.076 1.00 . A A . 10 THR HG21 1 1 4 1147 1 1 10 THR HG22 H 16.931 8.378 5.348 1.00 . A A . 10 THR HG22 1 1 4 1148 1 1 10 THR HG23 H 16.473 7.028 4.310 1.00 . A A . 10 THR HG23 1 1 4 1149 1 1 10 THR N N 14.408 10.488 4.172 1.00 . A A . 10 THR N 1 1 4 1150 1 1 10 THR O O 15.642 11.263 1.608 1.00 . A A . 10 THR O 1 1 4 1151 1 1 10 THR OG1 O 15.277 8.467 2.443 1.00 . A A . 10 THR OG1 1 1 4 1152 1 1 11 LYS C C 19.059 13.098 1.737 1.00 . A A . 11 LYS C 1 1 4 1153 1 1 11 LYS CA C 17.561 13.225 1.994 1.00 . A A . 11 LYS CA 1 1 4 1154 1 1 11 LYS CB C 17.231 14.645 2.459 1.00 . A A . 11 LYS CB 1 1 4 1155 1 1 11 LYS CD C 16.563 14.550 4.879 1.00 . A A . 11 LYS CD 1 1 4 1156 1 1 11 LYS CE C 16.666 15.361 6.161 1.00 . A A . 11 LYS CE 1 1 4 1157 1 1 11 LYS CG C 17.653 14.930 3.890 1.00 . A A . 11 LYS CG 1 1 4 1158 1 1 11 LYS H H 17.519 12.268 3.881 1.00 . A A . 11 LYS H 1 1 4 1159 1 1 11 LYS HA H 17.032 13.025 1.074 1.00 . A A . 11 LYS HA 1 1 4 1160 1 1 11 LYS HB2 H 17.733 15.349 1.811 1.00 . A A . 11 LYS HB2 1 1 4 1161 1 1 11 LYS HB3 H 16.164 14.797 2.384 1.00 . A A . 11 LYS HB3 1 1 4 1162 1 1 11 LYS HD2 H 15.599 14.733 4.427 1.00 . A A . 11 LYS HD2 1 1 4 1163 1 1 11 LYS HD3 H 16.657 13.500 5.119 1.00 . A A . 11 LYS HD3 1 1 4 1164 1 1 11 LYS HE2 H 17.132 16.308 5.936 1.00 . A A . 11 LYS HE2 1 1 4 1165 1 1 11 LYS HE3 H 15.671 15.531 6.545 1.00 . A A . 11 LYS HE3 1 1 4 1166 1 1 11 LYS HG2 H 18.542 14.359 4.114 1.00 . A A . 11 LYS HG2 1 1 4 1167 1 1 11 LYS HG3 H 17.865 15.985 3.991 1.00 . A A . 11 LYS HG3 1 1 4 1168 1 1 11 LYS HZ1 H 17.859 15.346 7.876 1.00 . A A . 11 LYS HZ1 1 1 4 1169 1 1 11 LYS HZ2 H 18.260 14.147 6.753 1.00 . A A . 11 LYS HZ2 1 1 4 1170 1 1 11 LYS HZ3 H 16.877 13.978 7.713 1.00 . A A . 11 LYS HZ3 1 1 4 1171 1 1 11 LYS N N 17.119 12.253 2.986 1.00 . A A . 11 LYS N 1 1 4 1172 1 1 11 LYS NZ N 17.472 14.659 7.198 1.00 . A A . 11 LYS NZ 1 1 4 1173 1 1 11 LYS O O 19.686 14.010 1.196 1.00 . A A . 11 LYS O 1 1 4 1174 1 1 12 LYS C C 21.277 10.490 1.053 1.00 . A A . 12 LYS C 1 1 4 1175 1 1 12 LYS CA C 21.051 11.713 1.935 1.00 . A A . 12 LYS CA 1 1 4 1176 1 1 12 LYS CB C 21.740 11.514 3.287 1.00 . A A . 12 LYS CB 1 1 4 1177 1 1 12 LYS CD C 21.552 10.319 5.488 1.00 . A A . 12 LYS CD 1 1 4 1178 1 1 12 LYS CE C 21.810 11.228 6.680 1.00 . A A . 12 LYS CE 1 1 4 1179 1 1 12 LYS CG C 20.801 11.047 4.386 1.00 . A A . 12 LYS CG 1 1 4 1180 1 1 12 LYS H H 19.074 11.272 2.551 1.00 . A A . 12 LYS H 1 1 4 1181 1 1 12 LYS HA H 21.476 12.577 1.448 1.00 . A A . 12 LYS HA 1 1 4 1182 1 1 12 LYS HB2 H 22.523 10.779 3.174 1.00 . A A . 12 LYS HB2 1 1 4 1183 1 1 12 LYS HB3 H 22.181 12.452 3.594 1.00 . A A . 12 LYS HB3 1 1 4 1184 1 1 12 LYS HD2 H 20.964 9.474 5.815 1.00 . A A . 12 LYS HD2 1 1 4 1185 1 1 12 LYS HD3 H 22.498 9.972 5.099 1.00 . A A . 12 LYS HD3 1 1 4 1186 1 1 12 LYS HE2 H 22.622 10.816 7.261 1.00 . A A . 12 LYS HE2 1 1 4 1187 1 1 12 LYS HE3 H 22.088 12.206 6.316 1.00 . A A . 12 LYS HE3 1 1 4 1188 1 1 12 LYS HG2 H 20.303 11.906 4.810 1.00 . A A . 12 LYS HG2 1 1 4 1189 1 1 12 LYS HG3 H 20.068 10.377 3.959 1.00 . A A . 12 LYS HG3 1 1 4 1190 1 1 12 LYS HZ1 H 20.191 12.304 7.444 1.00 . A A . 12 LYS HZ1 1 1 4 1191 1 1 12 LYS HZ2 H 20.872 11.217 8.546 1.00 . A A . 12 LYS HZ2 1 1 4 1192 1 1 12 LYS HZ3 H 19.898 10.645 7.287 1.00 . A A . 12 LYS HZ3 1 1 4 1193 1 1 12 LYS N N 19.627 11.962 2.126 1.00 . A A . 12 LYS N 1 1 4 1194 1 1 12 LYS NZ N 20.609 11.357 7.550 1.00 . A A . 12 LYS NZ 1 1 4 1195 1 1 12 LYS O O 21.585 10.616 -0.131 1.00 . A A . 12 LYS O 1 1 4 1196 1 1 13 ASN C C 20.496 8.065 -0.390 1.00 . A A . 13 ASN C 1 1 4 1197 1 1 13 ASN CA C 21.305 8.061 0.904 1.00 . A A . 13 ASN CA 1 1 4 1198 1 1 13 ASN CB C 20.896 6.868 1.770 1.00 . A A . 13 ASN CB 1 1 4 1199 1 1 13 ASN CG C 22.090 6.075 2.264 1.00 . A A . 13 ASN CG 1 1 4 1200 1 1 13 ASN H H 20.873 9.271 2.586 1.00 . A A . 13 ASN H 1 1 4 1201 1 1 13 ASN HA H 22.353 7.973 0.659 1.00 . A A . 13 ASN HA 1 1 4 1202 1 1 13 ASN HB2 H 20.346 7.226 2.629 1.00 . A A . 13 ASN HB2 1 1 4 1203 1 1 13 ASN HB3 H 20.264 6.210 1.192 1.00 . A A . 13 ASN HB3 1 1 4 1204 1 1 13 ASN HD21 H 20.953 4.461 2.499 1.00 . A A . 13 ASN HD21 1 1 4 1205 1 1 13 ASN HD22 H 22.619 4.273 2.916 1.00 . A A . 13 ASN HD22 1 1 4 1206 1 1 13 ASN N N 21.119 9.307 1.638 1.00 . A A . 13 ASN N 1 1 4 1207 1 1 13 ASN ND2 N 21.865 4.808 2.592 1.00 . A A . 13 ASN ND2 1 1 4 1208 1 1 13 ASN O O 20.871 7.424 -1.371 1.00 . A A . 13 ASN O 1 1 4 1209 1 1 13 ASN OD1 O 23.203 6.596 2.349 1.00 . A A . 13 ASN OD1 1 1 4 1210 1 1 14 MET C C 19.282 9.464 -2.745 1.00 . A A . 14 MET C 1 1 4 1211 1 1 14 MET CA C 18.523 8.883 -1.556 1.00 . A A . 14 MET CA 1 1 4 1212 1 1 14 MET CB C 17.296 9.744 -1.250 1.00 . A A . 14 MET CB 1 1 4 1213 1 1 14 MET CE C 15.044 7.155 -2.333 1.00 . A A . 14 MET CE 1 1 4 1214 1 1 14 MET CG C 16.217 9.666 -2.318 1.00 . A A . 14 MET CG 1 1 4 1215 1 1 14 MET H H 19.137 9.283 0.429 1.00 . A A . 14 MET H 1 1 4 1216 1 1 14 MET HA H 18.198 7.884 -1.806 1.00 . A A . 14 MET HA 1 1 4 1217 1 1 14 MET HB2 H 16.868 9.420 -0.313 1.00 . A A . 14 MET HB2 1 1 4 1218 1 1 14 MET HB3 H 17.606 10.774 -1.158 1.00 . A A . 14 MET HB3 1 1 4 1219 1 1 14 MET HE1 H 14.854 7.106 -3.395 1.00 . A A . 14 MET HE1 1 1 4 1220 1 1 14 MET HE2 H 16.074 6.892 -2.139 1.00 . A A . 14 MET HE2 1 1 4 1221 1 1 14 MET HE3 H 14.393 6.463 -1.819 1.00 . A A . 14 MET HE3 1 1 4 1222 1 1 14 MET HG2 H 15.949 10.669 -2.614 1.00 . A A . 14 MET HG2 1 1 4 1223 1 1 14 MET HG3 H 16.612 9.134 -3.171 1.00 . A A . 14 MET HG3 1 1 4 1224 1 1 14 MET N N 19.384 8.793 -0.383 1.00 . A A . 14 MET N 1 1 4 1225 1 1 14 MET O O 19.311 8.873 -3.824 1.00 . A A . 14 MET O 1 1 4 1226 1 1 14 MET SD S 14.732 8.818 -1.745 1.00 . A A . 14 MET SD 1 1 4 1227 1 1 15 ALA C C 22.000 10.598 -3.813 1.00 . A A . 15 ALA C 1 1 4 1228 1 1 15 ALA CA C 20.656 11.285 -3.594 1.00 . A A . 15 ALA CA 1 1 4 1229 1 1 15 ALA CB C 20.861 12.754 -3.256 1.00 . A A . 15 ALA CB 1 1 4 1230 1 1 15 ALA H H 19.836 11.047 -1.657 1.00 . A A . 15 ALA H 1 1 4 1231 1 1 15 ALA HA H 20.080 11.227 -4.506 1.00 . A A . 15 ALA HA 1 1 4 1232 1 1 15 ALA HB1 H 21.288 12.839 -2.268 1.00 . A A . 15 ALA HB1 1 1 4 1233 1 1 15 ALA HB2 H 21.530 13.199 -3.978 1.00 . A A . 15 ALA HB2 1 1 4 1234 1 1 15 ALA HB3 H 19.910 13.265 -3.283 1.00 . A A . 15 ALA HB3 1 1 4 1235 1 1 15 ALA N N 19.895 10.625 -2.539 1.00 . A A . 15 ALA N 1 1 4 1236 1 1 15 ALA O O 22.787 11.011 -4.665 1.00 . A A . 15 ALA O 1 1 4 1237 1 1 16 HIS C C 23.286 7.476 -3.868 1.00 . A A . 16 HIS C 1 1 4 1238 1 1 16 HIS CA C 23.505 8.804 -3.149 1.00 . A A . 16 HIS CA 1 1 4 1239 1 1 16 HIS CB C 24.099 8.554 -1.762 1.00 . A A . 16 HIS CB 1 1 4 1240 1 1 16 HIS CD2 C 26.660 8.946 -1.869 1.00 . A A . 16 HIS CD2 1 1 4 1241 1 1 16 HIS CE1 C 26.736 10.862 -0.807 1.00 . A A . 16 HIS CE1 1 1 4 1242 1 1 16 HIS CG C 25.392 9.271 -1.526 1.00 . A A . 16 HIS CG 1 1 4 1243 1 1 16 HIS H H 21.589 9.267 -2.379 1.00 . A A . 16 HIS H 1 1 4 1244 1 1 16 HIS HA H 24.197 9.400 -3.725 1.00 . A A . 16 HIS HA 1 1 4 1245 1 1 16 HIS HB2 H 23.395 8.884 -1.012 1.00 . A A . 16 HIS HB2 1 1 4 1246 1 1 16 HIS HB3 H 24.278 7.496 -1.640 1.00 . A A . 16 HIS HB3 1 1 4 1247 1 1 16 HIS HD1 H 24.719 10.976 -0.487 1.00 . A A . 16 HIS HD1 1 1 4 1248 1 1 16 HIS HD2 H 26.973 8.060 -2.404 1.00 . A A . 16 HIS HD2 1 1 4 1249 1 1 16 HIS HE1 H 27.101 11.768 -0.347 1.00 . A A . 16 HIS HE1 1 1 4 1250 1 1 16 HIS N N 22.256 9.548 -3.039 1.00 . A A . 16 HIS N 1 1 4 1251 1 1 16 HIS ND1 N 25.474 10.477 -0.861 1.00 . A A . 16 HIS ND1 1 1 4 1252 1 1 16 HIS NE2 N 27.477 9.950 -1.411 1.00 . A A . 16 HIS NE2 1 1 4 1253 1 1 16 HIS O O 24.234 6.855 -4.348 1.00 . A A . 16 HIS O 1 1 4 1254 1 1 17 ILE C C 22.259 5.742 -6.010 1.00 . A A . 17 ILE C 1 1 4 1255 1 1 17 ILE CA C 21.686 5.794 -4.598 1.00 . A A . 17 ILE CA 1 1 4 1256 1 1 17 ILE CB C 20.161 5.594 -4.667 1.00 . A A . 17 ILE CB 1 1 4 1257 1 1 17 ILE CD1 C 18.044 6.788 -5.422 1.00 . A A . 17 ILE CD1 1 1 4 1258 1 1 17 ILE CG1 C 19.533 6.614 -5.619 1.00 . A A . 17 ILE CG1 1 1 4 1259 1 1 17 ILE CG2 C 19.548 5.710 -3.280 1.00 . A A . 17 ILE CG2 1 1 4 1260 1 1 17 ILE H H 21.317 7.587 -3.536 1.00 . A A . 17 ILE H 1 1 4 1261 1 1 17 ILE HA H 22.110 4.986 -4.019 1.00 . A A . 17 ILE HA 1 1 4 1262 1 1 17 ILE HB H 19.968 4.599 -5.038 1.00 . A A . 17 ILE HB 1 1 4 1263 1 1 17 ILE HD11 H 17.645 7.408 -6.211 1.00 . A A . 17 ILE HD11 1 1 4 1264 1 1 17 ILE HD12 H 17.562 5.822 -5.445 1.00 . A A . 17 ILE HD12 1 1 4 1265 1 1 17 ILE HD13 H 17.860 7.259 -4.467 1.00 . A A . 17 ILE HD13 1 1 4 1266 1 1 17 ILE HG12 H 20.001 7.574 -5.468 1.00 . A A . 17 ILE HG12 1 1 4 1267 1 1 17 ILE HG13 H 19.699 6.294 -6.638 1.00 . A A . 17 ILE HG13 1 1 4 1268 1 1 17 ILE HG21 H 20.195 5.231 -2.559 1.00 . A A . 17 ILE HG21 1 1 4 1269 1 1 17 ILE HG22 H 19.434 6.752 -3.022 1.00 . A A . 17 ILE HG22 1 1 4 1270 1 1 17 ILE HG23 H 18.582 5.228 -3.271 1.00 . A A . 17 ILE HG23 1 1 4 1271 1 1 17 ILE N N 22.030 7.048 -3.938 1.00 . A A . 17 ILE N 1 1 4 1272 1 1 17 ILE O O 22.740 4.701 -6.458 1.00 . A A . 17 ILE O 1 1 4 1273 1 1 18 ARG C C 24.224 6.704 -8.098 1.00 . A A . 18 ARG C 1 1 4 1274 1 1 18 ARG CA C 22.720 6.957 -8.069 1.00 . A A . 18 ARG CA 1 1 4 1275 1 1 18 ARG CB C 22.410 8.329 -8.670 1.00 . A A . 18 ARG CB 1 1 4 1276 1 1 18 ARG CD C 22.401 9.649 -10.809 1.00 . A A . 18 ARG CD 1 1 4 1277 1 1 18 ARG CG C 22.151 8.293 -10.167 1.00 . A A . 18 ARG CG 1 1 4 1278 1 1 18 ARG CZ C 23.933 9.061 -12.639 1.00 . A A . 18 ARG CZ 1 1 4 1279 1 1 18 ARG H H 21.810 7.670 -6.296 1.00 . A A . 18 ARG H 1 1 4 1280 1 1 18 ARG HA H 22.228 6.196 -8.656 1.00 . A A . 18 ARG HA 1 1 4 1281 1 1 18 ARG HB2 H 21.533 8.732 -8.185 1.00 . A A . 18 ARG HB2 1 1 4 1282 1 1 18 ARG HB3 H 23.246 8.986 -8.487 1.00 . A A . 18 ARG HB3 1 1 4 1283 1 1 18 ARG HD2 H 21.502 10.242 -10.727 1.00 . A A . 18 ARG HD2 1 1 4 1284 1 1 18 ARG HD3 H 23.205 10.139 -10.280 1.00 . A A . 18 ARG HD3 1 1 4 1285 1 1 18 ARG HE H 22.102 9.813 -12.883 1.00 . A A . 18 ARG HE 1 1 4 1286 1 1 18 ARG HG2 H 22.810 7.566 -10.620 1.00 . A A . 18 ARG HG2 1 1 4 1287 1 1 18 ARG HG3 H 21.124 8.007 -10.339 1.00 . A A . 18 ARG HG3 1 1 4 1288 1 1 18 ARG HH11 H 24.658 8.726 -10.783 1.00 . A A . 18 ARG HH11 1 1 4 1289 1 1 18 ARG HH12 H 25.728 8.315 -12.082 1.00 . A A . 18 ARG HH12 1 1 4 1290 1 1 18 ARG HH21 H 23.502 9.277 -14.602 1.00 . A A . 18 ARG HH21 1 1 4 1291 1 1 18 ARG HH22 H 25.070 8.630 -14.254 1.00 . A A . 18 ARG HH22 1 1 4 1292 1 1 18 ARG N N 22.206 6.873 -6.707 1.00 . A A . 18 ARG N 1 1 4 1293 1 1 18 ARG NE N 22.764 9.529 -12.218 1.00 . A A . 18 ARG NE 1 1 4 1294 1 1 18 ARG NH1 N 24.848 8.669 -11.763 1.00 . A A . 18 ARG NH1 1 1 4 1295 1 1 18 ARG NH2 N 24.189 8.982 -13.938 1.00 . A A . 18 ARG NH2 1 1 4 1296 1 1 18 ARG O O 24.830 6.385 -7.075 1.00 . A A . 18 ARG O 1 1 5 1297 1 1 1 PHE C C 2.925 1.221 1.803 1.00 . A A . 1 PHE C 1 1 5 1298 1 1 1 PHE CA C 2.409 1.023 3.225 1.00 . A A . 1 PHE CA 1 1 5 1299 1 1 1 PHE CB C 1.214 1.945 3.479 1.00 . A A . 1 PHE CB 1 1 5 1300 1 1 1 PHE CD1 C -0.353 0.620 4.923 1.00 . A A . 1 PHE CD1 1 1 5 1301 1 1 1 PHE CD2 C 0.751 2.505 5.881 1.00 . A A . 1 PHE CD2 1 1 5 1302 1 1 1 PHE CE1 C -0.990 0.378 6.126 1.00 . A A . 1 PHE CE1 1 1 5 1303 1 1 1 PHE CE2 C 0.117 2.267 7.086 1.00 . A A . 1 PHE CE2 1 1 5 1304 1 1 1 PHE CG C 0.523 1.685 4.787 1.00 . A A . 1 PHE CG 1 1 5 1305 1 1 1 PHE CZ C -0.755 1.203 7.208 1.00 . A A . 1 PHE CZ 1 1 5 1306 1 1 1 PHE H1 H 4.029 0.537 4.498 1.00 . A A . 1 PHE H1 1 1 5 1307 1 1 1 PHE HA H 2.093 -0.002 3.341 1.00 . A A . 1 PHE HA 1 1 5 1308 1 1 1 PHE HB2 H 1.553 2.970 3.481 1.00 . A A . 1 PHE HB2 1 1 5 1309 1 1 1 PHE HB3 H 0.491 1.811 2.688 1.00 . A A . 1 PHE HB3 1 1 5 1310 1 1 1 PHE HD1 H -0.538 -0.026 4.077 1.00 . A A . 1 PHE HD1 1 1 5 1311 1 1 1 PHE HD2 H 1.432 3.338 5.786 1.00 . A A . 1 PHE HD2 1 1 5 1312 1 1 1 PHE HE1 H -1.671 -0.455 6.218 1.00 . A A . 1 PHE HE1 1 1 5 1313 1 1 1 PHE HE2 H 0.302 2.914 7.930 1.00 . A A . 1 PHE HE2 1 1 5 1314 1 1 1 PHE HZ H -1.251 1.015 8.149 1.00 . A A . 1 PHE HZ 1 1 5 1315 1 1 1 PHE N N 3.462 1.279 4.201 1.00 . A A . 1 PHE N 1 1 5 1316 1 1 1 PHE O O 2.533 0.504 0.882 1.00 . A A . 1 PHE O 1 1 5 1317 1 1 2 LEU C C 5.772 1.887 0.187 1.00 . A A . 2 LEU C 1 1 5 1318 1 1 2 LEU CA C 4.379 2.494 0.323 1.00 . A A . 2 LEU CA 1 1 5 1319 1 1 2 LEU CB C 4.445 4.006 0.102 1.00 . A A . 2 LEU CB 1 1 5 1320 1 1 2 LEU CD1 C 2.795 4.150 -1.779 1.00 . A A . 2 LEU CD1 1 1 5 1321 1 1 2 LEU CD2 C 2.022 4.429 0.583 1.00 . A A . 2 LEU CD2 1 1 5 1322 1 1 2 LEU CG C 3.161 4.669 -0.397 1.00 . A A . 2 LEU CG 1 1 5 1323 1 1 2 LEU H H 4.082 2.737 2.404 1.00 . A A . 2 LEU H 1 1 5 1324 1 1 2 LEU HA H 3.735 2.057 -0.426 1.00 . A A . 2 LEU HA 1 1 5 1325 1 1 2 LEU HB2 H 4.711 4.466 1.041 1.00 . A A . 2 LEU HB2 1 1 5 1326 1 1 2 LEU HB3 H 5.222 4.200 -0.625 1.00 . A A . 2 LEU HB3 1 1 5 1327 1 1 2 LEU HD11 H 1.895 4.639 -2.121 1.00 . A A . 2 LEU HD11 1 1 5 1328 1 1 2 LEU HD12 H 2.630 3.084 -1.732 1.00 . A A . 2 LEU HD12 1 1 5 1329 1 1 2 LEU HD13 H 3.602 4.359 -2.467 1.00 . A A . 2 LEU HD13 1 1 5 1330 1 1 2 LEU HD21 H 2.409 4.427 1.591 1.00 . A A . 2 LEU HD21 1 1 5 1331 1 1 2 LEU HD22 H 1.561 3.474 0.373 1.00 . A A . 2 LEU HD22 1 1 5 1332 1 1 2 LEU HD23 H 1.287 5.214 0.480 1.00 . A A . 2 LEU HD23 1 1 5 1333 1 1 2 LEU HG H 3.319 5.736 -0.473 1.00 . A A . 2 LEU HG 1 1 5 1334 1 1 2 LEU N N 3.808 2.200 1.632 1.00 . A A . 2 LEU N 1 1 5 1335 1 1 2 LEU O O 6.442 1.584 1.174 1.00 . A A . 2 LEU O 1 1 5 1336 1 1 3 PRO C C 8.675 2.083 -0.982 1.00 . A A . 3 PRO C 1 1 5 1337 1 1 3 PRO CA C 7.539 1.139 -1.358 1.00 . A A . 3 PRO CA 1 1 5 1338 1 1 3 PRO CB C 7.502 0.923 -2.873 1.00 . A A . 3 PRO CB 1 1 5 1339 1 1 3 PRO CD C 5.475 2.047 -2.288 1.00 . A A . 3 PRO CD 1 1 5 1340 1 1 3 PRO CG C 6.508 1.913 -3.373 1.00 . A A . 3 PRO CG 1 1 5 1341 1 1 3 PRO HA H 7.682 0.190 -0.862 1.00 . A A . 3 PRO HA 1 1 5 1342 1 1 3 PRO HB2 H 8.484 1.103 -3.289 1.00 . A A . 3 PRO HB2 1 1 5 1343 1 1 3 PRO HB3 H 7.194 -0.089 -3.089 1.00 . A A . 3 PRO HB3 1 1 5 1344 1 1 3 PRO HD2 H 5.102 3.059 -2.244 1.00 . A A . 3 PRO HD2 1 1 5 1345 1 1 3 PRO HD3 H 4.665 1.351 -2.450 1.00 . A A . 3 PRO HD3 1 1 5 1346 1 1 3 PRO HG2 H 6.991 2.862 -3.549 1.00 . A A . 3 PRO HG2 1 1 5 1347 1 1 3 PRO HG3 H 6.051 1.549 -4.281 1.00 . A A . 3 PRO HG3 1 1 5 1348 1 1 3 PRO N N 6.220 1.708 -1.064 1.00 . A A . 3 PRO N 1 1 5 1349 1 1 3 PRO O O 9.831 1.672 -0.880 1.00 . A A . 3 PRO O 1 1 5 1350 1 1 4 LYS C C 9.016 4.960 0.955 1.00 . A A . 4 LYS C 1 1 5 1351 1 1 4 LYS CA C 9.331 4.357 -0.411 1.00 . A A . 4 LYS CA 1 1 5 1352 1 1 4 LYS CB C 9.383 5.462 -1.468 1.00 . A A . 4 LYS CB 1 1 5 1353 1 1 4 LYS CD C 7.938 6.982 -2.850 1.00 . A A . 4 LYS CD 1 1 5 1354 1 1 4 LYS CE C 9.086 7.355 -3.775 1.00 . A A . 4 LYS CE 1 1 5 1355 1 1 4 LYS CG C 8.109 5.581 -2.287 1.00 . A A . 4 LYS CG 1 1 5 1356 1 1 4 LYS H H 7.401 3.620 -0.874 1.00 . A A . 4 LYS H 1 1 5 1357 1 1 4 LYS HA H 10.294 3.871 -0.363 1.00 . A A . 4 LYS HA 1 1 5 1358 1 1 4 LYS HB2 H 9.560 6.407 -0.976 1.00 . A A . 4 LYS HB2 1 1 5 1359 1 1 4 LYS HB3 H 10.202 5.259 -2.143 1.00 . A A . 4 LYS HB3 1 1 5 1360 1 1 4 LYS HD2 H 7.014 7.025 -3.407 1.00 . A A . 4 LYS HD2 1 1 5 1361 1 1 4 LYS HD3 H 7.901 7.687 -2.032 1.00 . A A . 4 LYS HD3 1 1 5 1362 1 1 4 LYS HE2 H 8.918 8.352 -4.152 1.00 . A A . 4 LYS HE2 1 1 5 1363 1 1 4 LYS HE3 H 10.007 7.335 -3.209 1.00 . A A . 4 LYS HE3 1 1 5 1364 1 1 4 LYS HG2 H 8.151 4.878 -3.105 1.00 . A A . 4 LYS HG2 1 1 5 1365 1 1 4 LYS HG3 H 7.263 5.351 -1.654 1.00 . A A . 4 LYS HG3 1 1 5 1366 1 1 4 LYS HZ1 H 9.744 5.572 -4.641 1.00 . A A . 4 LYS HZ1 1 1 5 1367 1 1 4 LYS HZ2 H 9.691 6.877 -5.716 1.00 . A A . 4 LYS HZ2 1 1 5 1368 1 1 4 LYS HZ3 H 8.257 6.117 -5.239 1.00 . A A . 4 LYS HZ3 1 1 5 1369 1 1 4 LYS N N 8.340 3.353 -0.777 1.00 . A A . 4 LYS N 1 1 5 1370 1 1 4 LYS NZ N 9.203 6.414 -4.923 1.00 . A A . 4 LYS NZ 1 1 5 1371 1 1 4 LYS O O 9.232 6.150 1.184 1.00 . A A . 4 LYS O 1 1 5 1372 1 1 5 LEU C C 9.257 5.478 3.773 1.00 . A A . 5 LEU C 1 1 5 1373 1 1 5 LEU CA C 8.162 4.582 3.203 1.00 . A A . 5 LEU CA 1 1 5 1374 1 1 5 LEU CB C 7.940 3.381 4.124 1.00 . A A . 5 LEU CB 1 1 5 1375 1 1 5 LEU CD1 C 6.342 2.043 5.518 1.00 . A A . 5 LEU CD1 1 1 5 1376 1 1 5 LEU CD2 C 6.894 4.396 6.163 1.00 . A A . 5 LEU CD2 1 1 5 1377 1 1 5 LEU CG C 6.691 3.432 5.004 1.00 . A A . 5 LEU CG 1 1 5 1378 1 1 5 LEU H H 8.357 3.193 1.618 1.00 . A A . 5 LEU H 1 1 5 1379 1 1 5 LEU HA H 7.246 5.149 3.137 1.00 . A A . 5 LEU HA 1 1 5 1380 1 1 5 LEU HB2 H 7.873 2.498 3.506 1.00 . A A . 5 LEU HB2 1 1 5 1381 1 1 5 LEU HB3 H 8.800 3.299 4.773 1.00 . A A . 5 LEU HB3 1 1 5 1382 1 1 5 LEU HD11 H 7.205 1.612 6.002 1.00 . A A . 5 LEU HD11 1 1 5 1383 1 1 5 LEU HD12 H 6.043 1.418 4.690 1.00 . A A . 5 LEU HD12 1 1 5 1384 1 1 5 LEU HD13 H 5.529 2.115 6.226 1.00 . A A . 5 LEU HD13 1 1 5 1385 1 1 5 LEU HD21 H 7.089 3.836 7.066 1.00 . A A . 5 LEU HD21 1 1 5 1386 1 1 5 LEU HD22 H 6.003 4.993 6.295 1.00 . A A . 5 LEU HD22 1 1 5 1387 1 1 5 LEU HD23 H 7.733 5.042 5.951 1.00 . A A . 5 LEU HD23 1 1 5 1388 1 1 5 LEU HG H 5.857 3.788 4.414 1.00 . A A . 5 LEU HG 1 1 5 1389 1 1 5 LEU N N 8.506 4.130 1.859 1.00 . A A . 5 LEU N 1 1 5 1390 1 1 5 LEU O O 8.974 6.462 4.457 1.00 . A A . 5 LEU O 1 1 5 1391 1 1 6 PHE C C 12.506 6.391 2.804 1.00 . A A . 6 PHE C 1 1 5 1392 1 1 6 PHE CA C 11.645 5.907 3.967 1.00 . A A . 6 PHE CA 1 1 5 1393 1 1 6 PHE CB C 12.490 5.067 4.927 1.00 . A A . 6 PHE CB 1 1 5 1394 1 1 6 PHE CD1 C 14.437 6.152 6.080 1.00 . A A . 6 PHE CD1 1 1 5 1395 1 1 6 PHE CD2 C 12.284 6.316 7.094 1.00 . A A . 6 PHE CD2 1 1 5 1396 1 1 6 PHE CE1 C 14.985 6.883 7.118 1.00 . A A . 6 PHE CE1 1 1 5 1397 1 1 6 PHE CE2 C 12.827 7.048 8.133 1.00 . A A . 6 PHE CE2 1 1 5 1398 1 1 6 PHE CG C 13.082 5.861 6.056 1.00 . A A . 6 PHE CG 1 1 5 1399 1 1 6 PHE CZ C 14.179 7.330 8.146 1.00 . A A . 6 PHE CZ 1 1 5 1400 1 1 6 PHE H H 10.669 4.337 2.935 1.00 . A A . 6 PHE H 1 1 5 1401 1 1 6 PHE HA H 11.260 6.765 4.497 1.00 . A A . 6 PHE HA 1 1 5 1402 1 1 6 PHE HB2 H 11.872 4.292 5.355 1.00 . A A . 6 PHE HB2 1 1 5 1403 1 1 6 PHE HB3 H 13.301 4.613 4.378 1.00 . A A . 6 PHE HB3 1 1 5 1404 1 1 6 PHE HD1 H 15.068 5.802 5.276 1.00 . A A . 6 PHE HD1 1 1 5 1405 1 1 6 PHE HD2 H 11.227 6.095 7.086 1.00 . A A . 6 PHE HD2 1 1 5 1406 1 1 6 PHE HE1 H 16.042 7.102 7.124 1.00 . A A . 6 PHE HE1 1 1 5 1407 1 1 6 PHE HE2 H 12.194 7.396 8.936 1.00 . A A . 6 PHE HE2 1 1 5 1408 1 1 6 PHE HZ H 14.605 7.902 8.957 1.00 . A A . 6 PHE HZ 1 1 5 1409 1 1 6 PHE N N 10.507 5.133 3.485 1.00 . A A . 6 PHE N 1 1 5 1410 1 1 6 PHE O O 13.415 7.201 2.986 1.00 . A A . 6 PHE O 1 1 5 1411 1 1 7 ALA C C 12.623 7.697 -0.007 1.00 . A A . 7 ALA C 1 1 5 1412 1 1 7 ALA CA C 12.958 6.271 0.416 1.00 . A A . 7 ALA CA 1 1 5 1413 1 1 7 ALA CB C 12.669 5.300 -0.719 1.00 . A A . 7 ALA CB 1 1 5 1414 1 1 7 ALA H H 11.476 5.248 1.528 1.00 . A A . 7 ALA H 1 1 5 1415 1 1 7 ALA HA H 14.011 6.213 0.648 1.00 . A A . 7 ALA HA 1 1 5 1416 1 1 7 ALA HB1 H 11.994 5.762 -1.424 1.00 . A A . 7 ALA HB1 1 1 5 1417 1 1 7 ALA HB2 H 13.593 5.046 -1.218 1.00 . A A . 7 ALA HB2 1 1 5 1418 1 1 7 ALA HB3 H 12.217 4.405 -0.320 1.00 . A A . 7 ALA HB3 1 1 5 1419 1 1 7 ALA N N 12.212 5.889 1.609 1.00 . A A . 7 ALA N 1 1 5 1420 1 1 7 ALA O O 13.445 8.385 -0.613 1.00 . A A . 7 ALA O 1 1 5 1421 1 1 8 LYS C C 11.333 10.474 1.067 1.00 . A A . 8 LYS C 1 1 5 1422 1 1 8 LYS CA C 10.966 9.481 -0.031 1.00 . A A . 8 LYS CA 1 1 5 1423 1 1 8 LYS CB C 9.454 9.497 -0.263 1.00 . A A . 8 LYS CB 1 1 5 1424 1 1 8 LYS CD C 7.606 10.016 1.357 1.00 . A A . 8 LYS CD 1 1 5 1425 1 1 8 LYS CE C 6.394 9.992 0.438 1.00 . A A . 8 LYS CE 1 1 5 1426 1 1 8 LYS CG C 8.651 9.000 0.927 1.00 . A A . 8 LYS CG 1 1 5 1427 1 1 8 LYS H H 10.800 7.540 0.798 1.00 . A A . 8 LYS H 1 1 5 1428 1 1 8 LYS HA H 11.465 9.771 -0.944 1.00 . A A . 8 LYS HA 1 1 5 1429 1 1 8 LYS HB2 H 9.146 10.508 -0.482 1.00 . A A . 8 LYS HB2 1 1 5 1430 1 1 8 LYS HB3 H 9.225 8.868 -1.112 1.00 . A A . 8 LYS HB3 1 1 5 1431 1 1 8 LYS HD2 H 7.285 9.786 2.362 1.00 . A A . 8 LYS HD2 1 1 5 1432 1 1 8 LYS HD3 H 8.045 11.003 1.334 1.00 . A A . 8 LYS HD3 1 1 5 1433 1 1 8 LYS HE2 H 6.142 11.007 0.170 1.00 . A A . 8 LYS HE2 1 1 5 1434 1 1 8 LYS HE3 H 6.646 9.436 -0.453 1.00 . A A . 8 LYS HE3 1 1 5 1435 1 1 8 LYS HG2 H 8.153 8.081 0.656 1.00 . A A . 8 LYS HG2 1 1 5 1436 1 1 8 LYS HG3 H 9.324 8.818 1.753 1.00 . A A . 8 LYS HG3 1 1 5 1437 1 1 8 LYS HZ1 H 5.453 9.078 2.063 1.00 . A A . 8 LYS HZ1 1 1 5 1438 1 1 8 LYS HZ2 H 4.929 8.508 0.560 1.00 . A A . 8 LYS HZ2 1 1 5 1439 1 1 8 LYS HZ3 H 4.418 10.022 1.115 1.00 . A A . 8 LYS HZ3 1 1 5 1440 1 1 8 LYS N N 11.411 8.136 0.315 1.00 . A A . 8 LYS N 1 1 5 1441 1 1 8 LYS NZ N 5.216 9.356 1.089 1.00 . A A . 8 LYS NZ 1 1 5 1442 1 1 8 LYS O O 11.622 11.639 0.791 1.00 . A A . 8 LYS O 1 1 5 1443 1 1 9 ILE C C 13.154 11.127 3.509 1.00 . A A . 9 ILE C 1 1 5 1444 1 1 9 ILE CA C 11.655 10.854 3.448 1.00 . A A . 9 ILE CA 1 1 5 1445 1 1 9 ILE CB C 11.207 10.215 4.776 1.00 . A A . 9 ILE CB 1 1 5 1446 1 1 9 ILE CD1 C 13.292 9.791 6.174 1.00 . A A . 9 ILE CD1 1 1 5 1447 1 1 9 ILE CG1 C 12.246 9.199 5.255 1.00 . A A . 9 ILE CG1 1 1 5 1448 1 1 9 ILE CG2 C 9.847 9.554 4.613 1.00 . A A . 9 ILE CG2 1 1 5 1449 1 1 9 ILE H H 11.082 9.069 2.466 1.00 . A A . 9 ILE H 1 1 5 1450 1 1 9 ILE HA H 11.134 11.792 3.329 1.00 . A A . 9 ILE HA 1 1 5 1451 1 1 9 ILE HB H 11.114 10.999 5.513 1.00 . A A . 9 ILE HB 1 1 5 1452 1 1 9 ILE HD11 H 13.067 9.522 7.195 1.00 . A A . 9 ILE HD11 1 1 5 1453 1 1 9 ILE HD12 H 14.265 9.410 5.905 1.00 . A A . 9 ILE HD12 1 1 5 1454 1 1 9 ILE HD13 H 13.288 10.867 6.077 1.00 . A A . 9 ILE HD13 1 1 5 1455 1 1 9 ILE HG12 H 11.746 8.407 5.789 1.00 . A A . 9 ILE HG12 1 1 5 1456 1 1 9 ILE HG13 H 12.754 8.784 4.397 1.00 . A A . 9 ILE HG13 1 1 5 1457 1 1 9 ILE HG21 H 9.251 9.735 5.496 1.00 . A A . 9 ILE HG21 1 1 5 1458 1 1 9 ILE HG22 H 9.346 9.968 3.751 1.00 . A A . 9 ILE HG22 1 1 5 1459 1 1 9 ILE HG23 H 9.977 8.491 4.478 1.00 . A A . 9 ILE HG23 1 1 5 1460 1 1 9 ILE N N 11.321 10.006 2.310 1.00 . A A . 9 ILE N 1 1 5 1461 1 1 9 ILE O O 13.590 12.152 4.033 1.00 . A A . 9 ILE O 1 1 5 1462 1 1 10 THR C C 15.856 11.180 1.771 1.00 . A A . 10 THR C 1 1 5 1463 1 1 10 THR CA C 15.392 10.343 2.957 1.00 . A A . 10 THR CA 1 1 5 1464 1 1 10 THR CB C 16.089 8.971 2.907 1.00 . A A . 10 THR CB 1 1 5 1465 1 1 10 THR CG2 C 15.959 8.248 4.239 1.00 . A A . 10 THR CG2 1 1 5 1466 1 1 10 THR H H 13.535 9.407 2.563 1.00 . A A . 10 THR H 1 1 5 1467 1 1 10 THR HA H 15.684 10.839 3.872 1.00 . A A . 10 THR HA 1 1 5 1468 1 1 10 THR HB H 17.138 9.124 2.698 1.00 . A A . 10 THR HB 1 1 5 1469 1 1 10 THR HG1 H 16.217 7.705 1.400 1.00 . A A . 10 THR HG1 1 1 5 1470 1 1 10 THR HG21 H 14.914 8.107 4.472 1.00 . A A . 10 THR HG21 1 1 5 1471 1 1 10 THR HG22 H 16.425 8.838 5.015 1.00 . A A . 10 THR HG22 1 1 5 1472 1 1 10 THR HG23 H 16.447 7.287 4.176 1.00 . A A . 10 THR HG23 1 1 5 1473 1 1 10 THR N N 13.941 10.203 2.966 1.00 . A A . 10 THR N 1 1 5 1474 1 1 10 THR O O 15.609 10.831 0.616 1.00 . A A . 10 THR O 1 1 5 1475 1 1 10 THR OG1 O 15.518 8.169 1.866 1.00 . A A . 10 THR OG1 1 1 5 1476 1 1 11 LYS C C 18.548 13.317 1.108 1.00 . A A . 11 LYS C 1 1 5 1477 1 1 11 LYS CA C 17.032 13.175 1.019 1.00 . A A . 11 LYS CA 1 1 5 1478 1 1 11 LYS CB C 16.372 14.551 1.131 1.00 . A A . 11 LYS CB 1 1 5 1479 1 1 11 LYS CD C 15.167 14.674 3.332 1.00 . A A . 11 LYS CD 1 1 5 1480 1 1 11 LYS CE C 14.825 15.665 4.433 1.00 . A A . 11 LYS CE 1 1 5 1481 1 1 11 LYS CG C 16.385 15.119 2.540 1.00 . A A . 11 LYS CG 1 1 5 1482 1 1 11 LYS H H 16.696 12.513 3.002 1.00 . A A . 11 LYS H 1 1 5 1483 1 1 11 LYS HA H 16.779 12.740 0.064 1.00 . A A . 11 LYS HA 1 1 5 1484 1 1 11 LYS HB2 H 16.892 15.240 0.482 1.00 . A A . 11 LYS HB2 1 1 5 1485 1 1 11 LYS HB3 H 15.344 14.472 0.807 1.00 . A A . 11 LYS HB3 1 1 5 1486 1 1 11 LYS HD2 H 14.323 14.591 2.663 1.00 . A A . 11 LYS HD2 1 1 5 1487 1 1 11 LYS HD3 H 15.371 13.710 3.777 1.00 . A A . 11 LYS HD3 1 1 5 1488 1 1 11 LYS HE2 H 15.650 16.352 4.550 1.00 . A A . 11 LYS HE2 1 1 5 1489 1 1 11 LYS HE3 H 13.940 16.212 4.145 1.00 . A A . 11 LYS HE3 1 1 5 1490 1 1 11 LYS HG2 H 17.275 14.778 3.047 1.00 . A A . 11 LYS HG2 1 1 5 1491 1 1 11 LYS HG3 H 16.391 16.198 2.483 1.00 . A A . 11 LYS HG3 1 1 5 1492 1 1 11 LYS HZ1 H 13.582 15.122 6.021 1.00 . A A . 11 LYS HZ1 1 1 5 1493 1 1 11 LYS HZ2 H 15.193 15.378 6.469 1.00 . A A . 11 LYS HZ2 1 1 5 1494 1 1 11 LYS HZ3 H 14.759 13.966 5.646 1.00 . A A . 11 LYS HZ3 1 1 5 1495 1 1 11 LYS N N 16.530 12.288 2.062 1.00 . A A . 11 LYS N 1 1 5 1496 1 1 11 LYS NZ N 14.572 14.985 5.733 1.00 . A A . 11 LYS NZ 1 1 5 1497 1 1 11 LYS O O 19.128 14.248 0.550 1.00 . A A . 11 LYS O 1 1 5 1498 1 1 12 LYS C C 21.261 11.141 1.401 1.00 . A A . 12 LYS C 1 1 5 1499 1 1 12 LYS CA C 20.633 12.408 1.974 1.00 . A A . 12 LYS CA 1 1 5 1500 1 1 12 LYS CB C 21.001 12.549 3.452 1.00 . A A . 12 LYS CB 1 1 5 1501 1 1 12 LYS CD C 20.489 11.671 5.749 1.00 . A A . 12 LYS CD 1 1 5 1502 1 1 12 LYS CE C 21.258 10.361 5.669 1.00 . A A . 12 LYS CE 1 1 5 1503 1 1 12 LYS CG C 19.916 12.065 4.398 1.00 . A A . 12 LYS CG 1 1 5 1504 1 1 12 LYS H H 18.666 11.670 2.235 1.00 . A A . 12 LYS H 1 1 5 1505 1 1 12 LYS HA H 21.015 13.260 1.433 1.00 . A A . 12 LYS HA 1 1 5 1506 1 1 12 LYS HB2 H 21.898 11.978 3.644 1.00 . A A . 12 LYS HB2 1 1 5 1507 1 1 12 LYS HB3 H 21.196 13.591 3.664 1.00 . A A . 12 LYS HB3 1 1 5 1508 1 1 12 LYS HD2 H 21.158 12.448 6.087 1.00 . A A . 12 LYS HD2 1 1 5 1509 1 1 12 LYS HD3 H 19.678 11.560 6.456 1.00 . A A . 12 LYS HD3 1 1 5 1510 1 1 12 LYS HE2 H 20.664 9.644 5.123 1.00 . A A . 12 LYS HE2 1 1 5 1511 1 1 12 LYS HE3 H 22.185 10.536 5.143 1.00 . A A . 12 LYS HE3 1 1 5 1512 1 1 12 LYS HG2 H 19.196 12.857 4.541 1.00 . A A . 12 LYS HG2 1 1 5 1513 1 1 12 LYS HG3 H 19.427 11.206 3.961 1.00 . A A . 12 LYS HG3 1 1 5 1514 1 1 12 LYS HZ1 H 20.923 9.019 7.234 1.00 . A A . 12 LYS HZ1 1 1 5 1515 1 1 12 LYS HZ2 H 21.434 10.549 7.741 1.00 . A A . 12 LYS HZ2 1 1 5 1516 1 1 12 LYS HZ3 H 22.543 9.472 7.055 1.00 . A A . 12 LYS HZ3 1 1 5 1517 1 1 12 LYS N N 19.184 12.388 1.813 1.00 . A A . 12 LYS N 1 1 5 1518 1 1 12 LYS NZ N 21.561 9.812 7.019 1.00 . A A . 12 LYS NZ 1 1 5 1519 1 1 12 LYS O O 21.819 11.154 0.305 1.00 . A A . 12 LYS O 1 1 5 1520 1 1 13 ASN C C 21.257 8.426 0.306 1.00 . A A . 13 ASN C 1 1 5 1521 1 1 13 ASN CA C 21.723 8.772 1.717 1.00 . A A . 13 ASN CA 1 1 5 1522 1 1 13 ASN CB C 21.319 7.659 2.686 1.00 . A A . 13 ASN CB 1 1 5 1523 1 1 13 ASN CG C 22.510 7.068 3.417 1.00 . A A . 13 ASN CG 1 1 5 1524 1 1 13 ASN H H 20.708 10.099 3.016 1.00 . A A . 13 ASN H 1 1 5 1525 1 1 13 ASN HA H 22.798 8.864 1.717 1.00 . A A . 13 ASN HA 1 1 5 1526 1 1 13 ASN HB2 H 20.634 8.059 3.419 1.00 . A A . 13 ASN HB2 1 1 5 1527 1 1 13 ASN HB3 H 20.830 6.869 2.136 1.00 . A A . 13 ASN HB3 1 1 5 1528 1 1 13 ASN HD21 H 21.475 7.021 5.115 1.00 . A A . 13 ASN HD21 1 1 5 1529 1 1 13 ASN HD22 H 23.098 6.434 5.207 1.00 . A A . 13 ASN HD22 1 1 5 1530 1 1 13 ASN N N 21.165 10.047 2.151 1.00 . A A . 13 ASN N 1 1 5 1531 1 1 13 ASN ND2 N 22.344 6.815 4.710 1.00 . A A . 13 ASN ND2 1 1 5 1532 1 1 13 ASN O O 21.957 7.739 -0.438 1.00 . A A . 13 ASN O 1 1 5 1533 1 1 13 ASN OD1 O 23.565 6.842 2.825 1.00 . A A . 13 ASN OD1 1 1 5 1534 1 1 14 MET C C 20.431 9.195 -2.469 1.00 . A A . 14 MET C 1 1 5 1535 1 1 14 MET CA C 19.515 8.651 -1.378 1.00 . A A . 14 MET CA 1 1 5 1536 1 1 14 MET CB C 18.126 9.281 -1.500 1.00 . A A . 14 MET CB 1 1 5 1537 1 1 14 MET CE C 16.171 6.450 -3.497 1.00 . A A . 14 MET CE 1 1 5 1538 1 1 14 MET CG C 17.362 8.834 -2.735 1.00 . A A . 14 MET CG 1 1 5 1539 1 1 14 MET H H 19.561 9.449 0.582 1.00 . A A . 14 MET H 1 1 5 1540 1 1 14 MET HA H 19.426 7.582 -1.498 1.00 . A A . 14 MET HA 1 1 5 1541 1 1 14 MET HB2 H 17.546 9.017 -0.629 1.00 . A A . 14 MET HB2 1 1 5 1542 1 1 14 MET HB3 H 18.233 10.355 -1.539 1.00 . A A . 14 MET HB3 1 1 5 1543 1 1 14 MET HE1 H 15.303 6.375 -4.136 1.00 . A A . 14 MET HE1 1 1 5 1544 1 1 14 MET HE2 H 17.047 6.639 -4.099 1.00 . A A . 14 MET HE2 1 1 5 1545 1 1 14 MET HE3 H 16.299 5.525 -2.954 1.00 . A A . 14 MET HE3 1 1 5 1546 1 1 14 MET HG2 H 17.012 9.708 -3.263 1.00 . A A . 14 MET HG2 1 1 5 1547 1 1 14 MET HG3 H 18.032 8.275 -3.373 1.00 . A A . 14 MET HG3 1 1 5 1548 1 1 14 MET N N 20.073 8.908 -0.055 1.00 . A A . 14 MET N 1 1 5 1549 1 1 14 MET O O 20.813 8.473 -3.389 1.00 . A A . 14 MET O 1 1 5 1550 1 1 14 MET SD S 15.943 7.795 -2.336 1.00 . A A . 14 MET SD 1 1 5 1551 1 1 15 ALA C C 23.101 10.688 -3.140 1.00 . A A . 15 ALA C 1 1 5 1552 1 1 15 ALA CA C 21.651 11.113 -3.338 1.00 . A A . 15 ALA CA 1 1 5 1553 1 1 15 ALA CB C 21.526 12.627 -3.246 1.00 . A A . 15 ALA CB 1 1 5 1554 1 1 15 ALA H H 20.441 10.998 -1.605 1.00 . A A . 15 ALA H 1 1 5 1555 1 1 15 ALA HA H 21.328 10.809 -4.323 1.00 . A A . 15 ALA HA 1 1 5 1556 1 1 15 ALA HB1 H 22.199 12.997 -2.487 1.00 . A A . 15 ALA HB1 1 1 5 1557 1 1 15 ALA HB2 H 21.778 13.068 -4.198 1.00 . A A . 15 ALA HB2 1 1 5 1558 1 1 15 ALA HB3 H 20.511 12.889 -2.985 1.00 . A A . 15 ALA HB3 1 1 5 1559 1 1 15 ALA N N 20.778 10.474 -2.361 1.00 . A A . 15 ALA N 1 1 5 1560 1 1 15 ALA O O 23.992 11.123 -3.871 1.00 . A A . 15 ALA O 1 1 5 1561 1 1 16 HIS C C 24.856 7.916 -2.342 1.00 . A A . 16 HIS C 1 1 5 1562 1 1 16 HIS CA C 24.677 9.350 -1.854 1.00 . A A . 16 HIS CA 1 1 5 1563 1 1 16 HIS CB C 24.953 9.428 -0.352 1.00 . A A . 16 HIS CB 1 1 5 1564 1 1 16 HIS CD2 C 25.926 11.694 0.451 1.00 . A A . 16 HIS CD2 1 1 5 1565 1 1 16 HIS CE1 C 28.056 11.195 0.317 1.00 . A A . 16 HIS CE1 1 1 5 1566 1 1 16 HIS CG C 26.017 10.418 0.011 1.00 . A A . 16 HIS CG 1 1 5 1567 1 1 16 HIS H H 22.583 9.524 -1.600 1.00 . A A . 16 HIS H 1 1 5 1568 1 1 16 HIS HA H 25.379 9.984 -2.373 1.00 . A A . 16 HIS HA 1 1 5 1569 1 1 16 HIS HB2 H 24.046 9.714 0.160 1.00 . A A . 16 HIS HB2 1 1 5 1570 1 1 16 HIS HB3 H 25.269 8.456 0.000 1.00 . A A . 16 HIS HB3 1 1 5 1571 1 1 16 HIS HD1 H 27.756 9.284 -0.351 1.00 . A A . 16 HIS HD1 1 1 5 1572 1 1 16 HIS HD2 H 25.014 12.249 0.627 1.00 . A A . 16 HIS HD2 1 1 5 1573 1 1 16 HIS HE1 H 29.133 11.265 0.361 1.00 . A A . 16 HIS HE1 1 1 5 1574 1 1 16 HIS N N 23.333 9.835 -2.147 1.00 . A A . 16 HIS N 1 1 5 1575 1 1 16 HIS ND1 N 27.365 10.135 -0.064 1.00 . A A . 16 HIS ND1 1 1 5 1576 1 1 16 HIS NE2 N 27.206 12.155 0.634 1.00 . A A . 16 HIS NE2 1 1 5 1577 1 1 16 HIS O O 25.981 7.436 -2.489 1.00 . A A . 16 HIS O 1 1 5 1578 1 1 17 ILE C C 24.671 5.720 -4.291 1.00 . A A . 17 ILE C 1 1 5 1579 1 1 17 ILE CA C 23.776 5.858 -3.063 1.00 . A A . 17 ILE CA 1 1 5 1580 1 1 17 ILE CB C 22.366 5.346 -3.409 1.00 . A A . 17 ILE CB 1 1 5 1581 1 1 17 ILE CD1 C 20.324 5.967 -4.797 1.00 . A A . 17 ILE CD1 1 1 5 1582 1 1 17 ILE CG1 C 21.826 6.070 -4.645 1.00 . A A . 17 ILE CG1 1 1 5 1583 1 1 17 ILE CG2 C 21.428 5.535 -2.226 1.00 . A A . 17 ILE CG2 1 1 5 1584 1 1 17 ILE H H 22.875 7.674 -2.455 1.00 . A A . 17 ILE H 1 1 5 1585 1 1 17 ILE HA H 24.176 5.244 -2.269 1.00 . A A . 17 ILE HA 1 1 5 1586 1 1 17 ILE HB H 22.432 4.290 -3.620 1.00 . A A . 17 ILE HB 1 1 5 1587 1 1 17 ILE HD11 H 20.027 4.930 -4.742 1.00 . A A . 17 ILE HD11 1 1 5 1588 1 1 17 ILE HD12 H 19.843 6.523 -4.007 1.00 . A A . 17 ILE HD12 1 1 5 1589 1 1 17 ILE HD13 H 20.031 6.373 -5.754 1.00 . A A . 17 ILE HD13 1 1 5 1590 1 1 17 ILE HG12 H 22.081 7.116 -4.582 1.00 . A A . 17 ILE HG12 1 1 5 1591 1 1 17 ILE HG13 H 22.280 5.645 -5.528 1.00 . A A . 17 ILE HG13 1 1 5 1592 1 1 17 ILE HG21 H 20.580 4.874 -2.330 1.00 . A A . 17 ILE HG21 1 1 5 1593 1 1 17 ILE HG22 H 21.953 5.304 -1.311 1.00 . A A . 17 ILE HG22 1 1 5 1594 1 1 17 ILE HG23 H 21.087 6.558 -2.197 1.00 . A A . 17 ILE HG23 1 1 5 1595 1 1 17 ILE N N 23.741 7.237 -2.591 1.00 . A A . 17 ILE N 1 1 5 1596 1 1 17 ILE O O 25.409 4.744 -4.426 1.00 . A A . 17 ILE O 1 1 5 1597 1 1 18 ARG C C 26.862 7.021 -6.089 1.00 . A A . 18 ARG C 1 1 5 1598 1 1 18 ARG CA C 25.404 6.692 -6.397 1.00 . A A . 18 ARG CA 1 1 5 1599 1 1 18 ARG CB C 24.848 7.694 -7.411 1.00 . A A . 18 ARG CB 1 1 5 1600 1 1 18 ARG CD C 22.712 8.429 -8.512 1.00 . A A . 18 ARG CD 1 1 5 1601 1 1 18 ARG CG C 23.551 7.243 -8.064 1.00 . A A . 18 ARG CG 1 1 5 1602 1 1 18 ARG CZ C 20.418 8.855 -9.287 1.00 . A A . 18 ARG CZ 1 1 5 1603 1 1 18 ARG H H 23.993 7.455 -5.017 1.00 . A A . 18 ARG H 1 1 5 1604 1 1 18 ARG HA H 25.353 5.700 -6.820 1.00 . A A . 18 ARG HA 1 1 5 1605 1 1 18 ARG HB2 H 24.665 8.633 -6.910 1.00 . A A . 18 ARG HB2 1 1 5 1606 1 1 18 ARG HB3 H 25.582 7.847 -8.188 1.00 . A A . 18 ARG HB3 1 1 5 1607 1 1 18 ARG HD2 H 22.550 9.080 -7.665 1.00 . A A . 18 ARG HD2 1 1 5 1608 1 1 18 ARG HD3 H 23.250 8.965 -9.279 1.00 . A A . 18 ARG HD3 1 1 5 1609 1 1 18 ARG HE H 21.286 7.060 -9.226 1.00 . A A . 18 ARG HE 1 1 5 1610 1 1 18 ARG HG2 H 23.785 6.636 -8.926 1.00 . A A . 18 ARG HG2 1 1 5 1611 1 1 18 ARG HG3 H 22.985 6.660 -7.353 1.00 . A A . 18 ARG HG3 1 1 5 1612 1 1 18 ARG HH11 H 21.430 10.496 -8.686 1.00 . A A . 18 ARG HH11 1 1 5 1613 1 1 18 ARG HH12 H 19.812 10.782 -9.235 1.00 . A A . 18 ARG HH12 1 1 5 1614 1 1 18 ARG HH21 H 19.154 7.424 -9.951 1.00 . A A . 18 ARG HH21 1 1 5 1615 1 1 18 ARG HH22 H 18.518 9.034 -9.954 1.00 . A A . 18 ARG HH22 1 1 5 1616 1 1 18 ARG N N 24.600 6.704 -5.181 1.00 . A A . 18 ARG N 1 1 5 1617 1 1 18 ARG NE N 21.416 8.014 -9.043 1.00 . A A . 18 ARG NE 1 1 5 1618 1 1 18 ARG NH1 N 20.565 10.151 -9.049 1.00 . A A . 18 ARG NH1 1 1 5 1619 1 1 18 ARG NH2 N 19.269 8.400 -9.770 1.00 . A A . 18 ARG NH2 1 1 5 1620 1 1 18 ARG O O 27.227 8.187 -5.941 1.00 . A A . 18 ARG O 1 1 6 1621 1 1 1 PHE C C 4.252 0.686 -3.076 1.00 . A A . 1 PHE C 1 1 6 1622 1 1 1 PHE CA C 4.042 0.822 -4.582 1.00 . A A . 1 PHE CA 1 1 6 1623 1 1 1 PHE CB C 4.108 2.296 -4.986 1.00 . A A . 1 PHE CB 1 1 6 1624 1 1 1 PHE CD1 C 6.583 2.296 -5.401 1.00 . A A . 1 PHE CD1 1 1 6 1625 1 1 1 PHE CD2 C 5.161 3.293 -7.034 1.00 . A A . 1 PHE CD2 1 1 6 1626 1 1 1 PHE CE1 C 7.689 2.606 -6.169 1.00 . A A . 1 PHE CE1 1 1 6 1627 1 1 1 PHE CE2 C 6.263 3.605 -7.807 1.00 . A A . 1 PHE CE2 1 1 6 1628 1 1 1 PHE CG C 5.308 2.635 -5.824 1.00 . A A . 1 PHE CG 1 1 6 1629 1 1 1 PHE CZ C 7.529 3.262 -7.374 1.00 . A A . 1 PHE CZ 1 1 6 1630 1 1 1 PHE H1 H 2.003 0.294 -4.368 1.00 . A A . 1 PHE H1 1 1 6 1631 1 1 1 PHE HA H 4.825 0.282 -5.092 1.00 . A A . 1 PHE HA 1 1 6 1632 1 1 1 PHE HB2 H 3.225 2.545 -5.556 1.00 . A A . 1 PHE HB2 1 1 6 1633 1 1 1 PHE HB3 H 4.141 2.905 -4.096 1.00 . A A . 1 PHE HB3 1 1 6 1634 1 1 1 PHE HD1 H 6.709 1.782 -4.458 1.00 . A A . 1 PHE HD1 1 1 6 1635 1 1 1 PHE HD2 H 4.172 3.563 -7.374 1.00 . A A . 1 PHE HD2 1 1 6 1636 1 1 1 PHE HE1 H 8.677 2.336 -5.827 1.00 . A A . 1 PHE HE1 1 1 6 1637 1 1 1 PHE HE2 H 6.135 4.119 -8.748 1.00 . A A . 1 PHE HE2 1 1 6 1638 1 1 1 PHE HZ H 8.392 3.505 -7.976 1.00 . A A . 1 PHE HZ 1 1 6 1639 1 1 1 PHE N N 2.765 0.243 -4.983 1.00 . A A . 1 PHE N 1 1 6 1640 1 1 1 PHE O O 3.323 0.870 -2.289 1.00 . A A . 1 PHE O 1 1 6 1641 1 1 2 LEU C C 5.776 1.543 -0.547 1.00 . A A . 2 LEU C 1 1 6 1642 1 1 2 LEU CA C 5.813 0.201 -1.272 1.00 . A A . 2 LEU CA 1 1 6 1643 1 1 2 LEU CB C 7.197 -0.433 -1.124 1.00 . A A . 2 LEU CB 1 1 6 1644 1 1 2 LEU CD1 C 7.101 -2.788 -1.979 1.00 . A A . 2 LEU CD1 1 1 6 1645 1 1 2 LEU CD2 C 8.488 -2.246 0.030 1.00 . A A . 2 LEU CD2 1 1 6 1646 1 1 2 LEU CG C 7.219 -1.913 -0.741 1.00 . A A . 2 LEU CG 1 1 6 1647 1 1 2 LEU H H 6.178 0.229 -3.356 1.00 . A A . 2 LEU H 1 1 6 1648 1 1 2 LEU HA H 5.076 -0.453 -0.830 1.00 . A A . 2 LEU HA 1 1 6 1649 1 1 2 LEU HB2 H 7.711 -0.329 -2.067 1.00 . A A . 2 LEU HB2 1 1 6 1650 1 1 2 LEU HB3 H 7.731 0.115 -0.362 1.00 . A A . 2 LEU HB3 1 1 6 1651 1 1 2 LEU HD11 H 6.442 -3.617 -1.773 1.00 . A A . 2 LEU HD11 1 1 6 1652 1 1 2 LEU HD12 H 8.077 -3.162 -2.250 1.00 . A A . 2 LEU HD12 1 1 6 1653 1 1 2 LEU HD13 H 6.700 -2.203 -2.795 1.00 . A A . 2 LEU HD13 1 1 6 1654 1 1 2 LEU HD21 H 8.496 -3.298 0.273 1.00 . A A . 2 LEU HD21 1 1 6 1655 1 1 2 LEU HD22 H 8.519 -1.665 0.941 1.00 . A A . 2 LEU HD22 1 1 6 1656 1 1 2 LEU HD23 H 9.350 -2.010 -0.577 1.00 . A A . 2 LEU HD23 1 1 6 1657 1 1 2 LEU HG H 6.373 -2.126 -0.101 1.00 . A A . 2 LEU HG 1 1 6 1658 1 1 2 LEU N N 5.479 0.363 -2.683 1.00 . A A . 2 LEU N 1 1 6 1659 1 1 2 LEU O O 5.846 2.609 -1.158 1.00 . A A . 2 LEU O 1 1 6 1660 1 1 3 PRO C C 6.957 3.422 1.668 1.00 . A A . 3 PRO C 1 1 6 1661 1 1 3 PRO CA C 5.619 2.693 1.627 1.00 . A A . 3 PRO CA 1 1 6 1662 1 1 3 PRO CB C 5.264 2.146 3.012 1.00 . A A . 3 PRO CB 1 1 6 1663 1 1 3 PRO CD C 5.575 0.255 1.584 1.00 . A A . 3 PRO CD 1 1 6 1664 1 1 3 PRO CG C 5.746 0.737 2.998 1.00 . A A . 3 PRO CG 1 1 6 1665 1 1 3 PRO HA H 4.848 3.376 1.299 1.00 . A A . 3 PRO HA 1 1 6 1666 1 1 3 PRO HB2 H 5.766 2.729 3.771 1.00 . A A . 3 PRO HB2 1 1 6 1667 1 1 3 PRO HB3 H 4.196 2.196 3.160 1.00 . A A . 3 PRO HB3 1 1 6 1668 1 1 3 PRO HD2 H 6.367 -0.431 1.321 1.00 . A A . 3 PRO HD2 1 1 6 1669 1 1 3 PRO HD3 H 4.611 -0.215 1.459 1.00 . A A . 3 PRO HD3 1 1 6 1670 1 1 3 PRO HG2 H 6.787 0.702 3.283 1.00 . A A . 3 PRO HG2 1 1 6 1671 1 1 3 PRO HG3 H 5.151 0.139 3.672 1.00 . A A . 3 PRO HG3 1 1 6 1672 1 1 3 PRO N N 5.664 1.491 0.789 1.00 . A A . 3 PRO N 1 1 6 1673 1 1 3 PRO O O 8.006 2.831 1.410 1.00 . A A . 3 PRO O 1 1 6 1674 1 1 4 LYS C C 8.326 6.061 3.484 1.00 . A A . 4 LYS C 1 1 6 1675 1 1 4 LYS CA C 8.124 5.519 2.073 1.00 . A A . 4 LYS CA 1 1 6 1676 1 1 4 LYS CB C 8.052 6.678 1.076 1.00 . A A . 4 LYS CB 1 1 6 1677 1 1 4 LYS CD C 6.544 8.500 0.228 1.00 . A A . 4 LYS CD 1 1 6 1678 1 1 4 LYS CE C 7.419 8.760 -0.988 1.00 . A A . 4 LYS CE 1 1 6 1679 1 1 4 LYS CG C 6.634 7.051 0.680 1.00 . A A . 4 LYS CG 1 1 6 1680 1 1 4 LYS H H 6.048 5.124 2.190 1.00 . A A . 4 LYS H 1 1 6 1681 1 1 4 LYS HA H 8.963 4.889 1.819 1.00 . A A . 4 LYS HA 1 1 6 1682 1 1 4 LYS HB2 H 8.521 7.546 1.515 1.00 . A A . 4 LYS HB2 1 1 6 1683 1 1 4 LYS HB3 H 8.592 6.402 0.181 1.00 . A A . 4 LYS HB3 1 1 6 1684 1 1 4 LYS HD2 H 5.519 8.726 -0.026 1.00 . A A . 4 LYS HD2 1 1 6 1685 1 1 4 LYS HD3 H 6.866 9.140 1.037 1.00 . A A . 4 LYS HD3 1 1 6 1686 1 1 4 LYS HE2 H 8.267 9.355 -0.684 1.00 . A A . 4 LYS HE2 1 1 6 1687 1 1 4 LYS HE3 H 7.765 7.812 -1.375 1.00 . A A . 4 LYS HE3 1 1 6 1688 1 1 4 LYS HG2 H 6.316 6.413 -0.131 1.00 . A A . 4 LYS HG2 1 1 6 1689 1 1 4 LYS HG3 H 5.982 6.908 1.530 1.00 . A A . 4 LYS HG3 1 1 6 1690 1 1 4 LYS HZ1 H 5.667 9.249 -2.013 1.00 . A A . 4 LYS HZ1 1 1 6 1691 1 1 4 LYS HZ2 H 7.043 9.204 -2.994 1.00 . A A . 4 LYS HZ2 1 1 6 1692 1 1 4 LYS HZ3 H 6.795 10.508 -1.946 1.00 . A A . 4 LYS HZ3 1 1 6 1693 1 1 4 LYS N N 6.915 4.709 1.995 1.00 . A A . 4 LYS N 1 1 6 1694 1 1 4 LYS NZ N 6.679 9.481 -2.060 1.00 . A A . 4 LYS NZ 1 1 6 1695 1 1 4 LYS O O 8.797 7.185 3.667 1.00 . A A . 4 LYS O 1 1 6 1696 1 1 5 LEU C C 9.461 6.329 6.113 1.00 . A A . 5 LEU C 1 1 6 1697 1 1 5 LEU CA C 8.113 5.655 5.875 1.00 . A A . 5 LEU CA 1 1 6 1698 1 1 5 LEU CB C 7.969 4.438 6.790 1.00 . A A . 5 LEU CB 1 1 6 1699 1 1 5 LEU CD1 C 6.691 3.138 8.511 1.00 . A A . 5 LEU CD1 1 1 6 1700 1 1 5 LEU CD2 C 6.712 5.637 8.598 1.00 . A A . 5 LEU CD2 1 1 6 1701 1 1 5 LEU CG C 6.732 4.417 7.689 1.00 . A A . 5 LEU CG 1 1 6 1702 1 1 5 LEU H H 7.600 4.373 4.271 1.00 . A A . 5 LEU H 1 1 6 1703 1 1 5 LEU HA H 7.327 6.360 6.101 1.00 . A A . 5 LEU HA 1 1 6 1704 1 1 5 LEU HB2 H 7.940 3.558 6.168 1.00 . A A . 5 LEU HB2 1 1 6 1705 1 1 5 LEU HB3 H 8.842 4.399 7.426 1.00 . A A . 5 LEU HB3 1 1 6 1706 1 1 5 LEU HD11 H 5.728 3.048 8.990 1.00 . A A . 5 LEU HD11 1 1 6 1707 1 1 5 LEU HD12 H 7.466 3.168 9.262 1.00 . A A . 5 LEU HD12 1 1 6 1708 1 1 5 LEU HD13 H 6.852 2.289 7.863 1.00 . A A . 5 LEU HD13 1 1 6 1709 1 1 5 LEU HD21 H 7.604 6.224 8.431 1.00 . A A . 5 LEU HD21 1 1 6 1710 1 1 5 LEU HD22 H 6.680 5.317 9.630 1.00 . A A . 5 LEU HD22 1 1 6 1711 1 1 5 LEU HD23 H 5.841 6.236 8.378 1.00 . A A . 5 LEU HD23 1 1 6 1712 1 1 5 LEU HG H 5.845 4.445 7.071 1.00 . A A . 5 LEU HG 1 1 6 1713 1 1 5 LEU N N 7.969 5.257 4.479 1.00 . A A . 5 LEU N 1 1 6 1714 1 1 5 LEU O O 9.559 7.292 6.874 1.00 . A A . 5 LEU O 1 1 6 1715 1 1 6 PHE C C 12.393 6.800 4.240 1.00 . A A . 6 PHE C 1 1 6 1716 1 1 6 PHE CA C 11.838 6.370 5.595 1.00 . A A . 6 PHE CA 1 1 6 1717 1 1 6 PHE CB C 12.772 5.342 6.237 1.00 . A A . 6 PHE CB 1 1 6 1718 1 1 6 PHE CD1 C 15.124 6.027 6.781 1.00 . A A . 6 PHE CD1 1 1 6 1719 1 1 6 PHE CD2 C 13.419 6.446 8.395 1.00 . A A . 6 PHE CD2 1 1 6 1720 1 1 6 PHE CE1 C 16.065 6.587 7.625 1.00 . A A . 6 PHE CE1 1 1 6 1721 1 1 6 PHE CE2 C 14.356 7.007 9.243 1.00 . A A . 6 PHE CE2 1 1 6 1722 1 1 6 PHE CG C 13.792 5.951 7.156 1.00 . A A . 6 PHE CG 1 1 6 1723 1 1 6 PHE CZ C 15.681 7.077 8.857 1.00 . A A . 6 PHE CZ 1 1 6 1724 1 1 6 PHE H H 10.354 5.049 4.863 1.00 . A A . 6 PHE H 1 1 6 1725 1 1 6 PHE HA H 11.775 7.236 6.235 1.00 . A A . 6 PHE HA 1 1 6 1726 1 1 6 PHE HB2 H 12.185 4.642 6.812 1.00 . A A . 6 PHE HB2 1 1 6 1727 1 1 6 PHE HB3 H 13.299 4.810 5.460 1.00 . A A . 6 PHE HB3 1 1 6 1728 1 1 6 PHE HD1 H 15.426 5.644 5.817 1.00 . A A . 6 PHE HD1 1 1 6 1729 1 1 6 PHE HD2 H 12.384 6.391 8.699 1.00 . A A . 6 PHE HD2 1 1 6 1730 1 1 6 PHE HE1 H 17.100 6.640 7.320 1.00 . A A . 6 PHE HE1 1 1 6 1731 1 1 6 PHE HE2 H 14.053 7.389 10.206 1.00 . A A . 6 PHE HE2 1 1 6 1732 1 1 6 PHE HZ H 16.414 7.515 9.517 1.00 . A A . 6 PHE HZ 1 1 6 1733 1 1 6 PHE N N 10.496 5.817 5.456 1.00 . A A . 6 PHE N 1 1 6 1734 1 1 6 PHE O O 13.438 7.444 4.161 1.00 . A A . 6 PHE O 1 1 6 1735 1 1 7 ALA C C 11.904 8.275 1.555 1.00 . A A . 7 ALA C 1 1 6 1736 1 1 7 ALA CA C 12.102 6.788 1.824 1.00 . A A . 7 ALA CA 1 1 6 1737 1 1 7 ALA CB C 11.337 5.958 0.803 1.00 . A A . 7 ALA CB 1 1 6 1738 1 1 7 ALA H H 10.858 5.926 3.303 1.00 . A A . 7 ALA H 1 1 6 1739 1 1 7 ALA HA H 13.152 6.551 1.728 1.00 . A A . 7 ALA HA 1 1 6 1740 1 1 7 ALA HB1 H 10.573 6.569 0.344 1.00 . A A . 7 ALA HB1 1 1 6 1741 1 1 7 ALA HB2 H 12.018 5.603 0.044 1.00 . A A . 7 ALA HB2 1 1 6 1742 1 1 7 ALA HB3 H 10.876 5.116 1.297 1.00 . A A . 7 ALA HB3 1 1 6 1743 1 1 7 ALA N N 11.683 6.438 3.175 1.00 . A A . 7 ALA N 1 1 6 1744 1 1 7 ALA O O 12.618 8.872 0.747 1.00 . A A . 7 ALA O 1 1 6 1745 1 1 8 LYS C C 11.471 11.132 3.032 1.00 . A A . 8 LYS C 1 1 6 1746 1 1 8 LYS CA C 10.638 10.289 2.071 1.00 . A A . 8 LYS CA 1 1 6 1747 1 1 8 LYS CB C 9.149 10.554 2.302 1.00 . A A . 8 LYS CB 1 1 6 1748 1 1 8 LYS CD C 7.966 11.231 4.413 1.00 . A A . 8 LYS CD 1 1 6 1749 1 1 8 LYS CE C 6.577 11.502 3.856 1.00 . A A . 8 LYS CE 1 1 6 1750 1 1 8 LYS CG C 8.655 10.101 3.665 1.00 . A A . 8 LYS CG 1 1 6 1751 1 1 8 LYS H H 10.396 8.342 2.865 1.00 . A A . 8 LYS H 1 1 6 1752 1 1 8 LYS HA H 10.891 10.565 1.058 1.00 . A A . 8 LYS HA 1 1 6 1753 1 1 8 LYS HB2 H 8.966 11.615 2.210 1.00 . A A . 8 LYS HB2 1 1 6 1754 1 1 8 LYS HB3 H 8.581 10.033 1.545 1.00 . A A . 8 LYS HB3 1 1 6 1755 1 1 8 LYS HD2 H 7.878 10.960 5.454 1.00 . A A . 8 LYS HD2 1 1 6 1756 1 1 8 LYS HD3 H 8.563 12.127 4.321 1.00 . A A . 8 LYS HD3 1 1 6 1757 1 1 8 LYS HE2 H 6.676 11.924 2.867 1.00 . A A . 8 LYS HE2 1 1 6 1758 1 1 8 LYS HE3 H 6.039 10.568 3.797 1.00 . A A . 8 LYS HE3 1 1 6 1759 1 1 8 LYS HG2 H 7.953 9.291 3.533 1.00 . A A . 8 LYS HG2 1 1 6 1760 1 1 8 LYS HG3 H 9.498 9.758 4.247 1.00 . A A . 8 LYS HG3 1 1 6 1761 1 1 8 LYS HZ1 H 6.116 12.361 5.703 1.00 . A A . 8 LYS HZ1 1 1 6 1762 1 1 8 LYS HZ2 H 4.794 12.242 4.654 1.00 . A A . 8 LYS HZ2 1 1 6 1763 1 1 8 LYS HZ3 H 5.974 13.427 4.397 1.00 . A A . 8 LYS HZ3 1 1 6 1764 1 1 8 LYS N N 10.931 8.871 2.235 1.00 . A A . 8 LYS N 1 1 6 1765 1 1 8 LYS NZ N 5.812 12.450 4.712 1.00 . A A . 8 LYS NZ 1 1 6 1766 1 1 8 LYS O O 11.859 12.255 2.711 1.00 . A A . 8 LYS O 1 1 6 1767 1 1 9 ILE C C 14.006 11.316 4.832 1.00 . A A . 9 ILE C 1 1 6 1768 1 1 9 ILE CA C 12.531 11.281 5.217 1.00 . A A . 9 ILE CA 1 1 6 1769 1 1 9 ILE CB C 12.388 10.623 6.602 1.00 . A A . 9 ILE CB 1 1 6 1770 1 1 9 ILE CD1 C 14.686 9.781 7.300 1.00 . A A . 9 ILE CD1 1 1 6 1771 1 1 9 ILE CG1 C 13.334 9.427 6.722 1.00 . A A . 9 ILE CG1 1 1 6 1772 1 1 9 ILE CG2 C 10.948 10.193 6.838 1.00 . A A . 9 ILE CG2 1 1 6 1773 1 1 9 ILE H H 11.405 9.683 4.408 1.00 . A A . 9 ILE H 1 1 6 1774 1 1 9 ILE HA H 12.163 12.295 5.282 1.00 . A A . 9 ILE HA 1 1 6 1775 1 1 9 ILE HB H 12.648 11.355 7.352 1.00 . A A . 9 ILE HB 1 1 6 1776 1 1 9 ILE HD11 H 15.454 9.214 6.795 1.00 . A A . 9 ILE HD11 1 1 6 1777 1 1 9 ILE HD12 H 14.870 10.836 7.166 1.00 . A A . 9 ILE HD12 1 1 6 1778 1 1 9 ILE HD13 H 14.700 9.544 8.354 1.00 . A A . 9 ILE HD13 1 1 6 1779 1 1 9 ILE HG12 H 12.885 8.684 7.362 1.00 . A A . 9 ILE HG12 1 1 6 1780 1 1 9 ILE HG13 H 13.492 9.003 5.741 1.00 . A A . 9 ILE HG13 1 1 6 1781 1 1 9 ILE HG21 H 10.853 9.135 6.647 1.00 . A A . 9 ILE HG21 1 1 6 1782 1 1 9 ILE HG22 H 10.675 10.399 7.862 1.00 . A A . 9 ILE HG22 1 1 6 1783 1 1 9 ILE HG23 H 10.295 10.740 6.174 1.00 . A A . 9 ILE HG23 1 1 6 1784 1 1 9 ILE N N 11.742 10.581 4.211 1.00 . A A . 9 ILE N 1 1 6 1785 1 1 9 ILE O O 14.741 12.222 5.228 1.00 . A A . 9 ILE O 1 1 6 1786 1 1 10 THR C C 16.052 11.079 2.365 1.00 . A A . 10 THR C 1 1 6 1787 1 1 10 THR CA C 15.821 10.242 3.618 1.00 . A A . 10 THR CA 1 1 6 1788 1 1 10 THR CB C 16.233 8.785 3.331 1.00 . A A . 10 THR CB 1 1 6 1789 1 1 10 THR CG2 C 16.377 7.999 4.625 1.00 . A A . 10 THR CG2 1 1 6 1790 1 1 10 THR H H 13.800 9.633 3.775 1.00 . A A . 10 THR H 1 1 6 1791 1 1 10 THR HA H 16.446 10.621 4.413 1.00 . A A . 10 THR HA 1 1 6 1792 1 1 10 THR HB H 17.186 8.791 2.822 1.00 . A A . 10 THR HB 1 1 6 1793 1 1 10 THR HG1 H 15.620 7.341 2.135 1.00 . A A . 10 THR HG1 1 1 6 1794 1 1 10 THR HG21 H 16.664 6.982 4.398 1.00 . A A . 10 THR HG21 1 1 6 1795 1 1 10 THR HG22 H 15.435 7.998 5.152 1.00 . A A . 10 THR HG22 1 1 6 1796 1 1 10 THR HG23 H 17.135 8.457 5.242 1.00 . A A . 10 THR HG23 1 1 6 1797 1 1 10 THR N N 14.434 10.325 4.057 1.00 . A A . 10 THR N 1 1 6 1798 1 1 10 THR O O 15.425 10.854 1.330 1.00 . A A . 10 THR O 1 1 6 1799 1 1 10 THR OG1 O 15.259 8.157 2.490 1.00 . A A . 10 THR OG1 1 1 6 1800 1 1 11 LYS C C 18.752 12.821 0.976 1.00 . A A . 11 LYS C 1 1 6 1801 1 1 11 LYS CA C 17.274 12.919 1.340 1.00 . A A . 11 LYS CA 1 1 6 1802 1 1 11 LYS CB C 16.915 14.368 1.674 1.00 . A A . 11 LYS CB 1 1 6 1803 1 1 11 LYS CD C 16.442 14.518 4.137 1.00 . A A . 11 LYS CD 1 1 6 1804 1 1 11 LYS CE C 16.606 15.472 5.310 1.00 . A A . 11 LYS CE 1 1 6 1805 1 1 11 LYS CG C 17.433 14.827 3.026 1.00 . A A . 11 LYS CG 1 1 6 1806 1 1 11 LYS H H 17.425 12.178 3.318 1.00 . A A . 11 LYS H 1 1 6 1807 1 1 11 LYS HA H 16.685 12.596 0.495 1.00 . A A . 11 LYS HA 1 1 6 1808 1 1 11 LYS HB2 H 17.331 15.014 0.915 1.00 . A A . 11 LYS HB2 1 1 6 1809 1 1 11 LYS HB3 H 15.839 14.470 1.671 1.00 . A A . 11 LYS HB3 1 1 6 1810 1 1 11 LYS HD2 H 15.439 14.611 3.749 1.00 . A A . 11 LYS HD2 1 1 6 1811 1 1 11 LYS HD3 H 16.605 13.507 4.481 1.00 . A A . 11 LYS HD3 1 1 6 1812 1 1 11 LYS HE2 H 17.651 15.523 5.573 1.00 . A A . 11 LYS HE2 1 1 6 1813 1 1 11 LYS HE3 H 16.262 16.452 5.011 1.00 . A A . 11 LYS HE3 1 1 6 1814 1 1 11 LYS HG2 H 18.362 14.320 3.237 1.00 . A A . 11 LYS HG2 1 1 6 1815 1 1 11 LYS HG3 H 17.602 15.894 2.994 1.00 . A A . 11 LYS HG3 1 1 6 1816 1 1 11 LYS HZ1 H 16.458 14.569 7.187 1.00 . A A . 11 LYS HZ1 1 1 6 1817 1 1 11 LYS HZ2 H 15.094 14.348 6.213 1.00 . A A . 11 LYS HZ2 1 1 6 1818 1 1 11 LYS HZ3 H 15.371 15.844 6.954 1.00 . A A . 11 LYS HZ3 1 1 6 1819 1 1 11 LYS N N 16.957 12.047 2.465 1.00 . A A . 11 LYS N 1 1 6 1820 1 1 11 LYS NZ N 15.827 15.027 6.499 1.00 . A A . 11 LYS NZ 1 1 6 1821 1 1 11 LYS O O 19.292 13.689 0.290 1.00 . A A . 11 LYS O 1 1 6 1822 1 1 12 LYS C C 21.032 10.232 0.412 1.00 . A A . 12 LYS C 1 1 6 1823 1 1 12 LYS CA C 20.817 11.545 1.158 1.00 . A A . 12 LYS CA 1 1 6 1824 1 1 12 LYS CB C 21.620 11.540 2.461 1.00 . A A . 12 LYS CB 1 1 6 1825 1 1 12 LYS CD C 20.125 12.355 4.309 1.00 . A A . 12 LYS CD 1 1 6 1826 1 1 12 LYS CE C 20.846 12.801 5.571 1.00 . A A . 12 LYS CE 1 1 6 1827 1 1 12 LYS CG C 20.801 11.148 3.679 1.00 . A A . 12 LYS CG 1 1 6 1828 1 1 12 LYS H H 18.917 11.100 1.979 1.00 . A A . 12 LYS H 1 1 6 1829 1 1 12 LYS HA H 21.159 12.359 0.537 1.00 . A A . 12 LYS HA 1 1 6 1830 1 1 12 LYS HB2 H 22.438 10.842 2.363 1.00 . A A . 12 LYS HB2 1 1 6 1831 1 1 12 LYS HB3 H 22.020 12.530 2.626 1.00 . A A . 12 LYS HB3 1 1 6 1832 1 1 12 LYS HD2 H 20.127 13.169 3.599 1.00 . A A . 12 LYS HD2 1 1 6 1833 1 1 12 LYS HD3 H 19.106 12.095 4.558 1.00 . A A . 12 LYS HD3 1 1 6 1834 1 1 12 LYS HE2 H 20.125 13.238 6.246 1.00 . A A . 12 LYS HE2 1 1 6 1835 1 1 12 LYS HE3 H 21.297 11.938 6.037 1.00 . A A . 12 LYS HE3 1 1 6 1836 1 1 12 LYS HG2 H 20.043 10.440 3.379 1.00 . A A . 12 LYS HG2 1 1 6 1837 1 1 12 LYS HG3 H 21.455 10.691 4.409 1.00 . A A . 12 LYS HG3 1 1 6 1838 1 1 12 LYS HZ1 H 21.614 14.413 4.488 1.00 . A A . 12 LYS HZ1 1 1 6 1839 1 1 12 LYS HZ2 H 22.792 13.324 5.022 1.00 . A A . 12 LYS HZ2 1 1 6 1840 1 1 12 LYS HZ3 H 22.077 14.399 6.115 1.00 . A A . 12 LYS HZ3 1 1 6 1841 1 1 12 LYS N N 19.402 11.758 1.438 1.00 . A A . 12 LYS N 1 1 6 1842 1 1 12 LYS NZ N 21.907 13.805 5.279 1.00 . A A . 12 LYS NZ 1 1 6 1843 1 1 12 LYS O O 21.243 10.224 -0.800 1.00 . A A . 12 LYS O 1 1 6 1844 1 1 13 ASN C C 20.260 7.622 -0.666 1.00 . A A . 13 ASN C 1 1 6 1845 1 1 13 ASN CA C 21.163 7.805 0.550 1.00 . A A . 13 ASN CA 1 1 6 1846 1 1 13 ASN CB C 20.877 6.713 1.581 1.00 . A A . 13 ASN CB 1 1 6 1847 1 1 13 ASN CG C 22.134 5.986 2.019 1.00 . A A . 13 ASN CG 1 1 6 1848 1 1 13 ASN H H 20.804 9.195 2.106 1.00 . A A . 13 ASN H 1 1 6 1849 1 1 13 ASN HA H 22.193 7.728 0.233 1.00 . A A . 13 ASN HA 1 1 6 1850 1 1 13 ASN HB2 H 20.421 7.160 2.453 1.00 . A A . 13 ASN HB2 1 1 6 1851 1 1 13 ASN HB3 H 20.196 5.992 1.154 1.00 . A A . 13 ASN HB3 1 1 6 1852 1 1 13 ASN HD21 H 21.478 5.928 3.895 1.00 . A A . 13 ASN HD21 1 1 6 1853 1 1 13 ASN HD22 H 23.022 5.206 3.617 1.00 . A A . 13 ASN HD22 1 1 6 1854 1 1 13 ASN N N 20.975 9.124 1.144 1.00 . A A . 13 ASN N 1 1 6 1855 1 1 13 ASN ND2 N 22.220 5.675 3.307 1.00 . A A . 13 ASN ND2 1 1 6 1856 1 1 13 ASN O O 20.590 6.882 -1.591 1.00 . A A . 13 ASN O 1 1 6 1857 1 1 13 ASN OD1 O 23.017 5.708 1.208 1.00 . A A . 13 ASN OD1 1 1 6 1858 1 1 14 MET C C 18.806 8.679 -3.064 1.00 . A A . 14 MET C 1 1 6 1859 1 1 14 MET CA C 18.168 8.217 -1.758 1.00 . A A . 14 MET CA 1 1 6 1860 1 1 14 MET CB C 16.927 9.060 -1.457 1.00 . A A . 14 MET CB 1 1 6 1861 1 1 14 MET CE C 13.701 7.076 -3.018 1.00 . A A . 14 MET CE 1 1 6 1862 1 1 14 MET CG C 15.776 8.812 -2.418 1.00 . A A . 14 MET CG 1 1 6 1863 1 1 14 MET H H 18.910 8.878 0.111 1.00 . A A . 14 MET H 1 1 6 1864 1 1 14 MET HA H 17.873 7.184 -1.861 1.00 . A A . 14 MET HA 1 1 6 1865 1 1 14 MET HB2 H 16.588 8.836 -0.457 1.00 . A A . 14 MET HB2 1 1 6 1866 1 1 14 MET HB3 H 17.194 10.105 -1.512 1.00 . A A . 14 MET HB3 1 1 6 1867 1 1 14 MET HE1 H 12.623 7.135 -2.994 1.00 . A A . 14 MET HE1 1 1 6 1868 1 1 14 MET HE2 H 14.065 7.504 -3.941 1.00 . A A . 14 MET HE2 1 1 6 1869 1 1 14 MET HE3 H 14.006 6.041 -2.956 1.00 . A A . 14 MET HE3 1 1 6 1870 1 1 14 MET HG2 H 15.438 9.761 -2.807 1.00 . A A . 14 MET HG2 1 1 6 1871 1 1 14 MET HG3 H 16.131 8.198 -3.232 1.00 . A A . 14 MET HG3 1 1 6 1872 1 1 14 MET N N 19.118 8.303 -0.656 1.00 . A A . 14 MET N 1 1 6 1873 1 1 14 MET O O 18.782 7.963 -4.065 1.00 . A A . 14 MET O 1 1 6 1874 1 1 14 MET SD S 14.382 7.982 -1.632 1.00 . A A . 14 MET SD 1 1 6 1875 1 1 15 ALA C C 21.378 9.779 -4.474 1.00 . A A . 15 ALA C 1 1 6 1876 1 1 15 ALA CA C 20.023 10.435 -4.229 1.00 . A A . 15 ALA CA 1 1 6 1877 1 1 15 ALA CB C 20.182 11.941 -4.084 1.00 . A A . 15 ALA CB 1 1 6 1878 1 1 15 ALA H H 19.364 10.402 -2.218 1.00 . A A . 15 ALA H 1 1 6 1879 1 1 15 ALA HA H 19.384 10.246 -5.079 1.00 . A A . 15 ALA HA 1 1 6 1880 1 1 15 ALA HB1 H 20.622 12.165 -3.123 1.00 . A A . 15 ALA HB1 1 1 6 1881 1 1 15 ALA HB2 H 20.823 12.312 -4.870 1.00 . A A . 15 ALA HB2 1 1 6 1882 1 1 15 ALA HB3 H 19.214 12.414 -4.156 1.00 . A A . 15 ALA HB3 1 1 6 1883 1 1 15 ALA N N 19.377 9.879 -3.046 1.00 . A A . 15 ALA N 1 1 6 1884 1 1 15 ALA O O 22.078 10.116 -5.429 1.00 . A A . 15 ALA O 1 1 6 1885 1 1 16 HIS C C 22.804 6.726 -4.265 1.00 . A A . 16 HIS C 1 1 6 1886 1 1 16 HIS CA C 23.014 8.138 -3.727 1.00 . A A . 16 HIS CA 1 1 6 1887 1 1 16 HIS CB C 23.721 8.080 -2.373 1.00 . A A . 16 HIS CB 1 1 6 1888 1 1 16 HIS CD2 C 26.000 8.979 -3.225 1.00 . A A . 16 HIS CD2 1 1 6 1889 1 1 16 HIS CE1 C 26.512 10.237 -1.504 1.00 . A A . 16 HIS CE1 1 1 6 1890 1 1 16 HIS CG C 24.993 8.870 -2.327 1.00 . A A . 16 HIS CG 1 1 6 1891 1 1 16 HIS H H 21.140 8.617 -2.864 1.00 . A A . 16 HIS H 1 1 6 1892 1 1 16 HIS HA H 23.630 8.687 -4.422 1.00 . A A . 16 HIS HA 1 1 6 1893 1 1 16 HIS HB2 H 23.061 8.471 -1.612 1.00 . A A . 16 HIS HB2 1 1 6 1894 1 1 16 HIS HB3 H 23.959 7.052 -2.142 1.00 . A A . 16 HIS HB3 1 1 6 1895 1 1 16 HIS HD1 H 24.816 9.802 -0.446 1.00 . A A . 16 HIS HD1 1 1 6 1896 1 1 16 HIS HD2 H 26.060 8.485 -4.185 1.00 . A A . 16 HIS HD2 1 1 6 1897 1 1 16 HIS HE1 H 27.035 10.915 -0.846 1.00 . A A . 16 HIS HE1 1 1 6 1898 1 1 16 HIS N N 21.742 8.841 -3.605 1.00 . A A . 16 HIS N 1 1 6 1899 1 1 16 HIS ND1 N 25.344 9.669 -1.260 1.00 . A A . 16 HIS ND1 1 1 6 1900 1 1 16 HIS NE2 N 26.932 9.834 -2.690 1.00 . A A . 16 HIS NE2 1 1 6 1901 1 1 16 HIS O O 23.742 6.088 -4.743 1.00 . A A . 16 HIS O 1 1 6 1902 1 1 17 ILE C C 21.703 4.708 -6.100 1.00 . A A . 17 ILE C 1 1 6 1903 1 1 17 ILE CA C 21.237 4.908 -4.662 1.00 . A A . 17 ILE CA 1 1 6 1904 1 1 17 ILE CB C 19.722 4.642 -4.584 1.00 . A A . 17 ILE CB 1 1 6 1905 1 1 17 ILE CD1 C 17.498 5.653 -5.300 1.00 . A A . 17 ILE CD1 1 1 6 1906 1 1 17 ILE CG1 C 18.976 5.514 -5.595 1.00 . A A . 17 ILE CG1 1 1 6 1907 1 1 17 ILE CG2 C 19.211 4.900 -3.174 1.00 . A A . 17 ILE CG2 1 1 6 1908 1 1 17 ILE H H 20.863 6.800 -3.792 1.00 . A A . 17 ILE H 1 1 6 1909 1 1 17 ILE HA H 21.741 4.192 -4.029 1.00 . A A . 17 ILE HA 1 1 6 1910 1 1 17 ILE HB H 19.549 3.603 -4.818 1.00 . A A . 17 ILE HB 1 1 6 1911 1 1 17 ILE HD11 H 17.012 6.158 -6.122 1.00 . A A . 17 ILE HD11 1 1 6 1912 1 1 17 ILE HD12 H 17.063 4.674 -5.170 1.00 . A A . 17 ILE HD12 1 1 6 1913 1 1 17 ILE HD13 H 17.365 6.229 -4.395 1.00 . A A . 17 ILE HD13 1 1 6 1914 1 1 17 ILE HG12 H 19.407 6.503 -5.596 1.00 . A A . 17 ILE HG12 1 1 6 1915 1 1 17 ILE HG13 H 19.079 5.080 -6.579 1.00 . A A . 17 ILE HG13 1 1 6 1916 1 1 17 ILE HG21 H 18.271 4.387 -3.032 1.00 . A A . 17 ILE HG21 1 1 6 1917 1 1 17 ILE HG22 H 19.931 4.535 -2.458 1.00 . A A . 17 ILE HG22 1 1 6 1918 1 1 17 ILE HG23 H 19.066 5.961 -3.032 1.00 . A A . 17 ILE HG23 1 1 6 1919 1 1 17 ILE N N 21.568 6.244 -4.183 1.00 . A A . 17 ILE N 1 1 6 1920 1 1 17 ILE O O 22.198 3.640 -6.460 1.00 . A A . 17 ILE O 1 1 6 1921 1 1 18 ARG C C 23.461 5.815 -8.451 1.00 . A A . 18 ARG C 1 1 6 1922 1 1 18 ARG CA C 21.947 5.682 -8.317 1.00 . A A . 18 ARG CA 1 1 6 1923 1 1 18 ARG CB C 21.255 6.786 -9.119 1.00 . A A . 18 ARG CB 1 1 6 1924 1 1 18 ARG CD C 20.257 8.936 -8.285 1.00 . A A . 18 ARG CD 1 1 6 1925 1 1 18 ARG CG C 21.541 8.186 -8.602 1.00 . A A . 18 ARG CG 1 1 6 1926 1 1 18 ARG CZ C 19.435 11.253 -8.248 1.00 . A A . 18 ARG CZ 1 1 6 1927 1 1 18 ARG H H 21.141 6.568 -6.572 1.00 . A A . 18 ARG H 1 1 6 1928 1 1 18 ARG HA H 21.646 4.722 -8.708 1.00 . A A . 18 ARG HA 1 1 6 1929 1 1 18 ARG HB2 H 21.586 6.730 -10.146 1.00 . A A . 18 ARG HB2 1 1 6 1930 1 1 18 ARG HB3 H 20.188 6.624 -9.084 1.00 . A A . 18 ARG HB3 1 1 6 1931 1 1 18 ARG HD2 H 19.492 8.622 -8.978 1.00 . A A . 18 ARG HD2 1 1 6 1932 1 1 18 ARG HD3 H 19.953 8.692 -7.278 1.00 . A A . 18 ARG HD3 1 1 6 1933 1 1 18 ARG HE H 21.328 10.721 -8.580 1.00 . A A . 18 ARG HE 1 1 6 1934 1 1 18 ARG HG2 H 22.134 8.113 -7.702 1.00 . A A . 18 ARG HG2 1 1 6 1935 1 1 18 ARG HG3 H 22.091 8.732 -9.355 1.00 . A A . 18 ARG HG3 1 1 6 1936 1 1 18 ARG HH11 H 18.027 9.845 -7.908 1.00 . A A . 18 ARG HH11 1 1 6 1937 1 1 18 ARG HH12 H 17.460 11.482 -7.885 1.00 . A A . 18 ARG HH12 1 1 6 1938 1 1 18 ARG HH21 H 20.594 12.880 -8.552 1.00 . A A . 18 ARG HH21 1 1 6 1939 1 1 18 ARG HH22 H 18.921 13.208 -8.252 1.00 . A A . 18 ARG HH22 1 1 6 1940 1 1 18 ARG N N 21.542 5.744 -6.918 1.00 . A A . 18 ARG N 1 1 6 1941 1 1 18 ARG NE N 20.428 10.383 -8.392 1.00 . A A . 18 ARG NE 1 1 6 1942 1 1 18 ARG NH1 N 18.206 10.825 -7.993 1.00 . A A . 18 ARG NH1 1 1 6 1943 1 1 18 ARG NH2 N 19.669 12.554 -8.360 1.00 . A A . 18 ARG NH2 1 1 6 1944 1 1 18 ARG O O 24.214 4.987 -7.939 1.00 . A A . 18 ARG O 1 1 7 1945 1 1 1 PHE C C 4.690 -1.416 -2.432 1.00 . A A . 1 PHE C 1 1 7 1946 1 1 1 PHE CA C 3.272 -1.978 -2.436 1.00 . A A . 1 PHE CA 1 1 7 1947 1 1 1 PHE CB C 2.735 -2.052 -1.005 1.00 . A A . 1 PHE CB 1 1 7 1948 1 1 1 PHE CD1 C 0.442 -1.075 -1.292 1.00 . A A . 1 PHE CD1 1 1 7 1949 1 1 1 PHE CD2 C 0.628 -3.316 -0.498 1.00 . A A . 1 PHE CD2 1 1 7 1950 1 1 1 PHE CE1 C -0.936 -1.162 -1.225 1.00 . A A . 1 PHE CE1 1 1 7 1951 1 1 1 PHE CE2 C -0.749 -3.408 -0.429 1.00 . A A . 1 PHE CE2 1 1 7 1952 1 1 1 PHE CG C 1.238 -2.149 -0.931 1.00 . A A . 1 PHE CG 1 1 7 1953 1 1 1 PHE CZ C -1.532 -2.330 -0.792 1.00 . A A . 1 PHE CZ 1 1 7 1954 1 1 1 PHE H1 H 2.385 -3.779 -3.110 1.00 . A A . 1 PHE H1 1 1 7 1955 1 1 1 PHE HA H 2.640 -1.323 -3.015 1.00 . A A . 1 PHE HA 1 1 7 1956 1 1 1 PHE HB2 H 3.149 -2.922 -0.518 1.00 . A A . 1 PHE HB2 1 1 7 1957 1 1 1 PHE HB3 H 3.039 -1.165 -0.469 1.00 . A A . 1 PHE HB3 1 1 7 1958 1 1 1 PHE HD1 H 0.908 -0.160 -1.631 1.00 . A A . 1 PHE HD1 1 1 7 1959 1 1 1 PHE HD2 H 1.239 -4.160 -0.213 1.00 . A A . 1 PHE HD2 1 1 7 1960 1 1 1 PHE HE1 H -1.545 -0.316 -1.509 1.00 . A A . 1 PHE HE1 1 1 7 1961 1 1 1 PHE HE2 H -1.213 -4.323 -0.090 1.00 . A A . 1 PHE HE2 1 1 7 1962 1 1 1 PHE HZ H -2.608 -2.400 -0.739 1.00 . A A . 1 PHE HZ 1 1 7 1963 1 1 1 PHE N N 3.237 -3.296 -3.059 1.00 . A A . 1 PHE N 1 1 7 1964 1 1 1 PHE O O 5.638 -2.088 -2.840 1.00 . A A . 1 PHE O 1 1 7 1965 1 1 2 LEU C C 6.047 1.788 -1.137 1.00 . A A . 2 LEU C 1 1 7 1966 1 1 2 LEU CA C 6.131 0.476 -1.909 1.00 . A A . 2 LEU CA 1 1 7 1967 1 1 2 LEU CB C 6.657 0.735 -3.322 1.00 . A A . 2 LEU CB 1 1 7 1968 1 1 2 LEU CD1 C 6.316 2.623 -4.936 1.00 . A A . 2 LEU CD1 1 1 7 1969 1 1 2 LEU CD2 C 5.222 0.412 -5.352 1.00 . A A . 2 LEU CD2 1 1 7 1970 1 1 2 LEU CG C 5.679 1.402 -4.290 1.00 . A A . 2 LEU CG 1 1 7 1971 1 1 2 LEU H H 4.037 0.307 -1.656 1.00 . A A . 2 LEU H 1 1 7 1972 1 1 2 LEU HA H 6.812 -0.187 -1.396 1.00 . A A . 2 LEU HA 1 1 7 1973 1 1 2 LEU HB2 H 7.525 1.370 -3.240 1.00 . A A . 2 LEU HB2 1 1 7 1974 1 1 2 LEU HB3 H 6.947 -0.216 -3.745 1.00 . A A . 2 LEU HB3 1 1 7 1975 1 1 2 LEU HD11 H 6.857 2.321 -5.820 1.00 . A A . 2 LEU HD11 1 1 7 1976 1 1 2 LEU HD12 H 6.997 3.085 -4.237 1.00 . A A . 2 LEU HD12 1 1 7 1977 1 1 2 LEU HD13 H 5.545 3.329 -5.207 1.00 . A A . 2 LEU HD13 1 1 7 1978 1 1 2 LEU HD21 H 4.386 -0.159 -4.976 1.00 . A A . 2 LEU HD21 1 1 7 1979 1 1 2 LEU HD22 H 6.035 -0.257 -5.594 1.00 . A A . 2 LEU HD22 1 1 7 1980 1 1 2 LEU HD23 H 4.922 0.949 -6.239 1.00 . A A . 2 LEU HD23 1 1 7 1981 1 1 2 LEU HG H 4.807 1.731 -3.742 1.00 . A A . 2 LEU HG 1 1 7 1982 1 1 2 LEU N N 4.828 -0.179 -1.967 1.00 . A A . 2 LEU N 1 1 7 1983 1 1 2 LEU O O 6.154 2.877 -1.701 1.00 . A A . 2 LEU O 1 1 7 1984 1 1 3 PRO C C 7.085 3.580 1.219 1.00 . A A . 3 PRO C 1 1 7 1985 1 1 3 PRO CA C 5.752 2.854 1.065 1.00 . A A . 3 PRO CA 1 1 7 1986 1 1 3 PRO CB C 5.313 2.255 2.404 1.00 . A A . 3 PRO CB 1 1 7 1987 1 1 3 PRO CD C 5.716 0.419 0.927 1.00 . A A . 3 PRO CD 1 1 7 1988 1 1 3 PRO CG C 5.797 0.847 2.366 1.00 . A A . 3 PRO CG 1 1 7 1989 1 1 3 PRO HA H 5.003 3.549 0.717 1.00 . A A . 3 PRO HA 1 1 7 1990 1 1 3 PRO HB2 H 5.766 2.808 3.215 1.00 . A A . 3 PRO HB2 1 1 7 1991 1 1 3 PRO HB3 H 4.237 2.300 2.487 1.00 . A A . 3 PRO HB3 1 1 7 1992 1 1 3 PRO HD2 H 6.524 -0.256 0.687 1.00 . A A . 3 PRO HD2 1 1 7 1993 1 1 3 PRO HD3 H 4.761 -0.044 0.724 1.00 . A A . 3 PRO HD3 1 1 7 1994 1 1 3 PRO HG2 H 6.818 0.800 2.714 1.00 . A A . 3 PRO HG2 1 1 7 1995 1 1 3 PRO HG3 H 5.162 0.224 2.978 1.00 . A A . 3 PRO HG3 1 1 7 1996 1 1 3 PRO N N 5.852 1.685 0.187 1.00 . A A . 3 PRO N 1 1 7 1997 1 1 3 PRO O O 8.149 2.994 1.019 1.00 . A A . 3 PRO O 1 1 7 1998 1 1 4 LYS C C 8.325 6.168 3.194 1.00 . A A . 4 LYS C 1 1 7 1999 1 1 4 LYS CA C 8.221 5.664 1.758 1.00 . A A . 4 LYS CA 1 1 7 2000 1 1 4 LYS CB C 8.216 6.849 0.789 1.00 . A A . 4 LYS CB 1 1 7 2001 1 1 4 LYS CD C 6.769 8.691 -0.118 1.00 . A A . 4 LYS CD 1 1 7 2002 1 1 4 LYS CE C 7.728 8.980 -1.263 1.00 . A A . 4 LYS CE 1 1 7 2003 1 1 4 LYS CG C 6.829 7.233 0.304 1.00 . A A . 4 LYS CG 1 1 7 2004 1 1 4 LYS H H 6.141 5.269 1.721 1.00 . A A . 4 LYS H 1 1 7 2005 1 1 4 LYS HA H 9.075 5.040 1.545 1.00 . A A . 4 LYS HA 1 1 7 2006 1 1 4 LYS HB2 H 8.651 7.705 1.284 1.00 . A A . 4 LYS HB2 1 1 7 2007 1 1 4 LYS HB3 H 8.818 6.597 -0.072 1.00 . A A . 4 LYS HB3 1 1 7 2008 1 1 4 LYS HD2 H 5.764 8.924 -0.438 1.00 . A A . 4 LYS HD2 1 1 7 2009 1 1 4 LYS HD3 H 7.033 9.313 0.726 1.00 . A A . 4 LYS HD3 1 1 7 2010 1 1 4 LYS HE2 H 8.740 8.921 -0.892 1.00 . A A . 4 LYS HE2 1 1 7 2011 1 1 4 LYS HE3 H 7.583 8.235 -2.032 1.00 . A A . 4 LYS HE3 1 1 7 2012 1 1 4 LYS HG2 H 6.569 6.614 -0.541 1.00 . A A . 4 LYS HG2 1 1 7 2013 1 1 4 LYS HG3 H 6.120 7.070 1.104 1.00 . A A . 4 LYS HG3 1 1 7 2014 1 1 4 LYS HZ1 H 6.489 10.481 -2.020 1.00 . A A . 4 LYS HZ1 1 1 7 2015 1 1 4 LYS HZ2 H 8.014 10.419 -2.749 1.00 . A A . 4 LYS HZ2 1 1 7 2016 1 1 4 LYS HZ3 H 7.846 11.064 -1.194 1.00 . A A . 4 LYS HZ3 1 1 7 2017 1 1 4 LYS N N 7.019 4.858 1.575 1.00 . A A . 4 LYS N 1 1 7 2018 1 1 4 LYS NZ N 7.504 10.331 -1.847 1.00 . A A . 4 LYS NZ 1 1 7 2019 1 1 4 LYS O O 8.781 7.286 3.439 1.00 . A A . 4 LYS O 1 1 7 2020 1 1 5 LEU C C 9.275 6.368 5.899 1.00 . A A . 5 LEU C 1 1 7 2021 1 1 5 LEU CA C 7.949 5.698 5.552 1.00 . A A . 5 LEU CA 1 1 7 2022 1 1 5 LEU CB C 7.749 4.456 6.423 1.00 . A A . 5 LEU CB 1 1 7 2023 1 1 5 LEU CD1 C 6.028 5.302 8.038 1.00 . A A . 5 LEU CD1 1 1 7 2024 1 1 5 LEU CD2 C 5.310 4.288 5.867 1.00 . A A . 5 LEU CD2 1 1 7 2025 1 1 5 LEU CG C 6.342 4.250 6.985 1.00 . A A . 5 LEU CG 1 1 7 2026 1 1 5 LEU H H 7.549 4.460 3.883 1.00 . A A . 5 LEU H 1 1 7 2027 1 1 5 LEU HA H 7.147 6.395 5.743 1.00 . A A . 5 LEU HA 1 1 7 2028 1 1 5 LEU HB2 H 7.996 3.591 5.827 1.00 . A A . 5 LEU HB2 1 1 7 2029 1 1 5 LEU HB3 H 8.433 4.524 7.257 1.00 . A A . 5 LEU HB3 1 1 7 2030 1 1 5 LEU HD11 H 5.492 6.120 7.581 1.00 . A A . 5 LEU HD11 1 1 7 2031 1 1 5 LEU HD12 H 6.950 5.670 8.465 1.00 . A A . 5 LEU HD12 1 1 7 2032 1 1 5 LEU HD13 H 5.422 4.862 8.816 1.00 . A A . 5 LEU HD13 1 1 7 2033 1 1 5 LEU HD21 H 5.767 3.963 4.944 1.00 . A A . 5 LEU HD21 1 1 7 2034 1 1 5 LEU HD22 H 4.943 5.298 5.750 1.00 . A A . 5 LEU HD22 1 1 7 2035 1 1 5 LEU HD23 H 4.488 3.632 6.113 1.00 . A A . 5 LEU HD23 1 1 7 2036 1 1 5 LEU HG H 6.288 3.279 7.458 1.00 . A A . 5 LEU HG 1 1 7 2037 1 1 5 LEU N N 7.902 5.337 4.139 1.00 . A A . 5 LEU N 1 1 7 2038 1 1 5 LEU O O 9.317 7.313 6.687 1.00 . A A . 5 LEU O 1 1 7 2039 1 1 6 PHE C C 12.329 6.885 4.245 1.00 . A A . 6 PHE C 1 1 7 2040 1 1 6 PHE CA C 11.683 6.424 5.549 1.00 . A A . 6 PHE CA 1 1 7 2041 1 1 6 PHE CB C 12.572 5.384 6.232 1.00 . A A . 6 PHE CB 1 1 7 2042 1 1 6 PHE CD1 C 14.872 6.063 6.972 1.00 . A A . 6 PHE CD1 1 1 7 2043 1 1 6 PHE CD2 C 13.047 6.434 8.461 1.00 . A A . 6 PHE CD2 1 1 7 2044 1 1 6 PHE CE1 C 15.743 6.604 7.898 1.00 . A A . 6 PHE CE1 1 1 7 2045 1 1 6 PHE CE2 C 13.913 6.976 9.391 1.00 . A A . 6 PHE CE2 1 1 7 2046 1 1 6 PHE CG C 13.516 5.972 7.242 1.00 . A A . 6 PHE CG 1 1 7 2047 1 1 6 PHE CZ C 15.263 7.060 9.110 1.00 . A A . 6 PHE CZ 1 1 7 2048 1 1 6 PHE H H 10.257 5.119 4.685 1.00 . A A . 6 PHE H 1 1 7 2049 1 1 6 PHE HA H 11.572 7.276 6.202 1.00 . A A . 6 PHE HA 1 1 7 2050 1 1 6 PHE HB2 H 11.948 4.666 6.741 1.00 . A A . 6 PHE HB2 1 1 7 2051 1 1 6 PHE HB3 H 13.160 4.876 5.482 1.00 . A A . 6 PHE HB3 1 1 7 2052 1 1 6 PHE HD1 H 15.249 5.706 6.023 1.00 . A A . 6 PHE HD1 1 1 7 2053 1 1 6 PHE HD2 H 11.992 6.368 8.683 1.00 . A A . 6 PHE HD2 1 1 7 2054 1 1 6 PHE HE1 H 16.798 6.668 7.675 1.00 . A A . 6 PHE HE1 1 1 7 2055 1 1 6 PHE HE2 H 13.535 7.332 10.338 1.00 . A A . 6 PHE HE2 1 1 7 2056 1 1 6 PHE HZ H 15.941 7.484 9.835 1.00 . A A . 6 PHE HZ 1 1 7 2057 1 1 6 PHE N N 10.355 5.873 5.304 1.00 . A A . 6 PHE N 1 1 7 2058 1 1 6 PHE O O 13.377 7.530 4.254 1.00 . A A . 6 PHE O 1 1 7 2059 1 1 7 ALA C C 12.026 8.423 1.568 1.00 . A A . 7 ALA C 1 1 7 2060 1 1 7 ALA CA C 12.207 6.929 1.816 1.00 . A A . 7 ALA CA 1 1 7 2061 1 1 7 ALA CB C 11.515 6.124 0.726 1.00 . A A . 7 ALA CB 1 1 7 2062 1 1 7 ALA H H 10.863 6.035 3.184 1.00 . A A . 7 ALA H 1 1 7 2063 1 1 7 ALA HA H 13.261 6.695 1.788 1.00 . A A . 7 ALA HA 1 1 7 2064 1 1 7 ALA HB1 H 12.249 5.785 0.009 1.00 . A A . 7 ALA HB1 1 1 7 2065 1 1 7 ALA HB2 H 11.021 5.271 1.167 1.00 . A A . 7 ALA HB2 1 1 7 2066 1 1 7 ALA HB3 H 10.785 6.745 0.228 1.00 . A A . 7 ALA HB3 1 1 7 2067 1 1 7 ALA N N 11.695 6.549 3.127 1.00 . A A . 7 ALA N 1 1 7 2068 1 1 7 ALA O O 12.791 9.037 0.823 1.00 . A A . 7 ALA O 1 1 7 2069 1 1 8 LYS C C 11.488 11.245 3.083 1.00 . A A . 8 LYS C 1 1 7 2070 1 1 8 LYS CA C 10.727 10.426 2.045 1.00 . A A . 8 LYS CA 1 1 7 2071 1 1 8 LYS CB C 9.225 10.686 2.175 1.00 . A A . 8 LYS CB 1 1 7 2072 1 1 8 LYS CD C 7.896 11.310 4.214 1.00 . A A . 8 LYS CD 1 1 7 2073 1 1 8 LYS CE C 6.642 10.790 4.900 1.00 . A A . 8 LYS CE 1 1 7 2074 1 1 8 LYS CG C 8.635 10.199 3.488 1.00 . A A . 8 LYS CG 1 1 7 2075 1 1 8 LYS H H 10.434 8.462 2.777 1.00 . A A . 8 LYS H 1 1 7 2076 1 1 8 LYS HA H 11.051 10.726 1.059 1.00 . A A . 8 LYS HA 1 1 7 2077 1 1 8 LYS HB2 H 9.047 11.749 2.098 1.00 . A A . 8 LYS HB2 1 1 7 2078 1 1 8 LYS HB3 H 8.713 10.184 1.367 1.00 . A A . 8 LYS HB3 1 1 7 2079 1 1 8 LYS HD2 H 8.549 11.738 4.960 1.00 . A A . 8 LYS HD2 1 1 7 2080 1 1 8 LYS HD3 H 7.616 12.071 3.499 1.00 . A A . 8 LYS HD3 1 1 7 2081 1 1 8 LYS HE2 H 6.105 10.160 4.208 1.00 . A A . 8 LYS HE2 1 1 7 2082 1 1 8 LYS HE3 H 6.934 10.211 5.763 1.00 . A A . 8 LYS HE3 1 1 7 2083 1 1 8 LYS HG2 H 7.944 9.394 3.285 1.00 . A A . 8 LYS HG2 1 1 7 2084 1 1 8 LYS HG3 H 9.435 9.838 4.119 1.00 . A A . 8 LYS HG3 1 1 7 2085 1 1 8 LYS HZ1 H 5.772 11.985 6.375 1.00 . A A . 8 LYS HZ1 1 1 7 2086 1 1 8 LYS HZ2 H 4.772 11.710 5.040 1.00 . A A . 8 LYS HZ2 1 1 7 2087 1 1 8 LYS HZ3 H 6.063 12.797 4.920 1.00 . A A . 8 LYS HZ3 1 1 7 2088 1 1 8 LYS N N 11.009 9.004 2.196 1.00 . A A . 8 LYS N 1 1 7 2089 1 1 8 LYS NZ N 5.750 11.899 5.339 1.00 . A A . 8 LYS NZ 1 1 7 2090 1 1 8 LYS O O 11.898 12.375 2.816 1.00 . A A . 8 LYS O 1 1 7 2091 1 1 9 ILE C C 13.885 11.389 5.063 1.00 . A A . 9 ILE C 1 1 7 2092 1 1 9 ILE CA C 12.387 11.344 5.341 1.00 . A A . 9 ILE CA 1 1 7 2093 1 1 9 ILE CB C 12.148 10.652 6.696 1.00 . A A . 9 ILE CB 1 1 7 2094 1 1 9 ILE CD1 C 14.392 9.786 7.528 1.00 . A A . 9 ILE CD1 1 1 7 2095 1 1 9 ILE CG1 C 13.082 9.450 6.851 1.00 . A A . 9 ILE CG1 1 1 7 2096 1 1 9 ILE CG2 C 10.695 10.220 6.822 1.00 . A A . 9 ILE CG2 1 1 7 2097 1 1 9 ILE H H 11.322 9.766 4.417 1.00 . A A . 9 ILE H 1 1 7 2098 1 1 9 ILE HA H 12.012 12.355 5.405 1.00 . A A . 9 ILE HA 1 1 7 2099 1 1 9 ILE HB H 12.356 11.364 7.480 1.00 . A A . 9 ILE HB 1 1 7 2100 1 1 9 ILE HD11 H 15.184 9.193 7.095 1.00 . A A . 9 ILE HD11 1 1 7 2101 1 1 9 ILE HD12 H 14.610 10.834 7.392 1.00 . A A . 9 ILE HD12 1 1 7 2102 1 1 9 ILE HD13 H 14.318 9.568 8.584 1.00 . A A . 9 ILE HD13 1 1 7 2103 1 1 9 ILE HG12 H 12.589 8.693 7.441 1.00 . A A . 9 ILE HG12 1 1 7 2104 1 1 9 ILE HG13 H 13.306 9.049 5.873 1.00 . A A . 9 ILE HG13 1 1 7 2105 1 1 9 ILE HG21 H 10.349 10.408 7.828 1.00 . A A . 9 ILE HG21 1 1 7 2106 1 1 9 ILE HG22 H 10.091 10.782 6.125 1.00 . A A . 9 ILE HG22 1 1 7 2107 1 1 9 ILE HG23 H 10.611 9.167 6.603 1.00 . A A . 9 ILE HG23 1 1 7 2108 1 1 9 ILE N N 11.673 10.668 4.265 1.00 . A A . 9 ILE N 1 1 7 2109 1 1 9 ILE O O 14.588 12.287 5.529 1.00 . A A . 9 ILE O 1 1 7 2110 1 1 10 THR C C 16.102 11.210 2.743 1.00 . A A . 10 THR C 1 1 7 2111 1 1 10 THR CA C 15.785 10.344 3.957 1.00 . A A . 10 THR CA 1 1 7 2112 1 1 10 THR CB C 16.221 8.895 3.668 1.00 . A A . 10 THR CB 1 1 7 2113 1 1 10 THR CG2 C 16.268 8.078 4.951 1.00 . A A . 10 THR CG2 1 1 7 2114 1 1 10 THR H H 13.760 9.729 3.957 1.00 . A A . 10 THR H 1 1 7 2115 1 1 10 THR HA H 16.351 10.706 4.803 1.00 . A A . 10 THR HA 1 1 7 2116 1 1 10 THR HB H 17.210 8.913 3.233 1.00 . A A . 10 THR HB 1 1 7 2117 1 1 10 THR HG1 H 15.791 8.029 1.949 1.00 . A A . 10 THR HG1 1 1 7 2118 1 1 10 THR HG21 H 16.570 7.067 4.722 1.00 . A A . 10 THR HG21 1 1 7 2119 1 1 10 THR HG22 H 15.289 8.068 5.407 1.00 . A A . 10 THR HG22 1 1 7 2120 1 1 10 THR HG23 H 16.978 8.521 5.632 1.00 . A A . 10 THR HG23 1 1 7 2121 1 1 10 THR N N 14.370 10.415 4.298 1.00 . A A . 10 THR N 1 1 7 2122 1 1 10 THR O O 15.542 11.014 1.664 1.00 . A A . 10 THR O 1 1 7 2123 1 1 10 THR OG1 O 15.314 8.286 2.742 1.00 . A A . 10 THR OG1 1 1 7 2124 1 1 11 LYS C C 18.893 12.948 1.559 1.00 . A A . 11 LYS C 1 1 7 2125 1 1 11 LYS CA C 17.398 13.064 1.844 1.00 . A A . 11 LYS CA 1 1 7 2126 1 1 11 LYS CB C 17.046 14.510 2.199 1.00 . A A . 11 LYS CB 1 1 7 2127 1 1 11 LYS CD C 16.342 14.593 4.608 1.00 . A A . 11 LYS CD 1 1 7 2128 1 1 11 LYS CE C 16.475 15.437 5.867 1.00 . A A . 11 LYS CE 1 1 7 2129 1 1 11 LYS CG C 17.445 14.905 3.610 1.00 . A A . 11 LYS CG 1 1 7 2130 1 1 11 LYS H H 17.416 12.275 3.809 1.00 . A A . 11 LYS H 1 1 7 2131 1 1 11 LYS HA H 16.852 12.776 0.959 1.00 . A A . 11 LYS HA 1 1 7 2132 1 1 11 LYS HB2 H 17.549 15.170 1.507 1.00 . A A . 11 LYS HB2 1 1 7 2133 1 1 11 LYS HB3 H 15.979 14.643 2.098 1.00 . A A . 11 LYS HB3 1 1 7 2134 1 1 11 LYS HD2 H 15.386 14.797 4.151 1.00 . A A . 11 LYS HD2 1 1 7 2135 1 1 11 LYS HD3 H 16.398 13.548 4.878 1.00 . A A . 11 LYS HD3 1 1 7 2136 1 1 11 LYS HE2 H 17.287 16.134 5.733 1.00 . A A . 11 LYS HE2 1 1 7 2137 1 1 11 LYS HE3 H 15.554 15.981 6.018 1.00 . A A . 11 LYS HE3 1 1 7 2138 1 1 11 LYS HG2 H 18.333 14.359 3.890 1.00 . A A . 11 LYS HG2 1 1 7 2139 1 1 11 LYS HG3 H 17.649 15.966 3.633 1.00 . A A . 11 LYS HG3 1 1 7 2140 1 1 11 LYS HZ1 H 15.852 14.301 7.505 1.00 . A A . 11 LYS HZ1 1 1 7 2141 1 1 11 LYS HZ2 H 17.294 15.145 7.766 1.00 . A A . 11 LYS HZ2 1 1 7 2142 1 1 11 LYS HZ3 H 17.290 13.755 6.801 1.00 . A A . 11 LYS HZ3 1 1 7 2143 1 1 11 LYS N N 17.004 12.168 2.925 1.00 . A A . 11 LYS N 1 1 7 2144 1 1 11 LYS NZ N 16.747 14.601 7.069 1.00 . A A . 11 LYS NZ 1 1 7 2145 1 1 11 LYS O O 19.477 13.805 0.895 1.00 . A A . 11 LYS O 1 1 7 2146 1 1 12 LYS C C 21.165 10.546 0.840 1.00 . A A . 12 LYS C 1 1 7 2147 1 1 12 LYS CA C 20.932 11.653 1.863 1.00 . A A . 12 LYS CA 1 1 7 2148 1 1 12 LYS CB C 21.603 11.287 3.188 1.00 . A A . 12 LYS CB 1 1 7 2149 1 1 12 LYS CD C 21.576 11.589 5.682 1.00 . A A . 12 LYS CD 1 1 7 2150 1 1 12 LYS CE C 22.286 12.918 5.892 1.00 . A A . 12 LYS CE 1 1 7 2151 1 1 12 LYS CG C 20.750 11.594 4.407 1.00 . A A . 12 LYS CG 1 1 7 2152 1 1 12 LYS H H 18.986 11.235 2.586 1.00 . A A . 12 LYS H 1 1 7 2153 1 1 12 LYS HA H 21.366 12.569 1.490 1.00 . A A . 12 LYS HA 1 1 7 2154 1 1 12 LYS HB2 H 21.824 10.230 3.186 1.00 . A A . 12 LYS HB2 1 1 7 2155 1 1 12 LYS HB3 H 22.528 11.840 3.274 1.00 . A A . 12 LYS HB3 1 1 7 2156 1 1 12 LYS HD2 H 20.925 11.405 6.523 1.00 . A A . 12 LYS HD2 1 1 7 2157 1 1 12 LYS HD3 H 22.315 10.802 5.619 1.00 . A A . 12 LYS HD3 1 1 7 2158 1 1 12 LYS HE2 H 22.592 13.303 4.931 1.00 . A A . 12 LYS HE2 1 1 7 2159 1 1 12 LYS HE3 H 21.597 13.609 6.354 1.00 . A A . 12 LYS HE3 1 1 7 2160 1 1 12 LYS HG2 H 20.301 12.568 4.286 1.00 . A A . 12 LYS HG2 1 1 7 2161 1 1 12 LYS HG3 H 19.974 10.846 4.489 1.00 . A A . 12 LYS HG3 1 1 7 2162 1 1 12 LYS HZ1 H 23.334 13.269 7.664 1.00 . A A . 12 LYS HZ1 1 1 7 2163 1 1 12 LYS HZ2 H 24.318 13.184 6.291 1.00 . A A . 12 LYS HZ2 1 1 7 2164 1 1 12 LYS HZ3 H 23.670 11.770 6.955 1.00 . A A . 12 LYS HZ3 1 1 7 2165 1 1 12 LYS N N 19.506 11.883 2.065 1.00 . A A . 12 LYS N 1 1 7 2166 1 1 12 LYS NZ N 23.486 12.775 6.761 1.00 . A A . 12 LYS NZ 1 1 7 2167 1 1 12 LYS O O 21.608 10.805 -0.278 1.00 . A A . 12 LYS O 1 1 7 2168 1 1 13 ASN C C 20.147 8.288 -0.887 1.00 . A A . 13 ASN C 1 1 7 2169 1 1 13 ASN CA C 21.037 8.166 0.347 1.00 . A A . 13 ASN CA 1 1 7 2170 1 1 13 ASN CB C 20.719 6.868 1.092 1.00 . A A . 13 ASN CB 1 1 7 2171 1 1 13 ASN CG C 21.943 5.992 1.274 1.00 . A A . 13 ASN CG 1 1 7 2172 1 1 13 ASN H H 20.511 9.169 2.135 1.00 . A A . 13 ASN H 1 1 7 2173 1 1 13 ASN HA H 22.069 8.146 0.031 1.00 . A A . 13 ASN HA 1 1 7 2174 1 1 13 ASN HB2 H 20.323 7.108 2.068 1.00 . A A . 13 ASN HB2 1 1 7 2175 1 1 13 ASN HB3 H 19.980 6.311 0.535 1.00 . A A . 13 ASN HB3 1 1 7 2176 1 1 13 ASN HD21 H 22.078 6.535 3.183 1.00 . A A . 13 ASN HD21 1 1 7 2177 1 1 13 ASN HD22 H 23.282 5.426 2.631 1.00 . A A . 13 ASN HD22 1 1 7 2178 1 1 13 ASN N N 20.861 9.312 1.231 1.00 . A A . 13 ASN N 1 1 7 2179 1 1 13 ASN ND2 N 22.489 5.983 2.485 1.00 . A A . 13 ASN ND2 1 1 7 2180 1 1 13 ASN O O 20.380 7.630 -1.900 1.00 . A A . 13 ASN O 1 1 7 2181 1 1 13 ASN OD1 O 22.392 5.330 0.338 1.00 . A A . 13 ASN OD1 1 1 7 2182 1 1 14 MET C C 18.945 9.846 -3.138 1.00 . A A . 14 MET C 1 1 7 2183 1 1 14 MET CA C 18.205 9.347 -1.902 1.00 . A A . 14 MET CA 1 1 7 2184 1 1 14 MET CB C 17.118 10.348 -1.505 1.00 . A A . 14 MET CB 1 1 7 2185 1 1 14 MET CE C 13.815 8.808 -3.191 1.00 . A A . 14 MET CE 1 1 7 2186 1 1 14 MET CG C 15.963 10.413 -2.492 1.00 . A A . 14 MET CG 1 1 7 2187 1 1 14 MET H H 18.994 9.634 0.041 1.00 . A A . 14 MET H 1 1 7 2188 1 1 14 MET HA H 17.742 8.399 -2.132 1.00 . A A . 14 MET HA 1 1 7 2189 1 1 14 MET HB2 H 16.723 10.068 -0.540 1.00 . A A . 14 MET HB2 1 1 7 2190 1 1 14 MET HB3 H 17.558 11.331 -1.435 1.00 . A A . 14 MET HB3 1 1 7 2191 1 1 14 MET HE1 H 14.635 8.277 -3.652 1.00 . A A . 14 MET HE1 1 1 7 2192 1 1 14 MET HE2 H 13.078 8.100 -2.842 1.00 . A A . 14 MET HE2 1 1 7 2193 1 1 14 MET HE3 H 13.363 9.471 -3.915 1.00 . A A . 14 MET HE3 1 1 7 2194 1 1 14 MET HG2 H 15.807 11.443 -2.776 1.00 . A A . 14 MET HG2 1 1 7 2195 1 1 14 MET HG3 H 16.223 9.836 -3.367 1.00 . A A . 14 MET HG3 1 1 7 2196 1 1 14 MET N N 19.128 9.137 -0.793 1.00 . A A . 14 MET N 1 1 7 2197 1 1 14 MET O O 18.826 9.270 -4.219 1.00 . A A . 14 MET O 1 1 7 2198 1 1 14 MET SD S 14.426 9.765 -1.806 1.00 . A A . 14 MET SD 1 1 7 2199 1 1 15 ALA C C 21.702 10.655 -4.389 1.00 . A A . 15 ALA C 1 1 7 2200 1 1 15 ALA CA C 20.470 11.496 -4.074 1.00 . A A . 15 ALA CA 1 1 7 2201 1 1 15 ALA CB C 20.873 12.926 -3.747 1.00 . A A . 15 ALA CB 1 1 7 2202 1 1 15 ALA H H 19.763 11.336 -2.086 1.00 . A A . 15 ALA H 1 1 7 2203 1 1 15 ALA HA H 19.830 11.519 -4.945 1.00 . A A . 15 ALA HA 1 1 7 2204 1 1 15 ALA HB1 H 20.781 13.091 -2.684 1.00 . A A . 15 ALA HB1 1 1 7 2205 1 1 15 ALA HB2 H 21.897 13.089 -4.050 1.00 . A A . 15 ALA HB2 1 1 7 2206 1 1 15 ALA HB3 H 20.228 13.612 -4.275 1.00 . A A . 15 ALA HB3 1 1 7 2207 1 1 15 ALA N N 19.709 10.921 -2.972 1.00 . A A . 15 ALA N 1 1 7 2208 1 1 15 ALA O O 22.474 10.980 -5.292 1.00 . A A . 15 ALA O 1 1 7 2209 1 1 16 HIS C C 22.594 7.401 -4.540 1.00 . A A . 16 HIS C 1 1 7 2210 1 1 16 HIS CA C 23.022 8.685 -3.836 1.00 . A A . 16 HIS CA 1 1 7 2211 1 1 16 HIS CB C 23.676 8.352 -2.495 1.00 . A A . 16 HIS CB 1 1 7 2212 1 1 16 HIS CD2 C 25.528 9.936 -1.605 1.00 . A A . 16 HIS CD2 1 1 7 2213 1 1 16 HIS CE1 C 27.229 9.082 -2.693 1.00 . A A . 16 HIS CE1 1 1 7 2214 1 1 16 HIS CG C 25.060 8.906 -2.349 1.00 . A A . 16 HIS CG 1 1 7 2215 1 1 16 HIS H H 21.233 9.368 -2.933 1.00 . A A . 16 HIS H 1 1 7 2216 1 1 16 HIS HA H 23.739 9.200 -4.458 1.00 . A A . 16 HIS HA 1 1 7 2217 1 1 16 HIS HB2 H 23.071 8.757 -1.697 1.00 . A A . 16 HIS HB2 1 1 7 2218 1 1 16 HIS HB3 H 23.734 7.279 -2.387 1.00 . A A . 16 HIS HB3 1 1 7 2219 1 1 16 HIS HD1 H 26.136 7.636 -3.641 1.00 . A A . 16 HIS HD1 1 1 7 2220 1 1 16 HIS HD2 H 24.947 10.570 -0.950 1.00 . A A . 16 HIS HD2 1 1 7 2221 1 1 16 HIS HE1 H 28.228 8.906 -3.063 1.00 . A A . 16 HIS HE1 1 1 7 2222 1 1 16 HIS N N 21.882 9.573 -3.637 1.00 . A A . 16 HIS N 1 1 7 2223 1 1 16 HIS ND1 N 26.150 8.393 -3.019 1.00 . A A . 16 HIS ND1 1 1 7 2224 1 1 16 HIS NE2 N 26.878 10.024 -1.836 1.00 . A A . 16 HIS NE2 1 1 7 2225 1 1 16 HIS O O 23.425 6.675 -5.086 1.00 . A A . 16 HIS O 1 1 7 2226 1 1 17 ILE C C 21.219 5.825 -6.608 1.00 . A A . 17 ILE C 1 1 7 2227 1 1 17 ILE CA C 20.757 5.932 -5.159 1.00 . A A . 17 ILE CA 1 1 7 2228 1 1 17 ILE CB C 19.217 5.917 -5.121 1.00 . A A . 17 ILE CB 1 1 7 2229 1 1 17 ILE CD1 C 17.212 7.363 -5.724 1.00 . A A . 17 ILE CD1 1 1 7 2230 1 1 17 ILE CG1 C 18.652 7.014 -6.025 1.00 . A A . 17 ILE CG1 1 1 7 2231 1 1 17 ILE CG2 C 18.721 6.092 -3.693 1.00 . A A . 17 ILE CG2 1 1 7 2232 1 1 17 ILE H H 20.682 7.745 -4.071 1.00 . A A . 17 ILE H 1 1 7 2233 1 1 17 ILE HA H 21.119 5.072 -4.612 1.00 . A A . 17 ILE HA 1 1 7 2234 1 1 17 ILE HB H 18.880 4.956 -5.478 1.00 . A A . 17 ILE HB 1 1 7 2235 1 1 17 ILE HD11 H 16.838 8.035 -6.482 1.00 . A A . 17 ILE HD11 1 1 7 2236 1 1 17 ILE HD12 H 16.617 6.462 -5.714 1.00 . A A . 17 ILE HD12 1 1 7 2237 1 1 17 ILE HD13 H 17.153 7.843 -4.758 1.00 . A A . 17 ILE HD13 1 1 7 2238 1 1 17 ILE HG12 H 19.242 7.909 -5.906 1.00 . A A . 17 ILE HG12 1 1 7 2239 1 1 17 ILE HG13 H 18.707 6.685 -7.053 1.00 . A A . 17 ILE HG13 1 1 7 2240 1 1 17 ILE HG21 H 17.708 5.726 -3.617 1.00 . A A . 17 ILE HG21 1 1 7 2241 1 1 17 ILE HG22 H 19.356 5.535 -3.021 1.00 . A A . 17 ILE HG22 1 1 7 2242 1 1 17 ILE HG23 H 18.746 7.138 -3.429 1.00 . A A . 17 ILE HG23 1 1 7 2243 1 1 17 ILE N N 21.294 7.128 -4.522 1.00 . A A . 17 ILE N 1 1 7 2244 1 1 17 ILE O O 21.539 4.739 -7.090 1.00 . A A . 17 ILE O 1 1 7 2245 1 1 18 ARG C C 20.848 6.034 -9.536 1.00 . A A . 18 ARG C 1 1 7 2246 1 1 18 ARG CA C 21.678 6.996 -8.691 1.00 . A A . 18 ARG CA 1 1 7 2247 1 1 18 ARG CB C 23.162 6.641 -8.804 1.00 . A A . 18 ARG CB 1 1 7 2248 1 1 18 ARG CD C 25.267 6.814 -10.166 1.00 . A A . 18 ARG CD 1 1 7 2249 1 1 18 ARG CG C 23.886 7.396 -9.907 1.00 . A A . 18 ARG CG 1 1 7 2250 1 1 18 ARG CZ C 26.764 8.720 -9.754 1.00 . A A . 18 ARG CZ 1 1 7 2251 1 1 18 ARG H H 20.987 7.796 -6.858 1.00 . A A . 18 ARG H 1 1 7 2252 1 1 18 ARG HA H 21.528 8.000 -9.059 1.00 . A A . 18 ARG HA 1 1 7 2253 1 1 18 ARG HB2 H 23.647 6.867 -7.866 1.00 . A A . 18 ARG HB2 1 1 7 2254 1 1 18 ARG HB3 H 23.253 5.584 -9.002 1.00 . A A . 18 ARG HB3 1 1 7 2255 1 1 18 ARG HD2 H 25.266 5.775 -9.871 1.00 . A A . 18 ARG HD2 1 1 7 2256 1 1 18 ARG HD3 H 25.481 6.887 -11.222 1.00 . A A . 18 ARG HD3 1 1 7 2257 1 1 18 ARG HE H 26.682 7.072 -8.634 1.00 . A A . 18 ARG HE 1 1 7 2258 1 1 18 ARG HG2 H 23.305 7.334 -10.815 1.00 . A A . 18 ARG HG2 1 1 7 2259 1 1 18 ARG HG3 H 23.990 8.430 -9.614 1.00 . A A . 18 ARG HG3 1 1 7 2260 1 1 18 ARG HH11 H 25.560 8.917 -11.364 1.00 . A A . 18 ARG HH11 1 1 7 2261 1 1 18 ARG HH12 H 26.621 10.254 -11.062 1.00 . A A . 18 ARG HH12 1 1 7 2262 1 1 18 ARG HH21 H 28.083 8.825 -8.226 1.00 . A A . 18 ARG HH21 1 1 7 2263 1 1 18 ARG HH22 H 28.056 10.200 -9.277 1.00 . A A . 18 ARG HH22 1 1 7 2264 1 1 18 ARG N N 21.254 6.961 -7.297 1.00 . A A . 18 ARG N 1 1 7 2265 1 1 18 ARG NE N 26.307 7.518 -9.421 1.00 . A A . 18 ARG NE 1 1 7 2266 1 1 18 ARG NH1 N 26.276 9.348 -10.814 1.00 . A A . 18 ARG NH1 1 1 7 2267 1 1 18 ARG NH2 N 27.712 9.295 -9.026 1.00 . A A . 18 ARG NH2 1 1 7 2268 1 1 18 ARG O O 21.162 5.787 -10.701 1.00 . A A . 18 ARG O 1 1 8 2269 1 1 1 PHE C C 2.541 1.568 -0.033 1.00 . A A . 1 PHE C 1 1 8 2270 1 1 1 PHE CA C 1.515 0.492 -0.374 1.00 . A A . 1 PHE CA 1 1 8 2271 1 1 1 PHE CB C 0.331 0.575 0.592 1.00 . A A . 1 PHE CB 1 1 8 2272 1 1 1 PHE CD1 C -1.941 0.689 -0.468 1.00 . A A . 1 PHE CD1 1 1 8 2273 1 1 1 PHE CD2 C -0.826 2.733 0.045 1.00 . A A . 1 PHE CD2 1 1 8 2274 1 1 1 PHE CE1 C -3.016 1.397 -0.971 1.00 . A A . 1 PHE CE1 1 1 8 2275 1 1 1 PHE CE2 C -1.898 3.447 -0.456 1.00 . A A . 1 PHE CE2 1 1 8 2276 1 1 1 PHE CG C -0.835 1.348 0.046 1.00 . A A . 1 PHE CG 1 1 8 2277 1 1 1 PHE CZ C -2.994 2.778 -0.966 1.00 . A A . 1 PHE CZ 1 1 8 2278 1 1 1 PHE H1 H 1.536 -1.625 -0.322 1.00 . A A . 1 PHE H1 1 1 8 2279 1 1 1 PHE HA H 1.160 0.655 -1.380 1.00 . A A . 1 PHE HA 1 1 8 2280 1 1 1 PHE HB2 H -0.010 -0.424 0.818 1.00 . A A . 1 PHE HB2 1 1 8 2281 1 1 1 PHE HB3 H 0.652 1.056 1.503 1.00 . A A . 1 PHE HB3 1 1 8 2282 1 1 1 PHE HD1 H -1.959 -0.392 -0.472 1.00 . A A . 1 PHE HD1 1 1 8 2283 1 1 1 PHE HD2 H 0.030 3.258 0.442 1.00 . A A . 1 PHE HD2 1 1 8 2284 1 1 1 PHE HE1 H -3.871 0.870 -1.369 1.00 . A A . 1 PHE HE1 1 1 8 2285 1 1 1 PHE HE2 H -1.879 4.526 -0.451 1.00 . A A . 1 PHE HE2 1 1 8 2286 1 1 1 PHE HZ H -3.833 3.333 -1.358 1.00 . A A . 1 PHE HZ 1 1 8 2287 1 1 1 PHE N N 2.117 -0.835 -0.324 1.00 . A A . 1 PHE N 1 1 8 2288 1 1 1 PHE O O 2.477 2.687 -0.544 1.00 . A A . 1 PHE O 1 1 8 2289 1 1 2 LEU C C 5.913 1.581 0.982 1.00 . A A . 2 LEU C 1 1 8 2290 1 1 2 LEU CA C 4.526 2.159 1.245 1.00 . A A . 2 LEU CA 1 1 8 2291 1 1 2 LEU CB C 4.376 2.500 2.729 1.00 . A A . 2 LEU CB 1 1 8 2292 1 1 2 LEU CD1 C 2.588 2.472 4.485 1.00 . A A . 2 LEU CD1 1 1 8 2293 1 1 2 LEU CD2 C 3.080 4.584 3.239 1.00 . A A . 2 LEU CD2 1 1 8 2294 1 1 2 LEU CG C 3.020 3.066 3.154 1.00 . A A . 2 LEU CG 1 1 8 2295 1 1 2 LEU H H 3.485 0.317 1.207 1.00 . A A . 2 LEU H 1 1 8 2296 1 1 2 LEU HA H 4.409 3.061 0.664 1.00 . A A . 2 LEU HA 1 1 8 2297 1 1 2 LEU HB2 H 4.549 1.597 3.295 1.00 . A A . 2 LEU HB2 1 1 8 2298 1 1 2 LEU HB3 H 5.133 3.229 2.978 1.00 . A A . 2 LEU HB3 1 1 8 2299 1 1 2 LEU HD11 H 1.758 1.799 4.327 1.00 . A A . 2 LEU HD11 1 1 8 2300 1 1 2 LEU HD12 H 2.285 3.266 5.152 1.00 . A A . 2 LEU HD12 1 1 8 2301 1 1 2 LEU HD13 H 3.413 1.930 4.923 1.00 . A A . 2 LEU HD13 1 1 8 2302 1 1 2 LEU HD21 H 3.017 5.002 2.245 1.00 . A A . 2 LEU HD21 1 1 8 2303 1 1 2 LEU HD22 H 4.011 4.883 3.697 1.00 . A A . 2 LEU HD22 1 1 8 2304 1 1 2 LEU HD23 H 2.253 4.943 3.834 1.00 . A A . 2 LEU HD23 1 1 8 2305 1 1 2 LEU HG H 2.278 2.800 2.414 1.00 . A A . 2 LEU HG 1 1 8 2306 1 1 2 LEU N N 3.486 1.223 0.834 1.00 . A A . 2 LEU N 1 1 8 2307 1 1 2 LEU O O 6.659 1.250 1.904 1.00 . A A . 2 LEU O 1 1 8 2308 1 1 3 PRO C C 8.718 1.873 -0.390 1.00 . A A . 3 PRO C 1 1 8 2309 1 1 3 PRO CA C 7.570 0.925 -0.719 1.00 . A A . 3 PRO CA 1 1 8 2310 1 1 3 PRO CB C 7.423 0.770 -2.235 1.00 . A A . 3 PRO CB 1 1 8 2311 1 1 3 PRO CD C 5.430 1.835 -1.455 1.00 . A A . 3 PRO CD 1 1 8 2312 1 1 3 PRO CG C 6.381 1.763 -2.618 1.00 . A A . 3 PRO CG 1 1 8 2313 1 1 3 PRO HA H 7.762 -0.040 -0.274 1.00 . A A . 3 PRO HA 1 1 8 2314 1 1 3 PRO HB2 H 8.368 0.983 -2.714 1.00 . A A . 3 PRO HB2 1 1 8 2315 1 1 3 PRO HB3 H 7.113 -0.238 -2.469 1.00 . A A . 3 PRO HB3 1 1 8 2316 1 1 3 PRO HD2 H 5.048 2.839 -1.342 1.00 . A A . 3 PRO HD2 1 1 8 2317 1 1 3 PRO HD3 H 4.620 1.133 -1.586 1.00 . A A . 3 PRO HD3 1 1 8 2318 1 1 3 PRO HG2 H 6.836 2.726 -2.790 1.00 . A A . 3 PRO HG2 1 1 8 2319 1 1 3 PRO HG3 H 5.863 1.427 -3.505 1.00 . A A . 3 PRO HG3 1 1 8 2320 1 1 3 PRO N N 6.269 1.460 -0.305 1.00 . A A . 3 PRO N 1 1 8 2321 1 1 3 PRO O O 9.883 1.475 -0.385 1.00 . A A . 3 PRO O 1 1 8 2322 1 1 4 LYS C C 9.160 4.681 1.625 1.00 . A A . 4 LYS C 1 1 8 2323 1 1 4 LYS CA C 9.384 4.134 0.219 1.00 . A A . 4 LYS CA 1 1 8 2324 1 1 4 LYS CB C 9.347 5.277 -0.798 1.00 . A A . 4 LYS CB 1 1 8 2325 1 1 4 LYS CD C 7.787 6.823 -2.017 1.00 . A A . 4 LYS CD 1 1 8 2326 1 1 4 LYS CE C 8.862 7.248 -3.005 1.00 . A A . 4 LYS CE 1 1 8 2327 1 1 4 LYS CG C 8.016 5.406 -1.519 1.00 . A A . 4 LYS CG 1 1 8 2328 1 1 4 LYS H H 7.436 3.385 -0.134 1.00 . A A . 4 LYS H 1 1 8 2329 1 1 4 LYS HA H 10.354 3.661 0.180 1.00 . A A . 4 LYS HA 1 1 8 2330 1 1 4 LYS HB2 H 9.546 6.206 -0.284 1.00 . A A . 4 LYS HB2 1 1 8 2331 1 1 4 LYS HB3 H 10.118 5.112 -1.536 1.00 . A A . 4 LYS HB3 1 1 8 2332 1 1 4 LYS HD2 H 6.825 6.873 -2.505 1.00 . A A . 4 LYS HD2 1 1 8 2333 1 1 4 LYS HD3 H 7.799 7.499 -1.173 1.00 . A A . 4 LYS HD3 1 1 8 2334 1 1 4 LYS HE2 H 9.505 7.973 -2.529 1.00 . A A . 4 LYS HE2 1 1 8 2335 1 1 4 LYS HE3 H 9.442 6.379 -3.281 1.00 . A A . 4 LYS HE3 1 1 8 2336 1 1 4 LYS HG2 H 8.008 4.734 -2.364 1.00 . A A . 4 LYS HG2 1 1 8 2337 1 1 4 LYS HG3 H 7.220 5.141 -0.837 1.00 . A A . 4 LYS HG3 1 1 8 2338 1 1 4 LYS HZ1 H 7.242 7.894 -4.154 1.00 . A A . 4 LYS HZ1 1 1 8 2339 1 1 4 LYS HZ2 H 8.526 7.277 -5.066 1.00 . A A . 4 LYS HZ2 1 1 8 2340 1 1 4 LYS HZ3 H 8.646 8.814 -4.370 1.00 . A A . 4 LYS HZ3 1 1 8 2341 1 1 4 LYS N N 8.382 3.128 -0.114 1.00 . A A . 4 LYS N 1 1 8 2342 1 1 4 LYS NZ N 8.278 7.851 -4.235 1.00 . A A . 4 LYS NZ 1 1 8 2343 1 1 4 LYS O O 9.376 5.866 1.882 1.00 . A A . 4 LYS O 1 1 8 2344 1 1 5 LEU C C 9.595 5.101 4.435 1.00 . A A . 5 LEU C 1 1 8 2345 1 1 5 LEU CA C 8.474 4.208 3.912 1.00 . A A . 5 LEU CA 1 1 8 2346 1 1 5 LEU CB C 8.334 2.971 4.801 1.00 . A A . 5 LEU CB 1 1 8 2347 1 1 5 LEU CD1 C 6.885 1.364 6.066 1.00 . A A . 5 LEU CD1 1 1 8 2348 1 1 5 LEU CD2 C 6.618 3.827 6.415 1.00 . A A . 5 LEU CD2 1 1 8 2349 1 1 5 LEU CG C 6.952 2.735 5.410 1.00 . A A . 5 LEU CG 1 1 8 2350 1 1 5 LEU H H 8.572 2.881 2.266 1.00 . A A . 5 LEU H 1 1 8 2351 1 1 5 LEU HA H 7.548 4.763 3.933 1.00 . A A . 5 LEU HA 1 1 8 2352 1 1 5 LEU HB2 H 8.586 2.107 4.206 1.00 . A A . 5 LEU HB2 1 1 8 2353 1 1 5 LEU HB3 H 9.042 3.066 5.612 1.00 . A A . 5 LEU HB3 1 1 8 2354 1 1 5 LEU HD11 H 6.186 1.393 6.887 1.00 . A A . 5 LEU HD11 1 1 8 2355 1 1 5 LEU HD12 H 7.863 1.094 6.435 1.00 . A A . 5 LEU HD12 1 1 8 2356 1 1 5 LEU HD13 H 6.560 0.633 5.340 1.00 . A A . 5 LEU HD13 1 1 8 2357 1 1 5 LEU HD21 H 7.457 3.972 7.080 1.00 . A A . 5 LEU HD21 1 1 8 2358 1 1 5 LEU HD22 H 5.751 3.534 6.990 1.00 . A A . 5 LEU HD22 1 1 8 2359 1 1 5 LEU HD23 H 6.410 4.747 5.891 1.00 . A A . 5 LEU HD23 1 1 8 2360 1 1 5 LEU HG H 6.210 2.764 4.624 1.00 . A A . 5 LEU HG 1 1 8 2361 1 1 5 LEU N N 8.726 3.812 2.531 1.00 . A A . 5 LEU N 1 1 8 2362 1 1 5 LEU O O 9.349 6.055 5.173 1.00 . A A . 5 LEU O 1 1 8 2363 1 1 6 PHE C C 12.754 6.098 3.274 1.00 . A A . 6 PHE C 1 1 8 2364 1 1 6 PHE CA C 11.985 5.560 4.476 1.00 . A A . 6 PHE CA 1 1 8 2365 1 1 6 PHE CB C 12.907 4.699 5.343 1.00 . A A . 6 PHE CB 1 1 8 2366 1 1 6 PHE CD1 C 14.915 5.774 6.397 1.00 . A A . 6 PHE CD1 1 1 8 2367 1 1 6 PHE CD2 C 12.837 5.866 7.563 1.00 . A A . 6 PHE CD2 1 1 8 2368 1 1 6 PHE CE1 C 15.524 6.475 7.420 1.00 . A A . 6 PHE CE1 1 1 8 2369 1 1 6 PHE CE2 C 13.441 6.568 8.589 1.00 . A A . 6 PHE CE2 1 1 8 2370 1 1 6 PHE CG C 13.566 5.462 6.457 1.00 . A A . 6 PHE CG 1 1 8 2371 1 1 6 PHE CZ C 14.787 6.872 8.518 1.00 . A A . 6 PHE CZ 1 1 8 2372 1 1 6 PHE H H 10.958 4.013 3.458 1.00 . A A . 6 PHE H 1 1 8 2373 1 1 6 PHE HA H 11.627 6.392 5.063 1.00 . A A . 6 PHE HA 1 1 8 2374 1 1 6 PHE HB2 H 12.331 3.900 5.784 1.00 . A A . 6 PHE HB2 1 1 8 2375 1 1 6 PHE HB3 H 13.683 4.279 4.722 1.00 . A A . 6 PHE HB3 1 1 8 2376 1 1 6 PHE HD1 H 15.493 5.463 5.538 1.00 . A A . 6 PHE HD1 1 1 8 2377 1 1 6 PHE HD2 H 11.785 5.628 7.621 1.00 . A A . 6 PHE HD2 1 1 8 2378 1 1 6 PHE HE1 H 16.577 6.711 7.361 1.00 . A A . 6 PHE HE1 1 1 8 2379 1 1 6 PHE HE2 H 12.862 6.877 9.447 1.00 . A A . 6 PHE HE2 1 1 8 2380 1 1 6 PHE HZ H 15.261 7.421 9.318 1.00 . A A . 6 PHE HZ 1 1 8 2381 1 1 6 PHE N N 10.826 4.785 4.047 1.00 . A A . 6 PHE N 1 1 8 2382 1 1 6 PHE O O 13.664 6.914 3.421 1.00 . A A . 6 PHE O 1 1 8 2383 1 1 7 ALA C C 12.654 7.506 0.511 1.00 . A A . 7 ALA C 1 1 8 2384 1 1 7 ALA CA C 13.036 6.071 0.857 1.00 . A A . 7 ALA CA 1 1 8 2385 1 1 7 ALA CB C 12.680 5.136 -0.290 1.00 . A A . 7 ALA CB 1 1 8 2386 1 1 7 ALA H H 11.651 4.986 2.033 1.00 . A A . 7 ALA H 1 1 8 2387 1 1 7 ALA HA H 14.104 6.020 1.012 1.00 . A A . 7 ALA HA 1 1 8 2388 1 1 7 ALA HB1 H 11.950 5.613 -0.928 1.00 . A A . 7 ALA HB1 1 1 8 2389 1 1 7 ALA HB2 H 13.569 4.914 -0.862 1.00 . A A . 7 ALA HB2 1 1 8 2390 1 1 7 ALA HB3 H 12.268 4.221 0.107 1.00 . A A . 7 ALA HB3 1 1 8 2391 1 1 7 ALA N N 12.383 5.635 2.085 1.00 . A A . 7 ALA N 1 1 8 2392 1 1 7 ALA O O 13.421 8.227 -0.126 1.00 . A A . 7 ALA O 1 1 8 2393 1 1 8 LYS C C 11.409 10.223 1.776 1.00 . A A . 8 LYS C 1 1 8 2394 1 1 8 LYS CA C 10.978 9.264 0.671 1.00 . A A . 8 LYS CA 1 1 8 2395 1 1 8 LYS CB C 9.453 9.265 0.547 1.00 . A A . 8 LYS CB 1 1 8 2396 1 1 8 LYS CD C 7.718 9.696 2.311 1.00 . A A . 8 LYS CD 1 1 8 2397 1 1 8 LYS CE C 6.445 9.690 1.478 1.00 . A A . 8 LYS CE 1 1 8 2398 1 1 8 LYS CG C 8.742 8.713 1.771 1.00 . A A . 8 LYS CG 1 1 8 2399 1 1 8 LYS H H 10.896 7.293 1.439 1.00 . A A . 8 LYS H 1 1 8 2400 1 1 8 LYS HA H 11.407 9.594 -0.263 1.00 . A A . 8 LYS HA 1 1 8 2401 1 1 8 LYS HB2 H 9.117 10.279 0.388 1.00 . A A . 8 LYS HB2 1 1 8 2402 1 1 8 LYS HB3 H 9.173 8.664 -0.307 1.00 . A A . 8 LYS HB3 1 1 8 2403 1 1 8 LYS HD2 H 7.471 9.424 3.327 1.00 . A A . 8 LYS HD2 1 1 8 2404 1 1 8 LYS HD3 H 8.143 10.690 2.296 1.00 . A A . 8 LYS HD3 1 1 8 2405 1 1 8 LYS HE2 H 6.257 8.683 1.140 1.00 . A A . 8 LYS HE2 1 1 8 2406 1 1 8 LYS HE3 H 5.624 10.021 2.097 1.00 . A A . 8 LYS HE3 1 1 8 2407 1 1 8 LYS HG2 H 8.238 7.797 1.501 1.00 . A A . 8 LYS HG2 1 1 8 2408 1 1 8 LYS HG3 H 9.474 8.511 2.539 1.00 . A A . 8 LYS HG3 1 1 8 2409 1 1 8 LYS HZ1 H 7.261 11.328 0.472 1.00 . A A . 8 LYS HZ1 1 1 8 2410 1 1 8 LYS HZ2 H 5.636 11.039 0.104 1.00 . A A . 8 LYS HZ2 1 1 8 2411 1 1 8 LYS HZ3 H 6.840 10.042 -0.543 1.00 . A A . 8 LYS HZ3 1 1 8 2412 1 1 8 LYS N N 11.463 7.914 0.935 1.00 . A A . 8 LYS N 1 1 8 2413 1 1 8 LYS NZ N 6.553 10.587 0.295 1.00 . A A . 8 LYS NZ 1 1 8 2414 1 1 8 LYS O O 11.663 11.401 1.524 1.00 . A A . 8 LYS O 1 1 8 2415 1 1 9 ILE C C 13.389 10.816 4.106 1.00 . A A . 9 ILE C 1 1 8 2416 1 1 9 ILE CA C 11.893 10.522 4.141 1.00 . A A . 9 ILE CA 1 1 8 2417 1 1 9 ILE CB C 11.549 9.829 5.473 1.00 . A A . 9 ILE CB 1 1 8 2418 1 1 9 ILE CD1 C 13.733 9.384 6.703 1.00 . A A . 9 ILE CD1 1 1 8 2419 1 1 9 ILE CG1 C 12.631 8.811 5.839 1.00 . A A . 9 ILE CG1 1 1 8 2420 1 1 9 ILE CG2 C 10.188 9.154 5.383 1.00 . A A . 9 ILE CG2 1 1 8 2421 1 1 9 ILE H H 11.275 8.765 3.137 1.00 . A A . 9 ILE H 1 1 8 2422 1 1 9 ILE HA H 11.352 11.456 4.094 1.00 . A A . 9 ILE HA 1 1 8 2423 1 1 9 ILE HB H 11.499 10.584 6.243 1.00 . A A . 9 ILE HB 1 1 8 2424 1 1 9 ILE HD11 H 14.680 8.955 6.411 1.00 . A A . 9 ILE HD11 1 1 8 2425 1 1 9 ILE HD12 H 13.768 10.456 6.578 1.00 . A A . 9 ILE HD12 1 1 8 2426 1 1 9 ILE HD13 H 13.536 9.149 7.739 1.00 . A A . 9 ILE HD13 1 1 8 2427 1 1 9 ILE HG12 H 12.180 7.993 6.377 1.00 . A A . 9 ILE HG12 1 1 8 2428 1 1 9 ILE HG13 H 13.082 8.435 4.931 1.00 . A A . 9 ILE HG13 1 1 8 2429 1 1 9 ILE HG21 H 10.322 8.098 5.202 1.00 . A A . 9 ILE HG21 1 1 8 2430 1 1 9 ILE HG22 H 9.655 9.295 6.311 1.00 . A A . 9 ILE HG22 1 1 8 2431 1 1 9 ILE HG23 H 9.623 9.590 4.573 1.00 . A A . 9 ILE HG23 1 1 8 2432 1 1 9 ILE N N 11.490 9.711 2.999 1.00 . A A . 9 ILE N 1 1 8 2433 1 1 9 ILE O O 13.847 11.829 4.636 1.00 . A A . 9 ILE O 1 1 8 2434 1 1 10 THR C C 15.960 10.974 2.186 1.00 . A A . 10 THR C 1 1 8 2435 1 1 10 THR CA C 15.592 10.087 3.370 1.00 . A A . 10 THR CA 1 1 8 2436 1 1 10 THR CB C 16.302 8.729 3.220 1.00 . A A . 10 THR CB 1 1 8 2437 1 1 10 THR CG2 C 16.276 7.956 4.530 1.00 . A A . 10 THR CG2 1 1 8 2438 1 1 10 THR H H 13.724 9.137 3.074 1.00 . A A . 10 THR H 1 1 8 2439 1 1 10 THR HA H 15.942 10.554 4.280 1.00 . A A . 10 THR HA 1 1 8 2440 1 1 10 THR HB H 17.331 8.906 2.944 1.00 . A A . 10 THR HB 1 1 8 2441 1 1 10 THR HG1 H 15.895 7.030 2.304 1.00 . A A . 10 THR HG1 1 1 8 2442 1 1 10 THR HG21 H 15.252 7.790 4.830 1.00 . A A . 10 THR HG21 1 1 8 2443 1 1 10 THR HG22 H 16.787 8.525 5.293 1.00 . A A . 10 THR HG22 1 1 8 2444 1 1 10 THR HG23 H 16.770 7.006 4.397 1.00 . A A . 10 THR HG23 1 1 8 2445 1 1 10 THR N N 14.148 9.924 3.476 1.00 . A A . 10 THR N 1 1 8 2446 1 1 10 THR O O 15.634 10.664 1.040 1.00 . A A . 10 THR O 1 1 8 2447 1 1 10 THR OG1 O 15.669 7.957 2.193 1.00 . A A . 10 THR OG1 1 1 8 2448 1 1 11 LYS C C 18.572 13.170 1.412 1.00 . A A . 11 LYS C 1 1 8 2449 1 1 11 LYS CA C 17.055 13.011 1.428 1.00 . A A . 11 LYS CA 1 1 8 2450 1 1 11 LYS CB C 16.392 14.374 1.641 1.00 . A A . 11 LYS CB 1 1 8 2451 1 1 11 LYS CD C 17.744 16.032 2.957 1.00 . A A . 11 LYS CD 1 1 8 2452 1 1 11 LYS CE C 17.702 16.937 4.178 1.00 . A A . 11 LYS CE 1 1 8 2453 1 1 11 LYS CG C 16.657 14.972 3.011 1.00 . A A . 11 LYS CG 1 1 8 2454 1 1 11 LYS H H 16.871 12.272 3.403 1.00 . A A . 11 LYS H 1 1 8 2455 1 1 11 LYS HA H 16.738 12.610 0.478 1.00 . A A . 11 LYS HA 1 1 8 2456 1 1 11 LYS HB2 H 16.761 15.061 0.893 1.00 . A A . 11 LYS HB2 1 1 8 2457 1 1 11 LYS HB3 H 15.324 14.264 1.519 1.00 . A A . 11 LYS HB3 1 1 8 2458 1 1 11 LYS HD2 H 18.707 15.546 2.916 1.00 . A A . 11 LYS HD2 1 1 8 2459 1 1 11 LYS HD3 H 17.604 16.633 2.069 1.00 . A A . 11 LYS HD3 1 1 8 2460 1 1 11 LYS HE2 H 16.773 16.771 4.702 1.00 . A A . 11 LYS HE2 1 1 8 2461 1 1 11 LYS HE3 H 18.530 16.685 4.825 1.00 . A A . 11 LYS HE3 1 1 8 2462 1 1 11 LYS HG2 H 15.747 15.424 3.379 1.00 . A A . 11 LYS HG2 1 1 8 2463 1 1 11 LYS HG3 H 16.967 14.185 3.684 1.00 . A A . 11 LYS HG3 1 1 8 2464 1 1 11 LYS HZ1 H 18.601 18.525 3.163 1.00 . A A . 11 LYS HZ1 1 1 8 2465 1 1 11 LYS HZ2 H 17.939 18.956 4.658 1.00 . A A . 11 LYS HZ2 1 1 8 2466 1 1 11 LYS HZ3 H 16.925 18.682 3.332 1.00 . A A . 11 LYS HZ3 1 1 8 2467 1 1 11 LYS N N 16.641 12.079 2.470 1.00 . A A . 11 LYS N 1 1 8 2468 1 1 11 LYS NZ N 17.798 18.376 3.807 1.00 . A A . 11 LYS NZ 1 1 8 2469 1 1 11 LYS O O 19.099 14.149 0.884 1.00 . A A . 11 LYS O 1 1 8 2470 1 1 12 LYS C C 21.321 11.010 1.346 1.00 . A A . 12 LYS C 1 1 8 2471 1 1 12 LYS CA C 20.727 12.230 2.045 1.00 . A A . 12 LYS CA 1 1 8 2472 1 1 12 LYS CB C 21.206 12.283 3.497 1.00 . A A . 12 LYS CB 1 1 8 2473 1 1 12 LYS CD C 19.221 12.747 4.963 1.00 . A A . 12 LYS CD 1 1 8 2474 1 1 12 LYS CE C 19.560 13.241 6.362 1.00 . A A . 12 LYS CE 1 1 8 2475 1 1 12 LYS CG C 20.213 11.700 4.487 1.00 . A A . 12 LYS CG 1 1 8 2476 1 1 12 LYS H H 18.793 11.445 2.398 1.00 . A A . 12 LYS H 1 1 8 2477 1 1 12 LYS HA H 21.059 13.120 1.532 1.00 . A A . 12 LYS HA 1 1 8 2478 1 1 12 LYS HB2 H 22.131 11.730 3.579 1.00 . A A . 12 LYS HB2 1 1 8 2479 1 1 12 LYS HB3 H 21.388 13.313 3.766 1.00 . A A . 12 LYS HB3 1 1 8 2480 1 1 12 LYS HD2 H 19.241 13.586 4.283 1.00 . A A . 12 LYS HD2 1 1 8 2481 1 1 12 LYS HD3 H 18.230 12.314 4.974 1.00 . A A . 12 LYS HD3 1 1 8 2482 1 1 12 LYS HE2 H 20.605 13.053 6.552 1.00 . A A . 12 LYS HE2 1 1 8 2483 1 1 12 LYS HE3 H 19.371 14.303 6.409 1.00 . A A . 12 LYS HE3 1 1 8 2484 1 1 12 LYS HG2 H 19.671 10.897 4.009 1.00 . A A . 12 LYS HG2 1 1 8 2485 1 1 12 LYS HG3 H 20.753 11.314 5.340 1.00 . A A . 12 LYS HG3 1 1 8 2486 1 1 12 LYS HZ1 H 18.988 12.926 8.346 1.00 . A A . 12 LYS HZ1 1 1 8 2487 1 1 12 LYS HZ2 H 18.931 11.533 7.387 1.00 . A A . 12 LYS HZ2 1 1 8 2488 1 1 12 LYS HZ3 H 17.733 12.717 7.230 1.00 . A A . 12 LYS HZ3 1 1 8 2489 1 1 12 LYS N N 19.270 12.200 1.994 1.00 . A A . 12 LYS N 1 1 8 2490 1 1 12 LYS NZ N 18.746 12.556 7.404 1.00 . A A . 12 LYS NZ 1 1 8 2491 1 1 12 LYS O O 21.794 11.101 0.215 1.00 . A A . 12 LYS O 1 1 8 2492 1 1 13 ASN C C 21.247 8.365 0.086 1.00 . A A . 13 ASN C 1 1 8 2493 1 1 13 ASN CA C 21.824 8.632 1.473 1.00 . A A . 13 ASN CA 1 1 8 2494 1 1 13 ASN CB C 21.515 7.456 2.402 1.00 . A A . 13 ASN CB 1 1 8 2495 1 1 13 ASN CG C 22.756 6.920 3.088 1.00 . A A . 13 ASN CG 1 1 8 2496 1 1 13 ASN H H 20.899 9.861 2.927 1.00 . A A . 13 ASN H 1 1 8 2497 1 1 13 ASN HA H 22.895 8.741 1.390 1.00 . A A . 13 ASN HA 1 1 8 2498 1 1 13 ASN HB2 H 20.818 7.779 3.161 1.00 . A A . 13 ASN HB2 1 1 8 2499 1 1 13 ASN HB3 H 21.070 6.658 1.827 1.00 . A A . 13 ASN HB3 1 1 8 2500 1 1 13 ASN HD21 H 21.708 6.533 4.734 1.00 . A A . 13 ASN HD21 1 1 8 2501 1 1 13 ASN HD22 H 23.388 6.133 4.801 1.00 . A A . 13 ASN HD22 1 1 8 2502 1 1 13 ASN N N 21.290 9.870 2.029 1.00 . A A . 13 ASN N 1 1 8 2503 1 1 13 ASN ND2 N 22.602 6.485 4.333 1.00 . A A . 13 ASN ND2 1 1 8 2504 1 1 13 ASN O O 21.885 7.725 -0.750 1.00 . A A . 13 ASN O 1 1 8 2505 1 1 13 ASN OD1 O 23.840 6.896 2.505 1.00 . A A . 13 ASN OD1 1 1 8 2506 1 1 14 MET C C 20.203 9.282 -2.566 1.00 . A A . 14 MET C 1 1 8 2507 1 1 14 MET CA C 19.375 8.677 -1.437 1.00 . A A . 14 MET CA 1 1 8 2508 1 1 14 MET CB C 17.983 9.311 -1.413 1.00 . A A . 14 MET CB 1 1 8 2509 1 1 14 MET CE C 16.562 6.304 -1.924 1.00 . A A . 14 MET CE 1 1 8 2510 1 1 14 MET CG C 17.121 8.931 -2.607 1.00 . A A . 14 MET CG 1 1 8 2511 1 1 14 MET H H 19.578 9.362 0.555 1.00 . A A . 14 MET H 1 1 8 2512 1 1 14 MET HA H 19.274 7.615 -1.609 1.00 . A A . 14 MET HA 1 1 8 2513 1 1 14 MET HB2 H 17.473 8.998 -0.515 1.00 . A A . 14 MET HB2 1 1 8 2514 1 1 14 MET HB3 H 18.089 10.385 -1.402 1.00 . A A . 14 MET HB3 1 1 8 2515 1 1 14 MET HE1 H 17.319 6.404 -1.161 1.00 . A A . 14 MET HE1 1 1 8 2516 1 1 14 MET HE2 H 15.842 5.558 -1.621 1.00 . A A . 14 MET HE2 1 1 8 2517 1 1 14 MET HE3 H 17.024 6.003 -2.853 1.00 . A A . 14 MET HE3 1 1 8 2518 1 1 14 MET HG2 H 16.736 9.833 -3.058 1.00 . A A . 14 MET HG2 1 1 8 2519 1 1 14 MET HG3 H 17.736 8.406 -3.324 1.00 . A A . 14 MET HG3 1 1 8 2520 1 1 14 MET N N 20.037 8.860 -0.151 1.00 . A A . 14 MET N 1 1 8 2521 1 1 14 MET O O 20.509 8.612 -3.552 1.00 . A A . 14 MET O 1 1 8 2522 1 1 14 MET SD S 15.732 7.875 -2.153 1.00 . A A . 14 MET SD 1 1 8 2523 1 1 15 ALA C C 22.817 10.813 -3.363 1.00 . A A . 15 ALA C 1 1 8 2524 1 1 15 ALA CA C 21.356 11.246 -3.422 1.00 . A A . 15 ALA CA 1 1 8 2525 1 1 15 ALA CB C 21.242 12.752 -3.237 1.00 . A A . 15 ALA CB 1 1 8 2526 1 1 15 ALA H H 20.288 11.034 -1.607 1.00 . A A . 15 ALA H 1 1 8 2527 1 1 15 ALA HA H 20.955 10.996 -4.394 1.00 . A A . 15 ALA HA 1 1 8 2528 1 1 15 ALA HB1 H 21.897 13.066 -2.437 1.00 . A A . 15 ALA HB1 1 1 8 2529 1 1 15 ALA HB2 H 21.527 13.250 -4.152 1.00 . A A . 15 ALA HB2 1 1 8 2530 1 1 15 ALA HB3 H 20.223 13.008 -2.990 1.00 . A A . 15 ALA HB3 1 1 8 2531 1 1 15 ALA N N 20.562 10.552 -2.415 1.00 . A A . 15 ALA N 1 1 8 2532 1 1 15 ALA O O 23.647 11.290 -4.137 1.00 . A A . 15 ALA O 1 1 8 2533 1 1 16 HIS C C 24.622 8.004 -2.859 1.00 . A A . 16 HIS C 1 1 8 2534 1 1 16 HIS CA C 24.486 9.410 -2.281 1.00 . A A . 16 HIS CA 1 1 8 2535 1 1 16 HIS CB C 24.881 9.407 -0.804 1.00 . A A . 16 HIS CB 1 1 8 2536 1 1 16 HIS CD2 C 27.252 10.453 -0.911 1.00 . A A . 16 HIS CD2 1 1 8 2537 1 1 16 HIS CE1 C 26.937 12.106 0.494 1.00 . A A . 16 HIS CE1 1 1 8 2538 1 1 16 HIS CG C 25.973 10.377 -0.475 1.00 . A A . 16 HIS CG 1 1 8 2539 1 1 16 HIS H H 22.418 9.565 -1.853 1.00 . A A . 16 HIS H 1 1 8 2540 1 1 16 HIS HA H 25.146 10.072 -2.820 1.00 . A A . 16 HIS HA 1 1 8 2541 1 1 16 HIS HB2 H 24.018 9.664 -0.207 1.00 . A A . 16 HIS HB2 1 1 8 2542 1 1 16 HIS HB3 H 25.221 8.418 -0.531 1.00 . A A . 16 HIS HB3 1 1 8 2543 1 1 16 HIS HD1 H 24.984 11.642 0.890 1.00 . A A . 16 HIS HD1 1 1 8 2544 1 1 16 HIS HD2 H 27.731 9.785 -1.614 1.00 . A A . 16 HIS HD2 1 1 8 2545 1 1 16 HIS HE1 H 27.103 12.979 1.107 1.00 . A A . 16 HIS HE1 1 1 8 2546 1 1 16 HIS N N 23.124 9.907 -2.441 1.00 . A A . 16 HIS N 1 1 8 2547 1 1 16 HIS ND1 N 25.807 11.427 0.405 1.00 . A A . 16 HIS ND1 1 1 8 2548 1 1 16 HIS NE2 N 27.830 11.535 -0.294 1.00 . A A . 16 HIS NE2 1 1 8 2549 1 1 16 HIS O O 25.730 7.535 -3.121 1.00 . A A . 16 HIS O 1 1 8 2550 1 1 17 ILE C C 24.277 5.916 -4.902 1.00 . A A . 17 ILE C 1 1 8 2551 1 1 17 ILE CA C 23.483 5.987 -3.602 1.00 . A A . 17 ILE CA 1 1 8 2552 1 1 17 ILE CB C 22.048 5.492 -3.863 1.00 . A A . 17 ILE CB 1 1 8 2553 1 1 17 ILE CD1 C 19.905 6.183 -5.050 1.00 . A A . 17 ILE CD1 1 1 8 2554 1 1 17 ILE CG1 C 21.414 6.281 -5.011 1.00 . A A . 17 ILE CG1 1 1 8 2555 1 1 17 ILE CG2 C 21.207 5.615 -2.601 1.00 . A A . 17 ILE CG2 1 1 8 2556 1 1 17 ILE H H 22.637 7.766 -2.827 1.00 . A A . 17 ILE H 1 1 8 2557 1 1 17 ILE HA H 23.942 5.332 -2.876 1.00 . A A . 17 ILE HA 1 1 8 2558 1 1 17 ILE HB H 22.094 4.449 -4.135 1.00 . A A . 17 ILE HB 1 1 8 2559 1 1 17 ILE HD11 H 19.488 6.695 -4.195 1.00 . A A . 17 ILE HD11 1 1 8 2560 1 1 17 ILE HD12 H 19.537 6.637 -5.957 1.00 . A A . 17 ILE HD12 1 1 8 2561 1 1 17 ILE HD13 H 19.611 5.143 -5.023 1.00 . A A . 17 ILE HD13 1 1 8 2562 1 1 17 ILE HG12 H 21.676 7.322 -4.911 1.00 . A A . 17 ILE HG12 1 1 8 2563 1 1 17 ILE HG13 H 21.796 5.906 -5.949 1.00 . A A . 17 ILE HG13 1 1 8 2564 1 1 17 ILE HG21 H 21.803 5.339 -1.743 1.00 . A A . 17 ILE HG21 1 1 8 2565 1 1 17 ILE HG22 H 20.871 6.635 -2.491 1.00 . A A . 17 ILE HG22 1 1 8 2566 1 1 17 ILE HG23 H 20.352 4.960 -2.672 1.00 . A A . 17 ILE HG23 1 1 8 2567 1 1 17 ILE N N 23.489 7.338 -3.055 1.00 . A A . 17 ILE N 1 1 8 2568 1 1 17 ILE O O 24.999 4.950 -5.148 1.00 . A A . 17 ILE O 1 1 8 2569 1 1 18 ARG C C 26.350 7.134 -6.788 1.00 . A A . 18 ARG C 1 1 8 2570 1 1 18 ARG CA C 24.845 7.002 -7.004 1.00 . A A . 18 ARG CA 1 1 8 2571 1 1 18 ARG CB C 24.335 8.175 -7.843 1.00 . A A . 18 ARG CB 1 1 8 2572 1 1 18 ARG CD C 22.302 9.268 -8.838 1.00 . A A . 18 ARG CD 1 1 8 2573 1 1 18 ARG CG C 22.943 7.956 -8.414 1.00 . A A . 18 ARG CG 1 1 8 2574 1 1 18 ARG CZ C 21.115 8.693 -10.913 1.00 . A A . 18 ARG CZ 1 1 8 2575 1 1 18 ARG H H 23.549 7.687 -5.478 1.00 . A A . 18 ARG H 1 1 8 2576 1 1 18 ARG HA H 24.649 6.081 -7.532 1.00 . A A . 18 ARG HA 1 1 8 2577 1 1 18 ARG HB2 H 24.311 9.061 -7.226 1.00 . A A . 18 ARG HB2 1 1 8 2578 1 1 18 ARG HB3 H 25.016 8.337 -8.665 1.00 . A A . 18 ARG HB3 1 1 8 2579 1 1 18 ARG HD2 H 21.348 9.364 -8.342 1.00 . A A . 18 ARG HD2 1 1 8 2580 1 1 18 ARG HD3 H 22.947 10.081 -8.540 1.00 . A A . 18 ARG HD3 1 1 8 2581 1 1 18 ARG HE H 22.713 9.881 -10.806 1.00 . A A . 18 ARG HE 1 1 8 2582 1 1 18 ARG HG2 H 23.016 7.308 -9.276 1.00 . A A . 18 ARG HG2 1 1 8 2583 1 1 18 ARG HG3 H 22.325 7.489 -7.662 1.00 . A A . 18 ARG HG3 1 1 8 2584 1 1 18 ARG HH11 H 20.352 7.860 -9.238 1.00 . A A . 18 ARG HH11 1 1 8 2585 1 1 18 ARG HH12 H 19.524 7.463 -10.708 1.00 . A A . 18 ARG HH12 1 1 8 2586 1 1 18 ARG HH21 H 21.632 9.366 -12.748 1.00 . A A . 18 ARG HH21 1 1 8 2587 1 1 18 ARG HH22 H 20.254 8.320 -12.703 1.00 . A A . 18 ARG HH22 1 1 8 2588 1 1 18 ARG N N 24.140 6.947 -5.729 1.00 . A A . 18 ARG N 1 1 8 2589 1 1 18 ARG NE N 22.093 9.333 -10.282 1.00 . A A . 18 ARG NE 1 1 8 2590 1 1 18 ARG NH1 N 20.261 7.943 -10.230 1.00 . A A . 18 ARG NH1 1 1 8 2591 1 1 18 ARG NH2 N 20.990 8.802 -12.230 1.00 . A A . 18 ARG NH2 1 1 8 2592 1 1 18 ARG O O 27.138 6.390 -7.371 1.00 . A A . 18 ARG O 1 1 9 2593 1 1 1 PHE C C 2.135 2.222 1.785 1.00 . A A . 1 PHE C 1 1 9 2594 1 1 1 PHE CA C 1.709 1.861 3.205 1.00 . A A . 1 PHE CA 1 1 9 2595 1 1 1 PHE CB C 2.545 0.686 3.718 1.00 . A A . 1 PHE CB 1 1 9 2596 1 1 1 PHE CD1 C 1.830 -1.159 5.260 1.00 . A A . 1 PHE CD1 1 1 9 2597 1 1 1 PHE CD2 C 1.979 1.054 6.135 1.00 . A A . 1 PHE CD2 1 1 9 2598 1 1 1 PHE CE1 C 1.430 -1.626 6.499 1.00 . A A . 1 PHE CE1 1 1 9 2599 1 1 1 PHE CE2 C 1.580 0.594 7.375 1.00 . A A . 1 PHE CE2 1 1 9 2600 1 1 1 PHE CG C 2.110 0.183 5.064 1.00 . A A . 1 PHE CG 1 1 9 2601 1 1 1 PHE CZ C 1.304 -0.747 7.557 1.00 . A A . 1 PHE CZ 1 1 9 2602 1 1 1 PHE H1 H -0.360 2.240 3.447 1.00 . A A . 1 PHE H1 1 1 9 2603 1 1 1 PHE HA H 1.872 2.714 3.845 1.00 . A A . 1 PHE HA 1 1 9 2604 1 1 1 PHE HB2 H 2.469 -0.132 3.018 1.00 . A A . 1 PHE HB2 1 1 9 2605 1 1 1 PHE HB3 H 3.576 0.995 3.794 1.00 . A A . 1 PHE HB3 1 1 9 2606 1 1 1 PHE HD1 H 1.929 -1.847 4.432 1.00 . A A . 1 PHE HD1 1 1 9 2607 1 1 1 PHE HD2 H 2.194 2.103 5.994 1.00 . A A . 1 PHE HD2 1 1 9 2608 1 1 1 PHE HE1 H 1.215 -2.675 6.637 1.00 . A A . 1 PHE HE1 1 1 9 2609 1 1 1 PHE HE2 H 1.482 1.282 8.201 1.00 . A A . 1 PHE HE2 1 1 9 2610 1 1 1 PHE HZ H 0.992 -1.110 8.525 1.00 . A A . 1 PHE HZ 1 1 9 2611 1 1 1 PHE N N 0.289 1.531 3.254 1.00 . A A . 1 PHE N 1 1 9 2612 1 1 1 PHE O O 1.308 2.287 0.874 1.00 . A A . 1 PHE O 1 1 9 2613 1 1 2 LEU C C 5.328 2.158 0.070 1.00 . A A . 2 LEU C 1 1 9 2614 1 1 2 LEU CA C 3.968 2.811 0.296 1.00 . A A . 2 LEU CA 1 1 9 2615 1 1 2 LEU CB C 4.091 4.331 0.168 1.00 . A A . 2 LEU CB 1 1 9 2616 1 1 2 LEU CD1 C 5.238 6.340 1.133 1.00 . A A . 2 LEU CD1 1 1 9 2617 1 1 2 LEU CD2 C 3.176 5.436 2.224 1.00 . A A . 2 LEU CD2 1 1 9 2618 1 1 2 LEU CG C 4.440 5.085 1.451 1.00 . A A . 2 LEU CG 1 1 9 2619 1 1 2 LEU H H 4.040 2.389 2.368 1.00 . A A . 2 LEU H 1 1 9 2620 1 1 2 LEU HA H 3.280 2.450 -0.454 1.00 . A A . 2 LEU HA 1 1 9 2621 1 1 2 LEU HB2 H 4.861 4.540 -0.558 1.00 . A A . 2 LEU HB2 1 1 9 2622 1 1 2 LEU HB3 H 3.146 4.709 -0.193 1.00 . A A . 2 LEU HB3 1 1 9 2623 1 1 2 LEU HD11 H 5.696 6.714 2.035 1.00 . A A . 2 LEU HD11 1 1 9 2624 1 1 2 LEU HD12 H 4.578 7.092 0.726 1.00 . A A . 2 LEU HD12 1 1 9 2625 1 1 2 LEU HD13 H 6.004 6.105 0.409 1.00 . A A . 2 LEU HD13 1 1 9 2626 1 1 2 LEU HD21 H 2.338 5.472 1.544 1.00 . A A . 2 LEU HD21 1 1 9 2627 1 1 2 LEU HD22 H 3.299 6.401 2.695 1.00 . A A . 2 LEU HD22 1 1 9 2628 1 1 2 LEU HD23 H 2.996 4.686 2.979 1.00 . A A . 2 LEU HD23 1 1 9 2629 1 1 2 LEU HG H 5.052 4.452 2.079 1.00 . A A . 2 LEU HG 1 1 9 2630 1 1 2 LEU N N 3.430 2.456 1.604 1.00 . A A . 2 LEU N 1 1 9 2631 1 1 2 LEU O O 6.015 1.758 1.010 1.00 . A A . 2 LEU O 1 1 9 2632 1 1 3 PRO C C 8.198 2.316 -1.183 1.00 . A A . 3 PRO C 1 1 9 2633 1 1 3 PRO CA C 7.010 1.448 -1.584 1.00 . A A . 3 PRO CA 1 1 9 2634 1 1 3 PRO CB C 6.916 1.342 -3.108 1.00 . A A . 3 PRO CB 1 1 9 2635 1 1 3 PRO CD C 4.960 2.505 -2.376 1.00 . A A . 3 PRO CD 1 1 9 2636 1 1 3 PRO CG C 5.951 2.406 -3.503 1.00 . A A . 3 PRO CG 1 1 9 2637 1 1 3 PRO HA H 7.127 0.462 -1.159 1.00 . A A . 3 PRO HA 1 1 9 2638 1 1 3 PRO HB2 H 7.891 1.511 -3.544 1.00 . A A . 3 PRO HB2 1 1 9 2639 1 1 3 PRO HB3 H 6.557 0.362 -3.383 1.00 . A A . 3 PRO HB3 1 1 9 2640 1 1 3 PRO HD2 H 4.633 3.526 -2.249 1.00 . A A . 3 PRO HD2 1 1 9 2641 1 1 3 PRO HD3 H 4.115 1.857 -2.558 1.00 . A A . 3 PRO HD3 1 1 9 2642 1 1 3 PRO HG2 H 6.469 3.344 -3.629 1.00 . A A . 3 PRO HG2 1 1 9 2643 1 1 3 PRO HG3 H 5.450 2.126 -4.418 1.00 . A A . 3 PRO HG3 1 1 9 2644 1 1 3 PRO N N 5.728 2.049 -1.205 1.00 . A A . 3 PRO N 1 1 9 2645 1 1 3 PRO O O 9.338 1.852 -1.154 1.00 . A A . 3 PRO O 1 1 9 2646 1 1 4 LYS C C 8.727 5.025 0.945 1.00 . A A . 4 LYS C 1 1 9 2647 1 1 4 LYS CA C 8.970 4.512 -0.471 1.00 . A A . 4 LYS CA 1 1 9 2648 1 1 4 LYS CB C 9.034 5.690 -1.447 1.00 . A A . 4 LYS CB 1 1 9 2649 1 1 4 LYS CD C 7.608 7.366 -2.659 1.00 . A A . 4 LYS CD 1 1 9 2650 1 1 4 LYS CE C 8.740 7.761 -3.594 1.00 . A A . 4 LYS CE 1 1 9 2651 1 1 4 LYS CG C 7.739 5.921 -2.206 1.00 . A A . 4 LYS CG 1 1 9 2652 1 1 4 LYS H H 6.996 3.891 -0.915 1.00 . A A . 4 LYS H 1 1 9 2653 1 1 4 LYS HA H 9.912 3.986 -0.494 1.00 . A A . 4 LYS HA 1 1 9 2654 1 1 4 LYS HB2 H 9.268 6.587 -0.894 1.00 . A A . 4 LYS HB2 1 1 9 2655 1 1 4 LYS HB3 H 9.819 5.504 -2.166 1.00 . A A . 4 LYS HB3 1 1 9 2656 1 1 4 LYS HD2 H 6.669 7.488 -3.177 1.00 . A A . 4 LYS HD2 1 1 9 2657 1 1 4 LYS HD3 H 7.628 8.009 -1.790 1.00 . A A . 4 LYS HD3 1 1 9 2658 1 1 4 LYS HE2 H 9.331 8.530 -3.119 1.00 . A A . 4 LYS HE2 1 1 9 2659 1 1 4 LYS HE3 H 9.358 6.895 -3.777 1.00 . A A . 4 LYS HE3 1 1 9 2660 1 1 4 LYS HG2 H 7.722 5.280 -3.075 1.00 . A A . 4 LYS HG2 1 1 9 2661 1 1 4 LYS HG3 H 6.906 5.679 -1.561 1.00 . A A . 4 LYS HG3 1 1 9 2662 1 1 4 LYS HZ1 H 8.683 7.768 -5.682 1.00 . A A . 4 LYS HZ1 1 1 9 2663 1 1 4 LYS HZ2 H 8.442 9.291 -4.985 1.00 . A A . 4 LYS HZ2 1 1 9 2664 1 1 4 LYS HZ3 H 7.201 8.141 -4.955 1.00 . A A . 4 LYS HZ3 1 1 9 2665 1 1 4 LYS N N 7.924 3.579 -0.873 1.00 . A A . 4 LYS N 1 1 9 2666 1 1 4 LYS NZ N 8.231 8.277 -4.895 1.00 . A A . 4 LYS NZ 1 1 9 2667 1 1 4 LYS O O 9.002 6.185 1.252 1.00 . A A . 4 LYS O 1 1 9 2668 1 1 5 LEU C C 9.084 5.324 3.782 1.00 . A A . 5 LEU C 1 1 9 2669 1 1 5 LEU CA C 7.933 4.517 3.189 1.00 . A A . 5 LEU CA 1 1 9 2670 1 1 5 LEU CB C 7.691 3.261 4.028 1.00 . A A . 5 LEU CB 1 1 9 2671 1 1 5 LEU CD1 C 6.140 1.735 5.273 1.00 . A A . 5 LEU CD1 1 1 9 2672 1 1 5 LEU CD2 C 5.868 4.214 5.461 1.00 . A A . 5 LEU CD2 1 1 9 2673 1 1 5 LEU CG C 6.266 3.065 4.547 1.00 . A A . 5 LEU CG 1 1 9 2674 1 1 5 LEU H H 8.014 3.242 1.501 1.00 . A A . 5 LEU H 1 1 9 2675 1 1 5 LEU HA H 7.041 5.124 3.199 1.00 . A A . 5 LEU HA 1 1 9 2676 1 1 5 LEU HB2 H 7.943 2.404 3.422 1.00 . A A . 5 LEU HB2 1 1 9 2677 1 1 5 LEU HB3 H 8.352 3.302 4.882 1.00 . A A . 5 LEU HB3 1 1 9 2678 1 1 5 LEU HD11 H 6.681 0.975 4.729 1.00 . A A . 5 LEU HD11 1 1 9 2679 1 1 5 LEU HD12 H 5.099 1.458 5.340 1.00 . A A . 5 LEU HD12 1 1 9 2680 1 1 5 LEU HD13 H 6.552 1.828 6.268 1.00 . A A . 5 LEU HD13 1 1 9 2681 1 1 5 LEU HD21 H 6.757 4.707 5.826 1.00 . A A . 5 LEU HD21 1 1 9 2682 1 1 5 LEU HD22 H 5.302 3.829 6.298 1.00 . A A . 5 LEU HD22 1 1 9 2683 1 1 5 LEU HD23 H 5.264 4.920 4.911 1.00 . A A . 5 LEU HD23 1 1 9 2684 1 1 5 LEU HG H 5.583 3.052 3.708 1.00 . A A . 5 LEU HG 1 1 9 2685 1 1 5 LEU N N 8.212 4.153 1.804 1.00 . A A . 5 LEU N 1 1 9 2686 1 1 5 LEU O O 8.867 6.265 4.545 1.00 . A A . 5 LEU O 1 1 9 2687 1 1 6 PHE C C 12.335 6.173 2.764 1.00 . A A . 6 PHE C 1 1 9 2688 1 1 6 PHE CA C 11.494 5.640 3.919 1.00 . A A . 6 PHE CA 1 1 9 2689 1 1 6 PHE CB C 12.333 4.698 4.785 1.00 . A A . 6 PHE CB 1 1 9 2690 1 1 6 PHE CD1 C 14.362 5.615 5.943 1.00 . A A . 6 PHE CD1 1 1 9 2691 1 1 6 PHE CD2 C 12.253 5.791 7.042 1.00 . A A . 6 PHE CD2 1 1 9 2692 1 1 6 PHE CE1 C 14.974 6.245 7.010 1.00 . A A . 6 PHE CE1 1 1 9 2693 1 1 6 PHE CE2 C 12.860 6.421 8.112 1.00 . A A . 6 PHE CE2 1 1 9 2694 1 1 6 PHE CG C 12.996 5.382 5.946 1.00 . A A . 6 PHE CG 1 1 9 2695 1 1 6 PHE CZ C 14.222 6.647 8.096 1.00 . A A . 6 PHE CZ 1 1 9 2696 1 1 6 PHE H H 10.417 4.191 2.813 1.00 . A A . 6 PHE H 1 1 9 2697 1 1 6 PHE HA H 11.164 6.471 4.523 1.00 . A A . 6 PHE HA 1 1 9 2698 1 1 6 PHE HB2 H 11.698 3.919 5.178 1.00 . A A . 6 PHE HB2 1 1 9 2699 1 1 6 PHE HB3 H 13.106 4.254 4.175 1.00 . A A . 6 PHE HB3 1 1 9 2700 1 1 6 PHE HD1 H 14.951 5.300 5.093 1.00 . A A . 6 PHE HD1 1 1 9 2701 1 1 6 PHE HD2 H 11.187 5.614 7.056 1.00 . A A . 6 PHE HD2 1 1 9 2702 1 1 6 PHE HE1 H 16.040 6.420 6.995 1.00 . A A . 6 PHE HE1 1 1 9 2703 1 1 6 PHE HE2 H 12.270 6.735 8.960 1.00 . A A . 6 PHE HE2 1 1 9 2704 1 1 6 PHE HZ H 14.699 7.140 8.931 1.00 . A A . 6 PHE HZ 1 1 9 2705 1 1 6 PHE N N 10.308 4.950 3.424 1.00 . A A . 6 PHE N 1 1 9 2706 1 1 6 PHE O O 13.284 6.929 2.970 1.00 . A A . 6 PHE O 1 1 9 2707 1 1 7 ALA C C 12.414 7.677 0.052 1.00 . A A . 7 ALA C 1 1 9 2708 1 1 7 ALA CA C 12.700 6.211 0.358 1.00 . A A . 7 ALA CA 1 1 9 2709 1 1 7 ALA CB C 12.333 5.339 -0.833 1.00 . A A . 7 ALA CB 1 1 9 2710 1 1 7 ALA H H 11.214 5.170 1.447 1.00 . A A . 7 ALA H 1 1 9 2711 1 1 7 ALA HA H 13.758 6.094 0.547 1.00 . A A . 7 ALA HA 1 1 9 2712 1 1 7 ALA HB1 H 13.228 5.086 -1.383 1.00 . A A . 7 ALA HB1 1 1 9 2713 1 1 7 ALA HB2 H 11.857 4.435 -0.484 1.00 . A A . 7 ALA HB2 1 1 9 2714 1 1 7 ALA HB3 H 11.654 5.878 -1.477 1.00 . A A . 7 ALA HB3 1 1 9 2715 1 1 7 ALA N N 11.980 5.773 1.547 1.00 . A A . 7 ALA N 1 1 9 2716 1 1 7 ALA O O 13.244 8.374 -0.533 1.00 . A A . 7 ALA O 1 1 9 2717 1 1 8 LYS C C 11.282 10.418 1.370 1.00 . A A . 8 LYS C 1 1 9 2718 1 1 8 LYS CA C 10.836 9.524 0.218 1.00 . A A . 8 LYS CA 1 1 9 2719 1 1 8 LYS CB C 9.319 9.618 0.043 1.00 . A A . 8 LYS CB 1 1 9 2720 1 1 8 LYS CD C 7.549 10.090 1.762 1.00 . A A . 8 LYS CD 1 1 9 2721 1 1 8 LYS CE C 6.311 10.188 0.883 1.00 . A A . 8 LYS CE 1 1 9 2722 1 1 8 LYS CG C 8.535 9.068 1.222 1.00 . A A . 8 LYS CG 1 1 9 2723 1 1 8 LYS H H 10.614 7.536 0.911 1.00 . A A . 8 LYS H 1 1 9 2724 1 1 8 LYS HA H 11.316 9.860 -0.689 1.00 . A A . 8 LYS HA 1 1 9 2725 1 1 8 LYS HB2 H 9.048 10.655 -0.090 1.00 . A A . 8 LYS HB2 1 1 9 2726 1 1 8 LYS HB3 H 9.035 9.064 -0.840 1.00 . A A . 8 LYS HB3 1 1 9 2727 1 1 8 LYS HD2 H 7.248 9.797 2.756 1.00 . A A . 8 LYS HD2 1 1 9 2728 1 1 8 LYS HD3 H 8.030 11.057 1.800 1.00 . A A . 8 LYS HD3 1 1 9 2729 1 1 8 LYS HE2 H 6.514 10.871 0.073 1.00 . A A . 8 LYS HE2 1 1 9 2730 1 1 8 LYS HE3 H 6.092 9.209 0.482 1.00 . A A . 8 LYS HE3 1 1 9 2731 1 1 8 LYS HG2 H 7.991 8.191 0.904 1.00 . A A . 8 LYS HG2 1 1 9 2732 1 1 8 LYS HG3 H 9.227 8.799 2.008 1.00 . A A . 8 LYS HG3 1 1 9 2733 1 1 8 LYS HZ1 H 5.119 11.716 1.661 1.00 . A A . 8 LYS HZ1 1 1 9 2734 1 1 8 LYS HZ2 H 5.162 10.325 2.622 1.00 . A A . 8 LYS HZ2 1 1 9 2735 1 1 8 LYS HZ3 H 4.252 10.340 1.196 1.00 . A A . 8 LYS HZ3 1 1 9 2736 1 1 8 LYS N N 11.233 8.140 0.449 1.00 . A A . 8 LYS N 1 1 9 2737 1 1 8 LYS NZ N 5.128 10.676 1.644 1.00 . A A . 8 LYS NZ 1 1 9 2738 1 1 8 LYS O O 11.612 11.587 1.169 1.00 . A A . 8 LYS O 1 1 9 2739 1 1 9 ILE C C 13.211 10.815 3.784 1.00 . A A . 9 ILE C 1 1 9 2740 1 1 9 ILE CA C 11.700 10.607 3.759 1.00 . A A . 9 ILE CA 1 1 9 2741 1 1 9 ILE CB C 11.270 9.891 5.053 1.00 . A A . 9 ILE CB 1 1 9 2742 1 1 9 ILE CD1 C 13.380 9.278 6.338 1.00 . A A . 9 ILE CD1 1 1 9 2743 1 1 9 ILE CG1 C 12.279 8.800 5.418 1.00 . A A . 9 ILE CG1 1 1 9 2744 1 1 9 ILE CG2 C 9.877 9.300 4.894 1.00 . A A . 9 ILE CG2 1 1 9 2745 1 1 9 ILE H H 11.018 8.925 2.672 1.00 . A A . 9 ILE H 1 1 9 2746 1 1 9 ILE HA H 11.215 11.572 3.728 1.00 . A A . 9 ILE HA 1 1 9 2747 1 1 9 ILE HB H 11.237 10.621 5.848 1.00 . A A . 9 ILE HB 1 1 9 2748 1 1 9 ILE HD11 H 13.403 10.358 6.343 1.00 . A A . 9 ILE HD11 1 1 9 2749 1 1 9 ILE HD12 H 13.197 8.917 7.338 1.00 . A A . 9 ILE HD12 1 1 9 2750 1 1 9 ILE HD13 H 14.331 8.902 5.988 1.00 . A A . 9 ILE HD13 1 1 9 2751 1 1 9 ILE HG12 H 11.763 7.992 5.911 1.00 . A A . 9 ILE HG12 1 1 9 2752 1 1 9 ILE HG13 H 12.739 8.429 4.513 1.00 . A A . 9 ILE HG13 1 1 9 2753 1 1 9 ILE HG21 H 9.319 9.442 5.808 1.00 . A A . 9 ILE HG21 1 1 9 2754 1 1 9 ILE HG22 H 9.367 9.796 4.082 1.00 . A A . 9 ILE HG22 1 1 9 2755 1 1 9 ILE HG23 H 9.956 8.245 4.680 1.00 . A A . 9 ILE HG23 1 1 9 2756 1 1 9 ILE N N 11.292 9.860 2.576 1.00 . A A . 9 ILE N 1 1 9 2757 1 1 9 ILE O O 13.707 11.780 4.366 1.00 . A A . 9 ILE O 1 1 9 2758 1 1 10 THR C C 15.852 10.884 1.953 1.00 . A A . 10 THR C 1 1 9 2759 1 1 10 THR CA C 15.393 9.985 3.096 1.00 . A A . 10 THR CA 1 1 9 2760 1 1 10 THR CB C 16.029 8.592 2.925 1.00 . A A . 10 THR CB 1 1 9 2761 1 1 10 THR CG2 C 15.911 7.783 4.208 1.00 . A A . 10 THR CG2 1 1 9 2762 1 1 10 THR H H 13.485 9.156 2.703 1.00 . A A . 10 THR H 1 1 9 2763 1 1 10 THR HA H 15.737 10.403 4.031 1.00 . A A . 10 THR HA 1 1 9 2764 1 1 10 THR HB H 17.076 8.718 2.691 1.00 . A A . 10 THR HB 1 1 9 2765 1 1 10 THR HG1 H 15.472 6.944 1.996 1.00 . A A . 10 THR HG1 1 1 9 2766 1 1 10 THR HG21 H 14.869 7.662 4.464 1.00 . A A . 10 THR HG21 1 1 9 2767 1 1 10 THR HG22 H 16.420 8.300 5.008 1.00 . A A . 10 THR HG22 1 1 9 2768 1 1 10 THR HG23 H 16.360 6.813 4.063 1.00 . A A . 10 THR HG23 1 1 9 2769 1 1 10 THR N N 13.938 9.902 3.148 1.00 . A A . 10 THR N 1 1 9 2770 1 1 10 THR O O 15.552 10.626 0.787 1.00 . A A . 10 THR O 1 1 9 2771 1 1 10 THR OG1 O 15.391 7.890 1.852 1.00 . A A . 10 THR OG1 1 1 9 2772 1 1 11 LYS C C 18.608 12.953 1.342 1.00 . A A . 11 LYS C 1 1 9 2773 1 1 11 LYS CA C 17.085 12.878 1.298 1.00 . A A . 11 LYS CA 1 1 9 2774 1 1 11 LYS CB C 16.489 14.268 1.528 1.00 . A A . 11 LYS CB 1 1 9 2775 1 1 11 LYS CD C 15.367 14.285 3.776 1.00 . A A . 11 LYS CD 1 1 9 2776 1 1 11 LYS CE C 15.104 15.213 4.952 1.00 . A A . 11 LYS CE 1 1 9 2777 1 1 11 LYS CG C 16.575 14.735 2.971 1.00 . A A . 11 LYS CG 1 1 9 2778 1 1 11 LYS H H 16.788 12.092 3.241 1.00 . A A . 11 LYS H 1 1 9 2779 1 1 11 LYS HA H 16.782 12.522 0.325 1.00 . A A . 11 LYS HA 1 1 9 2780 1 1 11 LYS HB2 H 17.015 14.979 0.909 1.00 . A A . 11 LYS HB2 1 1 9 2781 1 1 11 LYS HB3 H 15.448 14.252 1.238 1.00 . A A . 11 LYS HB3 1 1 9 2782 1 1 11 LYS HD2 H 14.499 14.281 3.134 1.00 . A A . 11 LYS HD2 1 1 9 2783 1 1 11 LYS HD3 H 15.546 13.286 4.149 1.00 . A A . 11 LYS HD3 1 1 9 2784 1 1 11 LYS HE2 H 15.509 14.763 5.846 1.00 . A A . 11 LYS HE2 1 1 9 2785 1 1 11 LYS HE3 H 15.598 16.155 4.768 1.00 . A A . 11 LYS HE3 1 1 9 2786 1 1 11 LYS HG2 H 17.467 14.325 3.420 1.00 . A A . 11 LYS HG2 1 1 9 2787 1 1 11 LYS HG3 H 16.625 15.815 2.987 1.00 . A A . 11 LYS HG3 1 1 9 2788 1 1 11 LYS HZ1 H 13.163 14.567 5.374 1.00 . A A . 11 LYS HZ1 1 1 9 2789 1 1 11 LYS HZ2 H 13.233 15.858 4.284 1.00 . A A . 11 LYS HZ2 1 1 9 2790 1 1 11 LYS HZ3 H 13.502 16.128 5.932 1.00 . A A . 11 LYS HZ3 1 1 9 2791 1 1 11 LYS N N 16.582 11.940 2.295 1.00 . A A . 11 LYS N 1 1 9 2792 1 1 11 LYS NZ N 13.649 15.459 5.150 1.00 . A A . 11 LYS NZ 1 1 9 2793 1 1 11 LYS O O 19.209 13.897 0.828 1.00 . A A . 11 LYS O 1 1 9 2794 1 1 12 LYS C C 21.234 10.646 1.399 1.00 . A A . 12 LYS C 1 1 9 2795 1 1 12 LYS CA C 20.681 11.902 2.066 1.00 . A A . 12 LYS CA 1 1 9 2796 1 1 12 LYS CB C 21.105 11.940 3.536 1.00 . A A . 12 LYS CB 1 1 9 2797 1 1 12 LYS CD C 19.091 12.526 4.919 1.00 . A A . 12 LYS CD 1 1 9 2798 1 1 12 LYS CE C 19.356 12.963 6.351 1.00 . A A . 12 LYS CE 1 1 9 2799 1 1 12 LYS CG C 20.042 11.421 4.489 1.00 . A A . 12 LYS CG 1 1 9 2800 1 1 12 LYS H H 18.694 11.227 2.347 1.00 . A A . 12 LYS H 1 1 9 2801 1 1 12 LYS HA H 21.081 12.768 1.562 1.00 . A A . 12 LYS HA 1 1 9 2802 1 1 12 LYS HB2 H 21.993 11.339 3.658 1.00 . A A . 12 LYS HB2 1 1 9 2803 1 1 12 LYS HB3 H 21.332 12.962 3.806 1.00 . A A . 12 LYS HB3 1 1 9 2804 1 1 12 LYS HD2 H 19.221 13.376 4.266 1.00 . A A . 12 LYS HD2 1 1 9 2805 1 1 12 LYS HD3 H 18.075 12.164 4.844 1.00 . A A . 12 LYS HD3 1 1 9 2806 1 1 12 LYS HE2 H 18.455 13.399 6.753 1.00 . A A . 12 LYS HE2 1 1 9 2807 1 1 12 LYS HE3 H 19.627 12.095 6.934 1.00 . A A . 12 LYS HE3 1 1 9 2808 1 1 12 LYS HG2 H 19.476 10.646 3.995 1.00 . A A . 12 LYS HG2 1 1 9 2809 1 1 12 LYS HG3 H 20.526 11.014 5.365 1.00 . A A . 12 LYS HG3 1 1 9 2810 1 1 12 LYS HZ1 H 20.086 14.875 6.767 1.00 . A A . 12 LYS HZ1 1 1 9 2811 1 1 12 LYS HZ2 H 20.884 14.099 5.494 1.00 . A A . 12 LYS HZ2 1 1 9 2812 1 1 12 LYS HZ3 H 21.190 13.635 7.092 1.00 . A A . 12 LYS HZ3 1 1 9 2813 1 1 12 LYS N N 19.228 11.951 1.957 1.00 . A A . 12 LYS N 1 1 9 2814 1 1 12 LYS NZ N 20.456 13.963 6.432 1.00 . A A . 12 LYS NZ 1 1 9 2815 1 1 12 LYS O O 21.759 10.702 0.288 1.00 . A A . 12 LYS O 1 1 9 2816 1 1 13 ASN C C 21.076 8.006 0.145 1.00 . A A . 13 ASN C 1 1 9 2817 1 1 13 ASN CA C 21.598 8.244 1.559 1.00 . A A . 13 ASN CA 1 1 9 2818 1 1 13 ASN CB C 21.173 7.093 2.473 1.00 . A A . 13 ASN CB 1 1 9 2819 1 1 13 ASN CG C 22.359 6.372 3.083 1.00 . A A . 13 ASN CG 1 1 9 2820 1 1 13 ASN H H 20.683 9.533 2.967 1.00 . A A . 13 ASN H 1 1 9 2821 1 1 13 ASN HA H 22.676 8.290 1.529 1.00 . A A . 13 ASN HA 1 1 9 2822 1 1 13 ASN HB2 H 20.563 7.484 3.274 1.00 . A A . 13 ASN HB2 1 1 9 2823 1 1 13 ASN HB3 H 20.597 6.381 1.901 1.00 . A A . 13 ASN HB3 1 1 9 2824 1 1 13 ASN HD21 H 22.024 7.253 4.834 1.00 . A A . 13 ASN HD21 1 1 9 2825 1 1 13 ASN HD22 H 23.371 6.172 4.783 1.00 . A A . 13 ASN HD22 1 1 9 2826 1 1 13 ASN N N 21.111 9.514 2.086 1.00 . A A . 13 ASN N 1 1 9 2827 1 1 13 ASN ND2 N 22.610 6.624 4.363 1.00 . A A . 13 ASN ND2 1 1 9 2828 1 1 13 ASN O O 21.722 7.337 -0.661 1.00 . A A . 13 ASN O 1 1 9 2829 1 1 13 ASN OD1 O 23.041 5.597 2.413 1.00 . A A . 13 ASN OD1 1 1 9 2830 1 1 14 MET C C 20.201 8.979 -2.550 1.00 . A A . 14 MET C 1 1 9 2831 1 1 14 MET CA C 19.295 8.406 -1.464 1.00 . A A . 14 MET CA 1 1 9 2832 1 1 14 MET CB C 17.932 9.100 -1.503 1.00 . A A . 14 MET CB 1 1 9 2833 1 1 14 MET CE C 16.363 6.110 -2.433 1.00 . A A . 14 MET CE 1 1 9 2834 1 1 14 MET CG C 17.112 8.761 -2.738 1.00 . A A . 14 MET CG 1 1 9 2835 1 1 14 MET H H 19.435 9.080 0.537 1.00 . A A . 14 MET H 1 1 9 2836 1 1 14 MET HA H 19.157 7.351 -1.646 1.00 . A A . 14 MET HA 1 1 9 2837 1 1 14 MET HB2 H 17.367 8.806 -0.631 1.00 . A A . 14 MET HB2 1 1 9 2838 1 1 14 MET HB3 H 18.084 10.169 -1.481 1.00 . A A . 14 MET HB3 1 1 9 2839 1 1 14 MET HE1 H 17.104 5.997 -1.655 1.00 . A A . 14 MET HE1 1 1 9 2840 1 1 14 MET HE2 H 15.579 5.380 -2.293 1.00 . A A . 14 MET HE2 1 1 9 2841 1 1 14 MET HE3 H 16.826 5.961 -3.397 1.00 . A A . 14 MET HE3 1 1 9 2842 1 1 14 MET HG2 H 16.784 9.680 -3.200 1.00 . A A . 14 MET HG2 1 1 9 2843 1 1 14 MET HG3 H 17.738 8.217 -3.430 1.00 . A A . 14 MET HG3 1 1 9 2844 1 1 14 MET N N 19.903 8.558 -0.147 1.00 . A A . 14 MET N 1 1 9 2845 1 1 14 MET O O 20.524 8.299 -3.524 1.00 . A A . 14 MET O 1 1 9 2846 1 1 14 MET SD S 15.664 7.758 -2.356 1.00 . A A . 14 MET SD 1 1 9 2847 1 1 15 ALA C C 22.912 10.398 -3.217 1.00 . A A . 15 ALA C 1 1 9 2848 1 1 15 ALA CA C 21.475 10.895 -3.341 1.00 . A A . 15 ALA CA 1 1 9 2849 1 1 15 ALA CB C 21.419 12.404 -3.153 1.00 . A A . 15 ALA CB 1 1 9 2850 1 1 15 ALA H H 20.314 10.723 -1.580 1.00 . A A . 15 ALA H 1 1 9 2851 1 1 15 ALA HA H 21.110 10.666 -4.332 1.00 . A A . 15 ALA HA 1 1 9 2852 1 1 15 ALA HB1 H 22.410 12.817 -3.265 1.00 . A A . 15 ALA HB1 1 1 9 2853 1 1 15 ALA HB2 H 20.763 12.834 -3.895 1.00 . A A . 15 ALA HB2 1 1 9 2854 1 1 15 ALA HB3 H 21.044 12.630 -2.166 1.00 . A A . 15 ALA HB3 1 1 9 2855 1 1 15 ALA N N 20.606 10.233 -2.376 1.00 . A A . 15 ALA N 1 1 9 2856 1 1 15 ALA O O 23.798 10.841 -3.948 1.00 . A A . 15 ALA O 1 1 9 2857 1 1 16 HIS C C 24.569 7.513 -2.645 1.00 . A A . 16 HIS C 1 1 9 2858 1 1 16 HIS CA C 24.466 8.920 -2.065 1.00 . A A . 16 HIS CA 1 1 9 2859 1 1 16 HIS CB C 24.790 8.893 -0.571 1.00 . A A . 16 HIS CB 1 1 9 2860 1 1 16 HIS CD2 C 25.914 10.910 0.612 1.00 . A A . 16 HIS CD2 1 1 9 2861 1 1 16 HIS CE1 C 27.958 10.615 -0.125 1.00 . A A . 16 HIS CE1 1 1 9 2862 1 1 16 HIS CG C 25.906 9.815 -0.184 1.00 . A A . 16 HIS CG 1 1 9 2863 1 1 16 HIS H H 22.390 9.164 -1.733 1.00 . A A . 16 HIS H 1 1 9 2864 1 1 16 HIS HA H 25.179 9.556 -2.568 1.00 . A A . 16 HIS HA 1 1 9 2865 1 1 16 HIS HB2 H 23.912 9.184 -0.014 1.00 . A A . 16 HIS HB2 1 1 9 2866 1 1 16 HIS HB3 H 25.075 7.890 -0.289 1.00 . A A . 16 HIS HB3 1 1 9 2867 1 1 16 HIS HD1 H 27.519 8.949 -1.227 1.00 . A A . 16 HIS HD1 1 1 9 2868 1 1 16 HIS HD2 H 25.066 11.330 1.134 1.00 . A A . 16 HIS HD2 1 1 9 2869 1 1 16 HIS HE1 H 29.016 10.744 -0.300 1.00 . A A . 16 HIS HE1 1 1 9 2870 1 1 16 HIS N N 23.136 9.477 -2.285 1.00 . A A . 16 HIS N 1 1 9 2871 1 1 16 HIS ND1 N 27.201 9.657 -0.630 1.00 . A A . 16 HIS ND1 1 1 9 2872 1 1 16 HIS NE2 N 27.201 11.389 0.632 1.00 . A A . 16 HIS NE2 1 1 9 2873 1 1 16 HIS O O 25.667 6.997 -2.857 1.00 . A A . 16 HIS O 1 1 9 2874 1 1 17 ILE C C 24.230 5.451 -4.716 1.00 . A A . 17 ILE C 1 1 9 2875 1 1 17 ILE CA C 23.380 5.550 -3.454 1.00 . A A . 17 ILE CA 1 1 9 2876 1 1 17 ILE CB C 21.939 5.119 -3.784 1.00 . A A . 17 ILE CB 1 1 9 2877 1 1 17 ILE CD1 C 19.885 5.907 -5.064 1.00 . A A . 17 ILE CD1 1 1 9 2878 1 1 17 ILE CG1 C 21.394 5.939 -4.955 1.00 . A A . 17 ILE CG1 1 1 9 2879 1 1 17 ILE CG2 C 21.046 5.272 -2.562 1.00 . A A . 17 ILE CG2 1 1 9 2880 1 1 17 ILE H H 22.577 7.360 -2.708 1.00 . A A . 17 ILE H 1 1 9 2881 1 1 17 ILE HA H 23.776 4.872 -2.711 1.00 . A A . 17 ILE HA 1 1 9 2882 1 1 17 ILE HB H 21.953 4.076 -4.061 1.00 . A A . 17 ILE HB 1 1 9 2883 1 1 17 ILE HD11 H 19.545 4.882 -5.063 1.00 . A A . 17 ILE HD11 1 1 9 2884 1 1 17 ILE HD12 H 19.452 6.433 -4.227 1.00 . A A . 17 ILE HD12 1 1 9 2885 1 1 17 ILE HD13 H 19.581 6.385 -5.985 1.00 . A A . 17 ILE HD13 1 1 9 2886 1 1 17 ILE HG12 H 21.695 6.968 -4.837 1.00 . A A . 17 ILE HG12 1 1 9 2887 1 1 17 ILE HG13 H 21.802 5.551 -5.877 1.00 . A A . 17 ILE HG13 1 1 9 2888 1 1 17 ILE HG21 H 20.168 4.655 -2.678 1.00 . A A . 17 ILE HG21 1 1 9 2889 1 1 17 ILE HG22 H 21.588 4.964 -1.680 1.00 . A A . 17 ILE HG22 1 1 9 2890 1 1 17 ILE HG23 H 20.750 6.305 -2.460 1.00 . A A . 17 ILE HG23 1 1 9 2891 1 1 17 ILE N N 23.419 6.897 -2.898 1.00 . A A . 17 ILE N 1 1 9 2892 1 1 17 ILE O O 24.922 4.456 -4.934 1.00 . A A . 17 ILE O 1 1 9 2893 1 1 18 ARG C C 26.404 6.860 -6.510 1.00 . A A . 18 ARG C 1 1 9 2894 1 1 18 ARG CA C 24.942 6.521 -6.783 1.00 . A A . 18 ARG CA 1 1 9 2895 1 1 18 ARG CB C 24.342 7.541 -7.752 1.00 . A A . 18 ARG CB 1 1 9 2896 1 1 18 ARG CD C 23.813 7.946 -10.175 1.00 . A A . 18 ARG CD 1 1 9 2897 1 1 18 ARG CG C 24.813 7.368 -9.187 1.00 . A A . 18 ARG CG 1 1 9 2898 1 1 18 ARG CZ C 22.962 10.148 -10.864 1.00 . A A . 18 ARG CZ 1 1 9 2899 1 1 18 ARG H H 23.606 7.254 -5.313 1.00 . A A . 18 ARG H 1 1 9 2900 1 1 18 ARG HA H 24.889 5.539 -7.229 1.00 . A A . 18 ARG HA 1 1 9 2901 1 1 18 ARG HB2 H 23.266 7.446 -7.736 1.00 . A A . 18 ARG HB2 1 1 9 2902 1 1 18 ARG HB3 H 24.613 8.533 -7.424 1.00 . A A . 18 ARG HB3 1 1 9 2903 1 1 18 ARG HD2 H 24.067 7.603 -11.167 1.00 . A A . 18 ARG HD2 1 1 9 2904 1 1 18 ARG HD3 H 22.826 7.595 -9.915 1.00 . A A . 18 ARG HD3 1 1 9 2905 1 1 18 ARG HE H 24.485 9.855 -9.609 1.00 . A A . 18 ARG HE 1 1 9 2906 1 1 18 ARG HG2 H 25.758 7.876 -9.309 1.00 . A A . 18 ARG HG2 1 1 9 2907 1 1 18 ARG HG3 H 24.939 6.315 -9.390 1.00 . A A . 18 ARG HG3 1 1 9 2908 1 1 18 ARG HH11 H 21.992 8.571 -11.672 1.00 . A A . 18 ARG HH11 1 1 9 2909 1 1 18 ARG HH12 H 21.403 10.129 -12.149 1.00 . A A . 18 ARG HH12 1 1 9 2910 1 1 18 ARG HH21 H 23.718 11.912 -10.229 1.00 . A A . 18 ARG HH21 1 1 9 2911 1 1 18 ARG HH22 H 22.385 12.028 -11.328 1.00 . A A . 18 ARG HH22 1 1 9 2912 1 1 18 ARG N N 24.176 6.490 -5.542 1.00 . A A . 18 ARG N 1 1 9 2913 1 1 18 ARG NE N 23.815 9.407 -10.165 1.00 . A A . 18 ARG NE 1 1 9 2914 1 1 18 ARG NH1 N 22.044 9.568 -11.624 1.00 . A A . 18 ARG NH1 1 1 9 2915 1 1 18 ARG NH2 N 23.027 11.472 -10.802 1.00 . A A . 18 ARG NH2 1 1 9 2916 1 1 18 ARG O O 27.200 5.988 -6.162 1.00 . A A . 18 ARG O 1 1 10 2917 1 1 1 PHE C C 3.383 0.610 -2.652 1.00 . A A . 1 PHE C 1 1 10 2918 1 1 1 PHE CA C 2.094 -0.199 -2.538 1.00 . A A . 1 PHE CA 1 1 10 2919 1 1 1 PHE CB C 2.129 -1.061 -1.275 1.00 . A A . 1 PHE CB 1 1 10 2920 1 1 1 PHE CD1 C -0.050 -2.297 -1.424 1.00 . A A . 1 PHE CD1 1 1 10 2921 1 1 1 PHE CD2 C 0.301 -0.838 0.429 1.00 . A A . 1 PHE CD2 1 1 10 2922 1 1 1 PHE CE1 C -1.304 -2.617 -0.940 1.00 . A A . 1 PHE CE1 1 1 10 2923 1 1 1 PHE CE2 C -0.952 -1.154 0.918 1.00 . A A . 1 PHE CE2 1 1 10 2924 1 1 1 PHE CG C 0.766 -1.406 -0.746 1.00 . A A . 1 PHE CG 1 1 10 2925 1 1 1 PHE CZ C -1.756 -2.044 0.232 1.00 . A A . 1 PHE CZ 1 1 10 2926 1 1 1 PHE H1 H 1.178 -0.816 -4.345 1.00 . A A . 1 PHE H1 1 1 10 2927 1 1 1 PHE HA H 1.260 0.483 -2.475 1.00 . A A . 1 PHE HA 1 1 10 2928 1 1 1 PHE HB2 H 2.643 -1.985 -1.493 1.00 . A A . 1 PHE HB2 1 1 10 2929 1 1 1 PHE HB3 H 2.663 -0.531 -0.501 1.00 . A A . 1 PHE HB3 1 1 10 2930 1 1 1 PHE HD1 H 0.303 -2.746 -2.342 1.00 . A A . 1 PHE HD1 1 1 10 2931 1 1 1 PHE HD2 H 0.928 -0.142 0.966 1.00 . A A . 1 PHE HD2 1 1 10 2932 1 1 1 PHE HE1 H -1.930 -3.312 -1.479 1.00 . A A . 1 PHE HE1 1 1 10 2933 1 1 1 PHE HE2 H -1.304 -0.705 1.835 1.00 . A A . 1 PHE HE2 1 1 10 2934 1 1 1 PHE HZ H -2.736 -2.292 0.613 1.00 . A A . 1 PHE HZ 1 1 10 2935 1 1 1 PHE N N 1.899 -1.035 -3.717 1.00 . A A . 1 PHE N 1 1 10 2936 1 1 1 PHE O O 4.293 0.247 -3.399 1.00 . A A . 1 PHE O 1 1 10 2937 1 1 2 LEU C C 5.116 2.855 -0.506 1.00 . A A . 2 LEU C 1 1 10 2938 1 1 2 LEU CA C 4.631 2.568 -1.924 1.00 . A A . 2 LEU CA 1 1 10 2939 1 1 2 LEU CB C 4.316 3.882 -2.642 1.00 . A A . 2 LEU CB 1 1 10 2940 1 1 2 LEU CD1 C 3.241 4.599 -4.790 1.00 . A A . 2 LEU CD1 1 1 10 2941 1 1 2 LEU CD2 C 5.732 4.442 -4.634 1.00 . A A . 2 LEU CD2 1 1 10 2942 1 1 2 LEU CG C 4.409 3.851 -4.168 1.00 . A A . 2 LEU CG 1 1 10 2943 1 1 2 LEU H H 2.697 1.945 -1.332 1.00 . A A . 2 LEU H 1 1 10 2944 1 1 2 LEU HA H 5.412 2.052 -2.461 1.00 . A A . 2 LEU HA 1 1 10 2945 1 1 2 LEU HB2 H 3.310 4.170 -2.379 1.00 . A A . 2 LEU HB2 1 1 10 2946 1 1 2 LEU HB3 H 5.009 4.629 -2.282 1.00 . A A . 2 LEU HB3 1 1 10 2947 1 1 2 LEU HD11 H 3.482 5.649 -4.861 1.00 . A A . 2 LEU HD11 1 1 10 2948 1 1 2 LEU HD12 H 2.363 4.473 -4.172 1.00 . A A . 2 LEU HD12 1 1 10 2949 1 1 2 LEU HD13 H 3.045 4.206 -5.777 1.00 . A A . 2 LEU HD13 1 1 10 2950 1 1 2 LEU HD21 H 5.972 4.059 -5.615 1.00 . A A . 2 LEU HD21 1 1 10 2951 1 1 2 LEU HD22 H 6.513 4.168 -3.940 1.00 . A A . 2 LEU HD22 1 1 10 2952 1 1 2 LEU HD23 H 5.650 5.518 -4.677 1.00 . A A . 2 LEU HD23 1 1 10 2953 1 1 2 LEU HG H 4.364 2.824 -4.505 1.00 . A A . 2 LEU HG 1 1 10 2954 1 1 2 LEU N N 3.454 1.707 -1.907 1.00 . A A . 2 LEU N 1 1 10 2955 1 1 2 LEU O O 4.989 3.967 0.007 1.00 . A A . 2 LEU O 1 1 10 2956 1 1 3 PRO C C 7.456 2.817 1.581 1.00 . A A . 3 PRO C 1 1 10 2957 1 1 3 PRO CA C 6.206 1.947 1.508 1.00 . A A . 3 PRO CA 1 1 10 2958 1 1 3 PRO CB C 6.538 0.501 1.888 1.00 . A A . 3 PRO CB 1 1 10 2959 1 1 3 PRO CD C 5.872 0.476 -0.408 1.00 . A A . 3 PRO CD 1 1 10 2960 1 1 3 PRO CG C 6.785 -0.184 0.588 1.00 . A A . 3 PRO CG 1 1 10 2961 1 1 3 PRO HA H 5.459 2.336 2.184 1.00 . A A . 3 PRO HA 1 1 10 2962 1 1 3 PRO HB2 H 7.416 0.484 2.517 1.00 . A A . 3 PRO HB2 1 1 10 2963 1 1 3 PRO HB3 H 5.703 0.062 2.413 1.00 . A A . 3 PRO HB3 1 1 10 2964 1 1 3 PRO HD2 H 6.340 0.516 -1.381 1.00 . A A . 3 PRO HD2 1 1 10 2965 1 1 3 PRO HD3 H 4.930 -0.049 -0.462 1.00 . A A . 3 PRO HD3 1 1 10 2966 1 1 3 PRO HG2 H 7.815 -0.055 0.295 1.00 . A A . 3 PRO HG2 1 1 10 2967 1 1 3 PRO HG3 H 6.546 -1.234 0.676 1.00 . A A . 3 PRO HG3 1 1 10 2968 1 1 3 PRO N N 5.688 1.829 0.142 1.00 . A A . 3 PRO N 1 1 10 2969 1 1 3 PRO O O 8.575 2.329 1.419 1.00 . A A . 3 PRO O 1 1 10 2970 1 1 4 LYS C C 8.427 5.684 3.307 1.00 . A A . 4 LYS C 1 1 10 2971 1 1 4 LYS CA C 8.371 5.047 1.922 1.00 . A A . 4 LYS CA 1 1 10 2972 1 1 4 LYS CB C 8.240 6.135 0.854 1.00 . A A . 4 LYS CB 1 1 10 2973 1 1 4 LYS CD C 6.606 7.734 -0.188 1.00 . A A . 4 LYS CD 1 1 10 2974 1 1 4 LYS CE C 7.524 8.019 -1.367 1.00 . A A . 4 LYS CE 1 1 10 2975 1 1 4 LYS CG C 6.818 6.331 0.356 1.00 . A A . 4 LYS CG 1 1 10 2976 1 1 4 LYS H H 6.344 4.437 1.946 1.00 . A A . 4 LYS H 1 1 10 2977 1 1 4 LYS HA H 9.285 4.498 1.754 1.00 . A A . 4 LYS HA 1 1 10 2978 1 1 4 LYS HB2 H 8.588 7.071 1.266 1.00 . A A . 4 LYS HB2 1 1 10 2979 1 1 4 LYS HB3 H 8.861 5.870 0.010 1.00 . A A . 4 LYS HB3 1 1 10 2980 1 1 4 LYS HD2 H 5.581 7.834 -0.511 1.00 . A A . 4 LYS HD2 1 1 10 2981 1 1 4 LYS HD3 H 6.810 8.449 0.597 1.00 . A A . 4 LYS HD3 1 1 10 2982 1 1 4 LYS HE2 H 8.359 8.610 -1.022 1.00 . A A . 4 LYS HE2 1 1 10 2983 1 1 4 LYS HE3 H 7.885 7.080 -1.760 1.00 . A A . 4 LYS HE3 1 1 10 2984 1 1 4 LYS HG2 H 6.620 5.618 -0.430 1.00 . A A . 4 LYS HG2 1 1 10 2985 1 1 4 LYS HG3 H 6.134 6.165 1.176 1.00 . A A . 4 LYS HG3 1 1 10 2986 1 1 4 LYS HZ1 H 5.944 9.182 -2.083 1.00 . A A . 4 LYS HZ1 1 1 10 2987 1 1 4 LYS HZ2 H 6.580 8.112 -3.228 1.00 . A A . 4 LYS HZ2 1 1 10 2988 1 1 4 LYS HZ3 H 7.430 9.517 -2.819 1.00 . A A . 4 LYS HZ3 1 1 10 2989 1 1 4 LYS N N 7.260 4.108 1.826 1.00 . A A . 4 LYS N 1 1 10 2990 1 1 4 LYS NZ N 6.820 8.760 -2.450 1.00 . A A . 4 LYS NZ 1 1 10 2991 1 1 4 LYS O O 8.759 6.862 3.447 1.00 . A A . 4 LYS O 1 1 10 2992 1 1 5 LEU C C 9.370 6.212 5.974 1.00 . A A . 5 LEU C 1 1 10 2993 1 1 5 LEU CA C 8.117 5.385 5.703 1.00 . A A . 5 LEU CA 1 1 10 2994 1 1 5 LEU CB C 8.045 4.211 6.681 1.00 . A A . 5 LEU CB 1 1 10 2995 1 1 5 LEU CD1 C 9.572 2.380 7.455 1.00 . A A . 5 LEU CD1 1 1 10 2996 1 1 5 LEU CD2 C 7.847 1.910 5.706 1.00 . A A . 5 LEU CD2 1 1 10 2997 1 1 5 LEU CG C 8.804 2.949 6.272 1.00 . A A . 5 LEU CG 1 1 10 2998 1 1 5 LEU H H 7.846 3.969 4.154 1.00 . A A . 5 LEU H 1 1 10 2999 1 1 5 LEU HA H 7.249 6.012 5.842 1.00 . A A . 5 LEU HA 1 1 10 3000 1 1 5 LEU HB2 H 8.444 4.544 7.627 1.00 . A A . 5 LEU HB2 1 1 10 3001 1 1 5 LEU HB3 H 7.004 3.947 6.804 1.00 . A A . 5 LEU HB3 1 1 10 3002 1 1 5 LEU HD11 H 10.484 2.940 7.595 1.00 . A A . 5 LEU HD11 1 1 10 3003 1 1 5 LEU HD12 H 9.811 1.344 7.265 1.00 . A A . 5 LEU HD12 1 1 10 3004 1 1 5 LEU HD13 H 8.964 2.451 8.346 1.00 . A A . 5 LEU HD13 1 1 10 3005 1 1 5 LEU HD21 H 7.448 1.312 6.512 1.00 . A A . 5 LEU HD21 1 1 10 3006 1 1 5 LEU HD22 H 8.376 1.273 5.012 1.00 . A A . 5 LEU HD22 1 1 10 3007 1 1 5 LEU HD23 H 7.038 2.408 5.193 1.00 . A A . 5 LEU HD23 1 1 10 3008 1 1 5 LEU HG H 9.520 3.201 5.501 1.00 . A A . 5 LEU HG 1 1 10 3009 1 1 5 LEU N N 8.102 4.898 4.328 1.00 . A A . 5 LEU N 1 1 10 3010 1 1 5 LEU O O 9.321 7.218 6.682 1.00 . A A . 5 LEU O 1 1 10 3011 1 1 6 PHE C C 12.343 6.899 4.238 1.00 . A A . 6 PHE C 1 1 10 3012 1 1 6 PHE CA C 11.757 6.483 5.584 1.00 . A A . 6 PHE CA 1 1 10 3013 1 1 6 PHE CB C 12.753 5.598 6.336 1.00 . A A . 6 PHE CB 1 1 10 3014 1 1 6 PHE CD1 C 14.984 6.560 6.961 1.00 . A A . 6 PHE CD1 1 1 10 3015 1 1 6 PHE CD2 C 13.153 6.878 8.456 1.00 . A A . 6 PHE CD2 1 1 10 3016 1 1 6 PHE CE1 C 15.810 7.263 7.818 1.00 . A A . 6 PHE CE1 1 1 10 3017 1 1 6 PHE CE2 C 13.975 7.582 9.317 1.00 . A A . 6 PHE CE2 1 1 10 3018 1 1 6 PHE CG C 13.648 6.361 7.270 1.00 . A A . 6 PHE CG 1 1 10 3019 1 1 6 PHE CZ C 15.305 7.773 8.998 1.00 . A A . 6 PHE CZ 1 1 10 3020 1 1 6 PHE H H 10.466 4.973 4.852 1.00 . A A . 6 PHE H 1 1 10 3021 1 1 6 PHE HA H 11.564 7.370 6.169 1.00 . A A . 6 PHE HA 1 1 10 3022 1 1 6 PHE HB2 H 12.208 4.871 6.919 1.00 . A A . 6 PHE HB2 1 1 10 3023 1 1 6 PHE HB3 H 13.378 5.084 5.620 1.00 . A A . 6 PHE HB3 1 1 10 3024 1 1 6 PHE HD1 H 15.380 6.161 6.038 1.00 . A A . 6 PHE HD1 1 1 10 3025 1 1 6 PHE HD2 H 12.114 6.729 8.707 1.00 . A A . 6 PHE HD2 1 1 10 3026 1 1 6 PHE HE1 H 16.850 7.410 7.566 1.00 . A A . 6 PHE HE1 1 1 10 3027 1 1 6 PHE HE2 H 13.577 7.979 10.238 1.00 . A A . 6 PHE HE2 1 1 10 3028 1 1 6 PHE HZ H 15.949 8.323 9.669 1.00 . A A . 6 PHE HZ 1 1 10 3029 1 1 6 PHE N N 10.491 5.782 5.405 1.00 . A A . 6 PHE N 1 1 10 3030 1 1 6 PHE O O 13.318 7.648 4.179 1.00 . A A . 6 PHE O 1 1 10 3031 1 1 7 ALA C C 11.867 8.169 1.449 1.00 . A A . 7 ALA C 1 1 10 3032 1 1 7 ALA CA C 12.203 6.728 1.815 1.00 . A A . 7 ALA CA 1 1 10 3033 1 1 7 ALA CB C 11.593 5.768 0.805 1.00 . A A . 7 ALA CB 1 1 10 3034 1 1 7 ALA H H 10.970 5.815 3.272 1.00 . A A . 7 ALA H 1 1 10 3035 1 1 7 ALA HA H 13.276 6.602 1.791 1.00 . A A . 7 ALA HA 1 1 10 3036 1 1 7 ALA HB1 H 12.354 5.447 0.109 1.00 . A A . 7 ALA HB1 1 1 10 3037 1 1 7 ALA HB2 H 11.191 4.909 1.322 1.00 . A A . 7 ALA HB2 1 1 10 3038 1 1 7 ALA HB3 H 10.801 6.268 0.267 1.00 . A A . 7 ALA HB3 1 1 10 3039 1 1 7 ALA N N 11.742 6.407 3.160 1.00 . A A . 7 ALA N 1 1 10 3040 1 1 7 ALA O O 12.563 8.797 0.650 1.00 . A A . 7 ALA O 1 1 10 3041 1 1 8 LYS C C 11.045 11.035 2.728 1.00 . A A . 8 LYS C 1 1 10 3042 1 1 8 LYS CA C 10.366 10.058 1.774 1.00 . A A . 8 LYS CA 1 1 10 3043 1 1 8 LYS CB C 8.845 10.172 1.908 1.00 . A A . 8 LYS CB 1 1 10 3044 1 1 8 LYS CD C 7.479 10.831 3.910 1.00 . A A . 8 LYS CD 1 1 10 3045 1 1 8 LYS CE C 6.280 10.249 4.642 1.00 . A A . 8 LYS CE 1 1 10 3046 1 1 8 LYS CG C 8.321 9.742 3.267 1.00 . A A . 8 LYS CG 1 1 10 3047 1 1 8 LYS H H 10.281 8.139 2.665 1.00 . A A . 8 LYS H 1 1 10 3048 1 1 8 LYS HA H 10.649 10.305 0.762 1.00 . A A . 8 LYS HA 1 1 10 3049 1 1 8 LYS HB2 H 8.557 11.199 1.742 1.00 . A A . 8 LYS HB2 1 1 10 3050 1 1 8 LYS HB3 H 8.382 9.551 1.154 1.00 . A A . 8 LYS HB3 1 1 10 3051 1 1 8 LYS HD2 H 8.088 11.376 4.616 1.00 . A A . 8 LYS HD2 1 1 10 3052 1 1 8 LYS HD3 H 7.128 11.504 3.140 1.00 . A A . 8 LYS HD3 1 1 10 3053 1 1 8 LYS HE2 H 5.503 10.998 4.687 1.00 . A A . 8 LYS HE2 1 1 10 3054 1 1 8 LYS HE3 H 5.921 9.391 4.094 1.00 . A A . 8 LYS HE3 1 1 10 3055 1 1 8 LYS HG2 H 7.714 8.857 3.145 1.00 . A A . 8 LYS HG2 1 1 10 3056 1 1 8 LYS HG3 H 9.159 9.520 3.912 1.00 . A A . 8 LYS HG3 1 1 10 3057 1 1 8 LYS HZ1 H 5.767 9.553 6.544 1.00 . A A . 8 LYS HZ1 1 1 10 3058 1 1 8 LYS HZ2 H 7.086 10.612 6.535 1.00 . A A . 8 LYS HZ2 1 1 10 3059 1 1 8 LYS HZ3 H 7.277 9.018 6.003 1.00 . A A . 8 LYS HZ3 1 1 10 3060 1 1 8 LYS N N 10.795 8.689 2.037 1.00 . A A . 8 LYS N 1 1 10 3061 1 1 8 LYS NZ N 6.627 9.828 6.028 1.00 . A A . 8 LYS NZ 1 1 10 3062 1 1 8 LYS O O 11.332 12.175 2.362 1.00 . A A . 8 LYS O 1 1 10 3063 1 1 9 ILE C C 13.433 11.588 4.649 1.00 . A A . 9 ILE C 1 1 10 3064 1 1 9 ILE CA C 11.949 11.414 4.954 1.00 . A A . 9 ILE CA 1 1 10 3065 1 1 9 ILE CB C 11.793 10.818 6.366 1.00 . A A . 9 ILE CB 1 1 10 3066 1 1 9 ILE CD1 C 14.121 10.271 7.238 1.00 . A A . 9 ILE CD1 1 1 10 3067 1 1 9 ILE CG1 C 12.852 9.740 6.609 1.00 . A A . 9 ILE CG1 1 1 10 3068 1 1 9 ILE CG2 C 10.396 10.246 6.548 1.00 . A A . 9 ILE CG2 1 1 10 3069 1 1 9 ILE H H 11.048 9.662 4.181 1.00 . A A . 9 ILE H 1 1 10 3070 1 1 9 ILE HA H 11.473 12.384 4.940 1.00 . A A . 9 ILE HA 1 1 10 3071 1 1 9 ILE HB H 11.927 11.612 7.084 1.00 . A A . 9 ILE HB 1 1 10 3072 1 1 9 ILE HD11 H 14.165 11.342 7.112 1.00 . A A . 9 ILE HD11 1 1 10 3073 1 1 9 ILE HD12 H 14.129 10.030 8.291 1.00 . A A . 9 ILE HD12 1 1 10 3074 1 1 9 ILE HD13 H 14.977 9.817 6.759 1.00 . A A . 9 ILE HD13 1 1 10 3075 1 1 9 ILE HG12 H 12.446 8.987 7.265 1.00 . A A . 9 ILE HG12 1 1 10 3076 1 1 9 ILE HG13 H 13.114 9.285 5.664 1.00 . A A . 9 ILE HG13 1 1 10 3077 1 1 9 ILE HG21 H 10.040 10.473 7.542 1.00 . A A . 9 ILE HG21 1 1 10 3078 1 1 9 ILE HG22 H 9.730 10.684 5.820 1.00 . A A . 9 ILE HG22 1 1 10 3079 1 1 9 ILE HG23 H 10.424 9.175 6.412 1.00 . A A . 9 ILE HG23 1 1 10 3080 1 1 9 ILE N N 11.301 10.580 3.950 1.00 . A A . 9 ILE N 1 1 10 3081 1 1 9 ILE O O 14.044 12.587 5.031 1.00 . A A . 9 ILE O 1 1 10 3082 1 1 10 THR C C 15.638 11.447 2.316 1.00 . A A . 10 THR C 1 1 10 3083 1 1 10 THR CA C 15.421 10.654 3.600 1.00 . A A . 10 THR CA 1 1 10 3084 1 1 10 THR CB C 16.000 9.238 3.420 1.00 . A A . 10 THR CB 1 1 10 3085 1 1 10 THR CG2 C 16.149 8.540 4.763 1.00 . A A . 10 THR CG2 1 1 10 3086 1 1 10 THR H H 13.469 9.839 3.682 1.00 . A A . 10 THR H 1 1 10 3087 1 1 10 THR HA H 15.954 11.138 4.406 1.00 . A A . 10 THR HA 1 1 10 3088 1 1 10 THR HB H 16.976 9.320 2.963 1.00 . A A . 10 THR HB 1 1 10 3089 1 1 10 THR HG1 H 15.070 8.899 1.714 1.00 . A A . 10 THR HG1 1 1 10 3090 1 1 10 THR HG21 H 16.552 7.549 4.611 1.00 . A A . 10 THR HG21 1 1 10 3091 1 1 10 THR HG22 H 15.184 8.467 5.240 1.00 . A A . 10 THR HG22 1 1 10 3092 1 1 10 THR HG23 H 16.819 9.108 5.391 1.00 . A A . 10 THR HG23 1 1 10 3093 1 1 10 THR N N 14.009 10.609 3.957 1.00 . A A . 10 THR N 1 1 10 3094 1 1 10 THR O O 15.101 11.103 1.263 1.00 . A A . 10 THR O 1 1 10 3095 1 1 10 THR OG1 O 15.148 8.465 2.567 1.00 . A A . 10 THR OG1 1 1 10 3096 1 1 11 LYS C C 18.220 13.393 0.976 1.00 . A A . 11 LYS C 1 1 10 3097 1 1 11 LYS CA C 16.721 13.351 1.255 1.00 . A A . 11 LYS CA 1 1 10 3098 1 1 11 LYS CB C 16.195 14.770 1.486 1.00 . A A . 11 LYS CB 1 1 10 3099 1 1 11 LYS CD C 17.971 15.680 3.011 1.00 . A A . 11 LYS CD 1 1 10 3100 1 1 11 LYS CE C 18.177 16.772 4.049 1.00 . A A . 11 LYS CE 1 1 10 3101 1 1 11 LYS CG C 16.503 15.315 2.870 1.00 . A A . 11 LYS CG 1 1 10 3102 1 1 11 LYS H H 16.829 12.733 3.277 1.00 . A A . 11 LYS H 1 1 10 3103 1 1 11 LYS HA H 16.220 12.926 0.399 1.00 . A A . 11 LYS HA 1 1 10 3104 1 1 11 LYS HB2 H 16.638 15.429 0.755 1.00 . A A . 11 LYS HB2 1 1 10 3105 1 1 11 LYS HB3 H 15.122 14.769 1.354 1.00 . A A . 11 LYS HB3 1 1 10 3106 1 1 11 LYS HD2 H 18.524 14.803 3.314 1.00 . A A . 11 LYS HD2 1 1 10 3107 1 1 11 LYS HD3 H 18.340 16.028 2.056 1.00 . A A . 11 LYS HD3 1 1 10 3108 1 1 11 LYS HE2 H 17.242 16.949 4.557 1.00 . A A . 11 LYS HE2 1 1 10 3109 1 1 11 LYS HE3 H 18.917 16.439 4.762 1.00 . A A . 11 LYS HE3 1 1 10 3110 1 1 11 LYS HG2 H 15.906 16.198 3.041 1.00 . A A . 11 LYS HG2 1 1 10 3111 1 1 11 LYS HG3 H 16.256 14.563 3.606 1.00 . A A . 11 LYS HG3 1 1 10 3112 1 1 11 LYS HZ1 H 19.558 18.324 3.832 1.00 . A A . 11 LYS HZ1 1 1 10 3113 1 1 11 LYS HZ2 H 17.951 18.802 3.612 1.00 . A A . 11 LYS HZ2 1 1 10 3114 1 1 11 LYS HZ3 H 18.745 17.926 2.402 1.00 . A A . 11 LYS HZ3 1 1 10 3115 1 1 11 LYS N N 16.430 12.510 2.410 1.00 . A A . 11 LYS N 1 1 10 3116 1 1 11 LYS NZ N 18.640 18.045 3.430 1.00 . A A . 11 LYS NZ 1 1 10 3117 1 1 11 LYS O O 18.708 14.284 0.280 1.00 . A A . 11 LYS O 1 1 10 3118 1 1 12 LYS C C 20.780 11.042 0.649 1.00 . A A . 12 LYS C 1 1 10 3119 1 1 12 LYS CA C 20.390 12.348 1.332 1.00 . A A . 12 LYS CA 1 1 10 3120 1 1 12 LYS CB C 21.110 12.468 2.677 1.00 . A A . 12 LYS CB 1 1 10 3121 1 1 12 LYS CD C 21.109 11.629 5.045 1.00 . A A . 12 LYS CD 1 1 10 3122 1 1 12 LYS CE C 20.285 10.893 6.090 1.00 . A A . 12 LYS CE 1 1 10 3123 1 1 12 LYS CG C 20.255 12.058 3.864 1.00 . A A . 12 LYS CG 1 1 10 3124 1 1 12 LYS H H 18.500 11.743 2.069 1.00 . A A . 12 LYS H 1 1 10 3125 1 1 12 LYS HA H 20.685 13.173 0.701 1.00 . A A . 12 LYS HA 1 1 10 3126 1 1 12 LYS HB2 H 21.988 11.839 2.658 1.00 . A A . 12 LYS HB2 1 1 10 3127 1 1 12 LYS HB3 H 21.416 13.494 2.818 1.00 . A A . 12 LYS HB3 1 1 10 3128 1 1 12 LYS HD2 H 21.892 10.974 4.693 1.00 . A A . 12 LYS HD2 1 1 10 3129 1 1 12 LYS HD3 H 21.549 12.507 5.497 1.00 . A A . 12 LYS HD3 1 1 10 3130 1 1 12 LYS HE2 H 20.199 11.518 6.966 1.00 . A A . 12 LYS HE2 1 1 10 3131 1 1 12 LYS HE3 H 19.302 10.703 5.686 1.00 . A A . 12 LYS HE3 1 1 10 3132 1 1 12 LYS HG2 H 19.643 12.897 4.161 1.00 . A A . 12 LYS HG2 1 1 10 3133 1 1 12 LYS HG3 H 19.621 11.233 3.571 1.00 . A A . 12 LYS HG3 1 1 10 3134 1 1 12 LYS HZ1 H 21.184 9.065 5.627 1.00 . A A . 12 LYS HZ1 1 1 10 3135 1 1 12 LYS HZ2 H 20.237 9.028 7.028 1.00 . A A . 12 LYS HZ2 1 1 10 3136 1 1 12 LYS HZ3 H 21.758 9.768 7.055 1.00 . A A . 12 LYS HZ3 1 1 10 3137 1 1 12 LYS N N 18.946 12.424 1.524 1.00 . A A . 12 LYS N 1 1 10 3138 1 1 12 LYS NZ N 20.910 9.598 6.478 1.00 . A A . 12 LYS NZ 1 1 10 3139 1 1 12 LYS O O 21.057 11.016 -0.550 1.00 . A A . 12 LYS O 1 1 10 3140 1 1 13 ASN C C 20.337 8.330 -0.364 1.00 . A A . 13 ASN C 1 1 10 3141 1 1 13 ASN CA C 21.152 8.648 0.886 1.00 . A A . 13 ASN CA 1 1 10 3142 1 1 13 ASN CB C 20.925 7.566 1.945 1.00 . A A . 13 ASN CB 1 1 10 3143 1 1 13 ASN CG C 22.227 7.013 2.493 1.00 . A A . 13 ASN CG 1 1 10 3144 1 1 13 ASN H H 20.565 10.042 2.367 1.00 . A A . 13 ASN H 1 1 10 3145 1 1 13 ASN HA H 22.199 8.669 0.624 1.00 . A A . 13 ASN HA 1 1 10 3146 1 1 13 ASN HB2 H 20.361 7.986 2.765 1.00 . A A . 13 ASN HB2 1 1 10 3147 1 1 13 ASN HB3 H 20.366 6.753 1.507 1.00 . A A . 13 ASN HB3 1 1 10 3148 1 1 13 ASN HD21 H 21.332 5.298 2.954 1.00 . A A . 13 ASN HD21 1 1 10 3149 1 1 13 ASN HD22 H 23.013 5.395 3.339 1.00 . A A . 13 ASN HD22 1 1 10 3150 1 1 13 ASN N N 20.797 9.958 1.419 1.00 . A A . 13 ASN N 1 1 10 3151 1 1 13 ASN ND2 N 22.186 5.777 2.978 1.00 . A A . 13 ASN ND2 1 1 10 3152 1 1 13 ASN O O 20.789 7.594 -1.241 1.00 . A A . 13 ASN O 1 1 10 3153 1 1 13 ASN OD1 O 23.255 7.689 2.481 1.00 . A A . 13 ASN OD1 1 1 10 3154 1 1 14 MET C C 18.917 9.143 -2.873 1.00 . A A . 14 MET C 1 1 10 3155 1 1 14 MET CA C 18.258 8.667 -1.583 1.00 . A A . 14 MET CA 1 1 10 3156 1 1 14 MET CB C 16.926 9.392 -1.380 1.00 . A A . 14 MET CB 1 1 10 3157 1 1 14 MET CE C 15.305 6.474 -1.370 1.00 . A A . 14 MET CE 1 1 10 3158 1 1 14 MET CG C 15.858 8.993 -2.386 1.00 . A A . 14 MET CG 1 1 10 3159 1 1 14 MET H H 18.829 9.467 0.292 1.00 . A A . 14 MET H 1 1 10 3160 1 1 14 MET HA H 18.073 7.606 -1.656 1.00 . A A . 14 MET HA 1 1 10 3161 1 1 14 MET HB2 H 16.557 9.171 -0.389 1.00 . A A . 14 MET HB2 1 1 10 3162 1 1 14 MET HB3 H 17.090 10.455 -1.466 1.00 . A A . 14 MET HB3 1 1 10 3163 1 1 14 MET HE1 H 16.266 6.466 -1.863 1.00 . A A . 14 MET HE1 1 1 10 3164 1 1 14 MET HE2 H 15.442 6.313 -0.311 1.00 . A A . 14 MET HE2 1 1 10 3165 1 1 14 MET HE3 H 14.685 5.689 -1.777 1.00 . A A . 14 MET HE3 1 1 10 3166 1 1 14 MET HG2 H 15.450 9.888 -2.832 1.00 . A A . 14 MET HG2 1 1 10 3167 1 1 14 MET HG3 H 16.315 8.387 -3.153 1.00 . A A . 14 MET HG3 1 1 10 3168 1 1 14 MET N N 19.134 8.890 -0.439 1.00 . A A . 14 MET N 1 1 10 3169 1 1 14 MET O O 19.017 8.392 -3.843 1.00 . A A . 14 MET O 1 1 10 3170 1 1 14 MET SD S 14.511 8.058 -1.635 1.00 . A A . 14 MET SD 1 1 10 3171 1 1 15 ALA C C 21.440 10.445 -4.198 1.00 . A A . 15 ALA C 1 1 10 3172 1 1 15 ALA CA C 20.015 10.969 -4.049 1.00 . A A . 15 ALA CA 1 1 10 3173 1 1 15 ALA CB C 20.016 12.488 -3.960 1.00 . A A . 15 ALA CB 1 1 10 3174 1 1 15 ALA H H 19.255 10.944 -2.074 1.00 . A A . 15 ALA H 1 1 10 3175 1 1 15 ALA HA H 19.445 10.684 -4.921 1.00 . A A . 15 ALA HA 1 1 10 3176 1 1 15 ALA HB1 H 19.997 12.905 -4.957 1.00 . A A . 15 ALA HB1 1 1 10 3177 1 1 15 ALA HB2 H 19.145 12.817 -3.415 1.00 . A A . 15 ALA HB2 1 1 10 3178 1 1 15 ALA HB3 H 20.908 12.817 -3.448 1.00 . A A . 15 ALA HB3 1 1 10 3179 1 1 15 ALA N N 19.364 10.394 -2.878 1.00 . A A . 15 ALA N 1 1 10 3180 1 1 15 ALA O O 22.154 10.815 -5.130 1.00 . A A . 15 ALA O 1 1 10 3181 1 1 16 HIS C C 23.148 7.561 -3.788 1.00 . A A . 16 HIS C 1 1 10 3182 1 1 16 HIS CA C 23.187 9.006 -3.301 1.00 . A A . 16 HIS CA 1 1 10 3183 1 1 16 HIS CB C 23.823 9.072 -1.912 1.00 . A A . 16 HIS CB 1 1 10 3184 1 1 16 HIS CD2 C 25.258 11.044 -1.029 1.00 . A A . 16 HIS CD2 1 1 10 3185 1 1 16 HIS CE1 C 26.981 10.809 -2.363 1.00 . A A . 16 HIS CE1 1 1 10 3186 1 1 16 HIS CG C 25.006 9.987 -1.837 1.00 . A A . 16 HIS CG 1 1 10 3187 1 1 16 HIS H H 21.232 9.325 -2.554 1.00 . A A . 16 HIS H 1 1 10 3188 1 1 16 HIS HA H 23.783 9.588 -3.988 1.00 . A A . 16 HIS HA 1 1 10 3189 1 1 16 HIS HB2 H 23.087 9.422 -1.203 1.00 . A A . 16 HIS HB2 1 1 10 3190 1 1 16 HIS HB3 H 24.149 8.082 -1.625 1.00 . A A . 16 HIS HB3 1 1 10 3191 1 1 16 HIS HD1 H 26.224 9.191 -3.360 1.00 . A A . 16 HIS HD1 1 1 10 3192 1 1 16 HIS HD2 H 24.609 11.428 -0.255 1.00 . A A . 16 HIS HD2 1 1 10 3193 1 1 16 HIS HE1 H 27.936 10.959 -2.845 1.00 . A A . 16 HIS HE1 1 1 10 3194 1 1 16 HIS N N 21.847 9.581 -3.272 1.00 . A A . 16 HIS N 1 1 10 3195 1 1 16 HIS ND1 N 26.104 9.867 -2.662 1.00 . A A . 16 HIS ND1 1 1 10 3196 1 1 16 HIS NE2 N 26.491 11.537 -1.376 1.00 . A A . 16 HIS NE2 1 1 10 3197 1 1 16 HIS O O 24.170 7.004 -4.191 1.00 . A A . 16 HIS O 1 1 10 3198 1 1 17 ILE C C 22.354 5.374 -5.588 1.00 . A A . 17 ILE C 1 1 10 3199 1 1 17 ILE CA C 21.793 5.580 -4.185 1.00 . A A . 17 ILE CA 1 1 10 3200 1 1 17 ILE CB C 20.310 5.165 -4.171 1.00 . A A . 17 ILE CB 1 1 10 3201 1 1 17 ILE CD1 C 18.039 5.919 -5.040 1.00 . A A . 17 ILE CD1 1 1 10 3202 1 1 17 ILE CG1 C 19.537 5.919 -5.255 1.00 . A A . 17 ILE CG1 1 1 10 3203 1 1 17 ILE CG2 C 19.700 5.423 -2.801 1.00 . A A . 17 ILE CG2 1 1 10 3204 1 1 17 ILE H H 21.187 7.456 -3.416 1.00 . A A . 17 ILE H 1 1 10 3205 1 1 17 ILE HA H 22.330 4.943 -3.497 1.00 . A A . 17 ILE HA 1 1 10 3206 1 1 17 ILE HB H 20.253 4.106 -4.370 1.00 . A A . 17 ILE HB 1 1 10 3207 1 1 17 ILE HD11 H 17.800 6.511 -4.169 1.00 . A A . 17 ILE HD11 1 1 10 3208 1 1 17 ILE HD12 H 17.551 6.338 -5.906 1.00 . A A . 17 ILE HD12 1 1 10 3209 1 1 17 ILE HD13 H 17.698 4.905 -4.889 1.00 . A A . 17 ILE HD13 1 1 10 3210 1 1 17 ILE HG12 H 19.868 6.945 -5.277 1.00 . A A . 17 ILE HG12 1 1 10 3211 1 1 17 ILE HG13 H 19.735 5.461 -6.213 1.00 . A A . 17 ILE HG13 1 1 10 3212 1 1 17 ILE HG21 H 20.415 5.162 -2.034 1.00 . A A . 17 ILE HG21 1 1 10 3213 1 1 17 ILE HG22 H 19.444 6.468 -2.713 1.00 . A A . 17 ILE HG22 1 1 10 3214 1 1 17 ILE HG23 H 18.811 4.823 -2.684 1.00 . A A . 17 ILE HG23 1 1 10 3215 1 1 17 ILE N N 21.964 6.960 -3.747 1.00 . A A . 17 ILE N 1 1 10 3216 1 1 17 ILE O O 22.971 4.349 -5.876 1.00 . A A . 17 ILE O 1 1 10 3217 1 1 18 ARG C C 22.070 5.048 -8.535 1.00 . A A . 18 ARG C 1 1 10 3218 1 1 18 ARG CA C 22.620 6.284 -7.829 1.00 . A A . 18 ARG CA 1 1 10 3219 1 1 18 ARG CB C 24.150 6.260 -7.852 1.00 . A A . 18 ARG CB 1 1 10 3220 1 1 18 ARG CD C 26.090 7.453 -8.913 1.00 . A A . 18 ARG CD 1 1 10 3221 1 1 18 ARG CG C 24.776 7.609 -8.165 1.00 . A A . 18 ARG CG 1 1 10 3222 1 1 18 ARG CZ C 26.101 9.425 -10.381 1.00 . A A . 18 ARG CZ 1 1 10 3223 1 1 18 ARG H H 21.637 7.149 -6.166 1.00 . A A . 18 ARG H 1 1 10 3224 1 1 18 ARG HA H 22.275 7.165 -8.350 1.00 . A A . 18 ARG HA 1 1 10 3225 1 1 18 ARG HB2 H 24.508 5.937 -6.886 1.00 . A A . 18 ARG HB2 1 1 10 3226 1 1 18 ARG HB3 H 24.475 5.554 -8.602 1.00 . A A . 18 ARG HB3 1 1 10 3227 1 1 18 ARG HD2 H 26.880 7.891 -8.321 1.00 . A A . 18 ARG HD2 1 1 10 3228 1 1 18 ARG HD3 H 26.287 6.401 -9.053 1.00 . A A . 18 ARG HD3 1 1 10 3229 1 1 18 ARG HE H 26.002 7.536 -11.011 1.00 . A A . 18 ARG HE 1 1 10 3230 1 1 18 ARG HG2 H 24.092 8.180 -8.776 1.00 . A A . 18 ARG HG2 1 1 10 3231 1 1 18 ARG HG3 H 24.958 8.134 -7.239 1.00 . A A . 18 ARG HG3 1 1 10 3232 1 1 18 ARG HH11 H 26.205 9.835 -8.406 1.00 . A A . 18 ARG HH11 1 1 10 3233 1 1 18 ARG HH12 H 26.212 11.217 -9.452 1.00 . A A . 18 ARG HH12 1 1 10 3234 1 1 18 ARG HH21 H 26.010 9.346 -12.399 1.00 . A A . 18 ARG HH21 1 1 10 3235 1 1 18 ARG HH22 H 26.100 10.937 -11.723 1.00 . A A . 18 ARG HH22 1 1 10 3236 1 1 18 ARG N N 22.136 6.357 -6.456 1.00 . A A . 18 ARG N 1 1 10 3237 1 1 18 ARG NE N 26.058 8.108 -10.218 1.00 . A A . 18 ARG NE 1 1 10 3238 1 1 18 ARG NH1 N 26.178 10.225 -9.326 1.00 . A A . 18 ARG NH1 1 1 10 3239 1 1 18 ARG NH2 N 26.068 9.946 -11.601 1.00 . A A . 18 ARG NH2 1 1 10 3240 1 1 18 ARG O O 22.693 3.986 -8.523 1.00 . A A . 18 ARG O 1 1 11 3241 1 1 1 PHE C C 4.617 0.197 -3.091 1.00 . A A . 1 PHE C 1 1 11 3242 1 1 1 PHE CA C 4.843 -0.137 -4.563 1.00 . A A . 1 PHE CA 1 1 11 3243 1 1 1 PHE CB C 5.055 -1.644 -4.728 1.00 . A A . 1 PHE CB 1 1 11 3244 1 1 1 PHE CD1 C 4.105 -2.658 -6.817 1.00 . A A . 1 PHE CD1 1 1 11 3245 1 1 1 PHE CD2 C 2.753 -2.634 -4.853 1.00 . A A . 1 PHE CD2 1 1 11 3246 1 1 1 PHE CE1 C 3.089 -3.286 -7.513 1.00 . A A . 1 PHE CE1 1 1 11 3247 1 1 1 PHE CE2 C 1.734 -3.262 -5.543 1.00 . A A . 1 PHE CE2 1 1 11 3248 1 1 1 PHE CG C 3.949 -2.326 -5.481 1.00 . A A . 1 PHE CG 1 1 11 3249 1 1 1 PHE CZ C 1.902 -3.588 -6.875 1.00 . A A . 1 PHE CZ 1 1 11 3250 1 1 1 PHE H1 H 6.551 0.175 -5.774 1.00 . A A . 1 PHE H1 1 1 11 3251 1 1 1 PHE HA H 3.971 0.159 -5.125 1.00 . A A . 1 PHE HA 1 1 11 3252 1 1 1 PHE HB2 H 5.976 -1.813 -5.266 1.00 . A A . 1 PHE HB2 1 1 11 3253 1 1 1 PHE HB3 H 5.125 -2.099 -3.752 1.00 . A A . 1 PHE HB3 1 1 11 3254 1 1 1 PHE HD1 H 5.034 -2.423 -7.317 1.00 . A A . 1 PHE HD1 1 1 11 3255 1 1 1 PHE HD2 H 2.620 -2.379 -3.812 1.00 . A A . 1 PHE HD2 1 1 11 3256 1 1 1 PHE HE1 H 3.224 -3.539 -8.554 1.00 . A A . 1 PHE HE1 1 1 11 3257 1 1 1 PHE HE2 H 0.806 -3.496 -5.043 1.00 . A A . 1 PHE HE2 1 1 11 3258 1 1 1 PHE HZ H 1.107 -4.079 -7.417 1.00 . A A . 1 PHE HZ 1 1 11 3259 1 1 1 PHE N N 5.987 0.596 -5.093 1.00 . A A . 1 PHE N 1 1 11 3260 1 1 1 PHE O O 3.478 0.326 -2.640 1.00 . A A . 1 PHE O 1 1 11 3261 1 1 2 LEU C C 5.700 2.161 -0.702 1.00 . A A . 2 LEU C 1 1 11 3262 1 1 2 LEU CA C 5.632 0.654 -0.926 1.00 . A A . 2 LEU CA 1 1 11 3263 1 1 2 LEU CB C 6.764 -0.038 -0.166 1.00 . A A . 2 LEU CB 1 1 11 3264 1 1 2 LEU CD1 C 6.362 -2.493 -0.475 1.00 . A A . 2 LEU CD1 1 1 11 3265 1 1 2 LEU CD2 C 7.391 -1.655 1.645 1.00 . A A . 2 LEU CD2 1 1 11 3266 1 1 2 LEU CG C 6.402 -1.351 0.529 1.00 . A A . 2 LEU CG 1 1 11 3267 1 1 2 LEU H H 6.589 0.220 -2.763 1.00 . A A . 2 LEU H 1 1 11 3268 1 1 2 LEU HA H 4.685 0.290 -0.556 1.00 . A A . 2 LEU HA 1 1 11 3269 1 1 2 LEU HB2 H 7.557 -0.244 -0.869 1.00 . A A . 2 LEU HB2 1 1 11 3270 1 1 2 LEU HB3 H 7.123 0.648 0.588 1.00 . A A . 2 LEU HB3 1 1 11 3271 1 1 2 LEU HD11 H 6.152 -3.418 0.040 1.00 . A A . 2 LEU HD11 1 1 11 3272 1 1 2 LEU HD12 H 7.317 -2.567 -0.974 1.00 . A A . 2 LEU HD12 1 1 11 3273 1 1 2 LEU HD13 H 5.589 -2.303 -1.205 1.00 . A A . 2 LEU HD13 1 1 11 3274 1 1 2 LEU HD21 H 7.117 -2.583 2.125 1.00 . A A . 2 LEU HD21 1 1 11 3275 1 1 2 LEU HD22 H 7.370 -0.855 2.371 1.00 . A A . 2 LEU HD22 1 1 11 3276 1 1 2 LEU HD23 H 8.385 -1.741 1.232 1.00 . A A . 2 LEU HD23 1 1 11 3277 1 1 2 LEU HG H 5.418 -1.259 0.968 1.00 . A A . 2 LEU HG 1 1 11 3278 1 1 2 LEU N N 5.709 0.335 -2.348 1.00 . A A . 2 LEU N 1 1 11 3279 1 1 2 LEU O O 6.150 2.922 -1.559 1.00 . A A . 2 LEU O 1 1 11 3280 1 1 3 PRO C C 6.656 4.563 1.074 1.00 . A A . 3 PRO C 1 1 11 3281 1 1 3 PRO CA C 5.247 4.025 0.846 1.00 . A A . 3 PRO CA 1 1 11 3282 1 1 3 PRO CB C 4.445 4.056 2.149 1.00 . A A . 3 PRO CB 1 1 11 3283 1 1 3 PRO CD C 4.696 1.755 1.549 1.00 . A A . 3 PRO CD 1 1 11 3284 1 1 3 PRO CG C 4.602 2.690 2.723 1.00 . A A . 3 PRO CG 1 1 11 3285 1 1 3 PRO HA H 4.750 4.627 0.100 1.00 . A A . 3 PRO HA 1 1 11 3286 1 1 3 PRO HB2 H 4.851 4.811 2.807 1.00 . A A . 3 PRO HB2 1 1 11 3287 1 1 3 PRO HB3 H 3.410 4.276 1.934 1.00 . A A . 3 PRO HB3 1 1 11 3288 1 1 3 PRO HD2 H 5.363 0.936 1.772 1.00 . A A . 3 PRO HD2 1 1 11 3289 1 1 3 PRO HD3 H 3.717 1.386 1.282 1.00 . A A . 3 PRO HD3 1 1 11 3290 1 1 3 PRO HG2 H 5.504 2.642 3.314 1.00 . A A . 3 PRO HG2 1 1 11 3291 1 1 3 PRO HG3 H 3.742 2.446 3.329 1.00 . A A . 3 PRO HG3 1 1 11 3292 1 1 3 PRO N N 5.246 2.605 0.480 1.00 . A A . 3 PRO N 1 1 11 3293 1 1 3 PRO O O 7.641 3.844 0.906 1.00 . A A . 3 PRO O 1 1 11 3294 1 1 4 LYS C C 8.137 6.921 3.165 1.00 . A A . 4 LYS C 1 1 11 3295 1 1 4 LYS CA C 8.032 6.467 1.713 1.00 . A A . 4 LYS CA 1 1 11 3296 1 1 4 LYS CB C 8.227 7.663 0.778 1.00 . A A . 4 LYS CB 1 1 11 3297 1 1 4 LYS CD C 7.074 9.650 -0.237 1.00 . A A . 4 LYS CD 1 1 11 3298 1 1 4 LYS CE C 8.138 9.801 -1.314 1.00 . A A . 4 LYS CE 1 1 11 3299 1 1 4 LYS CG C 6.929 8.203 0.203 1.00 . A A . 4 LYS CG 1 1 11 3300 1 1 4 LYS H H 5.922 6.354 1.576 1.00 . A A . 4 LYS H 1 1 11 3301 1 1 4 LYS HA H 8.805 5.739 1.519 1.00 . A A . 4 LYS HA 1 1 11 3302 1 1 4 LYS HB2 H 8.712 8.457 1.326 1.00 . A A . 4 LYS HB2 1 1 11 3303 1 1 4 LYS HB3 H 8.863 7.363 -0.042 1.00 . A A . 4 LYS HB3 1 1 11 3304 1 1 4 LYS HD2 H 6.129 9.994 -0.631 1.00 . A A . 4 LYS HD2 1 1 11 3305 1 1 4 LYS HD3 H 7.351 10.251 0.617 1.00 . A A . 4 LYS HD3 1 1 11 3306 1 1 4 LYS HE2 H 9.081 10.026 -0.840 1.00 . A A . 4 LYS HE2 1 1 11 3307 1 1 4 LYS HE3 H 8.219 8.870 -1.854 1.00 . A A . 4 LYS HE3 1 1 11 3308 1 1 4 LYS HG2 H 6.648 7.605 -0.651 1.00 . A A . 4 LYS HG2 1 1 11 3309 1 1 4 LYS HG3 H 6.158 8.141 0.958 1.00 . A A . 4 LYS HG3 1 1 11 3310 1 1 4 LYS HZ1 H 8.275 11.774 -1.986 1.00 . A A . 4 LYS HZ1 1 1 11 3311 1 1 4 LYS HZ2 H 6.778 11.048 -2.293 1.00 . A A . 4 LYS HZ2 1 1 11 3312 1 1 4 LYS HZ3 H 8.126 10.636 -3.229 1.00 . A A . 4 LYS HZ3 1 1 11 3313 1 1 4 LYS N N 6.744 5.831 1.459 1.00 . A A . 4 LYS N 1 1 11 3314 1 1 4 LYS NZ N 7.806 10.891 -2.273 1.00 . A A . 4 LYS NZ 1 1 11 3315 1 1 4 LYS O O 8.673 7.991 3.454 1.00 . A A . 4 LYS O 1 1 11 3316 1 1 5 LEU C C 9.034 6.952 5.901 1.00 . A A . 5 LEU C 1 1 11 3317 1 1 5 LEU CA C 7.664 6.416 5.499 1.00 . A A . 5 LEU CA 1 1 11 3318 1 1 5 LEU CB C 7.326 5.175 6.327 1.00 . A A . 5 LEU CB 1 1 11 3319 1 1 5 LEU CD1 C 5.408 3.756 7.096 1.00 . A A . 5 LEU CD1 1 1 11 3320 1 1 5 LEU CD2 C 6.040 5.804 8.385 1.00 . A A . 5 LEU CD2 1 1 11 3321 1 1 5 LEU CG C 5.955 5.172 7.003 1.00 . A A . 5 LEU CG 1 1 11 3322 1 1 5 LEU H H 7.212 5.261 3.785 1.00 . A A . 5 LEU H 1 1 11 3323 1 1 5 LEU HA H 6.923 7.178 5.689 1.00 . A A . 5 LEU HA 1 1 11 3324 1 1 5 LEU HB2 H 7.374 4.318 5.673 1.00 . A A . 5 LEU HB2 1 1 11 3325 1 1 5 LEU HB3 H 8.077 5.079 7.099 1.00 . A A . 5 LEU HB3 1 1 11 3326 1 1 5 LEU HD11 H 4.537 3.747 7.733 1.00 . A A . 5 LEU HD11 1 1 11 3327 1 1 5 LEU HD12 H 6.164 3.105 7.509 1.00 . A A . 5 LEU HD12 1 1 11 3328 1 1 5 LEU HD13 H 5.136 3.410 6.109 1.00 . A A . 5 LEU HD13 1 1 11 3329 1 1 5 LEU HD21 H 6.711 6.649 8.353 1.00 . A A . 5 LEU HD21 1 1 11 3330 1 1 5 LEU HD22 H 6.412 5.076 9.091 1.00 . A A . 5 LEU HD22 1 1 11 3331 1 1 5 LEU HD23 H 5.059 6.134 8.691 1.00 . A A . 5 LEU HD23 1 1 11 3332 1 1 5 LEU HG H 5.266 5.757 6.409 1.00 . A A . 5 LEU HG 1 1 11 3333 1 1 5 LEU N N 7.625 6.100 4.076 1.00 . A A . 5 LEU N 1 1 11 3334 1 1 5 LEU O O 9.138 7.888 6.695 1.00 . A A . 5 LEU O 1 1 11 3335 1 1 6 PHE C C 12.185 7.175 4.373 1.00 . A A . 6 PHE C 1 1 11 3336 1 1 6 PHE CA C 11.448 6.772 5.646 1.00 . A A . 6 PHE CA 1 1 11 3337 1 1 6 PHE CB C 12.206 5.646 6.352 1.00 . A A . 6 PHE CB 1 1 11 3338 1 1 6 PHE CD1 C 14.535 6.104 7.165 1.00 . A A . 6 PHE CD1 1 1 11 3339 1 1 6 PHE CD2 C 12.708 6.621 8.609 1.00 . A A . 6 PHE CD2 1 1 11 3340 1 1 6 PHE CE1 C 15.424 6.553 8.124 1.00 . A A . 6 PHE CE1 1 1 11 3341 1 1 6 PHE CE2 C 13.593 7.072 9.571 1.00 . A A . 6 PHE CE2 1 1 11 3342 1 1 6 PHE CG C 13.169 6.134 7.396 1.00 . A A . 6 PHE CG 1 1 11 3343 1 1 6 PHE CZ C 14.952 7.036 9.328 1.00 . A A . 6 PHE CZ 1 1 11 3344 1 1 6 PHE H H 9.936 5.613 4.721 1.00 . A A . 6 PHE H 1 1 11 3345 1 1 6 PHE HA H 11.396 7.626 6.303 1.00 . A A . 6 PHE HA 1 1 11 3346 1 1 6 PHE HB2 H 11.495 4.992 6.837 1.00 . A A . 6 PHE HB2 1 1 11 3347 1 1 6 PHE HB3 H 12.765 5.083 5.620 1.00 . A A . 6 PHE HB3 1 1 11 3348 1 1 6 PHE HD1 H 14.905 5.726 6.223 1.00 . A A . 6 PHE HD1 1 1 11 3349 1 1 6 PHE HD2 H 11.646 6.648 8.800 1.00 . A A . 6 PHE HD2 1 1 11 3350 1 1 6 PHE HE1 H 16.486 6.524 7.931 1.00 . A A . 6 PHE HE1 1 1 11 3351 1 1 6 PHE HE2 H 13.222 7.449 10.512 1.00 . A A . 6 PHE HE2 1 1 11 3352 1 1 6 PHE HZ H 15.645 7.388 10.078 1.00 . A A . 6 PHE HZ 1 1 11 3353 1 1 6 PHE N N 10.083 6.354 5.347 1.00 . A A . 6 PHE N 1 1 11 3354 1 1 6 PHE O O 13.283 7.729 4.427 1.00 . A A . 6 PHE O 1 1 11 3355 1 1 7 ALA C C 12.169 8.734 1.709 1.00 . A A . 7 ALA C 1 1 11 3356 1 1 7 ALA CA C 12.170 7.226 1.940 1.00 . A A . 7 ALA CA 1 1 11 3357 1 1 7 ALA CB C 11.429 6.518 0.815 1.00 . A A . 7 ALA CB 1 1 11 3358 1 1 7 ALA H H 10.700 6.450 3.249 1.00 . A A . 7 ALA H 1 1 11 3359 1 1 7 ALA HA H 13.191 6.873 1.943 1.00 . A A . 7 ALA HA 1 1 11 3360 1 1 7 ALA HB1 H 10.834 7.236 0.269 1.00 . A A . 7 ALA HB1 1 1 11 3361 1 1 7 ALA HB2 H 12.143 6.059 0.148 1.00 . A A . 7 ALA HB2 1 1 11 3362 1 1 7 ALA HB3 H 10.785 5.758 1.232 1.00 . A A . 7 ALA HB3 1 1 11 3363 1 1 7 ALA N N 11.574 6.892 3.227 1.00 . A A . 7 ALA N 1 1 11 3364 1 1 7 ALA O O 13.027 9.265 1.003 1.00 . A A . 7 ALA O 1 1 11 3365 1 1 8 LYS C C 11.905 11.581 3.240 1.00 . A A . 8 LYS C 1 1 11 3366 1 1 8 LYS CA C 11.088 10.866 2.168 1.00 . A A . 8 LYS CA 1 1 11 3367 1 1 8 LYS CB C 9.622 11.295 2.259 1.00 . A A . 8 LYS CB 1 1 11 3368 1 1 8 LYS CD C 7.503 10.630 3.432 1.00 . A A . 8 LYS CD 1 1 11 3369 1 1 8 LYS CE C 6.717 11.805 2.872 1.00 . A A . 8 LYS CE 1 1 11 3370 1 1 8 LYS CG C 8.975 10.971 3.594 1.00 . A A . 8 LYS CG 1 1 11 3371 1 1 8 LYS H H 10.546 8.939 2.858 1.00 . A A . 8 LYS H 1 1 11 3372 1 1 8 LYS HA H 11.475 11.137 1.198 1.00 . A A . 8 LYS HA 1 1 11 3373 1 1 8 LYS HB2 H 9.561 12.362 2.102 1.00 . A A . 8 LYS HB2 1 1 11 3374 1 1 8 LYS HB3 H 9.064 10.793 1.481 1.00 . A A . 8 LYS HB3 1 1 11 3375 1 1 8 LYS HD2 H 7.409 9.793 2.756 1.00 . A A . 8 LYS HD2 1 1 11 3376 1 1 8 LYS HD3 H 7.096 10.363 4.397 1.00 . A A . 8 LYS HD3 1 1 11 3377 1 1 8 LYS HE2 H 6.982 12.694 3.423 1.00 . A A . 8 LYS HE2 1 1 11 3378 1 1 8 LYS HE3 H 6.979 11.934 1.832 1.00 . A A . 8 LYS HE3 1 1 11 3379 1 1 8 LYS HG2 H 9.483 10.127 4.035 1.00 . A A . 8 LYS HG2 1 1 11 3380 1 1 8 LYS HG3 H 9.067 11.829 4.245 1.00 . A A . 8 LYS HG3 1 1 11 3381 1 1 8 LYS HZ1 H 4.770 12.486 3.202 1.00 . A A . 8 LYS HZ1 1 1 11 3382 1 1 8 LYS HZ2 H 5.040 10.902 3.729 1.00 . A A . 8 LYS HZ2 1 1 11 3383 1 1 8 LYS HZ3 H 4.873 11.227 2.077 1.00 . A A . 8 LYS HZ3 1 1 11 3384 1 1 8 LYS N N 11.201 9.419 2.308 1.00 . A A . 8 LYS N 1 1 11 3385 1 1 8 LYS NZ N 5.247 11.589 2.977 1.00 . A A . 8 LYS NZ 1 1 11 3386 1 1 8 LYS O O 12.536 12.604 2.973 1.00 . A A . 8 LYS O 1 1 11 3387 1 1 9 ILE C C 14.135 11.524 5.330 1.00 . A A . 9 ILE C 1 1 11 3388 1 1 9 ILE CA C 12.631 11.620 5.562 1.00 . A A . 9 ILE CA 1 1 11 3389 1 1 9 ILE CB C 12.284 10.932 6.895 1.00 . A A . 9 ILE CB 1 1 11 3390 1 1 9 ILE CD1 C 14.391 9.800 7.764 1.00 . A A . 9 ILE CD1 1 1 11 3391 1 1 9 ILE CG1 C 13.072 9.630 7.043 1.00 . A A . 9 ILE CG1 1 1 11 3392 1 1 9 ILE CG2 C 10.788 10.665 6.980 1.00 . A A . 9 ILE CG2 1 1 11 3393 1 1 9 ILE H H 11.368 10.220 4.602 1.00 . A A . 9 ILE H 1 1 11 3394 1 1 9 ILE HA H 12.354 12.662 5.634 1.00 . A A . 9 ILE HA 1 1 11 3395 1 1 9 ILE HB H 12.552 11.600 7.700 1.00 . A A . 9 ILE HB 1 1 11 3396 1 1 9 ILE HD11 H 14.736 10.817 7.650 1.00 . A A . 9 ILE HD11 1 1 11 3397 1 1 9 ILE HD12 H 14.260 9.579 8.812 1.00 . A A . 9 ILE HD12 1 1 11 3398 1 1 9 ILE HD13 H 15.121 9.124 7.343 1.00 . A A . 9 ILE HD13 1 1 11 3399 1 1 9 ILE HG12 H 12.481 8.919 7.597 1.00 . A A . 9 ILE HG12 1 1 11 3400 1 1 9 ILE HG13 H 13.280 9.230 6.060 1.00 . A A . 9 ILE HG13 1 1 11 3401 1 1 9 ILE HG21 H 10.596 9.625 6.763 1.00 . A A . 9 ILE HG21 1 1 11 3402 1 1 9 ILE HG22 H 10.438 10.896 7.974 1.00 . A A . 9 ILE HG22 1 1 11 3403 1 1 9 ILE HG23 H 10.271 11.284 6.263 1.00 . A A . 9 ILE HG23 1 1 11 3404 1 1 9 ILE N N 11.889 11.035 4.452 1.00 . A A . 9 ILE N 1 1 11 3405 1 1 9 ILE O O 14.906 12.342 5.833 1.00 . A A . 9 ILE O 1 1 11 3406 1 1 10 THR C C 16.397 11.169 3.077 1.00 . A A . 10 THR C 1 1 11 3407 1 1 10 THR CA C 15.959 10.317 4.262 1.00 . A A . 10 THR CA 1 1 11 3408 1 1 10 THR CB C 16.261 8.837 3.957 1.00 . A A . 10 THR CB 1 1 11 3409 1 1 10 THR CG2 C 16.186 7.997 5.222 1.00 . A A . 10 THR CG2 1 1 11 3410 1 1 10 THR H H 13.884 9.901 4.191 1.00 . A A . 10 THR H 1 1 11 3411 1 1 10 THR HA H 16.530 10.606 5.132 1.00 . A A . 10 THR HA 1 1 11 3412 1 1 10 THR HB H 17.261 8.766 3.553 1.00 . A A . 10 THR HB 1 1 11 3413 1 1 10 THR HG1 H 15.494 7.403 2.842 1.00 . A A . 10 THR HG1 1 1 11 3414 1 1 10 THR HG21 H 16.398 6.965 4.983 1.00 . A A . 10 THR HG21 1 1 11 3415 1 1 10 THR HG22 H 15.196 8.072 5.647 1.00 . A A . 10 THR HG22 1 1 11 3416 1 1 10 THR HG23 H 16.912 8.357 5.936 1.00 . A A . 10 THR HG23 1 1 11 3417 1 1 10 THR N N 14.547 10.520 4.562 1.00 . A A . 10 THR N 1 1 11 3418 1 1 10 THR O O 15.855 11.048 1.978 1.00 . A A . 10 THR O 1 1 11 3419 1 1 10 THR OG1 O 15.330 8.337 2.990 1.00 . A A . 10 THR OG1 1 1 11 3420 1 1 11 LYS C C 19.379 12.646 2.013 1.00 . A A . 11 LYS C 1 1 11 3421 1 1 11 LYS CA C 17.895 12.902 2.256 1.00 . A A . 11 LYS CA 1 1 11 3422 1 1 11 LYS CB C 17.675 14.370 2.630 1.00 . A A . 11 LYS CB 1 1 11 3423 1 1 11 LYS CD C 16.908 14.478 5.019 1.00 . A A . 11 LYS CD 1 1 11 3424 1 1 11 LYS CE C 17.081 15.285 6.297 1.00 . A A . 11 LYS CE 1 1 11 3425 1 1 11 LYS CG C 18.066 14.698 4.061 1.00 . A A . 11 LYS CG 1 1 11 3426 1 1 11 LYS H H 17.774 12.081 4.203 1.00 . A A . 11 LYS H 1 1 11 3427 1 1 11 LYS HA H 17.352 12.686 1.349 1.00 . A A . 11 LYS HA 1 1 11 3428 1 1 11 LYS HB2 H 18.262 14.990 1.968 1.00 . A A . 11 LYS HB2 1 1 11 3429 1 1 11 LYS HB3 H 16.630 14.609 2.501 1.00 . A A . 11 LYS HB3 1 1 11 3430 1 1 11 LYS HD2 H 15.990 14.782 4.538 1.00 . A A . 11 LYS HD2 1 1 11 3431 1 1 11 LYS HD3 H 16.854 13.428 5.271 1.00 . A A . 11 LYS HD3 1 1 11 3432 1 1 11 LYS HE2 H 17.999 15.848 6.230 1.00 . A A . 11 LYS HE2 1 1 11 3433 1 1 11 LYS HE3 H 16.248 15.965 6.394 1.00 . A A . 11 LYS HE3 1 1 11 3434 1 1 11 LYS HG2 H 18.888 14.062 4.355 1.00 . A A . 11 LYS HG2 1 1 11 3435 1 1 11 LYS HG3 H 18.373 15.733 4.112 1.00 . A A . 11 LYS HG3 1 1 11 3436 1 1 11 LYS HZ1 H 16.308 13.783 7.525 1.00 . A A . 11 LYS HZ1 1 1 11 3437 1 1 11 LYS HZ2 H 17.142 14.991 8.364 1.00 . A A . 11 LYS HZ2 1 1 11 3438 1 1 11 LYS HZ3 H 17.999 13.829 7.482 1.00 . A A . 11 LYS HZ3 1 1 11 3439 1 1 11 LYS N N 17.382 12.031 3.305 1.00 . A A . 11 LYS N 1 1 11 3440 1 1 11 LYS NZ N 17.137 14.411 7.502 1.00 . A A . 11 LYS NZ 1 1 11 3441 1 1 11 LYS O O 20.065 13.452 1.384 1.00 . A A . 11 LYS O 1 1 11 3442 1 1 12 LYS C C 21.428 10.053 1.302 1.00 . A A . 12 LYS C 1 1 11 3443 1 1 12 LYS CA C 21.271 11.151 2.349 1.00 . A A . 12 LYS CA 1 1 11 3444 1 1 12 LYS CB C 21.858 10.686 3.683 1.00 . A A . 12 LYS CB 1 1 11 3445 1 1 12 LYS CD C 21.779 10.924 6.183 1.00 . A A . 12 LYS CD 1 1 11 3446 1 1 12 LYS CE C 22.609 12.169 6.452 1.00 . A A . 12 LYS CE 1 1 11 3447 1 1 12 LYS CG C 21.000 11.044 4.884 1.00 . A A . 12 LYS CG 1 1 11 3448 1 1 12 LYS H H 19.273 10.914 3.005 1.00 . A A . 12 LYS H 1 1 11 3449 1 1 12 LYS HA H 21.806 12.028 2.016 1.00 . A A . 12 LYS HA 1 1 11 3450 1 1 12 LYS HB2 H 21.974 9.613 3.657 1.00 . A A . 12 LYS HB2 1 1 11 3451 1 1 12 LYS HB3 H 22.830 11.141 3.814 1.00 . A A . 12 LYS HB3 1 1 11 3452 1 1 12 LYS HD2 H 21.084 10.786 6.998 1.00 . A A . 12 LYS HD2 1 1 11 3453 1 1 12 LYS HD3 H 22.437 10.069 6.119 1.00 . A A . 12 LYS HD3 1 1 11 3454 1 1 12 LYS HE2 H 23.040 12.507 5.522 1.00 . A A . 12 LYS HE2 1 1 11 3455 1 1 12 LYS HE3 H 21.963 12.938 6.849 1.00 . A A . 12 LYS HE3 1 1 11 3456 1 1 12 LYS HG2 H 20.654 12.062 4.777 1.00 . A A . 12 LYS HG2 1 1 11 3457 1 1 12 LYS HG3 H 20.151 10.376 4.920 1.00 . A A . 12 LYS HG3 1 1 11 3458 1 1 12 LYS HZ1 H 24.438 11.314 6.986 1.00 . A A . 12 LYS HZ1 1 1 11 3459 1 1 12 LYS HZ2 H 23.329 11.411 8.260 1.00 . A A . 12 LYS HZ2 1 1 11 3460 1 1 12 LYS HZ3 H 24.134 12.802 7.732 1.00 . A A . 12 LYS HZ3 1 1 11 3461 1 1 12 LYS N N 19.869 11.517 2.513 1.00 . A A . 12 LYS N 1 1 11 3462 1 1 12 LYS NZ N 23.704 11.906 7.426 1.00 . A A . 12 LYS NZ 1 1 11 3463 1 1 12 LYS O O 21.932 10.295 0.206 1.00 . A A . 12 LYS O 1 1 11 3464 1 1 13 ASN C C 20.248 7.952 -0.518 1.00 . A A . 13 ASN C 1 1 11 3465 1 1 13 ASN CA C 21.083 7.711 0.736 1.00 . A A . 13 ASN CA 1 1 11 3466 1 1 13 ASN CB C 20.618 6.432 1.434 1.00 . A A . 13 ASN CB 1 1 11 3467 1 1 13 ASN CG C 21.745 5.436 1.627 1.00 . A A . 13 ASN CG 1 1 11 3468 1 1 13 ASN H H 20.599 8.715 2.535 1.00 . A A . 13 ASN H 1 1 11 3469 1 1 13 ASN HA H 22.118 7.599 0.450 1.00 . A A . 13 ASN HA 1 1 11 3470 1 1 13 ASN HB2 H 20.217 6.684 2.405 1.00 . A A . 13 ASN HB2 1 1 11 3471 1 1 13 ASN HB3 H 19.846 5.964 0.841 1.00 . A A . 13 ASN HB3 1 1 11 3472 1 1 13 ASN HD21 H 22.029 5.340 -0.339 1.00 . A A . 13 ASN HD21 1 1 11 3473 1 1 13 ASN HD22 H 23.075 4.355 0.620 1.00 . A A . 13 ASN HD22 1 1 11 3474 1 1 13 ASN N N 20.991 8.846 1.647 1.00 . A A . 13 ASN N 1 1 11 3475 1 1 13 ASN ND2 N 22.344 5.000 0.524 1.00 . A A . 13 ASN ND2 1 1 11 3476 1 1 13 ASN O O 20.447 7.300 -1.543 1.00 . A A . 13 ASN O 1 1 11 3477 1 1 13 ASN OD1 O 22.073 5.063 2.753 1.00 . A A . 13 ASN OD1 1 1 11 3478 1 1 14 MET C C 19.273 9.677 -2.757 1.00 . A A . 14 MET C 1 1 11 3479 1 1 14 MET CA C 18.450 9.220 -1.557 1.00 . A A . 14 MET CA 1 1 11 3480 1 1 14 MET CB C 17.453 10.312 -1.163 1.00 . A A . 14 MET CB 1 1 11 3481 1 1 14 MET CE C 14.348 8.652 -2.672 1.00 . A A . 14 MET CE 1 1 11 3482 1 1 14 MET CG C 16.341 10.515 -2.180 1.00 . A A . 14 MET CG 1 1 11 3483 1 1 14 MET H H 19.202 9.379 0.415 1.00 . A A . 14 MET H 1 1 11 3484 1 1 14 MET HA H 17.905 8.328 -1.828 1.00 . A A . 14 MET HA 1 1 11 3485 1 1 14 MET HB2 H 17.003 10.047 -0.218 1.00 . A A . 14 MET HB2 1 1 11 3486 1 1 14 MET HB3 H 17.983 11.245 -1.052 1.00 . A A . 14 MET HB3 1 1 11 3487 1 1 14 MET HE1 H 13.292 8.656 -2.896 1.00 . A A . 14 MET HE1 1 1 11 3488 1 1 14 MET HE2 H 14.911 8.771 -3.586 1.00 . A A . 14 MET HE2 1 1 11 3489 1 1 14 MET HE3 H 14.614 7.715 -2.204 1.00 . A A . 14 MET HE3 1 1 11 3490 1 1 14 MET HG2 H 16.294 11.562 -2.438 1.00 . A A . 14 MET HG2 1 1 11 3491 1 1 14 MET HG3 H 16.571 9.938 -3.063 1.00 . A A . 14 MET HG3 1 1 11 3492 1 1 14 MET N N 19.314 8.892 -0.429 1.00 . A A . 14 MET N 1 1 11 3493 1 1 14 MET O O 19.133 9.143 -3.857 1.00 . A A . 14 MET O 1 1 11 3494 1 1 14 MET SD S 14.728 10.002 -1.557 1.00 . A A . 14 MET SD 1 1 11 3495 1 1 15 ALA C C 22.133 10.246 -3.905 1.00 . A A . 15 ALA C 1 1 11 3496 1 1 15 ALA CA C 20.978 11.194 -3.602 1.00 . A A . 15 ALA CA 1 1 11 3497 1 1 15 ALA CB C 21.508 12.569 -3.222 1.00 . A A . 15 ALA CB 1 1 11 3498 1 1 15 ALA H H 20.198 11.052 -1.640 1.00 . A A . 15 ALA H 1 1 11 3499 1 1 15 ALA HA H 20.371 11.302 -4.489 1.00 . A A . 15 ALA HA 1 1 11 3500 1 1 15 ALA HB1 H 22.565 12.501 -3.012 1.00 . A A . 15 ALA HB1 1 1 11 3501 1 1 15 ALA HB2 H 21.346 13.255 -4.040 1.00 . A A . 15 ALA HB2 1 1 11 3502 1 1 15 ALA HB3 H 20.988 12.926 -2.345 1.00 . A A . 15 ALA HB3 1 1 11 3503 1 1 15 ALA N N 20.132 10.668 -2.538 1.00 . A A . 15 ALA N 1 1 11 3504 1 1 15 ALA O O 22.960 10.517 -4.776 1.00 . A A . 15 ALA O 1 1 11 3505 1 1 16 HIS C C 22.711 6.926 -4.124 1.00 . A A . 16 HIS C 1 1 11 3506 1 1 16 HIS CA C 23.238 8.143 -3.372 1.00 . A A . 16 HIS CA 1 1 11 3507 1 1 16 HIS CB C 23.815 7.713 -2.023 1.00 . A A . 16 HIS CB 1 1 11 3508 1 1 16 HIS CD2 C 25.788 9.346 -1.614 1.00 . A A . 16 HIS CD2 1 1 11 3509 1 1 16 HIS CE1 C 27.421 7.884 -1.622 1.00 . A A . 16 HIS CE1 1 1 11 3510 1 1 16 HIS CG C 25.241 8.126 -1.821 1.00 . A A . 16 HIS CG 1 1 11 3511 1 1 16 HIS H H 21.496 8.973 -2.501 1.00 . A A . 16 HIS H 1 1 11 3512 1 1 16 HIS HA H 24.021 8.602 -3.958 1.00 . A A . 16 HIS HA 1 1 11 3513 1 1 16 HIS HB2 H 23.228 8.154 -1.231 1.00 . A A . 16 HIS HB2 1 1 11 3514 1 1 16 HIS HB3 H 23.766 6.637 -1.944 1.00 . A A . 16 HIS HB3 1 1 11 3515 1 1 16 HIS HD1 H 26.217 6.263 -1.949 1.00 . A A . 16 HIS HD1 1 1 11 3516 1 1 16 HIS HD2 H 25.257 10.286 -1.554 1.00 . A A . 16 HIS HD2 1 1 11 3517 1 1 16 HIS HE1 H 28.406 7.442 -1.573 1.00 . A A . 16 HIS HE1 1 1 11 3518 1 1 16 HIS N N 22.184 9.133 -3.180 1.00 . A A . 16 HIS N 1 1 11 3519 1 1 16 HIS ND1 N 26.290 7.232 -1.822 1.00 . A A . 16 HIS ND1 1 1 11 3520 1 1 16 HIS NE2 N 27.144 9.169 -1.493 1.00 . A A . 16 HIS NE2 1 1 11 3521 1 1 16 HIS O O 23.484 6.136 -4.667 1.00 . A A . 16 HIS O 1 1 11 3522 1 1 17 ILE C C 21.255 5.545 -6.275 1.00 . A A . 17 ILE C 1 1 11 3523 1 1 17 ILE CA C 20.760 5.658 -4.838 1.00 . A A . 17 ILE CA 1 1 11 3524 1 1 17 ILE CB C 19.226 5.792 -4.844 1.00 . A A . 17 ILE CB 1 1 11 3525 1 1 17 ILE CD1 C 17.390 7.443 -5.461 1.00 . A A . 17 ILE CD1 1 1 11 3526 1 1 17 ILE CG1 C 18.798 6.963 -5.732 1.00 . A A . 17 ILE CG1 1 1 11 3527 1 1 17 ILE CG2 C 18.705 5.978 -3.427 1.00 . A A . 17 ILE CG2 1 1 11 3528 1 1 17 ILE H H 20.827 7.442 -3.700 1.00 . A A . 17 ILE H 1 1 11 3529 1 1 17 ILE HA H 21.020 4.754 -4.306 1.00 . A A . 17 ILE HA 1 1 11 3530 1 1 17 ILE HB H 18.809 4.879 -5.239 1.00 . A A . 17 ILE HB 1 1 11 3531 1 1 17 ILE HD11 H 17.347 7.901 -4.484 1.00 . A A . 17 ILE HD11 1 1 11 3532 1 1 17 ILE HD12 H 17.105 8.165 -6.211 1.00 . A A . 17 ILE HD12 1 1 11 3533 1 1 17 ILE HD13 H 16.710 6.603 -5.494 1.00 . A A . 17 ILE HD13 1 1 11 3534 1 1 17 ILE HG12 H 19.468 7.792 -5.571 1.00 . A A . 17 ILE HG12 1 1 11 3535 1 1 17 ILE HG13 H 18.852 6.657 -6.767 1.00 . A A . 17 ILE HG13 1 1 11 3536 1 1 17 ILE HG21 H 18.823 7.010 -3.132 1.00 . A A . 17 ILE HG21 1 1 11 3537 1 1 17 ILE HG22 H 17.659 5.712 -3.391 1.00 . A A . 17 ILE HG22 1 1 11 3538 1 1 17 ILE HG23 H 19.262 5.345 -2.752 1.00 . A A . 17 ILE HG23 1 1 11 3539 1 1 17 ILE N N 21.390 6.779 -4.152 1.00 . A A . 17 ILE N 1 1 11 3540 1 1 17 ILE O O 21.484 4.445 -6.779 1.00 . A A . 17 ILE O 1 1 11 3541 1 1 18 ARG C C 23.414 6.686 -8.367 1.00 . A A . 18 ARG C 1 1 11 3542 1 1 18 ARG CA C 21.890 6.720 -8.310 1.00 . A A . 18 ARG CA 1 1 11 3543 1 1 18 ARG CB C 21.370 7.970 -9.021 1.00 . A A . 18 ARG CB 1 1 11 3544 1 1 18 ARG CD C 20.683 7.790 -11.432 1.00 . A A . 18 ARG CD 1 1 11 3545 1 1 18 ARG CG C 20.228 7.693 -9.984 1.00 . A A . 18 ARG CG 1 1 11 3546 1 1 18 ARG CZ C 21.301 9.542 -13.043 1.00 . A A . 18 ARG CZ 1 1 11 3547 1 1 18 ARG H H 21.222 7.535 -6.475 1.00 . A A . 18 ARG H 1 1 11 3548 1 1 18 ARG HA H 21.503 5.845 -8.811 1.00 . A A . 18 ARG HA 1 1 11 3549 1 1 18 ARG HB2 H 21.023 8.674 -8.279 1.00 . A A . 18 ARG HB2 1 1 11 3550 1 1 18 ARG HB3 H 22.181 8.417 -9.577 1.00 . A A . 18 ARG HB3 1 1 11 3551 1 1 18 ARG HD2 H 21.531 7.137 -11.573 1.00 . A A . 18 ARG HD2 1 1 11 3552 1 1 18 ARG HD3 H 19.874 7.472 -12.072 1.00 . A A . 18 ARG HD3 1 1 11 3553 1 1 18 ARG HE H 21.158 9.806 -11.071 1.00 . A A . 18 ARG HE 1 1 11 3554 1 1 18 ARG HG2 H 19.850 6.697 -9.804 1.00 . A A . 18 ARG HG2 1 1 11 3555 1 1 18 ARG HG3 H 19.442 8.415 -9.814 1.00 . A A . 18 ARG HG3 1 1 11 3556 1 1 18 ARG HH11 H 20.926 7.732 -13.857 1.00 . A A . 18 ARG HH11 1 1 11 3557 1 1 18 ARG HH12 H 21.362 8.975 -14.982 1.00 . A A . 18 ARG HH12 1 1 11 3558 1 1 18 ARG HH21 H 21.734 11.451 -12.541 1.00 . A A . 18 ARG HH21 1 1 11 3559 1 1 18 ARG HH22 H 21.823 11.091 -14.232 1.00 . A A . 18 ARG HH22 1 1 11 3560 1 1 18 ARG N N 21.421 6.690 -6.930 1.00 . A A . 18 ARG N 1 1 11 3561 1 1 18 ARG NE N 21.069 9.151 -11.794 1.00 . A A . 18 ARG NE 1 1 11 3562 1 1 18 ARG NH1 N 21.188 8.679 -14.043 1.00 . A A . 18 ARG NH1 1 1 11 3563 1 1 18 ARG NH2 N 21.648 10.798 -13.293 1.00 . A A . 18 ARG NH2 1 1 11 3564 1 1 18 ARG O O 24.077 7.689 -8.106 1.00 . A A . 18 ARG O 1 1 12 3565 1 1 1 PHE C C 3.335 1.914 -2.398 1.00 . A A . 1 PHE C 1 1 12 3566 1 1 1 PHE CA C 2.372 2.943 -2.984 1.00 . A A . 1 PHE CA 1 1 12 3567 1 1 1 PHE CB C 2.502 2.969 -4.509 1.00 . A A . 1 PHE CB 1 1 12 3568 1 1 1 PHE CD1 C 0.723 2.190 -6.098 1.00 . A A . 1 PHE CD1 1 1 12 3569 1 1 1 PHE CD2 C 0.426 4.289 -5.006 1.00 . A A . 1 PHE CD2 1 1 12 3570 1 1 1 PHE CE1 C -0.483 2.355 -6.752 1.00 . A A . 1 PHE CE1 1 1 12 3571 1 1 1 PHE CE2 C -0.781 4.460 -5.657 1.00 . A A . 1 PHE CE2 1 1 12 3572 1 1 1 PHE CG C 1.191 3.153 -5.218 1.00 . A A . 1 PHE CG 1 1 12 3573 1 1 1 PHE CZ C -1.235 3.493 -6.532 1.00 . A A . 1 PHE CZ 1 1 12 3574 1 1 1 PHE H1 H 2.485 4.423 -1.474 1.00 . A A . 1 PHE H1 1 1 12 3575 1 1 1 PHE HA H 1.364 2.664 -2.722 1.00 . A A . 1 PHE HA 1 1 12 3576 1 1 1 PHE HB2 H 3.150 3.784 -4.794 1.00 . A A . 1 PHE HB2 1 1 12 3577 1 1 1 PHE HB3 H 2.933 2.038 -4.842 1.00 . A A . 1 PHE HB3 1 1 12 3578 1 1 1 PHE HD1 H 1.312 1.300 -6.271 1.00 . A A . 1 PHE HD1 1 1 12 3579 1 1 1 PHE HD2 H 0.781 5.046 -4.323 1.00 . A A . 1 PHE HD2 1 1 12 3580 1 1 1 PHE HE1 H -0.835 1.597 -7.436 1.00 . A A . 1 PHE HE1 1 1 12 3581 1 1 1 PHE HE2 H -1.367 5.350 -5.484 1.00 . A A . 1 PHE HE2 1 1 12 3582 1 1 1 PHE HZ H -2.178 3.624 -7.042 1.00 . A A . 1 PHE HZ 1 1 12 3583 1 1 1 PHE N N 2.628 4.268 -2.432 1.00 . A A . 1 PHE N 1 1 12 3584 1 1 1 PHE O O 3.012 0.730 -2.301 1.00 . A A . 1 PHE O 1 1 12 3585 1 1 2 LEU C C 5.927 1.963 -0.038 1.00 . A A . 2 LEU C 1 1 12 3586 1 1 2 LEU CA C 5.531 1.496 -1.435 1.00 . A A . 2 LEU CA 1 1 12 3587 1 1 2 LEU CB C 6.766 1.447 -2.337 1.00 . A A . 2 LEU CB 1 1 12 3588 1 1 2 LEU CD1 C 8.606 2.960 -3.116 1.00 . A A . 2 LEU CD1 1 1 12 3589 1 1 2 LEU CD2 C 6.538 2.697 -4.498 1.00 . A A . 2 LEU CD2 1 1 12 3590 1 1 2 LEU CG C 7.102 2.737 -3.085 1.00 . A A . 2 LEU CG 1 1 12 3591 1 1 2 LEU H H 4.719 3.328 -2.114 1.00 . A A . 2 LEU H 1 1 12 3592 1 1 2 LEU HA H 5.108 0.505 -1.364 1.00 . A A . 2 LEU HA 1 1 12 3593 1 1 2 LEU HB2 H 7.615 1.191 -1.722 1.00 . A A . 2 LEU HB2 1 1 12 3594 1 1 2 LEU HB3 H 6.607 0.669 -3.071 1.00 . A A . 2 LEU HB3 1 1 12 3595 1 1 2 LEU HD11 H 8.827 3.849 -3.687 1.00 . A A . 2 LEU HD11 1 1 12 3596 1 1 2 LEU HD12 H 9.086 2.109 -3.575 1.00 . A A . 2 LEU HD12 1 1 12 3597 1 1 2 LEU HD13 H 8.973 3.079 -2.107 1.00 . A A . 2 LEU HD13 1 1 12 3598 1 1 2 LEU HD21 H 7.307 2.374 -5.183 1.00 . A A . 2 LEU HD21 1 1 12 3599 1 1 2 LEU HD22 H 6.197 3.683 -4.778 1.00 . A A . 2 LEU HD22 1 1 12 3600 1 1 2 LEU HD23 H 5.709 2.005 -4.535 1.00 . A A . 2 LEU HD23 1 1 12 3601 1 1 2 LEU HG H 6.652 3.573 -2.568 1.00 . A A . 2 LEU HG 1 1 12 3602 1 1 2 LEU N N 4.520 2.375 -2.011 1.00 . A A . 2 LEU N 1 1 12 3603 1 1 2 LEU O O 5.725 3.118 0.338 1.00 . A A . 2 LEU O 1 1 12 3604 1 1 3 PRO C C 8.150 2.272 2.152 1.00 . A A . 3 PRO C 1 1 12 3605 1 1 3 PRO CA C 6.943 1.340 2.119 1.00 . A A . 3 PRO CA 1 1 12 3606 1 1 3 PRO CB C 7.315 -0.036 2.677 1.00 . A A . 3 PRO CB 1 1 12 3607 1 1 3 PRO CD C 6.776 -0.351 0.370 1.00 . A A . 3 PRO CD 1 1 12 3608 1 1 3 PRO CG C 7.660 -0.850 1.478 1.00 . A A . 3 PRO CG 1 1 12 3609 1 1 3 PRO HA H 6.145 1.766 2.708 1.00 . A A . 3 PRO HA 1 1 12 3610 1 1 3 PRO HB2 H 8.158 0.060 3.347 1.00 . A A . 3 PRO HB2 1 1 12 3611 1 1 3 PRO HB3 H 6.472 -0.452 3.208 1.00 . A A . 3 PRO HB3 1 1 12 3612 1 1 3 PRO HD2 H 7.294 -0.399 -0.577 1.00 . A A . 3 PRO HD2 1 1 12 3613 1 1 3 PRO HD3 H 5.861 -0.924 0.330 1.00 . A A . 3 PRO HD3 1 1 12 3614 1 1 3 PRO HG2 H 8.699 -0.706 1.223 1.00 . A A . 3 PRO HG2 1 1 12 3615 1 1 3 PRO HG3 H 7.462 -1.894 1.674 1.00 . A A . 3 PRO HG3 1 1 12 3616 1 1 3 PRO N N 6.505 1.045 0.751 1.00 . A A . 3 PRO N 1 1 12 3617 1 1 3 PRO O O 9.289 1.836 1.985 1.00 . A A . 3 PRO O 1 1 12 3618 1 1 4 LYS C C 9.002 5.224 3.795 1.00 . A A . 4 LYS C 1 1 12 3619 1 1 4 LYS CA C 8.958 4.552 2.427 1.00 . A A . 4 LYS CA 1 1 12 3620 1 1 4 LYS CB C 8.759 5.606 1.335 1.00 . A A . 4 LYS CB 1 1 12 3621 1 1 4 LYS CD C 7.034 7.097 0.281 1.00 . A A . 4 LYS CD 1 1 12 3622 1 1 4 LYS CE C 7.920 7.398 -0.918 1.00 . A A . 4 LYS CE 1 1 12 3623 1 1 4 LYS CG C 7.323 5.720 0.854 1.00 . A A . 4 LYS CG 1 1 12 3624 1 1 4 LYS H H 6.964 3.844 2.495 1.00 . A A . 4 LYS H 1 1 12 3625 1 1 4 LYS HA H 9.896 4.044 2.259 1.00 . A A . 4 LYS HA 1 1 12 3626 1 1 4 LYS HB2 H 9.066 6.567 1.720 1.00 . A A . 4 LYS HB2 1 1 12 3627 1 1 4 LYS HB3 H 9.381 5.352 0.489 1.00 . A A . 4 LYS HB3 1 1 12 3628 1 1 4 LYS HD2 H 6.001 7.139 -0.030 1.00 . A A . 4 LYS HD2 1 1 12 3629 1 1 4 LYS HD3 H 7.213 7.840 1.045 1.00 . A A . 4 LYS HD3 1 1 12 3630 1 1 4 LYS HE2 H 8.589 8.206 -0.662 1.00 . A A . 4 LYS HE2 1 1 12 3631 1 1 4 LYS HE3 H 8.497 6.516 -1.154 1.00 . A A . 4 LYS HE3 1 1 12 3632 1 1 4 LYS HG2 H 7.149 4.979 0.088 1.00 . A A . 4 LYS HG2 1 1 12 3633 1 1 4 LYS HG3 H 6.659 5.541 1.688 1.00 . A A . 4 LYS HG3 1 1 12 3634 1 1 4 LYS HZ1 H 7.008 8.823 -2.143 1.00 . A A . 4 LYS HZ1 1 1 12 3635 1 1 4 LYS HZ2 H 6.182 7.349 -2.074 1.00 . A A . 4 LYS HZ2 1 1 12 3636 1 1 4 LYS HZ3 H 7.604 7.480 -2.981 1.00 . A A . 4 LYS HZ3 1 1 12 3637 1 1 4 LYS N N 7.893 3.557 2.369 1.00 . A A . 4 LYS N 1 1 12 3638 1 1 4 LYS NZ N 7.123 7.790 -2.113 1.00 . A A . 4 LYS NZ 1 1 12 3639 1 1 4 LYS O O 9.279 6.419 3.903 1.00 . A A . 4 LYS O 1 1 12 3640 1 1 5 LEU C C 9.951 5.863 6.435 1.00 . A A . 5 LEU C 1 1 12 3641 1 1 5 LEU CA C 8.737 4.970 6.202 1.00 . A A . 5 LEU CA 1 1 12 3642 1 1 5 LEU CB C 8.736 3.818 7.208 1.00 . A A . 5 LEU CB 1 1 12 3643 1 1 5 LEU CD1 C 8.399 1.457 6.436 1.00 . A A . 5 LEU CD1 1 1 12 3644 1 1 5 LEU CD2 C 6.938 2.403 8.232 1.00 . A A . 5 LEU CD2 1 1 12 3645 1 1 5 LEU CG C 7.712 2.710 6.959 1.00 . A A . 5 LEU CG 1 1 12 3646 1 1 5 LEU H H 8.513 3.505 4.691 1.00 . A A . 5 LEU H 1 1 12 3647 1 1 5 LEU HA H 7.841 5.557 6.338 1.00 . A A . 5 LEU HA 1 1 12 3648 1 1 5 LEU HB2 H 9.717 3.370 7.199 1.00 . A A . 5 LEU HB2 1 1 12 3649 1 1 5 LEU HB3 H 8.541 4.235 8.187 1.00 . A A . 5 LEU HB3 1 1 12 3650 1 1 5 LEU HD11 H 8.634 0.804 7.262 1.00 . A A . 5 LEU HD11 1 1 12 3651 1 1 5 LEU HD12 H 9.309 1.733 5.924 1.00 . A A . 5 LEU HD12 1 1 12 3652 1 1 5 LEU HD13 H 7.741 0.947 5.748 1.00 . A A . 5 LEU HD13 1 1 12 3653 1 1 5 LEU HD21 H 6.306 3.243 8.480 1.00 . A A . 5 LEU HD21 1 1 12 3654 1 1 5 LEU HD22 H 7.631 2.223 9.041 1.00 . A A . 5 LEU HD22 1 1 12 3655 1 1 5 LEU HD23 H 6.327 1.525 8.079 1.00 . A A . 5 LEU HD23 1 1 12 3656 1 1 5 LEU HG H 7.007 3.041 6.209 1.00 . A A . 5 LEU HG 1 1 12 3657 1 1 5 LEU N N 8.727 4.449 4.839 1.00 . A A . 5 LEU N 1 1 12 3658 1 1 5 LEU O O 9.862 6.883 7.119 1.00 . A A . 5 LEU O 1 1 12 3659 1 1 6 PHE C C 12.864 6.651 4.641 1.00 . A A . 6 PHE C 1 1 12 3660 1 1 6 PHE CA C 12.317 6.240 6.005 1.00 . A A . 6 PHE CA 1 1 12 3661 1 1 6 PHE CB C 13.365 5.423 6.763 1.00 . A A . 6 PHE CB 1 1 12 3662 1 1 6 PHE CD1 C 15.554 6.509 7.334 1.00 . A A . 6 PHE CD1 1 1 12 3663 1 1 6 PHE CD2 C 13.729 6.774 8.846 1.00 . A A . 6 PHE CD2 1 1 12 3664 1 1 6 PHE CE1 C 16.355 7.272 8.162 1.00 . A A . 6 PHE CE1 1 1 12 3665 1 1 6 PHE CE2 C 14.526 7.537 9.678 1.00 . A A . 6 PHE CE2 1 1 12 3666 1 1 6 PHE CG C 14.233 6.252 7.666 1.00 . A A . 6 PHE CG 1 1 12 3667 1 1 6 PHE CZ C 15.841 7.785 9.336 1.00 . A A . 6 PHE CZ 1 1 12 3668 1 1 6 PHE H H 11.092 4.652 5.327 1.00 . A A . 6 PHE H 1 1 12 3669 1 1 6 PHE HA H 12.088 7.130 6.570 1.00 . A A . 6 PHE HA 1 1 12 3670 1 1 6 PHE HB2 H 12.864 4.685 7.371 1.00 . A A . 6 PHE HB2 1 1 12 3671 1 1 6 PHE HB3 H 14.004 4.924 6.052 1.00 . A A . 6 PHE HB3 1 1 12 3672 1 1 6 PHE HD1 H 15.957 6.107 6.415 1.00 . A A . 6 PHE HD1 1 1 12 3673 1 1 6 PHE HD2 H 12.701 6.580 9.115 1.00 . A A . 6 PHE HD2 1 1 12 3674 1 1 6 PHE HE1 H 17.383 7.463 7.892 1.00 . A A . 6 PHE HE1 1 1 12 3675 1 1 6 PHE HE2 H 14.121 7.938 10.596 1.00 . A A . 6 PHE HE2 1 1 12 3676 1 1 6 PHE HZ H 16.465 8.382 9.984 1.00 . A A . 6 PHE HZ 1 1 12 3677 1 1 6 PHE N N 11.084 5.474 5.861 1.00 . A A . 6 PHE N 1 1 12 3678 1 1 6 PHE O O 13.800 7.445 4.550 1.00 . A A . 6 PHE O 1 1 12 3679 1 1 7 ALA C C 12.289 7.827 1.829 1.00 . A A . 7 ALA C 1 1 12 3680 1 1 7 ALA CA C 12.701 6.413 2.225 1.00 . A A . 7 ALA CA 1 1 12 3681 1 1 7 ALA CB C 12.125 5.400 1.247 1.00 . A A . 7 ALA CB 1 1 12 3682 1 1 7 ALA H H 11.533 5.478 3.721 1.00 . A A . 7 ALA H 1 1 12 3683 1 1 7 ALA HA H 13.779 6.339 2.189 1.00 . A A . 7 ALA HA 1 1 12 3684 1 1 7 ALA HB1 H 11.774 4.535 1.791 1.00 . A A . 7 ALA HB1 1 1 12 3685 1 1 7 ALA HB2 H 11.302 5.846 0.710 1.00 . A A . 7 ALA HB2 1 1 12 3686 1 1 7 ALA HB3 H 12.891 5.099 0.548 1.00 . A A . 7 ALA HB3 1 1 12 3687 1 1 7 ALA N N 12.274 6.103 3.584 1.00 . A A . 7 ALA N 1 1 12 3688 1 1 7 ALA O O 12.943 8.467 1.005 1.00 . A A . 7 ALA O 1 1 12 3689 1 1 8 LYS C C 11.345 10.680 3.050 1.00 . A A . 8 LYS C 1 1 12 3690 1 1 8 LYS CA C 10.702 9.648 2.130 1.00 . A A . 8 LYS CA 1 1 12 3691 1 1 8 LYS CB C 9.180 9.690 2.283 1.00 . A A . 8 LYS CB 1 1 12 3692 1 1 8 LYS CD C 7.807 10.331 4.287 1.00 . A A . 8 LYS CD 1 1 12 3693 1 1 8 LYS CE C 6.420 10.337 3.664 1.00 . A A . 8 LYS CE 1 1 12 3694 1 1 8 LYS CG C 8.695 9.269 3.659 1.00 . A A . 8 LYS CG 1 1 12 3695 1 1 8 LYS H H 10.723 7.750 3.069 1.00 . A A . 8 LYS H 1 1 12 3696 1 1 8 LYS HA H 10.959 9.884 1.108 1.00 . A A . 8 LYS HA 1 1 12 3697 1 1 8 LYS HB2 H 8.840 10.698 2.097 1.00 . A A . 8 LYS HB2 1 1 12 3698 1 1 8 LYS HB3 H 8.738 9.030 1.551 1.00 . A A . 8 LYS HB3 1 1 12 3699 1 1 8 LYS HD2 H 7.714 10.131 5.344 1.00 . A A . 8 LYS HD2 1 1 12 3700 1 1 8 LYS HD3 H 8.262 11.300 4.140 1.00 . A A . 8 LYS HD3 1 1 12 3701 1 1 8 LYS HE2 H 6.212 9.354 3.269 1.00 . A A . 8 LYS HE2 1 1 12 3702 1 1 8 LYS HE3 H 5.697 10.576 4.430 1.00 . A A . 8 LYS HE3 1 1 12 3703 1 1 8 LYS HG2 H 8.131 8.352 3.567 1.00 . A A . 8 LYS HG2 1 1 12 3704 1 1 8 LYS HG3 H 9.551 9.105 4.298 1.00 . A A . 8 LYS HG3 1 1 12 3705 1 1 8 LYS HZ1 H 5.435 11.888 2.671 1.00 . A A . 8 LYS HZ1 1 1 12 3706 1 1 8 LYS HZ2 H 6.290 10.852 1.644 1.00 . A A . 8 LYS HZ2 1 1 12 3707 1 1 8 LYS HZ3 H 7.122 11.983 2.587 1.00 . A A . 8 LYS HZ3 1 1 12 3708 1 1 8 LYS N N 11.202 8.309 2.420 1.00 . A A . 8 LYS N 1 1 12 3709 1 1 8 LYS NZ N 6.309 11.335 2.564 1.00 . A A . 8 LYS NZ 1 1 12 3710 1 1 8 LYS O O 11.571 11.823 2.654 1.00 . A A . 8 LYS O 1 1 12 3711 1 1 9 ILE C C 13.728 11.397 4.924 1.00 . A A . 9 ILE C 1 1 12 3712 1 1 9 ILE CA C 12.258 11.157 5.254 1.00 . A A . 9 ILE CA 1 1 12 3713 1 1 9 ILE CB C 12.150 10.590 6.682 1.00 . A A . 9 ILE CB 1 1 12 3714 1 1 9 ILE CD1 C 14.513 10.178 7.533 1.00 . A A . 9 ILE CD1 1 1 12 3715 1 1 9 ILE CG1 C 13.264 9.571 6.935 1.00 . A A . 9 ILE CG1 1 1 12 3716 1 1 9 ILE CG2 C 10.785 9.955 6.897 1.00 . A A . 9 ILE CG2 1 1 12 3717 1 1 9 ILE H H 11.435 9.345 4.536 1.00 . A A . 9 ILE H 1 1 12 3718 1 1 9 ILE HA H 11.735 12.102 5.223 1.00 . A A . 9 ILE HA 1 1 12 3719 1 1 9 ILE HB H 12.255 11.407 7.379 1.00 . A A . 9 ILE HB 1 1 12 3720 1 1 9 ILE HD11 H 14.566 9.933 8.584 1.00 . A A . 9 ILE HD11 1 1 12 3721 1 1 9 ILE HD12 H 15.382 9.785 7.027 1.00 . A A . 9 ILE HD12 1 1 12 3722 1 1 9 ILE HD13 H 14.484 11.252 7.416 1.00 . A A . 9 ILE HD13 1 1 12 3723 1 1 9 ILE HG12 H 12.904 8.816 7.615 1.00 . A A . 9 ILE HG12 1 1 12 3724 1 1 9 ILE HG13 H 13.535 9.106 5.998 1.00 . A A . 9 ILE HG13 1 1 12 3725 1 1 9 ILE HG21 H 10.089 10.342 6.168 1.00 . A A . 9 ILE HG21 1 1 12 3726 1 1 9 ILE HG22 H 10.864 8.884 6.785 1.00 . A A . 9 ILE HG22 1 1 12 3727 1 1 9 ILE HG23 H 10.432 10.188 7.891 1.00 . A A . 9 ILE HG23 1 1 12 3728 1 1 9 ILE N N 11.639 10.268 4.279 1.00 . A A . 9 ILE N 1 1 12 3729 1 1 9 ILE O O 14.294 12.433 5.272 1.00 . A A . 9 ILE O 1 1 12 3730 1 1 10 THR C C 15.906 11.305 2.563 1.00 . A A . 10 THR C 1 1 12 3731 1 1 10 THR CA C 15.745 10.535 3.869 1.00 . A A . 10 THR CA 1 1 12 3732 1 1 10 THR CB C 16.391 9.146 3.716 1.00 . A A . 10 THR CB 1 1 12 3733 1 1 10 THR CG2 C 16.592 8.489 5.074 1.00 . A A . 10 THR CG2 1 1 12 3734 1 1 10 THR H H 13.837 9.628 3.999 1.00 . A A . 10 THR H 1 1 12 3735 1 1 10 THR HA H 16.264 11.066 4.655 1.00 . A A . 10 THR HA 1 1 12 3736 1 1 10 THR HB H 17.356 9.264 3.244 1.00 . A A . 10 THR HB 1 1 12 3737 1 1 10 THR HG1 H 16.081 7.989 2.149 1.00 . A A . 10 THR HG1 1 1 12 3738 1 1 10 THR HG21 H 17.042 7.517 4.941 1.00 . A A . 10 THR HG21 1 1 12 3739 1 1 10 THR HG22 H 15.637 8.380 5.565 1.00 . A A . 10 THR HG22 1 1 12 3740 1 1 10 THR HG23 H 17.240 9.106 5.679 1.00 . A A . 10 THR HG23 1 1 12 3741 1 1 10 THR N N 14.342 10.430 4.248 1.00 . A A . 10 THR N 1 1 12 3742 1 1 10 THR O O 15.374 10.908 1.527 1.00 . A A . 10 THR O 1 1 12 3743 1 1 10 THR OG1 O 15.568 8.311 2.894 1.00 . A A . 10 THR OG1 1 1 12 3744 1 1 11 LYS C C 18.370 13.344 1.140 1.00 . A A . 11 LYS C 1 1 12 3745 1 1 11 LYS CA C 16.879 13.234 1.440 1.00 . A A . 11 LYS CA 1 1 12 3746 1 1 11 LYS CB C 16.284 14.629 1.643 1.00 . A A . 11 LYS CB 1 1 12 3747 1 1 11 LYS CD C 15.670 14.883 4.066 1.00 . A A . 11 LYS CD 1 1 12 3748 1 1 11 LYS CE C 15.630 15.931 5.168 1.00 . A A . 11 LYS CE 1 1 12 3749 1 1 11 LYS CG C 16.656 15.261 2.973 1.00 . A A . 11 LYS CG 1 1 12 3750 1 1 11 LYS H H 17.044 12.673 3.475 1.00 . A A . 11 LYS H 1 1 12 3751 1 1 11 LYS HA H 16.389 12.761 0.602 1.00 . A A . 11 LYS HA 1 1 12 3752 1 1 11 LYS HB2 H 16.634 15.275 0.851 1.00 . A A . 11 LYS HB2 1 1 12 3753 1 1 11 LYS HB3 H 15.207 14.559 1.590 1.00 . A A . 11 LYS HB3 1 1 12 3754 1 1 11 LYS HD2 H 14.684 14.793 3.634 1.00 . A A . 11 LYS HD2 1 1 12 3755 1 1 11 LYS HD3 H 15.965 13.935 4.493 1.00 . A A . 11 LYS HD3 1 1 12 3756 1 1 11 LYS HE2 H 16.639 16.133 5.490 1.00 . A A . 11 LYS HE2 1 1 12 3757 1 1 11 LYS HE3 H 15.190 16.834 4.771 1.00 . A A . 11 LYS HE3 1 1 12 3758 1 1 11 LYS HG2 H 17.641 14.923 3.260 1.00 . A A . 11 LYS HG2 1 1 12 3759 1 1 11 LYS HG3 H 16.661 16.336 2.862 1.00 . A A . 11 LYS HG3 1 1 12 3760 1 1 11 LYS HZ1 H 14.873 14.439 6.419 1.00 . A A . 11 LYS HZ1 1 1 12 3761 1 1 11 LYS HZ2 H 13.835 15.759 6.223 1.00 . A A . 11 LYS HZ2 1 1 12 3762 1 1 11 LYS HZ3 H 15.201 15.897 7.212 1.00 . A A . 11 LYS HZ3 1 1 12 3763 1 1 11 LYS N N 16.645 12.408 2.619 1.00 . A A . 11 LYS N 1 1 12 3764 1 1 11 LYS NZ N 14.829 15.475 6.337 1.00 . A A . 11 LYS NZ 1 1 12 3765 1 1 11 LYS O O 18.803 14.233 0.407 1.00 . A A . 11 LYS O 1 1 12 3766 1 1 12 LYS C C 21.046 11.119 0.860 1.00 . A A . 12 LYS C 1 1 12 3767 1 1 12 LYS CA C 20.596 12.426 1.503 1.00 . A A . 12 LYS CA 1 1 12 3768 1 1 12 LYS CB C 21.325 12.630 2.834 1.00 . A A . 12 LYS CB 1 1 12 3769 1 1 12 LYS CD C 21.395 11.876 5.229 1.00 . A A . 12 LYS CD 1 1 12 3770 1 1 12 LYS CE C 21.284 12.920 6.329 1.00 . A A . 12 LYS CE 1 1 12 3771 1 1 12 LYS CG C 20.506 12.218 4.045 1.00 . A A . 12 LYS CG 1 1 12 3772 1 1 12 LYS H H 18.749 11.750 2.286 1.00 . A A . 12 LYS H 1 1 12 3773 1 1 12 LYS HA H 20.840 13.243 0.840 1.00 . A A . 12 LYS HA 1 1 12 3774 1 1 12 LYS HB2 H 22.234 12.048 2.825 1.00 . A A . 12 LYS HB2 1 1 12 3775 1 1 12 LYS HB3 H 21.578 13.676 2.935 1.00 . A A . 12 LYS HB3 1 1 12 3776 1 1 12 LYS HD2 H 21.097 10.917 5.626 1.00 . A A . 12 LYS HD2 1 1 12 3777 1 1 12 LYS HD3 H 22.421 11.826 4.894 1.00 . A A . 12 LYS HD3 1 1 12 3778 1 1 12 LYS HE2 H 20.254 12.980 6.648 1.00 . A A . 12 LYS HE2 1 1 12 3779 1 1 12 LYS HE3 H 21.900 12.613 7.161 1.00 . A A . 12 LYS HE3 1 1 12 3780 1 1 12 LYS HG2 H 19.854 13.034 4.322 1.00 . A A . 12 LYS HG2 1 1 12 3781 1 1 12 LYS HG3 H 19.913 11.352 3.789 1.00 . A A . 12 LYS HG3 1 1 12 3782 1 1 12 LYS HZ1 H 20.904 14.836 5.590 1.00 . A A . 12 LYS HZ1 1 1 12 3783 1 1 12 LYS HZ2 H 22.360 14.168 5.046 1.00 . A A . 12 LYS HZ2 1 1 12 3784 1 1 12 LYS HZ3 H 22.238 14.754 6.628 1.00 . A A . 12 LYS HZ3 1 1 12 3785 1 1 12 LYS N N 19.153 12.434 1.711 1.00 . A A . 12 LYS N 1 1 12 3786 1 1 12 LYS NZ N 21.728 14.264 5.866 1.00 . A A . 12 LYS NZ 1 1 12 3787 1 1 12 LYS O O 21.312 11.066 -0.340 1.00 . A A . 12 LYS O 1 1 12 3788 1 1 13 ASN C C 20.737 8.355 -0.055 1.00 . A A . 13 ASN C 1 1 12 3789 1 1 13 ASN CA C 21.545 8.757 1.175 1.00 . A A . 13 ASN CA 1 1 12 3790 1 1 13 ASN CB C 21.385 7.702 2.271 1.00 . A A . 13 ASN CB 1 1 12 3791 1 1 13 ASN CG C 22.706 7.334 2.917 1.00 . A A . 13 ASN CG 1 1 12 3792 1 1 13 ASN H H 20.903 10.170 2.614 1.00 . A A . 13 ASN H 1 1 12 3793 1 1 13 ASN HA H 22.587 8.823 0.901 1.00 . A A . 13 ASN HA 1 1 12 3794 1 1 13 ASN HB2 H 20.726 8.085 3.037 1.00 . A A . 13 ASN HB2 1 1 12 3795 1 1 13 ASN HB3 H 20.952 6.810 1.844 1.00 . A A . 13 ASN HB3 1 1 12 3796 1 1 13 ASN HD21 H 22.998 5.906 1.564 1.00 . A A . 13 ASN HD21 1 1 12 3797 1 1 13 ASN HD22 H 24.241 6.081 2.751 1.00 . A A . 13 ASN HD22 1 1 12 3798 1 1 13 ASN N N 21.128 10.065 1.666 1.00 . A A . 13 ASN N 1 1 12 3799 1 1 13 ASN ND2 N 23.383 6.340 2.354 1.00 . A A . 13 ASN ND2 1 1 12 3800 1 1 13 ASN O O 21.220 7.617 -0.913 1.00 . A A . 13 ASN O 1 1 12 3801 1 1 13 ASN OD1 O 23.113 7.936 3.911 1.00 . A A . 13 ASN OD1 1 1 12 3802 1 1 14 MET C C 19.250 9.011 -2.573 1.00 . A A . 14 MET C 1 1 12 3803 1 1 14 MET CA C 18.631 8.541 -1.260 1.00 . A A . 14 MET CA 1 1 12 3804 1 1 14 MET CB C 17.263 9.197 -1.065 1.00 . A A . 14 MET CB 1 1 12 3805 1 1 14 MET CE C 14.779 6.362 -2.404 1.00 . A A . 14 MET CE 1 1 12 3806 1 1 14 MET CG C 16.209 8.709 -2.045 1.00 . A A . 14 MET CG 1 1 12 3807 1 1 14 MET H H 19.176 9.431 0.581 1.00 . A A . 14 MET H 1 1 12 3808 1 1 14 MET HA H 18.504 7.470 -1.299 1.00 . A A . 14 MET HA 1 1 12 3809 1 1 14 MET HB2 H 16.917 8.989 -0.063 1.00 . A A . 14 MET HB2 1 1 12 3810 1 1 14 MET HB3 H 17.368 10.265 -1.186 1.00 . A A . 14 MET HB3 1 1 12 3811 1 1 14 MET HE1 H 14.097 5.625 -2.007 1.00 . A A . 14 MET HE1 1 1 12 3812 1 1 14 MET HE2 H 14.405 6.729 -3.348 1.00 . A A . 14 MET HE2 1 1 12 3813 1 1 14 MET HE3 H 15.750 5.911 -2.551 1.00 . A A . 14 MET HE3 1 1 12 3814 1 1 14 MET HG2 H 15.747 9.566 -2.513 1.00 . A A . 14 MET HG2 1 1 12 3815 1 1 14 MET HG3 H 16.691 8.106 -2.799 1.00 . A A . 14 MET HG3 1 1 12 3816 1 1 14 MET N N 19.505 8.847 -0.134 1.00 . A A . 14 MET N 1 1 12 3817 1 1 14 MET O O 19.382 8.236 -3.520 1.00 . A A . 14 MET O 1 1 12 3818 1 1 14 MET SD S 14.924 7.725 -1.250 1.00 . A A . 14 MET SD 1 1 12 3819 1 1 15 ALA C C 21.684 10.406 -3.966 1.00 . A A . 15 ALA C 1 1 12 3820 1 1 15 ALA CA C 20.234 10.855 -3.817 1.00 . A A . 15 ALA CA 1 1 12 3821 1 1 15 ALA CB C 20.153 12.374 -3.776 1.00 . A A . 15 ALA CB 1 1 12 3822 1 1 15 ALA H H 19.496 10.852 -1.834 1.00 . A A . 15 ALA H 1 1 12 3823 1 1 15 ALA HA H 19.672 10.512 -4.674 1.00 . A A . 15 ALA HA 1 1 12 3824 1 1 15 ALA HB1 H 20.460 12.776 -4.731 1.00 . A A . 15 ALA HB1 1 1 12 3825 1 1 15 ALA HB2 H 19.137 12.674 -3.569 1.00 . A A . 15 ALA HB2 1 1 12 3826 1 1 15 ALA HB3 H 20.804 12.749 -3.001 1.00 . A A . 15 ALA HB3 1 1 12 3827 1 1 15 ALA N N 19.628 10.284 -2.622 1.00 . A A . 15 ALA N 1 1 12 3828 1 1 15 ALA O O 22.367 10.785 -4.918 1.00 . A A . 15 ALA O 1 1 12 3829 1 1 16 HIS C C 23.552 7.634 -3.488 1.00 . A A . 16 HIS C 1 1 12 3830 1 1 16 HIS CA C 23.517 9.094 -3.046 1.00 . A A . 16 HIS CA 1 1 12 3831 1 1 16 HIS CB C 24.161 9.237 -1.667 1.00 . A A . 16 HIS CB 1 1 12 3832 1 1 16 HIS CD2 C 26.617 10.035 -1.422 1.00 . A A . 16 HIS CD2 1 1 12 3833 1 1 16 HIS CE1 C 26.291 12.179 -1.745 1.00 . A A . 16 HIS CE1 1 1 12 3834 1 1 16 HIS CG C 25.293 10.218 -1.634 1.00 . A A . 16 HIS CG 1 1 12 3835 1 1 16 HIS H H 21.554 9.329 -2.287 1.00 . A A . 16 HIS H 1 1 12 3836 1 1 16 HIS HA H 24.073 9.686 -3.757 1.00 . A A . 16 HIS HA 1 1 12 3837 1 1 16 HIS HB2 H 23.415 9.569 -0.961 1.00 . A A . 16 HIS HB2 1 1 12 3838 1 1 16 HIS HB3 H 24.544 8.276 -1.354 1.00 . A A . 16 HIS HB3 1 1 12 3839 1 1 16 HIS HD1 H 24.269 12.020 -2.012 1.00 . A A . 16 HIS HD1 1 1 12 3840 1 1 16 HIS HD2 H 27.112 9.093 -1.229 1.00 . A A . 16 HIS HD2 1 1 12 3841 1 1 16 HIS HE1 H 26.464 13.238 -1.858 1.00 . A A . 16 HIS HE1 1 1 12 3842 1 1 16 HIS N N 22.147 9.595 -3.020 1.00 . A A . 16 HIS N 1 1 12 3843 1 1 16 HIS ND1 N 25.121 11.572 -1.832 1.00 . A A . 16 HIS ND1 1 1 12 3844 1 1 16 HIS NE2 N 27.216 11.268 -1.496 1.00 . A A . 16 HIS NE2 1 1 12 3845 1 1 16 HIS O O 24.599 7.121 -3.886 1.00 . A A . 16 HIS O 1 1 12 3846 1 1 17 ILE C C 22.861 5.352 -5.211 1.00 . A A . 17 ILE C 1 1 12 3847 1 1 17 ILE CA C 22.304 5.571 -3.808 1.00 . A A . 17 ILE CA 1 1 12 3848 1 1 17 ILE CB C 20.846 5.076 -3.764 1.00 . A A . 17 ILE CB 1 1 12 3849 1 1 17 ILE CD1 C 18.529 5.677 -4.628 1.00 . A A . 17 ILE CD1 1 1 12 3850 1 1 17 ILE CG1 C 20.021 5.752 -4.861 1.00 . A A . 17 ILE CG1 1 1 12 3851 1 1 17 ILE CG2 C 20.237 5.343 -2.395 1.00 . A A . 17 ILE CG2 1 1 12 3852 1 1 17 ILE H H 21.604 7.434 -3.090 1.00 . A A . 17 ILE H 1 1 12 3853 1 1 17 ILE HA H 22.883 4.986 -3.107 1.00 . A A . 17 ILE HA 1 1 12 3854 1 1 17 ILE HB H 20.846 4.009 -3.929 1.00 . A A . 17 ILE HB 1 1 12 3855 1 1 17 ILE HD11 H 18.266 6.282 -3.773 1.00 . A A . 17 ILE HD11 1 1 12 3856 1 1 17 ILE HD12 H 18.009 6.041 -5.501 1.00 . A A . 17 ILE HD12 1 1 12 3857 1 1 17 ILE HD13 H 18.245 4.651 -4.442 1.00 . A A . 17 ILE HD13 1 1 12 3858 1 1 17 ILE HG12 H 20.295 6.794 -4.918 1.00 . A A . 17 ILE HG12 1 1 12 3859 1 1 17 ILE HG13 H 20.235 5.275 -5.807 1.00 . A A . 17 ILE HG13 1 1 12 3860 1 1 17 ILE HG21 H 19.924 6.375 -2.336 1.00 . A A . 17 ILE HG21 1 1 12 3861 1 1 17 ILE HG22 H 19.382 4.700 -2.251 1.00 . A A . 17 ILE HG22 1 1 12 3862 1 1 17 ILE HG23 H 20.971 5.144 -1.629 1.00 . A A . 17 ILE HG23 1 1 12 3863 1 1 17 ILE N N 22.403 6.971 -3.415 1.00 . A A . 17 ILE N 1 1 12 3864 1 1 17 ILE O O 23.531 4.354 -5.475 1.00 . A A . 17 ILE O 1 1 12 3865 1 1 18 ARG C C 24.331 7.018 -7.671 1.00 . A A . 18 ARG C 1 1 12 3866 1 1 18 ARG CA C 23.053 6.205 -7.482 1.00 . A A . 18 ARG CA 1 1 12 3867 1 1 18 ARG CB C 21.975 6.698 -8.448 1.00 . A A . 18 ARG CB 1 1 12 3868 1 1 18 ARG CD C 19.749 6.063 -9.428 1.00 . A A . 18 ARG CD 1 1 12 3869 1 1 18 ARG CG C 21.141 5.580 -9.052 1.00 . A A . 18 ARG CG 1 1 12 3870 1 1 18 ARG CZ C 18.655 7.068 -11.387 1.00 . A A . 18 ARG CZ 1 1 12 3871 1 1 18 ARG H H 22.041 7.066 -5.835 1.00 . A A . 18 ARG H 1 1 12 3872 1 1 18 ARG HA H 23.267 5.168 -7.693 1.00 . A A . 18 ARG HA 1 1 12 3873 1 1 18 ARG HB2 H 21.311 7.365 -7.918 1.00 . A A . 18 ARG HB2 1 1 12 3874 1 1 18 ARG HB3 H 22.449 7.239 -9.252 1.00 . A A . 18 ARG HB3 1 1 12 3875 1 1 18 ARG HD2 H 19.102 5.206 -9.538 1.00 . A A . 18 ARG HD2 1 1 12 3876 1 1 18 ARG HD3 H 19.377 6.696 -8.636 1.00 . A A . 18 ARG HD3 1 1 12 3877 1 1 18 ARG HE H 20.610 7.156 -11.003 1.00 . A A . 18 ARG HE 1 1 12 3878 1 1 18 ARG HG2 H 21.635 5.215 -9.941 1.00 . A A . 18 ARG HG2 1 1 12 3879 1 1 18 ARG HG3 H 21.053 4.780 -8.333 1.00 . A A . 18 ARG HG3 1 1 12 3880 1 1 18 ARG HH11 H 17.412 6.100 -10.122 1.00 . A A . 18 ARG HH11 1 1 12 3881 1 1 18 ARG HH12 H 16.654 6.813 -11.507 1.00 . A A . 18 ARG HH12 1 1 12 3882 1 1 18 ARG HH21 H 19.624 8.099 -12.830 1.00 . A A . 18 ARG HH21 1 1 12 3883 1 1 18 ARG HH22 H 17.913 7.949 -13.048 1.00 . A A . 18 ARG HH22 1 1 12 3884 1 1 18 ARG N N 22.580 6.294 -6.106 1.00 . A A . 18 ARG N 1 1 12 3885 1 1 18 ARG NE N 19.750 6.819 -10.677 1.00 . A A . 18 ARG NE 1 1 12 3886 1 1 18 ARG NH1 N 17.477 6.623 -10.972 1.00 . A A . 18 ARG NH1 1 1 12 3887 1 1 18 ARG NH2 N 18.737 7.763 -12.514 1.00 . A A . 18 ARG NH2 1 1 12 3888 1 1 18 ARG O O 25.254 6.938 -6.861 1.00 . A A . 18 ARG O 1 1 13 3889 1 1 1 PHE C C 4.828 -1.238 -2.473 1.00 . A A . 1 PHE C 1 1 13 3890 1 1 1 PHE CA C 3.409 -1.780 -2.621 1.00 . A A . 1 PHE CA 1 1 13 3891 1 1 1 PHE CB C 2.609 -1.500 -1.347 1.00 . A A . 1 PHE CB 1 1 13 3892 1 1 1 PHE CD1 C 0.639 -3.038 -1.574 1.00 . A A . 1 PHE CD1 1 1 13 3893 1 1 1 PHE CD2 C 0.246 -0.686 -1.567 1.00 . A A . 1 PHE CD2 1 1 13 3894 1 1 1 PHE CE1 C -0.717 -3.267 -1.714 1.00 . A A . 1 PHE CE1 1 1 13 3895 1 1 1 PHE CE2 C -1.111 -0.909 -1.706 1.00 . A A . 1 PHE CE2 1 1 13 3896 1 1 1 PHE CG C 1.135 -1.746 -1.499 1.00 . A A . 1 PHE CG 1 1 13 3897 1 1 1 PHE CZ C -1.593 -2.202 -1.781 1.00 . A A . 1 PHE CZ 1 1 13 3898 1 1 1 PHE H1 H 4.127 -3.768 -2.509 1.00 . A A . 1 PHE H1 1 1 13 3899 1 1 1 PHE HA H 2.932 -1.283 -3.452 1.00 . A A . 1 PHE HA 1 1 13 3900 1 1 1 PHE HB2 H 2.972 -2.139 -0.556 1.00 . A A . 1 PHE HB2 1 1 13 3901 1 1 1 PHE HB3 H 2.747 -0.468 -1.063 1.00 . A A . 1 PHE HB3 1 1 13 3902 1 1 1 PHE HD1 H 1.324 -3.873 -1.522 1.00 . A A . 1 PHE HD1 1 1 13 3903 1 1 1 PHE HD2 H 0.621 0.325 -1.511 1.00 . A A . 1 PHE HD2 1 1 13 3904 1 1 1 PHE HE1 H -1.090 -4.279 -1.772 1.00 . A A . 1 PHE HE1 1 1 13 3905 1 1 1 PHE HE2 H -1.793 -0.074 -1.759 1.00 . A A . 1 PHE HE2 1 1 13 3906 1 1 1 PHE HZ H -2.652 -2.379 -1.889 1.00 . A A . 1 PHE HZ 1 1 13 3907 1 1 1 PHE N N 3.426 -3.210 -2.906 1.00 . A A . 1 PHE N 1 1 13 3908 1 1 1 PHE O O 5.785 -2.001 -2.332 1.00 . A A . 1 PHE O 1 1 13 3909 1 1 2 LEU C C 6.145 2.031 -1.590 1.00 . A A . 2 LEU C 1 1 13 3910 1 1 2 LEU CA C 6.259 0.729 -2.377 1.00 . A A . 2 LEU CA 1 1 13 3911 1 1 2 LEU CB C 6.854 1.005 -3.759 1.00 . A A . 2 LEU CB 1 1 13 3912 1 1 2 LEU CD1 C 7.216 0.155 -6.089 1.00 . A A . 2 LEU CD1 1 1 13 3913 1 1 2 LEU CD2 C 8.459 -0.874 -4.178 1.00 . A A . 2 LEU CD2 1 1 13 3914 1 1 2 LEU CG C 7.156 -0.224 -4.617 1.00 . A A . 2 LEU CG 1 1 13 3915 1 1 2 LEU H H 4.159 0.639 -2.622 1.00 . A A . 2 LEU H 1 1 13 3916 1 1 2 LEU HA H 6.911 0.055 -1.841 1.00 . A A . 2 LEU HA 1 1 13 3917 1 1 2 LEU HB2 H 6.155 1.624 -4.301 1.00 . A A . 2 LEU HB2 1 1 13 3918 1 1 2 LEU HB3 H 7.778 1.547 -3.618 1.00 . A A . 2 LEU HB3 1 1 13 3919 1 1 2 LEU HD11 H 7.377 -0.732 -6.682 1.00 . A A . 2 LEU HD11 1 1 13 3920 1 1 2 LEU HD12 H 8.028 0.848 -6.249 1.00 . A A . 2 LEU HD12 1 1 13 3921 1 1 2 LEU HD13 H 6.284 0.619 -6.379 1.00 . A A . 2 LEU HD13 1 1 13 3922 1 1 2 LEU HD21 H 9.117 -0.120 -3.770 1.00 . A A . 2 LEU HD21 1 1 13 3923 1 1 2 LEU HD22 H 8.933 -1.342 -5.029 1.00 . A A . 2 LEU HD22 1 1 13 3924 1 1 2 LEU HD23 H 8.254 -1.619 -3.424 1.00 . A A . 2 LEU HD23 1 1 13 3925 1 1 2 LEU HG H 6.361 -0.947 -4.492 1.00 . A A . 2 LEU HG 1 1 13 3926 1 1 2 LEU N N 4.957 0.084 -2.507 1.00 . A A . 2 LEU N 1 1 13 3927 1 1 2 LEU O O 6.312 3.126 -2.127 1.00 . A A . 2 LEU O 1 1 13 3928 1 1 3 PRO C C 7.049 3.765 0.862 1.00 . A A . 3 PRO C 1 1 13 3929 1 1 3 PRO CA C 5.717 3.068 0.604 1.00 . A A . 3 PRO CA 1 1 13 3930 1 1 3 PRO CB C 5.174 2.457 1.898 1.00 . A A . 3 PRO CB 1 1 13 3931 1 1 3 PRO CD C 5.645 0.637 0.422 1.00 . A A . 3 PRO CD 1 1 13 3932 1 1 3 PRO CG C 5.634 1.040 1.870 1.00 . A A . 3 PRO CG 1 1 13 3933 1 1 3 PRO HA H 5.007 3.784 0.215 1.00 . A A . 3 PRO HA 1 1 13 3934 1 1 3 PRO HB2 H 5.579 2.989 2.747 1.00 . A A . 3 PRO HB2 1 1 13 3935 1 1 3 PRO HB3 H 4.096 2.522 1.906 1.00 . A A . 3 PRO HB3 1 1 13 3936 1 1 3 PRO HD2 H 6.455 -0.051 0.228 1.00 . A A . 3 PRO HD2 1 1 13 3937 1 1 3 PRO HD3 H 4.699 0.196 0.145 1.00 . A A . 3 PRO HD3 1 1 13 3938 1 1 3 PRO HG2 H 6.626 0.968 2.288 1.00 . A A . 3 PRO HG2 1 1 13 3939 1 1 3 PRO HG3 H 4.945 0.421 2.426 1.00 . A A . 3 PRO HG3 1 1 13 3940 1 1 3 PRO N N 5.857 1.911 -0.286 1.00 . A A . 3 PRO N 1 1 13 3941 1 1 3 PRO O O 8.106 3.134 0.838 1.00 . A A . 3 PRO O 1 1 13 3942 1 1 4 LYS C C 8.144 6.467 2.769 1.00 . A A . 4 LYS C 1 1 13 3943 1 1 4 LYS CA C 8.192 5.852 1.373 1.00 . A A . 4 LYS CA 1 1 13 3944 1 1 4 LYS CB C 8.348 6.955 0.324 1.00 . A A . 4 LYS CB 1 1 13 3945 1 1 4 LYS CD C 7.090 8.787 -0.847 1.00 . A A . 4 LYS CD 1 1 13 3946 1 1 4 LYS CE C 8.166 8.963 -1.907 1.00 . A A . 4 LYS CE 1 1 13 3947 1 1 4 LYS CG C 7.040 7.357 -0.335 1.00 . A A . 4 LYS CG 1 1 13 3948 1 1 4 LYS H H 6.118 5.516 1.114 1.00 . A A . 4 LYS H 1 1 13 3949 1 1 4 LYS HA H 9.041 5.188 1.315 1.00 . A A . 4 LYS HA 1 1 13 3950 1 1 4 LYS HB2 H 8.772 7.828 0.797 1.00 . A A . 4 LYS HB2 1 1 13 3951 1 1 4 LYS HB3 H 9.023 6.609 -0.446 1.00 . A A . 4 LYS HB3 1 1 13 3952 1 1 4 LYS HD2 H 6.132 9.040 -1.277 1.00 . A A . 4 LYS HD2 1 1 13 3953 1 1 4 LYS HD3 H 7.301 9.449 -0.018 1.00 . A A . 4 LYS HD3 1 1 13 3954 1 1 4 LYS HE2 H 9.132 8.950 -1.426 1.00 . A A . 4 LYS HE2 1 1 13 3955 1 1 4 LYS HE3 H 8.101 8.143 -2.606 1.00 . A A . 4 LYS HE3 1 1 13 3956 1 1 4 LYS HG2 H 6.848 6.695 -1.167 1.00 . A A . 4 LYS HG2 1 1 13 3957 1 1 4 LYS HG3 H 6.242 7.270 0.388 1.00 . A A . 4 LYS HG3 1 1 13 3958 1 1 4 LYS HZ1 H 7.110 10.250 -3.168 1.00 . A A . 4 LYS HZ1 1 1 13 3959 1 1 4 LYS HZ2 H 8.791 10.363 -3.325 1.00 . A A . 4 LYS HZ2 1 1 13 3960 1 1 4 LYS HZ3 H 8.019 11.045 -1.983 1.00 . A A . 4 LYS HZ3 1 1 13 3961 1 1 4 LYS N N 6.991 5.069 1.109 1.00 . A A . 4 LYS N 1 1 13 3962 1 1 4 LYS NZ N 8.011 10.245 -2.647 1.00 . A A . 4 LYS NZ 1 1 13 3963 1 1 4 LYS O O 8.620 7.583 2.983 1.00 . A A . 4 LYS O 1 1 13 3964 1 1 5 LEU C C 8.772 6.826 5.558 1.00 . A A . 5 LEU C 1 1 13 3965 1 1 5 LEU CA C 7.459 6.206 5.090 1.00 . A A . 5 LEU CA 1 1 13 3966 1 1 5 LEU CB C 7.068 5.054 6.017 1.00 . A A . 5 LEU CB 1 1 13 3967 1 1 5 LEU CD1 C 8.868 4.466 7.658 1.00 . A A . 5 LEU CD1 1 1 13 3968 1 1 5 LEU CD2 C 7.623 2.651 6.471 1.00 . A A . 5 LEU CD2 1 1 13 3969 1 1 5 LEU CG C 8.180 4.063 6.364 1.00 . A A . 5 LEU CG 1 1 13 3970 1 1 5 LEU H H 7.207 4.852 3.483 1.00 . A A . 5 LEU H 1 1 13 3971 1 1 5 LEU HA H 6.688 6.960 5.121 1.00 . A A . 5 LEU HA 1 1 13 3972 1 1 5 LEU HB2 H 6.705 5.480 6.939 1.00 . A A . 5 LEU HB2 1 1 13 3973 1 1 5 LEU HB3 H 6.270 4.503 5.539 1.00 . A A . 5 LEU HB3 1 1 13 3974 1 1 5 LEU HD11 H 9.568 3.697 7.948 1.00 . A A . 5 LEU HD11 1 1 13 3975 1 1 5 LEU HD12 H 8.129 4.591 8.435 1.00 . A A . 5 LEU HD12 1 1 13 3976 1 1 5 LEU HD13 H 9.396 5.397 7.511 1.00 . A A . 5 LEU HD13 1 1 13 3977 1 1 5 LEU HD21 H 8.021 2.174 7.354 1.00 . A A . 5 LEU HD21 1 1 13 3978 1 1 5 LEU HD22 H 7.908 2.085 5.596 1.00 . A A . 5 LEU HD22 1 1 13 3979 1 1 5 LEU HD23 H 6.546 2.694 6.538 1.00 . A A . 5 LEU HD23 1 1 13 3980 1 1 5 LEU HG H 8.920 4.073 5.575 1.00 . A A . 5 LEU HG 1 1 13 3981 1 1 5 LEU N N 7.568 5.733 3.714 1.00 . A A . 5 LEU N 1 1 13 3982 1 1 5 LEU O O 8.777 7.803 6.306 1.00 . A A . 5 LEU O 1 1 13 3983 1 1 6 PHE C C 12.017 7.113 4.243 1.00 . A A . 6 PHE C 1 1 13 3984 1 1 6 PHE CA C 11.204 6.749 5.482 1.00 . A A . 6 PHE CA 1 1 13 3985 1 1 6 PHE CB C 11.953 5.702 6.307 1.00 . A A . 6 PHE CB 1 1 13 3986 1 1 6 PHE CD1 C 14.217 6.288 7.216 1.00 . A A . 6 PHE CD1 1 1 13 3987 1 1 6 PHE CD2 C 12.295 6.855 8.509 1.00 . A A . 6 PHE CD2 1 1 13 3988 1 1 6 PHE CE1 C 15.036 6.833 8.188 1.00 . A A . 6 PHE CE1 1 1 13 3989 1 1 6 PHE CE2 C 13.109 7.402 9.484 1.00 . A A . 6 PHE CE2 1 1 13 3990 1 1 6 PHE CG C 12.839 6.294 7.365 1.00 . A A . 6 PHE CG 1 1 13 3991 1 1 6 PHE CZ C 14.481 7.389 9.323 1.00 . A A . 6 PHE CZ 1 1 13 3992 1 1 6 PHE H H 9.815 5.476 4.516 1.00 . A A . 6 PHE H 1 1 13 3993 1 1 6 PHE HA H 11.066 7.636 6.080 1.00 . A A . 6 PHE HA 1 1 13 3994 1 1 6 PHE HB2 H 11.236 5.060 6.797 1.00 . A A . 6 PHE HB2 1 1 13 3995 1 1 6 PHE HB3 H 12.570 5.109 5.649 1.00 . A A . 6 PHE HB3 1 1 13 3996 1 1 6 PHE HD1 H 14.652 5.853 6.328 1.00 . A A . 6 PHE HD1 1 1 13 3997 1 1 6 PHE HD2 H 11.223 6.865 8.637 1.00 . A A . 6 PHE HD2 1 1 13 3998 1 1 6 PHE HE1 H 16.108 6.822 8.059 1.00 . A A . 6 PHE HE1 1 1 13 3999 1 1 6 PHE HE2 H 12.673 7.836 10.371 1.00 . A A . 6 PHE HE2 1 1 13 4000 1 1 6 PHE HZ H 15.118 7.816 10.083 1.00 . A A . 6 PHE HZ 1 1 13 4001 1 1 6 PHE N N 9.884 6.252 5.110 1.00 . A A . 6 PHE N 1 1 13 4002 1 1 6 PHE O O 13.080 7.725 4.342 1.00 . A A . 6 PHE O 1 1 13 4003 1 1 7 ALA C C 12.103 8.501 1.474 1.00 . A A . 7 ALA C 1 1 13 4004 1 1 7 ALA CA C 12.185 7.018 1.817 1.00 . A A . 7 ALA CA 1 1 13 4005 1 1 7 ALA CB C 11.590 6.181 0.695 1.00 . A A . 7 ALA CB 1 1 13 4006 1 1 7 ALA H H 10.657 6.246 3.061 1.00 . A A . 7 ALA H 1 1 13 4007 1 1 7 ALA HA H 13.224 6.741 1.926 1.00 . A A . 7 ALA HA 1 1 13 4008 1 1 7 ALA HB1 H 10.939 6.798 0.093 1.00 . A A . 7 ALA HB1 1 1 13 4009 1 1 7 ALA HB2 H 12.384 5.787 0.079 1.00 . A A . 7 ALA HB2 1 1 13 4010 1 1 7 ALA HB3 H 11.022 5.365 1.117 1.00 . A A . 7 ALA HB3 1 1 13 4011 1 1 7 ALA N N 11.508 6.731 3.076 1.00 . A A . 7 ALA N 1 1 13 4012 1 1 7 ALA O O 12.982 9.045 0.807 1.00 . A A . 7 ALA O 1 1 13 4013 1 1 8 LYS C C 11.519 11.420 2.750 1.00 . A A . 8 LYS C 1 1 13 4014 1 1 8 LYS CA C 10.841 10.573 1.678 1.00 . A A . 8 LYS CA 1 1 13 4015 1 1 8 LYS CB C 9.346 10.899 1.626 1.00 . A A . 8 LYS CB 1 1 13 4016 1 1 8 LYS CD C 7.818 11.685 3.458 1.00 . A A . 8 LYS CD 1 1 13 4017 1 1 8 LYS CE C 6.450 11.255 3.965 1.00 . A A . 8 LYS CE 1 1 13 4018 1 1 8 LYS CG C 8.595 10.510 2.887 1.00 . A A . 8 LYS CG 1 1 13 4019 1 1 8 LYS H H 10.372 8.663 2.461 1.00 . A A . 8 LYS H 1 1 13 4020 1 1 8 LYS HA H 11.284 10.802 0.721 1.00 . A A . 8 LYS HA 1 1 13 4021 1 1 8 LYS HB2 H 9.227 11.962 1.474 1.00 . A A . 8 LYS HB2 1 1 13 4022 1 1 8 LYS HB3 H 8.904 10.373 0.792 1.00 . A A . 8 LYS HB3 1 1 13 4023 1 1 8 LYS HD2 H 8.376 12.110 4.278 1.00 . A A . 8 LYS HD2 1 1 13 4024 1 1 8 LYS HD3 H 7.688 12.429 2.685 1.00 . A A . 8 LYS HD3 1 1 13 4025 1 1 8 LYS HE2 H 5.810 11.063 3.118 1.00 . A A . 8 LYS HE2 1 1 13 4026 1 1 8 LYS HE3 H 6.564 10.349 4.543 1.00 . A A . 8 LYS HE3 1 1 13 4027 1 1 8 LYS HG2 H 7.903 9.715 2.652 1.00 . A A . 8 LYS HG2 1 1 13 4028 1 1 8 LYS HG3 H 9.304 10.166 3.626 1.00 . A A . 8 LYS HG3 1 1 13 4029 1 1 8 LYS HZ1 H 4.868 12.522 4.470 1.00 . A A . 8 LYS HZ1 1 1 13 4030 1 1 8 LYS HZ2 H 6.396 13.167 4.804 1.00 . A A . 8 LYS HZ2 1 1 13 4031 1 1 8 LYS HZ3 H 5.750 11.964 5.802 1.00 . A A . 8 LYS HZ3 1 1 13 4032 1 1 8 LYS N N 11.039 9.151 1.935 1.00 . A A . 8 LYS N 1 1 13 4033 1 1 8 LYS NZ N 5.822 12.300 4.820 1.00 . A A . 8 LYS NZ 1 1 13 4034 1 1 8 LYS O O 12.004 12.517 2.472 1.00 . A A . 8 LYS O 1 1 13 4035 1 1 9 ILE C C 13.694 11.576 4.978 1.00 . A A . 9 ILE C 1 1 13 4036 1 1 9 ILE CA C 12.173 11.610 5.086 1.00 . A A . 9 ILE CA 1 1 13 4037 1 1 9 ILE CB C 11.752 11.011 6.440 1.00 . A A . 9 ILE CB 1 1 13 4038 1 1 9 ILE CD1 C 13.850 10.141 7.590 1.00 . A A . 9 ILE CD1 1 1 13 4039 1 1 9 ILE CG1 C 12.620 9.797 6.778 1.00 . A A . 9 ILE CG1 1 1 13 4040 1 1 9 ILE CG2 C 10.280 10.626 6.415 1.00 . A A . 9 ILE CG2 1 1 13 4041 1 1 9 ILE H H 11.147 10.024 4.132 1.00 . A A . 9 ILE H 1 1 13 4042 1 1 9 ILE HA H 11.843 12.639 5.052 1.00 . A A . 9 ILE HA 1 1 13 4043 1 1 9 ILE HB H 11.888 11.765 7.200 1.00 . A A . 9 ILE HB 1 1 13 4044 1 1 9 ILE HD11 H 14.667 9.500 7.295 1.00 . A A . 9 ILE HD11 1 1 13 4045 1 1 9 ILE HD12 H 14.119 11.172 7.417 1.00 . A A . 9 ILE HD12 1 1 13 4046 1 1 9 ILE HD13 H 13.640 9.995 8.640 1.00 . A A . 9 ILE HD13 1 1 13 4047 1 1 9 ILE HG12 H 12.036 9.091 7.345 1.00 . A A . 9 ILE HG12 1 1 13 4048 1 1 9 ILE HG13 H 12.948 9.332 5.859 1.00 . A A . 9 ILE HG13 1 1 13 4049 1 1 9 ILE HG21 H 10.189 9.566 6.223 1.00 . A A . 9 ILE HG21 1 1 13 4050 1 1 9 ILE HG22 H 9.831 10.858 7.368 1.00 . A A . 9 ILE HG22 1 1 13 4051 1 1 9 ILE HG23 H 9.777 11.177 5.635 1.00 . A A . 9 ILE HG23 1 1 13 4052 1 1 9 ILE N N 11.551 10.902 3.973 1.00 . A A . 9 ILE N 1 1 13 4053 1 1 9 ILE O O 14.383 12.466 5.477 1.00 . A A . 9 ILE O 1 1 13 4054 1 1 10 THR C C 16.143 11.177 2.935 1.00 . A A . 10 THR C 1 1 13 4055 1 1 10 THR CA C 15.651 10.392 4.146 1.00 . A A . 10 THR CA 1 1 13 4056 1 1 10 THR CB C 16.044 8.912 3.979 1.00 . A A . 10 THR CB 1 1 13 4057 1 1 10 THR CG2 C 15.927 8.169 5.301 1.00 . A A . 10 THR CG2 1 1 13 4058 1 1 10 THR H H 13.610 9.866 3.945 1.00 . A A . 10 THR H 1 1 13 4059 1 1 10 THR HA H 16.136 10.775 5.032 1.00 . A A . 10 THR HA 1 1 13 4060 1 1 10 THR HB H 17.071 8.864 3.645 1.00 . A A . 10 THR HB 1 1 13 4061 1 1 10 THR HG1 H 15.532 8.497 2.120 1.00 . A A . 10 THR HG1 1 1 13 4062 1 1 10 THR HG21 H 16.578 8.627 6.031 1.00 . A A . 10 THR HG21 1 1 13 4063 1 1 10 THR HG22 H 16.213 7.137 5.160 1.00 . A A . 10 THR HG22 1 1 13 4064 1 1 10 THR HG23 H 14.907 8.215 5.650 1.00 . A A . 10 THR HG23 1 1 13 4065 1 1 10 THR N N 14.212 10.543 4.320 1.00 . A A . 10 THR N 1 1 13 4066 1 1 10 THR O O 15.699 10.946 1.810 1.00 . A A . 10 THR O 1 1 13 4067 1 1 10 THR OG1 O 15.206 8.290 3.000 1.00 . A A . 10 THR OG1 1 1 13 4068 1 1 11 LYS C C 19.127 12.728 1.991 1.00 . A A . 11 LYS C 1 1 13 4069 1 1 11 LYS CA C 17.618 12.924 2.100 1.00 . A A . 11 LYS CA 1 1 13 4070 1 1 11 LYS CB C 17.301 14.401 2.343 1.00 . A A . 11 LYS CB 1 1 13 4071 1 1 11 LYS CD C 18.970 14.906 4.152 1.00 . A A . 11 LYS CD 1 1 13 4072 1 1 11 LYS CE C 19.304 16.202 4.873 1.00 . A A . 11 LYS CE 1 1 13 4073 1 1 11 LYS CG C 17.497 14.836 3.785 1.00 . A A . 11 LYS CG 1 1 13 4074 1 1 11 LYS H H 17.378 12.243 4.090 1.00 . A A . 11 LYS H 1 1 13 4075 1 1 11 LYS HA H 17.159 12.614 1.174 1.00 . A A . 11 LYS HA 1 1 13 4076 1 1 11 LYS HB2 H 17.944 15.002 1.717 1.00 . A A . 11 LYS HB2 1 1 13 4077 1 1 11 LYS HB3 H 16.272 14.586 2.070 1.00 . A A . 11 LYS HB3 1 1 13 4078 1 1 11 LYS HD2 H 19.211 14.075 4.798 1.00 . A A . 11 LYS HD2 1 1 13 4079 1 1 11 LYS HD3 H 19.560 14.844 3.248 1.00 . A A . 11 LYS HD3 1 1 13 4080 1 1 11 LYS HE2 H 18.863 17.025 4.332 1.00 . A A . 11 LYS HE2 1 1 13 4081 1 1 11 LYS HE3 H 18.887 16.162 5.869 1.00 . A A . 11 LYS HE3 1 1 13 4082 1 1 11 LYS HG2 H 17.057 15.814 3.920 1.00 . A A . 11 LYS HG2 1 1 13 4083 1 1 11 LYS HG3 H 17.006 14.126 4.435 1.00 . A A . 11 LYS HG3 1 1 13 4084 1 1 11 LYS HZ1 H 20.971 17.387 5.297 1.00 . A A . 11 LYS HZ1 1 1 13 4085 1 1 11 LYS HZ2 H 21.218 16.282 4.041 1.00 . A A . 11 LYS HZ2 1 1 13 4086 1 1 11 LYS HZ3 H 21.191 15.746 5.646 1.00 . A A . 11 LYS HZ3 1 1 13 4087 1 1 11 LYS N N 17.063 12.105 3.172 1.00 . A A . 11 LYS N 1 1 13 4088 1 1 11 LYS NZ N 20.774 16.419 4.971 1.00 . A A . 11 LYS NZ 1 1 13 4089 1 1 11 LYS O O 19.825 13.531 1.373 1.00 . A A . 11 LYS O 1 1 13 4090 1 1 12 LYS C C 21.343 10.216 1.587 1.00 . A A . 12 LYS C 1 1 13 4091 1 1 12 LYS CA C 21.050 11.349 2.564 1.00 . A A . 12 LYS CA 1 1 13 4092 1 1 12 LYS CB C 21.542 10.971 3.963 1.00 . A A . 12 LYS CB 1 1 13 4093 1 1 12 LYS CD C 21.241 11.315 6.433 1.00 . A A . 12 LYS CD 1 1 13 4094 1 1 12 LYS CE C 21.980 12.614 6.716 1.00 . A A . 12 LYS CE 1 1 13 4095 1 1 12 LYS CG C 20.570 11.341 5.070 1.00 . A A . 12 LYS CG 1 1 13 4096 1 1 12 LYS H H 19.017 11.050 3.073 1.00 . A A . 12 LYS H 1 1 13 4097 1 1 12 LYS HA H 21.571 12.236 2.236 1.00 . A A . 12 LYS HA 1 1 13 4098 1 1 12 LYS HB2 H 21.706 9.904 3.998 1.00 . A A . 12 LYS HB2 1 1 13 4099 1 1 12 LYS HB3 H 22.478 11.477 4.151 1.00 . A A . 12 LYS HB3 1 1 13 4100 1 1 12 LYS HD2 H 20.488 11.169 7.193 1.00 . A A . 12 LYS HD2 1 1 13 4101 1 1 12 LYS HD3 H 21.947 10.496 6.462 1.00 . A A . 12 LYS HD3 1 1 13 4102 1 1 12 LYS HE2 H 22.962 12.379 7.097 1.00 . A A . 12 LYS HE2 1 1 13 4103 1 1 12 LYS HE3 H 22.074 13.167 5.793 1.00 . A A . 12 LYS HE3 1 1 13 4104 1 1 12 LYS HG2 H 20.190 12.335 4.887 1.00 . A A . 12 LYS HG2 1 1 13 4105 1 1 12 LYS HG3 H 19.752 10.635 5.069 1.00 . A A . 12 LYS HG3 1 1 13 4106 1 1 12 LYS HZ1 H 20.245 13.480 7.492 1.00 . A A . 12 LYS HZ1 1 1 13 4107 1 1 12 LYS HZ2 H 21.632 14.426 7.696 1.00 . A A . 12 LYS HZ2 1 1 13 4108 1 1 12 LYS HZ3 H 21.388 13.063 8.668 1.00 . A A . 12 LYS HZ3 1 1 13 4109 1 1 12 LYS N N 19.624 11.654 2.595 1.00 . A A . 12 LYS N 1 1 13 4110 1 1 12 LYS NZ N 21.261 13.455 7.713 1.00 . A A . 12 LYS NZ 1 1 13 4111 1 1 12 LYS O O 21.927 10.434 0.526 1.00 . A A . 12 LYS O 1 1 13 4112 1 1 13 ASN C C 20.430 7.990 -0.230 1.00 . A A . 13 ASN C 1 1 13 4113 1 1 13 ASN CA C 21.151 7.837 1.106 1.00 . A A . 13 ASN CA 1 1 13 4114 1 1 13 ASN CB C 20.670 6.570 1.816 1.00 . A A . 13 ASN CB 1 1 13 4115 1 1 13 ASN CG C 21.810 5.630 2.157 1.00 . A A . 13 ASN CG 1 1 13 4116 1 1 13 ASN H H 20.473 8.894 2.810 1.00 . A A . 13 ASN H 1 1 13 4117 1 1 13 ASN HA H 22.212 7.755 0.922 1.00 . A A . 13 ASN HA 1 1 13 4118 1 1 13 ASN HB2 H 20.170 6.847 2.733 1.00 . A A . 13 ASN HB2 1 1 13 4119 1 1 13 ASN HB3 H 19.975 6.048 1.176 1.00 . A A . 13 ASN HB3 1 1 13 4120 1 1 13 ASN HD21 H 22.329 5.525 0.240 1.00 . A A . 13 ASN HD21 1 1 13 4121 1 1 13 ASN HD22 H 23.297 4.601 1.333 1.00 . A A . 13 ASN HD22 1 1 13 4122 1 1 13 ASN N N 20.933 9.005 1.952 1.00 . A A . 13 ASN N 1 1 13 4123 1 1 13 ASN ND2 N 22.554 5.210 1.141 1.00 . A A . 13 ASN ND2 1 1 13 4124 1 1 13 ASN O O 20.748 7.304 -1.201 1.00 . A A . 13 ASN O 1 1 13 4125 1 1 13 ASN OD1 O 22.019 5.287 3.321 1.00 . A A . 13 ASN OD1 1 1 13 4126 1 1 14 MET C C 19.607 9.578 -2.626 1.00 . A A . 14 MET C 1 1 13 4127 1 1 14 MET CA C 18.692 9.140 -1.488 1.00 . A A . 14 MET CA 1 1 13 4128 1 1 14 MET CB C 17.623 10.205 -1.238 1.00 . A A . 14 MET CB 1 1 13 4129 1 1 14 MET CE C 14.750 8.339 -2.926 1.00 . A A . 14 MET CE 1 1 13 4130 1 1 14 MET CG C 16.605 10.319 -2.361 1.00 . A A . 14 MET CG 1 1 13 4131 1 1 14 MET H H 19.249 9.411 0.536 1.00 . A A . 14 MET H 1 1 13 4132 1 1 14 MET HA H 18.208 8.215 -1.766 1.00 . A A . 14 MET HA 1 1 13 4133 1 1 14 MET HB2 H 17.096 9.963 -0.327 1.00 . A A . 14 MET HB2 1 1 13 4134 1 1 14 MET HB3 H 18.106 11.163 -1.121 1.00 . A A . 14 MET HB3 1 1 13 4135 1 1 14 MET HE1 H 14.953 8.616 -3.950 1.00 . A A . 14 MET HE1 1 1 13 4136 1 1 14 MET HE2 H 15.435 7.562 -2.621 1.00 . A A . 14 MET HE2 1 1 13 4137 1 1 14 MET HE3 H 13.735 7.978 -2.845 1.00 . A A . 14 MET HE3 1 1 13 4138 1 1 14 MET HG2 H 16.545 11.352 -2.671 1.00 . A A . 14 MET HG2 1 1 13 4139 1 1 14 MET HG3 H 16.938 9.715 -3.192 1.00 . A A . 14 MET HG3 1 1 13 4140 1 1 14 MET N N 19.457 8.895 -0.271 1.00 . A A . 14 MET N 1 1 13 4141 1 1 14 MET O O 19.591 8.993 -3.709 1.00 . A A . 14 MET O 1 1 13 4142 1 1 14 MET SD S 14.961 9.768 -1.867 1.00 . A A . 14 MET SD 1 1 13 4143 1 1 15 ALA C C 22.540 10.213 -3.529 1.00 . A A . 15 ALA C 1 1 13 4144 1 1 15 ALA CA C 21.328 11.126 -3.378 1.00 . A A . 15 ALA CA 1 1 13 4145 1 1 15 ALA CB C 21.768 12.537 -3.015 1.00 . A A . 15 ALA CB 1 1 13 4146 1 1 15 ALA H H 20.372 11.036 -1.492 1.00 . A A . 15 ALA H 1 1 13 4147 1 1 15 ALA HA H 20.803 11.171 -4.322 1.00 . A A . 15 ALA HA 1 1 13 4148 1 1 15 ALA HB1 H 21.365 13.235 -3.735 1.00 . A A . 15 ALA HB1 1 1 13 4149 1 1 15 ALA HB2 H 21.405 12.785 -2.029 1.00 . A A . 15 ALA HB2 1 1 13 4150 1 1 15 ALA HB3 H 22.847 12.590 -3.026 1.00 . A A . 15 ALA HB3 1 1 13 4151 1 1 15 ALA N N 20.405 10.611 -2.375 1.00 . A A . 15 ALA N 1 1 13 4152 1 1 15 ALA O O 23.435 10.481 -4.332 1.00 . A A . 15 ALA O 1 1 13 4153 1 1 16 HIS C C 23.257 6.913 -3.542 1.00 . A A . 16 HIS C 1 1 13 4154 1 1 16 HIS CA C 23.666 8.182 -2.801 1.00 . A A . 16 HIS CA 1 1 13 4155 1 1 16 HIS CB C 24.129 7.834 -1.386 1.00 . A A . 16 HIS CB 1 1 13 4156 1 1 16 HIS CD2 C 25.961 9.524 -0.668 1.00 . A A . 16 HIS CD2 1 1 13 4157 1 1 16 HIS CE1 C 27.700 8.199 -0.831 1.00 . A A . 16 HIS CE1 1 1 13 4158 1 1 16 HIS CG C 25.513 8.312 -1.073 1.00 . A A . 16 HIS CG 1 1 13 4159 1 1 16 HIS H H 21.821 8.976 -2.133 1.00 . A A . 16 HIS H 1 1 13 4160 1 1 16 HIS HA H 24.483 8.647 -3.333 1.00 . A A . 16 HIS HA 1 1 13 4161 1 1 16 HIS HB2 H 23.454 8.284 -0.672 1.00 . A A . 16 HIS HB2 1 1 13 4162 1 1 16 HIS HB3 H 24.112 6.760 -1.262 1.00 . A A . 16 HIS HB3 1 1 13 4163 1 1 16 HIS HD1 H 26.631 6.564 -1.437 1.00 . A A . 16 HIS HD1 1 1 13 4164 1 1 16 HIS HD2 H 25.359 10.404 -0.490 1.00 . A A . 16 HIS HD2 1 1 13 4165 1 1 16 HIS HE1 H 28.714 7.827 -0.810 1.00 . A A . 16 HIS HE1 1 1 13 4166 1 1 16 HIS N N 22.563 9.135 -2.753 1.00 . A A . 16 HIS N 1 1 13 4167 1 1 16 HIS ND1 N 26.628 7.505 -1.166 1.00 . A A . 16 HIS ND1 1 1 13 4168 1 1 16 HIS NE2 N 27.323 9.427 -0.525 1.00 . A A . 16 HIS NE2 1 1 13 4169 1 1 16 HIS O O 24.106 6.133 -3.974 1.00 . A A . 16 HIS O 1 1 13 4170 1 1 17 ILE C C 22.061 5.384 -5.752 1.00 . A A . 17 ILE C 1 1 13 4171 1 1 17 ILE CA C 21.429 5.538 -4.373 1.00 . A A . 17 ILE CA 1 1 13 4172 1 1 17 ILE CB C 19.899 5.610 -4.527 1.00 . A A . 17 ILE CB 1 1 13 4173 1 1 17 ILE CD1 C 18.070 7.157 -5.387 1.00 . A A . 17 ILE CD1 1 1 13 4174 1 1 17 ILE CG1 C 19.514 6.723 -5.504 1.00 . A A . 17 ILE CG1 1 1 13 4175 1 1 17 ILE CG2 C 19.240 5.834 -3.174 1.00 . A A . 17 ILE CG2 1 1 13 4176 1 1 17 ILE H H 21.323 7.370 -3.318 1.00 . A A . 17 ILE H 1 1 13 4177 1 1 17 ILE HA H 21.671 4.669 -3.778 1.00 . A A . 17 ILE HA 1 1 13 4178 1 1 17 ILE HB H 19.554 4.664 -4.916 1.00 . A A . 17 ILE HB 1 1 13 4179 1 1 17 ILE HD11 H 17.427 6.291 -5.448 1.00 . A A . 17 ILE HD11 1 1 13 4180 1 1 17 ILE HD12 H 17.918 7.653 -4.440 1.00 . A A . 17 ILE HD12 1 1 13 4181 1 1 17 ILE HD13 H 17.832 7.837 -6.192 1.00 . A A . 17 ILE HD13 1 1 13 4182 1 1 17 ILE HG12 H 20.135 7.585 -5.320 1.00 . A A . 17 ILE HG12 1 1 13 4183 1 1 17 ILE HG13 H 19.676 6.376 -6.514 1.00 . A A . 17 ILE HG13 1 1 13 4184 1 1 17 ILE HG21 H 19.755 5.254 -2.422 1.00 . A A . 17 ILE HG21 1 1 13 4185 1 1 17 ILE HG22 H 19.292 6.881 -2.918 1.00 . A A . 17 ILE HG22 1 1 13 4186 1 1 17 ILE HG23 H 18.207 5.525 -3.221 1.00 . A A . 17 ILE HG23 1 1 13 4187 1 1 17 ILE N N 21.951 6.712 -3.684 1.00 . A A . 17 ILE N 1 1 13 4188 1 1 17 ILE O O 22.376 4.274 -6.181 1.00 . A A . 17 ILE O 1 1 13 4189 1 1 18 ARG C C 24.193 7.204 -7.768 1.00 . A A . 18 ARG C 1 1 13 4190 1 1 18 ARG CA C 22.841 6.495 -7.771 1.00 . A A . 18 ARG CA 1 1 13 4191 1 1 18 ARG CB C 21.905 7.166 -8.778 1.00 . A A . 18 ARG CB 1 1 13 4192 1 1 18 ARG CD C 20.303 9.080 -9.077 1.00 . A A . 18 ARG CD 1 1 13 4193 1 1 18 ARG CG C 21.619 8.626 -8.465 1.00 . A A . 18 ARG CG 1 1 13 4194 1 1 18 ARG CZ C 19.217 9.029 -11.282 1.00 . A A . 18 ARG CZ 1 1 13 4195 1 1 18 ARG H H 21.975 7.360 -6.045 1.00 . A A . 18 ARG H 1 1 13 4196 1 1 18 ARG HA H 22.989 5.466 -8.061 1.00 . A A . 18 ARG HA 1 1 13 4197 1 1 18 ARG HB2 H 22.351 7.112 -9.760 1.00 . A A . 18 ARG HB2 1 1 13 4198 1 1 18 ARG HB3 H 20.966 6.633 -8.788 1.00 . A A . 18 ARG HB3 1 1 13 4199 1 1 18 ARG HD2 H 19.508 8.462 -8.688 1.00 . A A . 18 ARG HD2 1 1 13 4200 1 1 18 ARG HD3 H 20.128 10.108 -8.799 1.00 . A A . 18 ARG HD3 1 1 13 4201 1 1 18 ARG HE H 21.181 8.864 -10.975 1.00 . A A . 18 ARG HE 1 1 13 4202 1 1 18 ARG HG2 H 21.567 8.751 -7.393 1.00 . A A . 18 ARG HG2 1 1 13 4203 1 1 18 ARG HG3 H 22.419 9.232 -8.861 1.00 . A A . 18 ARG HG3 1 1 13 4204 1 1 18 ARG HH11 H 17.958 9.259 -9.719 1.00 . A A . 18 ARG HH11 1 1 13 4205 1 1 18 ARG HH12 H 17.205 9.222 -11.279 1.00 . A A . 18 ARG HH12 1 1 13 4206 1 1 18 ARG HH21 H 20.201 8.814 -13.034 1.00 . A A . 18 ARG HH21 1 1 13 4207 1 1 18 ARG HH22 H 18.482 8.968 -13.164 1.00 . A A . 18 ARG HH22 1 1 13 4208 1 1 18 ARG N N 22.246 6.506 -6.441 1.00 . A A . 18 ARG N 1 1 13 4209 1 1 18 ARG NE N 20.313 8.977 -10.534 1.00 . A A . 18 ARG NE 1 1 13 4210 1 1 18 ARG NH1 N 18.029 9.182 -10.713 1.00 . A A . 18 ARG NH1 1 1 13 4211 1 1 18 ARG NH2 N 19.308 8.929 -12.602 1.00 . A A . 18 ARG NH2 1 1 13 4212 1 1 18 ARG O O 25.152 6.735 -8.380 1.00 . A A . 18 ARG O 1 1 14 4213 1 1 1 PHE C C 4.497 1.005 -3.128 1.00 . A A . 1 PHE C 1 1 14 4214 1 1 1 PHE CA C 4.504 0.935 -4.652 1.00 . A A . 1 PHE CA 1 1 14 4215 1 1 1 PHE CB C 4.724 -0.509 -5.106 1.00 . A A . 1 PHE CB 1 1 14 4216 1 1 1 PHE CD1 C 3.157 -1.683 -6.676 1.00 . A A . 1 PHE CD1 1 1 14 4217 1 1 1 PHE CD2 C 2.539 -1.506 -4.380 1.00 . A A . 1 PHE CD2 1 1 14 4218 1 1 1 PHE CE1 C 1.984 -2.364 -6.943 1.00 . A A . 1 PHE CE1 1 1 14 4219 1 1 1 PHE CE2 C 1.364 -2.186 -4.641 1.00 . A A . 1 PHE CE2 1 1 14 4220 1 1 1 PHE CG C 3.448 -1.248 -5.393 1.00 . A A . 1 PHE CG 1 1 14 4221 1 1 1 PHE CZ C 1.086 -2.615 -5.924 1.00 . A A . 1 PHE CZ 1 1 14 4222 1 1 1 PHE H1 H 5.331 2.345 -5.998 1.00 . A A . 1 PHE H1 1 1 14 4223 1 1 1 PHE HA H 3.550 1.279 -5.021 1.00 . A A . 1 PHE HA 1 1 14 4224 1 1 1 PHE HB2 H 5.316 -0.509 -6.009 1.00 . A A . 1 PHE HB2 1 1 14 4225 1 1 1 PHE HB3 H 5.253 -1.046 -4.333 1.00 . A A . 1 PHE HB3 1 1 14 4226 1 1 1 PHE HD1 H 3.859 -1.487 -7.474 1.00 . A A . 1 PHE HD1 1 1 14 4227 1 1 1 PHE HD2 H 2.754 -1.171 -3.376 1.00 . A A . 1 PHE HD2 1 1 14 4228 1 1 1 PHE HE1 H 1.770 -2.697 -7.948 1.00 . A A . 1 PHE HE1 1 1 14 4229 1 1 1 PHE HE2 H 0.663 -2.381 -3.843 1.00 . A A . 1 PHE HE2 1 1 14 4230 1 1 1 PHE HZ H 0.169 -3.146 -6.131 1.00 . A A . 1 PHE HZ 1 1 14 4231 1 1 1 PHE N N 5.536 1.803 -5.207 1.00 . A A . 1 PHE N 1 1 14 4232 1 1 1 PHE O O 3.504 1.404 -2.518 1.00 . A A . 1 PHE O 1 1 14 4233 1 1 2 LEU C C 5.724 2.062 -0.535 1.00 . A A . 2 LEU C 1 1 14 4234 1 1 2 LEU CA C 5.735 0.632 -1.065 1.00 . A A . 2 LEU CA 1 1 14 4235 1 1 2 LEU CB C 7.021 -0.074 -0.635 1.00 . A A . 2 LEU CB 1 1 14 4236 1 1 2 LEU CD1 C 6.254 -2.374 -1.273 1.00 . A A . 2 LEU CD1 1 1 14 4237 1 1 2 LEU CD2 C 8.215 -2.092 0.254 1.00 . A A . 2 LEU CD2 1 1 14 4238 1 1 2 LEU CG C 6.869 -1.524 -0.172 1.00 . A A . 2 LEU CG 1 1 14 4239 1 1 2 LEU H H 6.369 0.306 -3.058 1.00 . A A . 2 LEU H 1 1 14 4240 1 1 2 LEU HA H 4.888 0.102 -0.654 1.00 . A A . 2 LEU HA 1 1 14 4241 1 1 2 LEU HB2 H 7.700 -0.065 -1.473 1.00 . A A . 2 LEU HB2 1 1 14 4242 1 1 2 LEU HB3 H 7.451 0.491 0.180 1.00 . A A . 2 LEU HB3 1 1 14 4243 1 1 2 LEU HD11 H 6.070 -3.369 -0.898 1.00 . A A . 2 LEU HD11 1 1 14 4244 1 1 2 LEU HD12 H 6.934 -2.424 -2.110 1.00 . A A . 2 LEU HD12 1 1 14 4245 1 1 2 LEU HD13 H 5.322 -1.930 -1.592 1.00 . A A . 2 LEU HD13 1 1 14 4246 1 1 2 LEU HD21 H 8.120 -3.154 0.423 1.00 . A A . 2 LEU HD21 1 1 14 4247 1 1 2 LEU HD22 H 8.537 -1.610 1.166 1.00 . A A . 2 LEU HD22 1 1 14 4248 1 1 2 LEU HD23 H 8.943 -1.914 -0.524 1.00 . A A . 2 LEU HD23 1 1 14 4249 1 1 2 LEU HG H 6.207 -1.555 0.683 1.00 . A A . 2 LEU HG 1 1 14 4250 1 1 2 LEU N N 5.611 0.614 -2.519 1.00 . A A . 2 LEU N 1 1 14 4251 1 1 2 LEU O O 5.974 3.022 -1.263 1.00 . A A . 2 LEU O 1 1 14 4252 1 1 3 PRO C C 6.763 4.146 1.565 1.00 . A A . 3 PRO C 1 1 14 4253 1 1 3 PRO CA C 5.381 3.518 1.423 1.00 . A A . 3 PRO CA 1 1 14 4254 1 1 3 PRO CB C 4.794 3.201 2.801 1.00 . A A . 3 PRO CB 1 1 14 4255 1 1 3 PRO CD C 5.120 1.108 1.694 1.00 . A A . 3 PRO CD 1 1 14 4256 1 1 3 PRO CG C 5.142 1.773 3.042 1.00 . A A . 3 PRO CG 1 1 14 4257 1 1 3 PRO HA H 4.728 4.201 0.900 1.00 . A A . 3 PRO HA 1 1 14 4258 1 1 3 PRO HB2 H 5.240 3.849 3.543 1.00 . A A . 3 PRO HB2 1 1 14 4259 1 1 3 PRO HB3 H 3.724 3.349 2.783 1.00 . A A . 3 PRO HB3 1 1 14 4260 1 1 3 PRO HD2 H 5.873 0.336 1.641 1.00 . A A . 3 PRO HD2 1 1 14 4261 1 1 3 PRO HD3 H 4.141 0.697 1.491 1.00 . A A . 3 PRO HD3 1 1 14 4262 1 1 3 PRO HG2 H 6.126 1.704 3.479 1.00 . A A . 3 PRO HG2 1 1 14 4263 1 1 3 PRO HG3 H 4.408 1.322 3.694 1.00 . A A . 3 PRO HG3 1 1 14 4264 1 1 3 PRO N N 5.429 2.209 0.766 1.00 . A A . 3 PRO N 1 1 14 4265 1 1 3 PRO O O 7.782 3.473 1.408 1.00 . A A . 3 PRO O 1 1 14 4266 1 1 4 LYS C C 8.174 6.720 3.442 1.00 . A A . 4 LYS C 1 1 14 4267 1 1 4 LYS CA C 8.049 6.160 2.029 1.00 . A A . 4 LYS CA 1 1 14 4268 1 1 4 LYS CB C 8.148 7.297 1.008 1.00 . A A . 4 LYS CB 1 1 14 4269 1 1 4 LYS CD C 6.858 9.201 -0.001 1.00 . A A . 4 LYS CD 1 1 14 4270 1 1 4 LYS CE C 7.851 9.364 -1.142 1.00 . A A . 4 LYS CE 1 1 14 4271 1 1 4 LYS CG C 6.800 7.763 0.485 1.00 . A A . 4 LYS CG 1 1 14 4272 1 1 4 LYS H H 5.946 5.924 1.976 1.00 . A A . 4 LYS H 1 1 14 4273 1 1 4 LYS HA H 8.855 5.464 1.858 1.00 . A A . 4 LYS HA 1 1 14 4274 1 1 4 LYS HB2 H 8.642 8.138 1.471 1.00 . A A . 4 LYS HB2 1 1 14 4275 1 1 4 LYS HB3 H 8.739 6.960 0.169 1.00 . A A . 4 LYS HB3 1 1 14 4276 1 1 4 LYS HD2 H 5.879 9.496 -0.347 1.00 . A A . 4 LYS HD2 1 1 14 4277 1 1 4 LYS HD3 H 7.159 9.838 0.819 1.00 . A A . 4 LYS HD3 1 1 14 4278 1 1 4 LYS HE2 H 8.843 9.154 -0.772 1.00 . A A . 4 LYS HE2 1 1 14 4279 1 1 4 LYS HE3 H 7.601 8.660 -1.922 1.00 . A A . 4 LYS HE3 1 1 14 4280 1 1 4 LYS HG2 H 6.504 7.128 -0.337 1.00 . A A . 4 LYS HG2 1 1 14 4281 1 1 4 LYS HG3 H 6.071 7.691 1.280 1.00 . A A . 4 LYS HG3 1 1 14 4282 1 1 4 LYS HZ1 H 8.797 11.073 -1.882 1.00 . A A . 4 LYS HZ1 1 1 14 4283 1 1 4 LYS HZ2 H 7.366 11.393 -1.039 1.00 . A A . 4 LYS HZ2 1 1 14 4284 1 1 4 LYS HZ3 H 7.300 10.752 -2.603 1.00 . A A . 4 LYS HZ3 1 1 14 4285 1 1 4 LYS N N 6.792 5.440 1.864 1.00 . A A . 4 LYS N 1 1 14 4286 1 1 4 LYS NZ N 7.826 10.742 -1.707 1.00 . A A . 4 LYS NZ 1 1 14 4287 1 1 4 LYS O O 8.705 7.814 3.643 1.00 . A A . 4 LYS O 1 1 14 4288 1 1 5 LEU C C 9.111 6.966 6.151 1.00 . A A . 5 LEU C 1 1 14 4289 1 1 5 LEU CA C 7.741 6.385 5.814 1.00 . A A . 5 LEU CA 1 1 14 4290 1 1 5 LEU CB C 7.435 5.203 6.736 1.00 . A A . 5 LEU CB 1 1 14 4291 1 1 5 LEU CD1 C 8.567 3.089 7.465 1.00 . A A . 5 LEU CD1 1 1 14 4292 1 1 5 LEU CD2 C 6.872 3.027 5.627 1.00 . A A . 5 LEU CD2 1 1 14 4293 1 1 5 LEU CG C 7.973 3.844 6.286 1.00 . A A . 5 LEU CG 1 1 14 4294 1 1 5 LEU H H 7.272 5.104 4.196 1.00 . A A . 5 LEU H 1 1 14 4295 1 1 5 LEU HA H 6.993 7.149 5.961 1.00 . A A . 5 LEU HA 1 1 14 4296 1 1 5 LEU HB2 H 7.858 5.422 7.705 1.00 . A A . 5 LEU HB2 1 1 14 4297 1 1 5 LEU HB3 H 6.361 5.123 6.824 1.00 . A A . 5 LEU HB3 1 1 14 4298 1 1 5 LEU HD11 H 9.385 2.473 7.122 1.00 . A A . 5 LEU HD11 1 1 14 4299 1 1 5 LEU HD12 H 7.808 2.464 7.912 1.00 . A A . 5 LEU HD12 1 1 14 4300 1 1 5 LEU HD13 H 8.930 3.794 8.198 1.00 . A A . 5 LEU HD13 1 1 14 4301 1 1 5 LEU HD21 H 6.875 3.211 4.563 1.00 . A A . 5 LEU HD21 1 1 14 4302 1 1 5 LEU HD22 H 5.915 3.314 6.039 1.00 . A A . 5 LEU HD22 1 1 14 4303 1 1 5 LEU HD23 H 7.043 1.977 5.812 1.00 . A A . 5 LEU HD23 1 1 14 4304 1 1 5 LEU HG H 8.758 3.998 5.559 1.00 . A A . 5 LEU HG 1 1 14 4305 1 1 5 LEU N N 7.683 5.965 4.418 1.00 . A A . 5 LEU N 1 1 14 4306 1 1 5 LEU O O 9.217 7.938 6.899 1.00 . A A . 5 LEU O 1 1 14 4307 1 1 6 PHE C C 12.213 7.180 4.520 1.00 . A A . 6 PHE C 1 1 14 4308 1 1 6 PHE CA C 11.519 6.825 5.832 1.00 . A A . 6 PHE CA 1 1 14 4309 1 1 6 PHE CB C 12.319 5.751 6.571 1.00 . A A . 6 PHE CB 1 1 14 4310 1 1 6 PHE CD1 C 14.658 6.283 7.308 1.00 . A A . 6 PHE CD1 1 1 14 4311 1 1 6 PHE CD2 C 12.855 6.858 8.758 1.00 . A A . 6 PHE CD2 1 1 14 4312 1 1 6 PHE CE1 C 15.561 6.796 8.221 1.00 . A A . 6 PHE CE1 1 1 14 4313 1 1 6 PHE CE2 C 13.752 7.372 9.674 1.00 . A A . 6 PHE CE2 1 1 14 4314 1 1 6 PHE CG C 13.297 6.308 7.565 1.00 . A A . 6 PHE CG 1 1 14 4315 1 1 6 PHE CZ C 15.107 7.340 9.406 1.00 . A A . 6 PHE CZ 1 1 14 4316 1 1 6 PHE H H 10.008 5.596 5.004 1.00 . A A . 6 PHE H 1 1 14 4317 1 1 6 PHE HA H 11.467 7.710 6.448 1.00 . A A . 6 PHE HA 1 1 14 4318 1 1 6 PHE HB2 H 11.636 5.106 7.104 1.00 . A A . 6 PHE HB2 1 1 14 4319 1 1 6 PHE HB3 H 12.873 5.166 5.852 1.00 . A A . 6 PHE HB3 1 1 14 4320 1 1 6 PHE HD1 H 15.014 5.857 6.380 1.00 . A A . 6 PHE HD1 1 1 14 4321 1 1 6 PHE HD2 H 11.796 6.883 8.970 1.00 . A A . 6 PHE HD2 1 1 14 4322 1 1 6 PHE HE1 H 16.619 6.769 8.007 1.00 . A A . 6 PHE HE1 1 1 14 4323 1 1 6 PHE HE2 H 13.395 7.797 10.601 1.00 . A A . 6 PHE HE2 1 1 14 4324 1 1 6 PHE HZ H 15.810 7.742 10.120 1.00 . A A . 6 PHE HZ 1 1 14 4325 1 1 6 PHE N N 10.156 6.367 5.592 1.00 . A A . 6 PHE N 1 1 14 4326 1 1 6 PHE O O 13.307 7.743 4.516 1.00 . A A . 6 PHE O 1 1 14 4327 1 1 7 ALA C C 12.058 8.618 1.775 1.00 . A A . 7 ALA C 1 1 14 4328 1 1 7 ALA CA C 12.122 7.127 2.089 1.00 . A A . 7 ALA CA 1 1 14 4329 1 1 7 ALA CB C 11.383 6.330 1.024 1.00 . A A . 7 ALA CB 1 1 14 4330 1 1 7 ALA H H 10.700 6.396 3.475 1.00 . A A . 7 ALA H 1 1 14 4331 1 1 7 ALA HA H 13.156 6.813 2.086 1.00 . A A . 7 ALA HA 1 1 14 4332 1 1 7 ALA HB1 H 10.818 5.538 1.495 1.00 . A A . 7 ALA HB1 1 1 14 4333 1 1 7 ALA HB2 H 10.710 6.983 0.488 1.00 . A A . 7 ALA HB2 1 1 14 4334 1 1 7 ALA HB3 H 12.096 5.903 0.335 1.00 . A A . 7 ALA HB3 1 1 14 4335 1 1 7 ALA N N 11.569 6.844 3.407 1.00 . A A . 7 ALA N 1 1 14 4336 1 1 7 ALA O O 12.877 9.140 1.019 1.00 . A A . 7 ALA O 1 1 14 4337 1 1 8 LYS C C 11.718 11.535 3.159 1.00 . A A . 8 LYS C 1 1 14 4338 1 1 8 LYS CA C 10.908 10.732 2.146 1.00 . A A . 8 LYS CA 1 1 14 4339 1 1 8 LYS CB C 9.429 11.110 2.245 1.00 . A A . 8 LYS CB 1 1 14 4340 1 1 8 LYS CD C 8.136 11.925 4.239 1.00 . A A . 8 LYS CD 1 1 14 4341 1 1 8 LYS CE C 6.806 12.270 3.587 1.00 . A A . 8 LYS CE 1 1 14 4342 1 1 8 LYS CG C 8.791 10.728 3.569 1.00 . A A . 8 LYS CG 1 1 14 4343 1 1 8 LYS H H 10.457 8.828 2.955 1.00 . A A . 8 LYS H 1 1 14 4344 1 1 8 LYS HA H 11.265 10.963 1.154 1.00 . A A . 8 LYS HA 1 1 14 4345 1 1 8 LYS HB2 H 9.333 12.178 2.118 1.00 . A A . 8 LYS HB2 1 1 14 4346 1 1 8 LYS HB3 H 8.889 10.612 1.452 1.00 . A A . 8 LYS HB3 1 1 14 4347 1 1 8 LYS HD2 H 7.965 11.696 5.280 1.00 . A A . 8 LYS HD2 1 1 14 4348 1 1 8 LYS HD3 H 8.798 12.776 4.160 1.00 . A A . 8 LYS HD3 1 1 14 4349 1 1 8 LYS HE2 H 6.987 12.568 2.566 1.00 . A A . 8 LYS HE2 1 1 14 4350 1 1 8 LYS HE3 H 6.176 11.393 3.599 1.00 . A A . 8 LYS HE3 1 1 14 4351 1 1 8 LYS HG2 H 8.039 9.973 3.392 1.00 . A A . 8 LYS HG2 1 1 14 4352 1 1 8 LYS HG3 H 9.553 10.333 4.225 1.00 . A A . 8 LYS HG3 1 1 14 4353 1 1 8 LYS HZ1 H 6.757 13.827 4.978 1.00 . A A . 8 LYS HZ1 1 1 14 4354 1 1 8 LYS HZ2 H 5.286 13.007 4.815 1.00 . A A . 8 LYS HZ2 1 1 14 4355 1 1 8 LYS HZ3 H 5.787 14.093 3.618 1.00 . A A . 8 LYS HZ3 1 1 14 4356 1 1 8 LYS N N 11.080 9.300 2.362 1.00 . A A . 8 LYS N 1 1 14 4357 1 1 8 LYS NZ N 6.110 13.377 4.299 1.00 . A A . 8 LYS NZ 1 1 14 4358 1 1 8 LYS O O 12.217 12.618 2.850 1.00 . A A . 8 LYS O 1 1 14 4359 1 1 9 ILE C C 14.098 11.584 5.165 1.00 . A A . 9 ILE C 1 1 14 4360 1 1 9 ILE CA C 12.597 11.664 5.424 1.00 . A A . 9 ILE CA 1 1 14 4361 1 1 9 ILE CB C 12.292 11.052 6.803 1.00 . A A . 9 ILE CB 1 1 14 4362 1 1 9 ILE CD1 C 14.456 10.058 7.704 1.00 . A A . 9 ILE CD1 1 1 14 4363 1 1 9 ILE CG1 C 13.132 9.791 7.023 1.00 . A A . 9 ILE CG1 1 1 14 4364 1 1 9 ILE CG2 C 10.809 10.735 6.927 1.00 . A A . 9 ILE CG2 1 1 14 4365 1 1 9 ILE H H 11.426 10.132 4.552 1.00 . A A . 9 ILE H 1 1 14 4366 1 1 9 ILE HA H 12.300 12.703 5.439 1.00 . A A . 9 ILE HA 1 1 14 4367 1 1 9 ILE HB H 12.545 11.780 7.559 1.00 . A A . 9 ILE HB 1 1 14 4368 1 1 9 ILE HD11 H 14.385 9.789 8.748 1.00 . A A . 9 ILE HD11 1 1 14 4369 1 1 9 ILE HD12 H 15.229 9.471 7.232 1.00 . A A . 9 ILE HD12 1 1 14 4370 1 1 9 ILE HD13 H 14.699 11.108 7.620 1.00 . A A . 9 ILE HD13 1 1 14 4371 1 1 9 ILE HG12 H 12.577 9.099 7.637 1.00 . A A . 9 ILE HG12 1 1 14 4372 1 1 9 ILE HG13 H 13.336 9.333 6.066 1.00 . A A . 9 ILE HG13 1 1 14 4373 1 1 9 ILE HG21 H 10.650 9.682 6.750 1.00 . A A . 9 ILE HG21 1 1 14 4374 1 1 9 ILE HG22 H 10.469 10.988 7.919 1.00 . A A . 9 ILE HG22 1 1 14 4375 1 1 9 ILE HG23 H 10.257 11.310 6.199 1.00 . A A . 9 ILE HG23 1 1 14 4376 1 1 9 ILE N N 11.846 10.997 4.367 1.00 . A A . 9 ILE N 1 1 14 4377 1 1 9 ILE O O 14.862 12.445 5.603 1.00 . A A . 9 ILE O 1 1 14 4378 1 1 10 THR C C 16.319 11.138 2.885 1.00 . A A . 10 THR C 1 1 14 4379 1 1 10 THR CA C 15.924 10.352 4.130 1.00 . A A . 10 THR CA 1 1 14 4380 1 1 10 THR CB C 16.251 8.863 3.908 1.00 . A A . 10 THR CB 1 1 14 4381 1 1 10 THR CG2 C 16.225 8.101 5.224 1.00 . A A . 10 THR CG2 1 1 14 4382 1 1 10 THR H H 13.858 9.892 4.128 1.00 . A A . 10 THR H 1 1 14 4383 1 1 10 THR HA H 16.507 10.706 4.968 1.00 . A A . 10 THR HA 1 1 14 4384 1 1 10 THR HB H 17.243 8.787 3.485 1.00 . A A . 10 THR HB 1 1 14 4385 1 1 10 THR HG1 H 15.458 7.338 2.941 1.00 . A A . 10 THR HG1 1 1 14 4386 1 1 10 THR HG21 H 15.244 8.184 5.669 1.00 . A A . 10 THR HG21 1 1 14 4387 1 1 10 THR HG22 H 16.961 8.516 5.896 1.00 . A A . 10 THR HG22 1 1 14 4388 1 1 10 THR HG23 H 16.449 7.061 5.042 1.00 . A A . 10 THR HG23 1 1 14 4389 1 1 10 THR N N 14.515 10.544 4.448 1.00 . A A . 10 THR N 1 1 14 4390 1 1 10 THR O O 15.758 10.939 1.808 1.00 . A A . 10 THR O 1 1 14 4391 1 1 10 THR OG1 O 15.310 8.285 2.997 1.00 . A A . 10 THR OG1 1 1 14 4392 1 1 11 LYS C C 19.247 12.608 1.669 1.00 . A A . 11 LYS C 1 1 14 4393 1 1 11 LYS CA C 17.763 12.848 1.928 1.00 . A A . 11 LYS CA 1 1 14 4394 1 1 11 LYS CB C 17.518 14.331 2.217 1.00 . A A . 11 LYS CB 1 1 14 4395 1 1 11 LYS CD C 16.797 14.570 4.611 1.00 . A A . 11 LYS CD 1 1 14 4396 1 1 11 LYS CE C 16.980 15.455 5.835 1.00 . A A . 11 LYS CE 1 1 14 4397 1 1 11 LYS CG C 17.931 14.754 3.616 1.00 . A A . 11 LYS CG 1 1 14 4398 1 1 11 LYS H H 17.699 12.145 3.924 1.00 . A A . 11 LYS H 1 1 14 4399 1 1 11 LYS HA H 17.206 12.565 1.048 1.00 . A A . 11 LYS HA 1 1 14 4400 1 1 11 LYS HB2 H 18.077 14.921 1.505 1.00 . A A . 11 LYS HB2 1 1 14 4401 1 1 11 LYS HB3 H 16.465 14.540 2.096 1.00 . A A . 11 LYS HB3 1 1 14 4402 1 1 11 LYS HD2 H 15.864 14.826 4.132 1.00 . A A . 11 LYS HD2 1 1 14 4403 1 1 11 LYS HD3 H 16.771 13.536 4.926 1.00 . A A . 11 LYS HD3 1 1 14 4404 1 1 11 LYS HE2 H 16.743 14.880 6.717 1.00 . A A . 11 LYS HE2 1 1 14 4405 1 1 11 LYS HE3 H 18.011 15.775 5.880 1.00 . A A . 11 LYS HE3 1 1 14 4406 1 1 11 LYS HG2 H 18.772 14.155 3.930 1.00 . A A . 11 LYS HG2 1 1 14 4407 1 1 11 LYS HG3 H 18.215 15.797 3.598 1.00 . A A . 11 LYS HG3 1 1 14 4408 1 1 11 LYS HZ1 H 16.581 17.430 5.285 1.00 . A A . 11 LYS HZ1 1 1 14 4409 1 1 11 LYS HZ2 H 15.874 16.971 6.752 1.00 . A A . 11 LYS HZ2 1 1 14 4410 1 1 11 LYS HZ3 H 15.216 16.432 5.290 1.00 . A A . 11 LYS HZ3 1 1 14 4411 1 1 11 LYS N N 17.290 12.032 3.040 1.00 . A A . 11 LYS N 1 1 14 4412 1 1 11 LYS NZ N 16.101 16.656 5.787 1.00 . A A . 11 LYS NZ 1 1 14 4413 1 1 11 LYS O O 19.901 13.389 0.978 1.00 . A A . 11 LYS O 1 1 14 4414 1 1 12 LYS C C 21.338 10.033 1.058 1.00 . A A . 12 LYS C 1 1 14 4415 1 1 12 LYS CA C 21.178 11.177 2.054 1.00 . A A . 12 LYS CA 1 1 14 4416 1 1 12 LYS CB C 21.797 10.788 3.399 1.00 . A A . 12 LYS CB 1 1 14 4417 1 1 12 LYS CD C 21.749 11.128 5.887 1.00 . A A . 12 LYS CD 1 1 14 4418 1 1 12 LYS CE C 21.248 12.150 6.896 1.00 . A A . 12 LYS CE 1 1 14 4419 1 1 12 LYS CG C 20.950 11.183 4.596 1.00 . A A . 12 LYS CG 1 1 14 4420 1 1 12 LYS H H 19.199 10.938 2.767 1.00 . A A . 12 LYS H 1 1 14 4421 1 1 12 LYS HA H 21.688 12.047 1.670 1.00 . A A . 12 LYS HA 1 1 14 4422 1 1 12 LYS HB2 H 21.937 9.717 3.420 1.00 . A A . 12 LYS HB2 1 1 14 4423 1 1 12 LYS HB3 H 22.760 11.270 3.491 1.00 . A A . 12 LYS HB3 1 1 14 4424 1 1 12 LYS HD2 H 21.657 10.141 6.316 1.00 . A A . 12 LYS HD2 1 1 14 4425 1 1 12 LYS HD3 H 22.787 11.332 5.666 1.00 . A A . 12 LYS HD3 1 1 14 4426 1 1 12 LYS HE2 H 21.980 12.248 7.683 1.00 . A A . 12 LYS HE2 1 1 14 4427 1 1 12 LYS HE3 H 21.128 13.100 6.397 1.00 . A A . 12 LYS HE3 1 1 14 4428 1 1 12 LYS HG2 H 20.587 12.190 4.452 1.00 . A A . 12 LYS HG2 1 1 14 4429 1 1 12 LYS HG3 H 20.112 10.504 4.672 1.00 . A A . 12 LYS HG3 1 1 14 4430 1 1 12 LYS HZ1 H 20.083 11.437 8.476 1.00 . A A . 12 LYS HZ1 1 1 14 4431 1 1 12 LYS HZ2 H 19.529 10.965 6.949 1.00 . A A . 12 LYS HZ2 1 1 14 4432 1 1 12 LYS HZ3 H 19.284 12.551 7.484 1.00 . A A . 12 LYS HZ3 1 1 14 4433 1 1 12 LYS N N 19.772 11.522 2.227 1.00 . A A . 12 LYS N 1 1 14 4434 1 1 12 LYS NZ N 19.945 11.748 7.493 1.00 . A A . 12 LYS NZ 1 1 14 4435 1 1 12 LYS O O 21.819 10.231 -0.057 1.00 . A A . 12 LYS O 1 1 14 4436 1 1 13 ASN C C 20.163 7.820 -0.634 1.00 . A A . 13 ASN C 1 1 14 4437 1 1 13 ASN CA C 21.031 7.660 0.611 1.00 . A A . 13 ASN CA 1 1 14 4438 1 1 13 ASN CB C 20.611 6.405 1.381 1.00 . A A . 13 ASN CB 1 1 14 4439 1 1 13 ASN CG C 21.766 5.446 1.595 1.00 . A A . 13 ASN CG 1 1 14 4440 1 1 13 ASN H H 20.558 8.740 2.369 1.00 . A A . 13 ASN H 1 1 14 4441 1 1 13 ASN HA H 22.061 7.557 0.307 1.00 . A A . 13 ASN HA 1 1 14 4442 1 1 13 ASN HB2 H 20.225 6.695 2.347 1.00 . A A . 13 ASN HB2 1 1 14 4443 1 1 13 ASN HB3 H 19.839 5.892 0.828 1.00 . A A . 13 ASN HB3 1 1 14 4444 1 1 13 ASN HD21 H 21.279 4.451 -0.056 1.00 . A A . 13 ASN HD21 1 1 14 4445 1 1 13 ASN HD22 H 22.652 3.852 0.804 1.00 . A A . 13 ASN HD22 1 1 14 4446 1 1 13 ASN N N 20.932 8.835 1.469 1.00 . A A . 13 ASN N 1 1 14 4447 1 1 13 ASN ND2 N 21.914 4.486 0.690 1.00 . A A . 13 ASN ND2 1 1 14 4448 1 1 13 ASN O O 20.356 7.124 -1.630 1.00 . A A . 13 ASN O 1 1 14 4449 1 1 13 ASN OD1 O 22.516 5.567 2.564 1.00 . A A . 13 ASN OD1 1 1 14 4450 1 1 14 MET C C 19.099 9.411 -2.931 1.00 . A A . 14 MET C 1 1 14 4451 1 1 14 MET CA C 18.313 8.996 -1.691 1.00 . A A . 14 MET CA 1 1 14 4452 1 1 14 MET CB C 17.300 10.082 -1.328 1.00 . A A . 14 MET CB 1 1 14 4453 1 1 14 MET CE C 14.531 7.976 -2.153 1.00 . A A . 14 MET CE 1 1 14 4454 1 1 14 MET CG C 16.162 10.210 -2.327 1.00 . A A . 14 MET CG 1 1 14 4455 1 1 14 MET H H 19.105 9.266 0.253 1.00 . A A . 14 MET H 1 1 14 4456 1 1 14 MET HA H 17.784 8.079 -1.906 1.00 . A A . 14 MET HA 1 1 14 4457 1 1 14 MET HB2 H 16.877 9.854 -0.361 1.00 . A A . 14 MET HB2 1 1 14 4458 1 1 14 MET HB3 H 17.811 11.032 -1.274 1.00 . A A . 14 MET HB3 1 1 14 4459 1 1 14 MET HE1 H 14.016 7.391 -1.406 1.00 . A A . 14 MET HE1 1 1 14 4460 1 1 14 MET HE2 H 14.011 7.894 -3.096 1.00 . A A . 14 MET HE2 1 1 14 4461 1 1 14 MET HE3 H 15.541 7.608 -2.265 1.00 . A A . 14 MET HE3 1 1 14 4462 1 1 14 MET HG2 H 16.084 11.242 -2.635 1.00 . A A . 14 MET HG2 1 1 14 4463 1 1 14 MET HG3 H 16.386 9.596 -3.187 1.00 . A A . 14 MET HG3 1 1 14 4464 1 1 14 MET N N 19.209 8.742 -0.568 1.00 . A A . 14 MET N 1 1 14 4465 1 1 14 MET O O 18.948 8.822 -4.000 1.00 . A A . 14 MET O 1 1 14 4466 1 1 14 MET SD S 14.575 9.692 -1.644 1.00 . A A . 14 MET SD 1 1 14 4467 1 1 15 ALA C C 21.920 9.988 -4.169 1.00 . A A . 15 ALA C 1 1 14 4468 1 1 15 ALA CA C 20.750 10.924 -3.886 1.00 . A A . 15 ALA CA 1 1 14 4469 1 1 15 ALA CB C 21.255 12.327 -3.585 1.00 . A A . 15 ALA CB 1 1 14 4470 1 1 15 ALA H H 20.016 10.860 -1.902 1.00 . A A . 15 ALA H 1 1 14 4471 1 1 15 ALA HA H 20.121 10.974 -4.763 1.00 . A A . 15 ALA HA 1 1 14 4472 1 1 15 ALA HB1 H 21.771 12.716 -4.451 1.00 . A A . 15 ALA HB1 1 1 14 4473 1 1 15 ALA HB2 H 20.418 12.967 -3.347 1.00 . A A . 15 ALA HB2 1 1 14 4474 1 1 15 ALA HB3 H 21.933 12.293 -2.746 1.00 . A A . 15 ALA HB3 1 1 14 4475 1 1 15 ALA N N 19.939 10.431 -2.779 1.00 . A A . 15 ALA N 1 1 14 4476 1 1 15 ALA O O 22.721 10.235 -5.070 1.00 . A A . 15 ALA O 1 1 14 4477 1 1 16 HIS C C 22.570 6.674 -4.241 1.00 . A A . 16 HIS C 1 1 14 4478 1 1 16 HIS CA C 23.086 7.939 -3.560 1.00 . A A . 16 HIS CA 1 1 14 4479 1 1 16 HIS CB C 23.702 7.589 -2.206 1.00 . A A . 16 HIS CB 1 1 14 4480 1 1 16 HIS CD2 C 26.155 8.013 -2.930 1.00 . A A . 16 HIS CD2 1 1 14 4481 1 1 16 HIS CE1 C 26.891 8.903 -1.066 1.00 . A A . 16 HIS CE1 1 1 14 4482 1 1 16 HIS CG C 25.121 8.043 -2.058 1.00 . A A . 16 HIS CG 1 1 14 4483 1 1 16 HIS H H 21.343 8.770 -2.691 1.00 . A A . 16 HIS H 1 1 14 4484 1 1 16 HIS HA H 23.844 8.385 -4.186 1.00 . A A . 16 HIS HA 1 1 14 4485 1 1 16 HIS HB2 H 23.121 8.055 -1.423 1.00 . A A . 16 HIS HB2 1 1 14 4486 1 1 16 HIS HB3 H 23.680 6.516 -2.074 1.00 . A A . 16 HIS HB3 1 1 14 4487 1 1 16 HIS HD1 H 25.105 8.762 -0.078 1.00 . A A . 16 HIS HD1 1 1 14 4488 1 1 16 HIS HD2 H 26.130 7.636 -3.943 1.00 . A A . 16 HIS HD2 1 1 14 4489 1 1 16 HIS HE1 H 27.536 9.355 -0.328 1.00 . A A . 16 HIS HE1 1 1 14 4490 1 1 16 HIS N N 22.013 8.912 -3.393 1.00 . A A . 16 HIS N 1 1 14 4491 1 1 16 HIS ND1 N 25.615 8.604 -0.899 1.00 . A A . 16 HIS ND1 1 1 14 4492 1 1 16 HIS NE2 N 27.244 8.554 -2.290 1.00 . A A . 16 HIS NE2 1 1 14 4493 1 1 16 HIS O O 23.350 5.877 -4.762 1.00 . A A . 16 HIS O 1 1 14 4494 1 1 17 ILE C C 21.102 5.157 -6.288 1.00 . A A . 17 ILE C 1 1 14 4495 1 1 17 ILE CA C 20.635 5.330 -4.846 1.00 . A A . 17 ILE CA 1 1 14 4496 1 1 17 ILE CB C 19.099 5.429 -4.824 1.00 . A A . 17 ILE CB 1 1 14 4497 1 1 17 ILE CD1 C 17.211 7.005 -5.480 1.00 . A A . 17 ILE CD1 1 1 14 4498 1 1 17 ILE CG1 C 18.624 6.544 -5.758 1.00 . A A . 17 ILE CG1 1 1 14 4499 1 1 17 ILE CG2 C 18.604 5.672 -3.406 1.00 . A A . 17 ILE CG2 1 1 14 4500 1 1 17 ILE H H 20.684 7.168 -3.799 1.00 . A A . 17 ILE H 1 1 14 4501 1 1 17 ILE HA H 20.928 4.459 -4.278 1.00 . A A . 17 ILE HA 1 1 14 4502 1 1 17 ILE HB H 18.694 4.488 -5.164 1.00 . A A . 17 ILE HB 1 1 14 4503 1 1 17 ILE HD11 H 16.894 7.686 -6.256 1.00 . A A . 17 ILE HD11 1 1 14 4504 1 1 17 ILE HD12 H 16.551 6.151 -5.457 1.00 . A A . 17 ILE HD12 1 1 14 4505 1 1 17 ILE HD13 H 17.178 7.510 -4.525 1.00 . A A . 17 ILE HD13 1 1 14 4506 1 1 17 ILE HG12 H 19.277 7.396 -5.652 1.00 . A A . 17 ILE HG12 1 1 14 4507 1 1 17 ILE HG13 H 18.664 6.190 -6.778 1.00 . A A . 17 ILE HG13 1 1 14 4508 1 1 17 ILE HG21 H 19.192 5.087 -2.715 1.00 . A A . 17 ILE HG21 1 1 14 4509 1 1 17 ILE HG22 H 18.704 6.720 -3.165 1.00 . A A . 17 ILE HG22 1 1 14 4510 1 1 17 ILE HG23 H 17.567 5.383 -3.332 1.00 . A A . 17 ILE HG23 1 1 14 4511 1 1 17 ILE N N 21.254 6.497 -4.230 1.00 . A A . 17 ILE N 1 1 14 4512 1 1 17 ILE O O 21.345 4.039 -6.743 1.00 . A A . 17 ILE O 1 1 14 4513 1 1 18 ARG C C 22.963 5.455 -8.537 1.00 . A A . 18 ARG C 1 1 14 4514 1 1 18 ARG CA C 21.664 6.244 -8.391 1.00 . A A . 18 ARG CA 1 1 14 4515 1 1 18 ARG CB C 21.859 7.668 -8.916 1.00 . A A . 18 ARG CB 1 1 14 4516 1 1 18 ARG CD C 20.801 9.546 -10.207 1.00 . A A . 18 ARG CD 1 1 14 4517 1 1 18 ARG CG C 20.906 8.039 -10.040 1.00 . A A . 18 ARG CG 1 1 14 4518 1 1 18 ARG CZ C 22.363 10.034 -12.042 1.00 . A A . 18 ARG CZ 1 1 14 4519 1 1 18 ARG H H 21.018 7.133 -6.583 1.00 . A A . 18 ARG H 1 1 14 4520 1 1 18 ARG HA H 20.895 5.758 -8.972 1.00 . A A . 18 ARG HA 1 1 14 4521 1 1 18 ARG HB2 H 21.709 8.362 -8.102 1.00 . A A . 18 ARG HB2 1 1 14 4522 1 1 18 ARG HB3 H 22.870 7.768 -9.282 1.00 . A A . 18 ARG HB3 1 1 14 4523 1 1 18 ARG HD2 H 19.979 9.766 -10.871 1.00 . A A . 18 ARG HD2 1 1 14 4524 1 1 18 ARG HD3 H 20.611 9.990 -9.241 1.00 . A A . 18 ARG HD3 1 1 14 4525 1 1 18 ARG HE H 22.621 10.597 -10.146 1.00 . A A . 18 ARG HE 1 1 14 4526 1 1 18 ARG HG2 H 21.268 7.610 -10.963 1.00 . A A . 18 ARG HG2 1 1 14 4527 1 1 18 ARG HG3 H 19.927 7.641 -9.815 1.00 . A A . 18 ARG HG3 1 1 14 4528 1 1 18 ARG HH11 H 20.722 8.984 -12.578 1.00 . A A . 18 ARG HH11 1 1 14 4529 1 1 18 ARG HH12 H 21.831 9.334 -13.862 1.00 . A A . 18 ARG HH12 1 1 14 4530 1 1 18 ARG HH21 H 24.088 11.065 -11.828 1.00 . A A . 18 ARG HH21 1 1 14 4531 1 1 18 ARG HH22 H 23.746 10.517 -13.434 1.00 . A A . 18 ARG HH22 1 1 14 4532 1 1 18 ARG N N 21.226 6.271 -7.001 1.00 . A A . 18 ARG N 1 1 14 4533 1 1 18 ARG NE N 22.024 10.122 -10.760 1.00 . A A . 18 ARG NE 1 1 14 4534 1 1 18 ARG NH1 N 21.574 9.398 -12.897 1.00 . A A . 18 ARG NH1 1 1 14 4535 1 1 18 ARG NH2 N 23.492 10.584 -12.470 1.00 . A A . 18 ARG NH2 1 1 14 4536 1 1 18 ARG O O 23.965 5.768 -7.895 1.00 . A A . 18 ARG O 1 1 15 4537 1 1 1 PHE C C 6.260 -0.553 -3.301 1.00 . A A . 1 PHE C 1 1 15 4538 1 1 1 PHE CA C 6.478 -0.631 -4.809 1.00 . A A . 1 PHE CA 1 1 15 4539 1 1 1 PHE CB C 6.950 0.725 -5.339 1.00 . A A . 1 PHE CB 1 1 15 4540 1 1 1 PHE CD1 C 8.563 0.428 -7.238 1.00 . A A . 1 PHE CD1 1 1 15 4541 1 1 1 PHE CD2 C 9.436 0.943 -5.079 1.00 . A A . 1 PHE CD2 1 1 15 4542 1 1 1 PHE CE1 C 9.845 0.404 -7.754 1.00 . A A . 1 PHE CE1 1 1 15 4543 1 1 1 PHE CE2 C 10.720 0.920 -5.590 1.00 . A A . 1 PHE CE2 1 1 15 4544 1 1 1 PHE CG C 8.344 0.698 -5.896 1.00 . A A . 1 PHE CG 1 1 15 4545 1 1 1 PHE CZ C 10.925 0.649 -6.929 1.00 . A A . 1 PHE CZ 1 1 15 4546 1 1 1 PHE H1 H 4.417 -0.578 -5.291 1.00 . A A . 1 PHE H1 1 1 15 4547 1 1 1 PHE HA H 7.237 -1.371 -5.013 1.00 . A A . 1 PHE HA 1 1 15 4548 1 1 1 PHE HB2 H 6.285 1.047 -6.125 1.00 . A A . 1 PHE HB2 1 1 15 4549 1 1 1 PHE HB3 H 6.926 1.445 -4.535 1.00 . A A . 1 PHE HB3 1 1 15 4550 1 1 1 PHE HD1 H 7.719 0.236 -7.884 1.00 . A A . 1 PHE HD1 1 1 15 4551 1 1 1 PHE HD2 H 9.278 1.154 -4.032 1.00 . A A . 1 PHE HD2 1 1 15 4552 1 1 1 PHE HE1 H 10.002 0.192 -8.801 1.00 . A A . 1 PHE HE1 1 1 15 4553 1 1 1 PHE HE2 H 11.563 1.112 -4.943 1.00 . A A . 1 PHE HE2 1 1 15 4554 1 1 1 PHE HZ H 11.927 0.631 -7.330 1.00 . A A . 1 PHE HZ 1 1 15 4555 1 1 1 PHE N N 5.257 -1.044 -5.490 1.00 . A A . 1 PHE N 1 1 15 4556 1 1 1 PHE O O 5.133 -0.671 -2.818 1.00 . A A . 1 PHE O 1 1 15 4557 1 1 2 LEU C C 7.066 1.183 -0.665 1.00 . A A . 2 LEU C 1 1 15 4558 1 1 2 LEU CA C 7.276 -0.261 -1.108 1.00 . A A . 2 LEU CA 1 1 15 4559 1 1 2 LEU CB C 8.553 -0.819 -0.479 1.00 . A A . 2 LEU CB 1 1 15 4560 1 1 2 LEU CD1 C 8.241 -3.179 -1.265 1.00 . A A . 2 LEU CD1 1 1 15 4561 1 1 2 LEU CD2 C 9.809 -2.690 0.621 1.00 . A A . 2 LEU CD2 1 1 15 4562 1 1 2 LEU CG C 8.509 -2.290 -0.061 1.00 . A A . 2 LEU CG 1 1 15 4563 1 1 2 LEU H H 8.217 -0.269 -3.004 1.00 . A A . 2 LEU H 1 1 15 4564 1 1 2 LEU HA H 6.434 -0.852 -0.778 1.00 . A A . 2 LEU HA 1 1 15 4565 1 1 2 LEU HB2 H 9.352 -0.703 -1.194 1.00 . A A . 2 LEU HB2 1 1 15 4566 1 1 2 LEU HB3 H 8.772 -0.231 0.401 1.00 . A A . 2 LEU HB3 1 1 15 4567 1 1 2 LEU HD11 H 7.178 -3.228 -1.447 1.00 . A A . 2 LEU HD11 1 1 15 4568 1 1 2 LEU HD12 H 8.619 -4.171 -1.071 1.00 . A A . 2 LEU HD12 1 1 15 4569 1 1 2 LEU HD13 H 8.736 -2.768 -2.133 1.00 . A A . 2 LEU HD13 1 1 15 4570 1 1 2 LEU HD21 H 9.988 -3.743 0.463 1.00 . A A . 2 LEU HD21 1 1 15 4571 1 1 2 LEU HD22 H 9.736 -2.492 1.680 1.00 . A A . 2 LEU HD22 1 1 15 4572 1 1 2 LEU HD23 H 10.625 -2.120 0.203 1.00 . A A . 2 LEU HD23 1 1 15 4573 1 1 2 LEU HG H 7.702 -2.433 0.645 1.00 . A A . 2 LEU HG 1 1 15 4574 1 1 2 LEU N N 7.346 -0.355 -2.562 1.00 . A A . 2 LEU N 1 1 15 4575 1 1 2 LEU O O 7.322 2.130 -1.409 1.00 . A A . 2 LEU O 1 1 15 4576 1 1 3 PRO C C 7.628 3.450 1.429 1.00 . A A . 3 PRO C 1 1 15 4577 1 1 3 PRO CA C 6.339 2.685 1.149 1.00 . A A . 3 PRO CA 1 1 15 4578 1 1 3 PRO CB C 5.607 2.374 2.457 1.00 . A A . 3 PRO CB 1 1 15 4579 1 1 3 PRO CD C 6.263 0.275 1.519 1.00 . A A . 3 PRO CD 1 1 15 4580 1 1 3 PRO CG C 6.048 0.998 2.820 1.00 . A A . 3 PRO CG 1 1 15 4581 1 1 3 PRO HA H 5.702 3.278 0.509 1.00 . A A . 3 PRO HA 1 1 15 4582 1 1 3 PRO HB2 H 5.892 3.094 3.211 1.00 . A A . 3 PRO HB2 1 1 15 4583 1 1 3 PRO HB3 H 4.540 2.417 2.295 1.00 . A A . 3 PRO HB3 1 1 15 4584 1 1 3 PRO HD2 H 7.084 -0.421 1.607 1.00 . A A . 3 PRO HD2 1 1 15 4585 1 1 3 PRO HD3 H 5.361 -0.237 1.218 1.00 . A A . 3 PRO HD3 1 1 15 4586 1 1 3 PRO HG2 H 6.969 1.044 3.381 1.00 . A A . 3 PRO HG2 1 1 15 4587 1 1 3 PRO HG3 H 5.278 0.508 3.398 1.00 . A A . 3 PRO HG3 1 1 15 4588 1 1 3 PRO N N 6.591 1.358 0.577 1.00 . A A . 3 PRO N 1 1 15 4589 1 1 3 PRO O O 8.698 2.856 1.562 1.00 . A A . 3 PRO O 1 1 15 4590 1 1 4 LYS C C 8.501 6.381 3.093 1.00 . A A . 4 LYS C 1 1 15 4591 1 1 4 LYS CA C 8.676 5.618 1.784 1.00 . A A . 4 LYS CA 1 1 15 4592 1 1 4 LYS CB C 8.889 6.602 0.632 1.00 . A A . 4 LYS CB 1 1 15 4593 1 1 4 LYS CD C 7.694 8.209 -0.885 1.00 . A A . 4 LYS CD 1 1 15 4594 1 1 4 LYS CE C 8.821 8.260 -1.905 1.00 . A A . 4 LYS CE 1 1 15 4595 1 1 4 LYS CG C 7.635 6.861 -0.186 1.00 . A A . 4 LYS CG 1 1 15 4596 1 1 4 LYS H H 6.639 5.186 1.403 1.00 . A A . 4 LYS H 1 1 15 4597 1 1 4 LYS HA H 9.543 4.980 1.866 1.00 . A A . 4 LYS HA 1 1 15 4598 1 1 4 LYS HB2 H 9.229 7.544 1.037 1.00 . A A . 4 LYS HB2 1 1 15 4599 1 1 4 LYS HB3 H 9.648 6.208 -0.027 1.00 . A A . 4 LYS HB3 1 1 15 4600 1 1 4 LYS HD2 H 6.756 8.383 -1.392 1.00 . A A . 4 LYS HD2 1 1 15 4601 1 1 4 LYS HD3 H 7.854 8.981 -0.145 1.00 . A A . 4 LYS HD3 1 1 15 4602 1 1 4 LYS HE2 H 9.438 7.383 -1.785 1.00 . A A . 4 LYS HE2 1 1 15 4603 1 1 4 LYS HE3 H 8.392 8.266 -2.896 1.00 . A A . 4 LYS HE3 1 1 15 4604 1 1 4 LYS HG2 H 7.537 6.086 -0.932 1.00 . A A . 4 LYS HG2 1 1 15 4605 1 1 4 LYS HG3 H 6.777 6.843 0.471 1.00 . A A . 4 LYS HG3 1 1 15 4606 1 1 4 LYS HZ1 H 10.419 9.292 -1.041 1.00 . A A . 4 LYS HZ1 1 1 15 4607 1 1 4 LYS HZ2 H 9.087 10.270 -1.401 1.00 . A A . 4 LYS HZ2 1 1 15 4608 1 1 4 LYS HZ3 H 10.104 9.734 -2.643 1.00 . A A . 4 LYS HZ3 1 1 15 4609 1 1 4 LYS N N 7.519 4.771 1.518 1.00 . A A . 4 LYS N 1 1 15 4610 1 1 4 LYS NZ N 9.667 9.474 -1.736 1.00 . A A . 4 LYS NZ 1 1 15 4611 1 1 4 LYS O O 8.927 7.531 3.215 1.00 . A A . 4 LYS O 1 1 15 4612 1 1 5 LEU C C 8.891 7.088 5.853 1.00 . A A . 5 LEU C 1 1 15 4613 1 1 5 LEU CA C 7.644 6.353 5.372 1.00 . A A . 5 LEU CA 1 1 15 4614 1 1 5 LEU CB C 7.236 5.293 6.396 1.00 . A A . 5 LEU CB 1 1 15 4615 1 1 5 LEU CD1 C 4.878 4.452 6.512 1.00 . A A . 5 LEU CD1 1 1 15 4616 1 1 5 LEU CD2 C 5.972 5.383 8.559 1.00 . A A . 5 LEU CD2 1 1 15 4617 1 1 5 LEU CG C 5.864 5.480 7.045 1.00 . A A . 5 LEU CG 1 1 15 4618 1 1 5 LEU H H 7.557 4.822 3.914 1.00 . A A . 5 LEU H 1 1 15 4619 1 1 5 LEU HA H 6.840 7.066 5.263 1.00 . A A . 5 LEU HA 1 1 15 4620 1 1 5 LEU HB2 H 7.239 4.335 5.900 1.00 . A A . 5 LEU HB2 1 1 15 4621 1 1 5 LEU HB3 H 7.977 5.292 7.183 1.00 . A A . 5 LEU HB3 1 1 15 4622 1 1 5 LEU HD11 H 3.924 4.926 6.336 1.00 . A A . 5 LEU HD11 1 1 15 4623 1 1 5 LEU HD12 H 4.758 3.659 7.236 1.00 . A A . 5 LEU HD12 1 1 15 4624 1 1 5 LEU HD13 H 5.252 4.040 5.586 1.00 . A A . 5 LEU HD13 1 1 15 4625 1 1 5 LEU HD21 H 5.928 4.346 8.857 1.00 . A A . 5 LEU HD21 1 1 15 4626 1 1 5 LEU HD22 H 5.154 5.923 9.014 1.00 . A A . 5 LEU HD22 1 1 15 4627 1 1 5 LEU HD23 H 6.909 5.811 8.882 1.00 . A A . 5 LEU HD23 1 1 15 4628 1 1 5 LEU HG H 5.487 6.463 6.798 1.00 . A A . 5 LEU HG 1 1 15 4629 1 1 5 LEU N N 7.874 5.735 4.070 1.00 . A A . 5 LEU N 1 1 15 4630 1 1 5 LEU O O 8.800 8.162 6.449 1.00 . A A . 5 LEU O 1 1 15 4631 1 1 6 PHE C C 12.228 7.328 4.786 1.00 . A A . 6 PHE C 1 1 15 4632 1 1 6 PHE CA C 11.321 7.105 5.993 1.00 . A A . 6 PHE CA 1 1 15 4633 1 1 6 PHE CB C 12.027 6.215 7.017 1.00 . A A . 6 PHE CB 1 1 15 4634 1 1 6 PHE CD1 C 14.154 7.037 8.065 1.00 . A A . 6 PHE CD1 1 1 15 4635 1 1 6 PHE CD2 C 12.083 7.659 9.068 1.00 . A A . 6 PHE CD2 1 1 15 4636 1 1 6 PHE CE1 C 14.840 7.746 9.033 1.00 . A A . 6 PHE CE1 1 1 15 4637 1 1 6 PHE CE2 C 12.763 8.370 10.039 1.00 . A A . 6 PHE CE2 1 1 15 4638 1 1 6 PHE CG C 12.770 6.986 8.071 1.00 . A A . 6 PHE CG 1 1 15 4639 1 1 6 PHE CZ C 14.144 8.413 10.021 1.00 . A A . 6 PHE CZ 1 1 15 4640 1 1 6 PHE H H 10.063 5.649 5.109 1.00 . A A . 6 PHE H 1 1 15 4641 1 1 6 PHE HA H 11.104 8.059 6.447 1.00 . A A . 6 PHE HA 1 1 15 4642 1 1 6 PHE HB2 H 11.294 5.597 7.514 1.00 . A A . 6 PHE HB2 1 1 15 4643 1 1 6 PHE HB3 H 12.737 5.582 6.506 1.00 . A A . 6 PHE HB3 1 1 15 4644 1 1 6 PHE HD1 H 14.700 6.515 7.291 1.00 . A A . 6 PHE HD1 1 1 15 4645 1 1 6 PHE HD2 H 11.003 7.626 9.084 1.00 . A A . 6 PHE HD2 1 1 15 4646 1 1 6 PHE HE1 H 15.920 7.777 9.016 1.00 . A A . 6 PHE HE1 1 1 15 4647 1 1 6 PHE HE2 H 12.216 8.891 10.811 1.00 . A A . 6 PHE HE2 1 1 15 4648 1 1 6 PHE HZ H 14.678 8.968 10.778 1.00 . A A . 6 PHE HZ 1 1 15 4649 1 1 6 PHE N N 10.055 6.505 5.588 1.00 . A A . 6 PHE N 1 1 15 4650 1 1 6 PHE O O 13.270 7.975 4.890 1.00 . A A . 6 PHE O 1 1 15 4651 1 1 7 ALA C C 12.510 8.350 1.870 1.00 . A A . 7 ALA C 1 1 15 4652 1 1 7 ALA CA C 12.597 6.928 2.414 1.00 . A A . 7 ALA CA 1 1 15 4653 1 1 7 ALA CB C 12.117 5.931 1.370 1.00 . A A . 7 ALA CB 1 1 15 4654 1 1 7 ALA H H 10.983 6.283 3.622 1.00 . A A . 7 ALA H 1 1 15 4655 1 1 7 ALA HA H 13.629 6.703 2.643 1.00 . A A . 7 ALA HA 1 1 15 4656 1 1 7 ALA HB1 H 12.970 5.481 0.884 1.00 . A A . 7 ALA HB1 1 1 15 4657 1 1 7 ALA HB2 H 11.528 5.164 1.849 1.00 . A A . 7 ALA HB2 1 1 15 4658 1 1 7 ALA HB3 H 11.513 6.443 0.636 1.00 . A A . 7 ALA HB3 1 1 15 4659 1 1 7 ALA N N 11.823 6.787 3.641 1.00 . A A . 7 ALA N 1 1 15 4660 1 1 7 ALA O O 13.427 8.828 1.203 1.00 . A A . 7 ALA O 1 1 15 4661 1 1 8 LYS C C 11.752 11.392 2.705 1.00 . A A . 8 LYS C 1 1 15 4662 1 1 8 LYS CA C 11.193 10.390 1.700 1.00 . A A . 8 LYS CA 1 1 15 4663 1 1 8 LYS CB C 9.702 10.654 1.477 1.00 . A A . 8 LYS CB 1 1 15 4664 1 1 8 LYS CD C 8.004 11.620 3.055 1.00 . A A . 8 LYS CD 1 1 15 4665 1 1 8 LYS CE C 6.693 11.625 2.284 1.00 . A A . 8 LYS CE 1 1 15 4666 1 1 8 LYS CG C 8.849 10.406 2.709 1.00 . A A . 8 LYS CG 1 1 15 4667 1 1 8 LYS H H 10.705 8.587 2.696 1.00 . A A . 8 LYS H 1 1 15 4668 1 1 8 LYS HA H 11.715 10.509 0.763 1.00 . A A . 8 LYS HA 1 1 15 4669 1 1 8 LYS HB2 H 9.572 11.683 1.175 1.00 . A A . 8 LYS HB2 1 1 15 4670 1 1 8 LYS HB3 H 9.350 10.009 0.685 1.00 . A A . 8 LYS HB3 1 1 15 4671 1 1 8 LYS HD2 H 7.786 11.607 4.113 1.00 . A A . 8 LYS HD2 1 1 15 4672 1 1 8 LYS HD3 H 8.558 12.516 2.812 1.00 . A A . 8 LYS HD3 1 1 15 4673 1 1 8 LYS HE2 H 6.255 12.610 2.350 1.00 . A A . 8 LYS HE2 1 1 15 4674 1 1 8 LYS HE3 H 6.898 11.391 1.250 1.00 . A A . 8 LYS HE3 1 1 15 4675 1 1 8 LYS HG2 H 8.195 9.568 2.520 1.00 . A A . 8 LYS HG2 1 1 15 4676 1 1 8 LYS HG3 H 9.496 10.179 3.544 1.00 . A A . 8 LYS HG3 1 1 15 4677 1 1 8 LYS HZ1 H 6.029 9.666 2.570 1.00 . A A . 8 LYS HZ1 1 1 15 4678 1 1 8 LYS HZ2 H 4.780 10.798 2.430 1.00 . A A . 8 LYS HZ2 1 1 15 4679 1 1 8 LYS HZ3 H 5.679 10.703 3.860 1.00 . A A . 8 LYS HZ3 1 1 15 4680 1 1 8 LYS N N 11.401 9.022 2.159 1.00 . A A . 8 LYS N 1 1 15 4681 1 1 8 LYS NZ N 5.727 10.629 2.824 1.00 . A A . 8 LYS NZ 1 1 15 4682 1 1 8 LYS O O 12.237 12.459 2.327 1.00 . A A . 8 LYS O 1 1 15 4683 1 1 9 ILE C C 13.709 11.919 5.069 1.00 . A A . 9 ILE C 1 1 15 4684 1 1 9 ILE CA C 12.184 11.910 5.043 1.00 . A A . 9 ILE CA 1 1 15 4685 1 1 9 ILE CB C 11.661 11.474 6.424 1.00 . A A . 9 ILE CB 1 1 15 4686 1 1 9 ILE CD1 C 13.669 10.803 7.837 1.00 . A A . 9 ILE CD1 1 1 15 4687 1 1 9 ILE CG1 C 12.514 10.333 6.981 1.00 . A A . 9 ILE CG1 1 1 15 4688 1 1 9 ILE CG2 C 10.201 11.055 6.329 1.00 . A A . 9 ILE CG2 1 1 15 4689 1 1 9 ILE H H 11.285 10.179 4.223 1.00 . A A . 9 ILE H 1 1 15 4690 1 1 9 ILE HA H 11.833 12.912 4.846 1.00 . A A . 9 ILE HA 1 1 15 4691 1 1 9 ILE HB H 11.724 12.320 7.091 1.00 . A A . 9 ILE HB 1 1 15 4692 1 1 9 ILE HD11 H 14.542 10.203 7.626 1.00 . A A . 9 ILE HD11 1 1 15 4693 1 1 9 ILE HD12 H 13.881 11.839 7.618 1.00 . A A . 9 ILE HD12 1 1 15 4694 1 1 9 ILE HD13 H 13.407 10.702 8.880 1.00 . A A . 9 ILE HD13 1 1 15 4695 1 1 9 ILE HG12 H 11.894 9.690 7.585 1.00 . A A . 9 ILE HG12 1 1 15 4696 1 1 9 ILE HG13 H 12.920 9.763 6.157 1.00 . A A . 9 ILE HG13 1 1 15 4697 1 1 9 ILE HG21 H 9.764 11.475 5.436 1.00 . A A . 9 ILE HG21 1 1 15 4698 1 1 9 ILE HG22 H 10.139 9.978 6.287 1.00 . A A . 9 ILE HG22 1 1 15 4699 1 1 9 ILE HG23 H 9.666 11.413 7.195 1.00 . A A . 9 ILE HG23 1 1 15 4700 1 1 9 ILE N N 11.683 11.042 3.985 1.00 . A A . 9 ILE N 1 1 15 4701 1 1 9 ILE O O 14.329 12.893 5.499 1.00 . A A . 9 ILE O 1 1 15 4702 1 1 10 THR C C 16.340 11.344 3.315 1.00 . A A . 10 THR C 1 1 15 4703 1 1 10 THR CA C 15.763 10.709 4.575 1.00 . A A . 10 THR CA 1 1 15 4704 1 1 10 THR CB C 16.208 9.236 4.645 1.00 . A A . 10 THR CB 1 1 15 4705 1 1 10 THR CG2 C 15.979 8.667 6.037 1.00 . A A . 10 THR CG2 1 1 15 4706 1 1 10 THR H H 13.762 10.084 4.277 1.00 . A A . 10 THR H 1 1 15 4707 1 1 10 THR HA H 16.157 11.224 5.439 1.00 . A A . 10 THR HA 1 1 15 4708 1 1 10 THR HB H 17.264 9.184 4.420 1.00 . A A . 10 THR HB 1 1 15 4709 1 1 10 THR HG1 H 16.067 7.794 3.307 1.00 . A A . 10 THR HG1 1 1 15 4710 1 1 10 THR HG21 H 14.929 8.732 6.284 1.00 . A A . 10 THR HG21 1 1 15 4711 1 1 10 THR HG22 H 16.554 9.230 6.755 1.00 . A A . 10 THR HG22 1 1 15 4712 1 1 10 THR HG23 H 16.289 7.633 6.058 1.00 . A A . 10 THR HG23 1 1 15 4713 1 1 10 THR N N 14.310 10.827 4.606 1.00 . A A . 10 THR N 1 1 15 4714 1 1 10 THR O O 16.002 10.950 2.198 1.00 . A A . 10 THR O 1 1 15 4715 1 1 10 THR OG1 O 15.486 8.460 3.682 1.00 . A A . 10 THR OG1 1 1 15 4716 1 1 11 LYS C C 19.180 12.379 2.029 1.00 . A A . 11 LYS C 1 1 15 4717 1 1 11 LYS CA C 17.839 13.017 2.378 1.00 . A A . 11 LYS CA 1 1 15 4718 1 1 11 LYS CB C 18.038 14.498 2.709 1.00 . A A . 11 LYS CB 1 1 15 4719 1 1 11 LYS CD C 20.320 15.129 3.547 1.00 . A A . 11 LYS CD 1 1 15 4720 1 1 11 LYS CE C 21.035 15.835 4.689 1.00 . A A . 11 LYS CE 1 1 15 4721 1 1 11 LYS CG C 18.904 14.737 3.933 1.00 . A A . 11 LYS CG 1 1 15 4722 1 1 11 LYS H H 17.442 12.597 4.415 1.00 . A A . 11 LYS H 1 1 15 4723 1 1 11 LYS HA H 17.181 12.932 1.527 1.00 . A A . 11 LYS HA 1 1 15 4724 1 1 11 LYS HB2 H 18.503 14.984 1.864 1.00 . A A . 11 LYS HB2 1 1 15 4725 1 1 11 LYS HB3 H 17.071 14.948 2.885 1.00 . A A . 11 LYS HB3 1 1 15 4726 1 1 11 LYS HD2 H 20.873 14.239 3.286 1.00 . A A . 11 LYS HD2 1 1 15 4727 1 1 11 LYS HD3 H 20.280 15.793 2.694 1.00 . A A . 11 LYS HD3 1 1 15 4728 1 1 11 LYS HE2 H 20.415 15.782 5.571 1.00 . A A . 11 LYS HE2 1 1 15 4729 1 1 11 LYS HE3 H 21.971 15.330 4.876 1.00 . A A . 11 LYS HE3 1 1 15 4730 1 1 11 LYS HG2 H 18.470 15.532 4.521 1.00 . A A . 11 LYS HG2 1 1 15 4731 1 1 11 LYS HG3 H 18.939 13.830 4.521 1.00 . A A . 11 LYS HG3 1 1 15 4732 1 1 11 LYS HZ1 H 21.177 17.849 5.224 1.00 . A A . 11 LYS HZ1 1 1 15 4733 1 1 11 LYS HZ2 H 20.658 17.598 3.634 1.00 . A A . 11 LYS HZ2 1 1 15 4734 1 1 11 LYS HZ3 H 22.286 17.375 4.037 1.00 . A A . 11 LYS HZ3 1 1 15 4735 1 1 11 LYS N N 17.213 12.328 3.500 1.00 . A A . 11 LYS N 1 1 15 4736 1 1 11 LYS NZ N 21.308 17.264 4.374 1.00 . A A . 11 LYS NZ 1 1 15 4737 1 1 11 LYS O O 20.005 12.981 1.341 1.00 . A A . 11 LYS O 1 1 15 4738 1 1 12 LYS C C 20.414 9.349 1.192 1.00 . A A . 12 LYS C 1 1 15 4739 1 1 12 LYS CA C 20.630 10.435 2.241 1.00 . A A . 12 LYS CA 1 1 15 4740 1 1 12 LYS CB C 21.167 9.813 3.532 1.00 . A A . 12 LYS CB 1 1 15 4741 1 1 12 LYS CD C 21.333 10.029 6.029 1.00 . A A . 12 LYS CD 1 1 15 4742 1 1 12 LYS CE C 22.473 11.015 6.237 1.00 . A A . 12 LYS CE 1 1 15 4743 1 1 12 LYS CG C 20.523 10.370 4.790 1.00 . A A . 12 LYS CG 1 1 15 4744 1 1 12 LYS H H 18.695 10.729 3.048 1.00 . A A . 12 LYS H 1 1 15 4745 1 1 12 LYS HA H 21.353 11.143 1.865 1.00 . A A . 12 LYS HA 1 1 15 4746 1 1 12 LYS HB2 H 20.992 8.747 3.504 1.00 . A A . 12 LYS HB2 1 1 15 4747 1 1 12 LYS HB3 H 22.231 9.992 3.588 1.00 . A A . 12 LYS HB3 1 1 15 4748 1 1 12 LYS HD2 H 20.685 10.059 6.892 1.00 . A A . 12 LYS HD2 1 1 15 4749 1 1 12 LYS HD3 H 21.744 9.036 5.918 1.00 . A A . 12 LYS HD3 1 1 15 4750 1 1 12 LYS HE2 H 22.995 11.144 5.302 1.00 . A A . 12 LYS HE2 1 1 15 4751 1 1 12 LYS HE3 H 22.059 11.962 6.552 1.00 . A A . 12 LYS HE3 1 1 15 4752 1 1 12 LYS HG2 H 20.452 11.444 4.702 1.00 . A A . 12 LYS HG2 1 1 15 4753 1 1 12 LYS HG3 H 19.532 9.949 4.892 1.00 . A A . 12 LYS HG3 1 1 15 4754 1 1 12 LYS HZ1 H 23.518 11.242 8.032 1.00 . A A . 12 LYS HZ1 1 1 15 4755 1 1 12 LYS HZ2 H 24.373 10.396 6.843 1.00 . A A . 12 LYS HZ2 1 1 15 4756 1 1 12 LYS HZ3 H 23.109 9.639 7.675 1.00 . A A . 12 LYS HZ3 1 1 15 4757 1 1 12 LYS N N 19.391 11.157 2.505 1.00 . A A . 12 LYS N 1 1 15 4758 1 1 12 LYS NZ N 23.436 10.539 7.269 1.00 . A A . 12 LYS NZ 1 1 15 4759 1 1 12 LYS O O 20.884 9.464 0.061 1.00 . A A . 12 LYS O 1 1 15 4760 1 1 13 ASN C C 18.617 7.666 -0.540 1.00 . A A . 13 ASN C 1 1 15 4761 1 1 13 ASN CA C 19.420 7.190 0.667 1.00 . A A . 13 ASN CA 1 1 15 4762 1 1 13 ASN CB C 18.657 6.083 1.397 1.00 . A A . 13 ASN CB 1 1 15 4763 1 1 13 ASN CG C 19.472 4.811 1.531 1.00 . A A . 13 ASN CG 1 1 15 4764 1 1 13 ASN H H 19.351 8.262 2.490 1.00 . A A . 13 ASN H 1 1 15 4765 1 1 13 ASN HA H 20.365 6.797 0.323 1.00 . A A . 13 ASN HA 1 1 15 4766 1 1 13 ASN HB2 H 18.397 6.427 2.387 1.00 . A A . 13 ASN HB2 1 1 15 4767 1 1 13 ASN HB3 H 17.754 5.855 0.850 1.00 . A A . 13 ASN HB3 1 1 15 4768 1 1 13 ASN HD21 H 19.640 5.097 3.492 1.00 . A A . 13 ASN HD21 1 1 15 4769 1 1 13 ASN HD22 H 20.411 3.681 2.870 1.00 . A A . 13 ASN HD22 1 1 15 4770 1 1 13 ASN N N 19.699 8.296 1.575 1.00 . A A . 13 ASN N 1 1 15 4771 1 1 13 ASN ND2 N 19.882 4.498 2.754 1.00 . A A . 13 ASN ND2 1 1 15 4772 1 1 13 ASN O O 18.570 6.996 -1.571 1.00 . A A . 13 ASN O 1 1 15 4773 1 1 13 ASN OD1 O 19.728 4.118 0.546 1.00 . A A . 13 ASN OD1 1 1 15 4774 1 1 14 MET C C 18.038 9.618 -2.730 1.00 . A A . 14 MET C 1 1 15 4775 1 1 14 MET CA C 17.188 9.396 -1.483 1.00 . A A . 14 MET CA 1 1 15 4776 1 1 14 MET CB C 16.557 10.717 -1.040 1.00 . A A . 14 MET CB 1 1 15 4777 1 1 14 MET CE C 13.245 9.611 -1.903 1.00 . A A . 14 MET CE 1 1 15 4778 1 1 14 MET CG C 15.491 11.232 -1.993 1.00 . A A . 14 MET CG 1 1 15 4779 1 1 14 MET H H 18.063 9.318 0.442 1.00 . A A . 14 MET H 1 1 15 4780 1 1 14 MET HA H 16.403 8.693 -1.718 1.00 . A A . 14 MET HA 1 1 15 4781 1 1 14 MET HB2 H 16.105 10.579 -0.069 1.00 . A A . 14 MET HB2 1 1 15 4782 1 1 14 MET HB3 H 17.333 11.465 -0.964 1.00 . A A . 14 MET HB3 1 1 15 4783 1 1 14 MET HE1 H 12.823 9.751 -2.887 1.00 . A A . 14 MET HE1 1 1 15 4784 1 1 14 MET HE2 H 14.068 8.914 -1.960 1.00 . A A . 14 MET HE2 1 1 15 4785 1 1 14 MET HE3 H 12.488 9.222 -1.238 1.00 . A A . 14 MET HE3 1 1 15 4786 1 1 14 MET HG2 H 15.724 12.254 -2.255 1.00 . A A . 14 MET HG2 1 1 15 4787 1 1 14 MET HG3 H 15.502 10.623 -2.885 1.00 . A A . 14 MET HG3 1 1 15 4788 1 1 14 MET N N 17.988 8.829 -0.404 1.00 . A A . 14 MET N 1 1 15 4789 1 1 14 MET O O 17.693 9.156 -3.818 1.00 . A A . 14 MET O 1 1 15 4790 1 1 14 MET SD S 13.837 11.182 -1.278 1.00 . A A . 14 MET SD 1 1 15 4791 1 1 15 ALA C C 20.875 9.380 -4.040 1.00 . A A . 15 ALA C 1 1 15 4792 1 1 15 ALA CA C 20.048 10.609 -3.677 1.00 . A A . 15 ALA CA 1 1 15 4793 1 1 15 ALA CB C 20.960 11.779 -3.336 1.00 . A A . 15 ALA CB 1 1 15 4794 1 1 15 ALA H H 19.370 10.670 -1.674 1.00 . A A . 15 ALA H 1 1 15 4795 1 1 15 ALA HA H 19.447 10.891 -4.530 1.00 . A A . 15 ALA HA 1 1 15 4796 1 1 15 ALA HB1 H 21.088 12.401 -4.210 1.00 . A A . 15 ALA HB1 1 1 15 4797 1 1 15 ALA HB2 H 20.517 12.360 -2.542 1.00 . A A . 15 ALA HB2 1 1 15 4798 1 1 15 ALA HB3 H 21.921 11.404 -3.017 1.00 . A A . 15 ALA HB3 1 1 15 4799 1 1 15 ALA N N 19.149 10.328 -2.565 1.00 . A A . 15 ALA N 1 1 15 4800 1 1 15 ALA O O 21.695 9.419 -4.958 1.00 . A A . 15 ALA O 1 1 15 4801 1 1 16 HIS C C 20.492 6.032 -4.273 1.00 . A A . 16 HIS C 1 1 15 4802 1 1 16 HIS CA C 21.379 7.048 -3.558 1.00 . A A . 16 HIS CA 1 1 15 4803 1 1 16 HIS CB C 21.887 6.460 -2.241 1.00 . A A . 16 HIS CB 1 1 15 4804 1 1 16 HIS CD2 C 24.241 7.437 -1.759 1.00 . A A . 16 HIS CD2 1 1 15 4805 1 1 16 HIS CE1 C 25.428 5.648 -2.206 1.00 . A A . 16 HIS CE1 1 1 15 4806 1 1 16 HIS CG C 23.380 6.458 -2.123 1.00 . A A . 16 HIS CG 1 1 15 4807 1 1 16 HIS H H 19.988 8.320 -2.595 1.00 . A A . 16 HIS H 1 1 15 4808 1 1 16 HIS HA H 22.224 7.276 -4.190 1.00 . A A . 16 HIS HA 1 1 15 4809 1 1 16 HIS HB2 H 21.491 7.039 -1.420 1.00 . A A . 16 HIS HB2 1 1 15 4810 1 1 16 HIS HB3 H 21.545 5.439 -2.154 1.00 . A A . 16 HIS HB3 1 1 15 4811 1 1 16 HIS HD1 H 23.822 4.477 -2.688 1.00 . A A . 16 HIS HD1 1 1 15 4812 1 1 16 HIS HD2 H 23.981 8.447 -1.474 1.00 . A A . 16 HIS HD2 1 1 15 4813 1 1 16 HIS HE1 H 26.262 4.976 -2.343 1.00 . A A . 16 HIS HE1 1 1 15 4814 1 1 16 HIS N N 20.654 8.289 -3.313 1.00 . A A . 16 HIS N 1 1 15 4815 1 1 16 HIS ND1 N 24.155 5.351 -2.398 1.00 . A A . 16 HIS ND1 1 1 15 4816 1 1 16 HIS NE2 N 25.507 6.909 -1.819 1.00 . A A . 16 HIS NE2 1 1 15 4817 1 1 16 HIS O O 20.984 5.065 -4.854 1.00 . A A . 16 HIS O 1 1 15 4818 1 1 17 ILE C C 18.592 5.133 -6.330 1.00 . A A . 17 ILE C 1 1 15 4819 1 1 17 ILE CA C 18.229 5.365 -4.868 1.00 . A A . 17 ILE CA 1 1 15 4820 1 1 17 ILE CB C 16.795 5.921 -4.788 1.00 . A A . 17 ILE CB 1 1 15 4821 1 1 17 ILE CD1 C 15.460 8.024 -5.311 1.00 . A A . 17 ILE CD1 1 1 15 4822 1 1 17 ILE CG1 C 16.661 7.173 -5.658 1.00 . A A . 17 ILE CG1 1 1 15 4823 1 1 17 ILE CG2 C 16.426 6.230 -3.345 1.00 . A A . 17 ILE CG2 1 1 15 4824 1 1 17 ILE H H 18.853 7.048 -3.746 1.00 . A A . 17 ILE H 1 1 15 4825 1 1 17 ILE HA H 18.256 4.419 -4.347 1.00 . A A . 17 ILE HA 1 1 15 4826 1 1 17 ILE HB H 16.119 5.164 -5.154 1.00 . A A . 17 ILE HB 1 1 15 4827 1 1 17 ILE HD11 H 15.600 8.466 -4.336 1.00 . A A . 17 ILE HD11 1 1 15 4828 1 1 17 ILE HD12 H 15.346 8.804 -6.048 1.00 . A A . 17 ILE HD12 1 1 15 4829 1 1 17 ILE HD13 H 14.573 7.407 -5.301 1.00 . A A . 17 ILE HD13 1 1 15 4830 1 1 17 ILE HG12 H 17.544 7.782 -5.539 1.00 . A A . 17 ILE HG12 1 1 15 4831 1 1 17 ILE HG13 H 16.571 6.875 -6.693 1.00 . A A . 17 ILE HG13 1 1 15 4832 1 1 17 ILE HG21 H 16.823 5.461 -2.700 1.00 . A A . 17 ILE HG21 1 1 15 4833 1 1 17 ILE HG22 H 16.843 7.185 -3.064 1.00 . A A . 17 ILE HG22 1 1 15 4834 1 1 17 ILE HG23 H 15.351 6.263 -3.248 1.00 . A A . 17 ILE HG23 1 1 15 4835 1 1 17 ILE N N 19.184 6.260 -4.225 1.00 . A A . 17 ILE N 1 1 15 4836 1 1 17 ILE O O 18.477 4.019 -6.840 1.00 . A A . 17 ILE O 1 1 15 4837 1 1 18 ARG C C 20.714 5.322 -8.567 1.00 . A A . 18 ARG C 1 1 15 4838 1 1 18 ARG CA C 19.415 6.105 -8.405 1.00 . A A . 18 ARG CA 1 1 15 4839 1 1 18 ARG CB C 19.572 7.505 -9.001 1.00 . A A . 18 ARG CB 1 1 15 4840 1 1 18 ARG CD C 18.500 9.421 -10.224 1.00 . A A . 18 ARG CD 1 1 15 4841 1 1 18 ARG CG C 18.267 8.105 -9.498 1.00 . A A . 18 ARG CG 1 1 15 4842 1 1 18 ARG CZ C 17.705 11.745 -10.135 1.00 . A A . 18 ARG CZ 1 1 15 4843 1 1 18 ARG H H 19.104 7.055 -6.539 1.00 . A A . 18 ARG H 1 1 15 4844 1 1 18 ARG HA H 18.628 5.586 -8.930 1.00 . A A . 18 ARG HA 1 1 15 4845 1 1 18 ARG HB2 H 19.980 8.161 -8.247 1.00 . A A . 18 ARG HB2 1 1 15 4846 1 1 18 ARG HB3 H 20.259 7.453 -9.832 1.00 . A A . 18 ARG HB3 1 1 15 4847 1 1 18 ARG HD2 H 19.552 9.663 -10.174 1.00 . A A . 18 ARG HD2 1 1 15 4848 1 1 18 ARG HD3 H 18.207 9.303 -11.257 1.00 . A A . 18 ARG HD3 1 1 15 4849 1 1 18 ARG HE H 17.216 10.322 -8.826 1.00 . A A . 18 ARG HE 1 1 15 4850 1 1 18 ARG HG2 H 17.798 7.410 -10.179 1.00 . A A . 18 ARG HG2 1 1 15 4851 1 1 18 ARG HG3 H 17.618 8.280 -8.654 1.00 . A A . 18 ARG HG3 1 1 15 4852 1 1 18 ARG HH11 H 18.939 11.328 -11.678 1.00 . A A . 18 ARG HH11 1 1 15 4853 1 1 18 ARG HH12 H 18.371 12.963 -11.604 1.00 . A A . 18 ARG HH12 1 1 15 4854 1 1 18 ARG HH21 H 16.460 12.471 -8.717 1.00 . A A . 18 ARG HH21 1 1 15 4855 1 1 18 ARG HH22 H 16.962 13.612 -9.918 1.00 . A A . 18 ARG HH22 1 1 15 4856 1 1 18 ARG N N 19.034 6.193 -7.000 1.00 . A A . 18 ARG N 1 1 15 4857 1 1 18 ARG NE N 17.734 10.515 -9.635 1.00 . A A . 18 ARG NE 1 1 15 4858 1 1 18 ARG NH1 N 18.395 12.036 -11.228 1.00 . A A . 18 ARG NH1 1 1 15 4859 1 1 18 ARG NH2 N 16.983 12.687 -9.541 1.00 . A A . 18 ARG NH2 1 1 15 4860 1 1 18 ARG O O 21.309 5.305 -9.645 1.00 . A A . 18 ARG O 1 1 16 4861 1 1 1 PHE C C 4.184 -0.241 -2.404 1.00 . A A . 1 PHE C 1 1 16 4862 1 1 1 PHE CA C 4.012 -0.067 -3.911 1.00 . A A . 1 PHE CA 1 1 16 4863 1 1 1 PHE CB C 4.652 -1.245 -4.648 1.00 . A A . 1 PHE CB 1 1 16 4864 1 1 1 PHE CD1 C 3.257 -2.890 -5.930 1.00 . A A . 1 PHE CD1 1 1 16 4865 1 1 1 PHE CD2 C 3.833 -0.829 -6.983 1.00 . A A . 1 PHE CD2 1 1 16 4866 1 1 1 PHE CE1 C 2.562 -3.277 -7.060 1.00 . A A . 1 PHE CE1 1 1 16 4867 1 1 1 PHE CE2 C 3.139 -1.211 -8.115 1.00 . A A . 1 PHE CE2 1 1 16 4868 1 1 1 PHE CG C 3.899 -1.663 -5.878 1.00 . A A . 1 PHE CG 1 1 16 4869 1 1 1 PHE CZ C 2.504 -2.437 -8.155 1.00 . A A . 1 PHE CZ 1 1 16 4870 1 1 1 PHE H1 H 5.572 1.309 -4.308 1.00 . A A . 1 PHE H1 1 1 16 4871 1 1 1 PHE HA H 2.958 -0.039 -4.140 1.00 . A A . 1 PHE HA 1 1 16 4872 1 1 1 PHE HB2 H 5.652 -0.972 -4.949 1.00 . A A . 1 PHE HB2 1 1 16 4873 1 1 1 PHE HB3 H 4.700 -2.093 -3.982 1.00 . A A . 1 PHE HB3 1 1 16 4874 1 1 1 PHE HD1 H 3.302 -3.548 -5.074 1.00 . A A . 1 PHE HD1 1 1 16 4875 1 1 1 PHE HD2 H 4.329 0.130 -6.954 1.00 . A A . 1 PHE HD2 1 1 16 4876 1 1 1 PHE HE1 H 2.067 -4.236 -7.088 1.00 . A A . 1 PHE HE1 1 1 16 4877 1 1 1 PHE HE2 H 3.096 -0.552 -8.970 1.00 . A A . 1 PHE HE2 1 1 16 4878 1 1 1 PHE HZ H 1.961 -2.737 -9.039 1.00 . A A . 1 PHE HZ 1 1 16 4879 1 1 1 PHE N N 4.600 1.190 -4.359 1.00 . A A . 1 PHE N 1 1 16 4880 1 1 1 PHE O O 3.397 -0.928 -1.753 1.00 . A A . 1 PHE O 1 1 16 4881 1 1 2 LEU C C 5.493 1.687 0.211 1.00 . A A . 2 LEU C 1 1 16 4882 1 1 2 LEU CA C 5.497 0.302 -0.427 1.00 . A A . 2 LEU CA 1 1 16 4883 1 1 2 LEU CB C 6.846 -0.378 -0.189 1.00 . A A . 2 LEU CB 1 1 16 4884 1 1 2 LEU CD1 C 9.289 0.028 -0.581 1.00 . A A . 2 LEU CD1 1 1 16 4885 1 1 2 LEU CD2 C 7.946 -1.232 -2.274 1.00 . A A . 2 LEU CD2 1 1 16 4886 1 1 2 LEU CG C 7.925 -0.116 -1.240 1.00 . A A . 2 LEU CG 1 1 16 4887 1 1 2 LEU H H 5.812 0.919 -2.427 1.00 . A A . 2 LEU H 1 1 16 4888 1 1 2 LEU HA H 4.718 -0.293 0.026 1.00 . A A . 2 LEU HA 1 1 16 4889 1 1 2 LEU HB2 H 7.224 -0.040 0.764 1.00 . A A . 2 LEU HB2 1 1 16 4890 1 1 2 LEU HB3 H 6.675 -1.445 -0.148 1.00 . A A . 2 LEU HB3 1 1 16 4891 1 1 2 LEU HD11 H 10.058 -0.264 -1.280 1.00 . A A . 2 LEU HD11 1 1 16 4892 1 1 2 LEU HD12 H 9.335 -0.607 0.291 1.00 . A A . 2 LEU HD12 1 1 16 4893 1 1 2 LEU HD13 H 9.439 1.056 -0.287 1.00 . A A . 2 LEU HD13 1 1 16 4894 1 1 2 LEU HD21 H 7.202 -1.973 -2.018 1.00 . A A . 2 LEU HD21 1 1 16 4895 1 1 2 LEU HD22 H 8.923 -1.693 -2.287 1.00 . A A . 2 LEU HD22 1 1 16 4896 1 1 2 LEU HD23 H 7.726 -0.824 -3.249 1.00 . A A . 2 LEU HD23 1 1 16 4897 1 1 2 LEU HG H 7.703 0.811 -1.751 1.00 . A A . 2 LEU HG 1 1 16 4898 1 1 2 LEU N N 5.220 0.387 -1.857 1.00 . A A . 2 LEU N 1 1 16 4899 1 1 2 LEU O O 5.649 2.707 -0.460 1.00 . A A . 2 LEU O 1 1 16 4900 1 1 3 PRO C C 6.658 3.644 2.366 1.00 . A A . 3 PRO C 1 1 16 4901 1 1 3 PRO CA C 5.288 2.980 2.299 1.00 . A A . 3 PRO CA 1 1 16 4902 1 1 3 PRO CB C 4.837 2.541 3.694 1.00 . A A . 3 PRO CB 1 1 16 4903 1 1 3 PRO CD C 5.121 0.549 2.404 1.00 . A A . 3 PRO CD 1 1 16 4904 1 1 3 PRO CG C 5.246 1.112 3.792 1.00 . A A . 3 PRO CG 1 1 16 4905 1 1 3 PRO HA H 4.571 3.677 1.890 1.00 . A A . 3 PRO HA 1 1 16 4906 1 1 3 PRO HB2 H 5.330 3.146 4.442 1.00 . A A . 3 PRO HB2 1 1 16 4907 1 1 3 PRO HB3 H 3.767 2.651 3.782 1.00 . A A . 3 PRO HB3 1 1 16 4908 1 1 3 PRO HD2 H 5.889 -0.190 2.225 1.00 . A A . 3 PRO HD2 1 1 16 4909 1 1 3 PRO HD3 H 4.141 0.120 2.257 1.00 . A A . 3 PRO HD3 1 1 16 4910 1 1 3 PRO HG2 H 6.268 1.045 4.133 1.00 . A A . 3 PRO HG2 1 1 16 4911 1 1 3 PRO HG3 H 4.588 0.587 4.469 1.00 . A A . 3 PRO HG3 1 1 16 4912 1 1 3 PRO N N 5.313 1.726 1.540 1.00 . A A . 3 PRO N 1 1 16 4913 1 1 3 PRO O O 7.689 2.973 2.311 1.00 . A A . 3 PRO O 1 1 16 4914 1 1 4 LYS C C 8.009 6.471 3.890 1.00 . A A . 4 LYS C 1 1 16 4915 1 1 4 LYS CA C 7.908 5.724 2.564 1.00 . A A . 4 LYS CA 1 1 16 4916 1 1 4 LYS CB C 8.000 6.714 1.401 1.00 . A A . 4 LYS CB 1 1 16 4917 1 1 4 LYS CD C 6.692 8.441 0.129 1.00 . A A . 4 LYS CD 1 1 16 4918 1 1 4 LYS CE C 7.696 8.464 -1.014 1.00 . A A . 4 LYS CE 1 1 16 4919 1 1 4 LYS CG C 6.651 7.082 0.807 1.00 . A A . 4 LYS CG 1 1 16 4920 1 1 4 LYS H H 5.809 5.447 2.526 1.00 . A A . 4 LYS H 1 1 16 4921 1 1 4 LYS HA H 8.727 5.024 2.496 1.00 . A A . 4 LYS HA 1 1 16 4922 1 1 4 LYS HB2 H 8.475 7.619 1.750 1.00 . A A . 4 LYS HB2 1 1 16 4923 1 1 4 LYS HB3 H 8.606 6.278 0.620 1.00 . A A . 4 LYS HB3 1 1 16 4924 1 1 4 LYS HD2 H 5.712 8.668 -0.263 1.00 . A A . 4 LYS HD2 1 1 16 4925 1 1 4 LYS HD3 H 6.972 9.189 0.858 1.00 . A A . 4 LYS HD3 1 1 16 4926 1 1 4 LYS HE2 H 8.691 8.395 -0.603 1.00 . A A . 4 LYS HE2 1 1 16 4927 1 1 4 LYS HE3 H 7.511 7.614 -1.654 1.00 . A A . 4 LYS HE3 1 1 16 4928 1 1 4 LYS HG2 H 6.373 6.336 0.077 1.00 . A A . 4 LYS HG2 1 1 16 4929 1 1 4 LYS HG3 H 5.914 7.106 1.598 1.00 . A A . 4 LYS HG3 1 1 16 4930 1 1 4 LYS HZ1 H 8.537 10.042 -2.092 1.00 . A A . 4 LYS HZ1 1 1 16 4931 1 1 4 LYS HZ2 H 7.121 10.456 -1.266 1.00 . A A . 4 LYS HZ2 1 1 16 4932 1 1 4 LYS HZ3 H 7.035 9.534 -2.682 1.00 . A A . 4 LYS HZ3 1 1 16 4933 1 1 4 LYS N N 6.664 4.968 2.487 1.00 . A A . 4 LYS N 1 1 16 4934 1 1 4 LYS NZ N 7.590 9.711 -1.820 1.00 . A A . 4 LYS NZ 1 1 16 4935 1 1 4 LYS O O 8.527 7.588 3.948 1.00 . A A . 4 LYS O 1 1 16 4936 1 1 5 LEU C C 8.905 7.100 6.548 1.00 . A A . 5 LEU C 1 1 16 4937 1 1 5 LEU CA C 7.549 6.454 6.280 1.00 . A A . 5 LEU CA 1 1 16 4938 1 1 5 LEU CB C 7.252 5.403 7.351 1.00 . A A . 5 LEU CB 1 1 16 4939 1 1 5 LEU CD1 C 5.637 4.571 9.078 1.00 . A A . 5 LEU CD1 1 1 16 4940 1 1 5 LEU CD2 C 6.894 6.698 9.467 1.00 . A A . 5 LEU CD2 1 1 16 4941 1 1 5 LEU CG C 6.240 5.805 8.424 1.00 . A A . 5 LEU CG 1 1 16 4942 1 1 5 LEU H H 7.113 4.961 4.846 1.00 . A A . 5 LEU H 1 1 16 4943 1 1 5 LEU HA H 6.787 7.218 6.317 1.00 . A A . 5 LEU HA 1 1 16 4944 1 1 5 LEU HB2 H 6.875 4.522 6.854 1.00 . A A . 5 LEU HB2 1 1 16 4945 1 1 5 LEU HB3 H 8.183 5.164 7.846 1.00 . A A . 5 LEU HB3 1 1 16 4946 1 1 5 LEU HD11 H 6.429 3.919 9.415 1.00 . A A . 5 LEU HD11 1 1 16 4947 1 1 5 LEU HD12 H 5.021 4.048 8.362 1.00 . A A . 5 LEU HD12 1 1 16 4948 1 1 5 LEU HD13 H 5.033 4.870 9.922 1.00 . A A . 5 LEU HD13 1 1 16 4949 1 1 5 LEU HD21 H 6.206 7.479 9.755 1.00 . A A . 5 LEU HD21 1 1 16 4950 1 1 5 LEU HD22 H 7.788 7.141 9.052 1.00 . A A . 5 LEU HD22 1 1 16 4951 1 1 5 LEU HD23 H 7.154 6.109 10.334 1.00 . A A . 5 LEU HD23 1 1 16 4952 1 1 5 LEU HG H 5.437 6.362 7.961 1.00 . A A . 5 LEU HG 1 1 16 4953 1 1 5 LEU N N 7.513 5.849 4.954 1.00 . A A . 5 LEU N 1 1 16 4954 1 1 5 LEU O O 8.987 8.167 7.156 1.00 . A A . 5 LEU O 1 1 16 4955 1 1 6 PHE C C 12.024 7.139 4.934 1.00 . A A . 6 PHE C 1 1 16 4956 1 1 6 PHE CA C 11.320 6.957 6.276 1.00 . A A . 6 PHE CA 1 1 16 4957 1 1 6 PHE CB C 12.127 6.008 7.164 1.00 . A A . 6 PHE CB 1 1 16 4958 1 1 6 PHE CD1 C 14.446 6.678 7.848 1.00 . A A . 6 PHE CD1 1 1 16 4959 1 1 6 PHE CD2 C 12.613 7.413 9.185 1.00 . A A . 6 PHE CD2 1 1 16 4960 1 1 6 PHE CE1 C 15.327 7.327 8.693 1.00 . A A . 6 PHE CE1 1 1 16 4961 1 1 6 PHE CE2 C 13.489 8.064 10.033 1.00 . A A . 6 PHE CE2 1 1 16 4962 1 1 6 PHE CG C 13.081 6.714 8.084 1.00 . A A . 6 PHE CG 1 1 16 4963 1 1 6 PHE CZ C 14.848 8.020 9.787 1.00 . A A . 6 PHE CZ 1 1 16 4964 1 1 6 PHE H H 9.837 5.600 5.610 1.00 . A A . 6 PHE H 1 1 16 4965 1 1 6 PHE HA H 11.246 7.917 6.763 1.00 . A A . 6 PHE HA 1 1 16 4966 1 1 6 PHE HB2 H 11.447 5.429 7.771 1.00 . A A . 6 PHE HB2 1 1 16 4967 1 1 6 PHE HB3 H 12.700 5.341 6.537 1.00 . A A . 6 PHE HB3 1 1 16 4968 1 1 6 PHE HD1 H 14.822 6.135 6.992 1.00 . A A . 6 PHE HD1 1 1 16 4969 1 1 6 PHE HD2 H 11.551 7.447 9.379 1.00 . A A . 6 PHE HD2 1 1 16 4970 1 1 6 PHE HE1 H 16.388 7.290 8.498 1.00 . A A . 6 PHE HE1 1 1 16 4971 1 1 6 PHE HE2 H 13.112 8.605 10.888 1.00 . A A . 6 PHE HE2 1 1 16 4972 1 1 6 PHE HZ H 15.534 8.528 10.448 1.00 . A A . 6 PHE HZ 1 1 16 4973 1 1 6 PHE N N 9.967 6.446 6.087 1.00 . A A . 6 PHE N 1 1 16 4974 1 1 6 PHE O O 13.109 7.714 4.864 1.00 . A A . 6 PHE O 1 1 16 4975 1 1 7 ALA C C 11.880 8.184 2.017 1.00 . A A . 7 ALA C 1 1 16 4976 1 1 7 ALA CA C 11.962 6.752 2.533 1.00 . A A . 7 ALA CA 1 1 16 4977 1 1 7 ALA CB C 11.249 5.804 1.581 1.00 . A A . 7 ALA CB 1 1 16 4978 1 1 7 ALA H H 10.535 6.195 3.992 1.00 . A A . 7 ALA H 1 1 16 4979 1 1 7 ALA HA H 13.001 6.457 2.584 1.00 . A A . 7 ALA HA 1 1 16 4980 1 1 7 ALA HB1 H 10.692 5.074 2.151 1.00 . A A . 7 ALA HB1 1 1 16 4981 1 1 7 ALA HB2 H 10.571 6.365 0.955 1.00 . A A . 7 ALA HB2 1 1 16 4982 1 1 7 ALA HB3 H 11.976 5.299 0.963 1.00 . A A . 7 ALA HB3 1 1 16 4983 1 1 7 ALA N N 11.398 6.643 3.872 1.00 . A A . 7 ALA N 1 1 16 4984 1 1 7 ALA O O 12.698 8.610 1.201 1.00 . A A . 7 ALA O 1 1 16 4985 1 1 8 LYS C C 11.480 11.258 2.985 1.00 . A A . 8 LYS C 1 1 16 4986 1 1 8 LYS CA C 10.696 10.310 2.084 1.00 . A A . 8 LYS CA 1 1 16 4987 1 1 8 LYS CB C 9.210 10.674 2.115 1.00 . A A . 8 LYS CB 1 1 16 4988 1 1 8 LYS CD C 7.875 11.729 3.963 1.00 . A A . 8 LYS CD 1 1 16 4989 1 1 8 LYS CE C 6.495 11.892 3.342 1.00 . A A . 8 LYS CE 1 1 16 4990 1 1 8 LYS CG C 8.560 10.465 3.472 1.00 . A A . 8 LYS CG 1 1 16 4991 1 1 8 LYS H H 10.266 8.529 3.145 1.00 . A A . 8 LYS H 1 1 16 4992 1 1 8 LYS HA H 11.061 10.409 1.073 1.00 . A A . 8 LYS HA 1 1 16 4993 1 1 8 LYS HB2 H 9.100 11.713 1.842 1.00 . A A . 8 LYS HB2 1 1 16 4994 1 1 8 LYS HB3 H 8.687 10.064 1.392 1.00 . A A . 8 LYS HB3 1 1 16 4995 1 1 8 LYS HD2 H 7.770 11.678 5.036 1.00 . A A . 8 LYS HD2 1 1 16 4996 1 1 8 LYS HD3 H 8.482 12.583 3.698 1.00 . A A . 8 LYS HD3 1 1 16 4997 1 1 8 LYS HE2 H 6.219 10.965 2.863 1.00 . A A . 8 LYS HE2 1 1 16 4998 1 1 8 LYS HE3 H 5.787 12.116 4.126 1.00 . A A . 8 LYS HE3 1 1 16 4999 1 1 8 LYS HG2 H 7.825 9.678 3.392 1.00 . A A . 8 LYS HG2 1 1 16 5000 1 1 8 LYS HG3 H 9.321 10.179 4.185 1.00 . A A . 8 LYS HG3 1 1 16 5001 1 1 8 LYS HZ1 H 6.711 13.893 2.783 1.00 . A A . 8 LYS HZ1 1 1 16 5002 1 1 8 LYS HZ2 H 5.516 13.065 1.918 1.00 . A A . 8 LYS HZ2 1 1 16 5003 1 1 8 LYS HZ3 H 7.150 12.793 1.575 1.00 . A A . 8 LYS HZ3 1 1 16 5004 1 1 8 LYS N N 10.886 8.925 2.496 1.00 . A A . 8 LYS N 1 1 16 5005 1 1 8 LYS NZ N 6.466 12.987 2.334 1.00 . A A . 8 LYS NZ 1 1 16 5006 1 1 8 LYS O O 11.966 12.297 2.536 1.00 . A A . 8 LYS O 1 1 16 5007 1 1 9 ILE C C 13.834 11.622 4.990 1.00 . A A . 9 ILE C 1 1 16 5008 1 1 9 ILE CA C 12.329 11.711 5.220 1.00 . A A . 9 ILE CA 1 1 16 5009 1 1 9 ILE CB C 12.017 11.289 6.668 1.00 . A A . 9 ILE CB 1 1 16 5010 1 1 9 ILE CD1 C 14.183 10.461 7.717 1.00 . A A . 9 ILE CD1 1 1 16 5011 1 1 9 ILE CG1 C 12.870 10.084 7.066 1.00 . A A . 9 ILE CG1 1 1 16 5012 1 1 9 ILE CG2 C 10.537 10.970 6.818 1.00 . A A . 9 ILE CG2 1 1 16 5013 1 1 9 ILE H H 11.192 10.055 4.555 1.00 . A A . 9 ILE H 1 1 16 5014 1 1 9 ILE HA H 12.016 12.737 5.090 1.00 . A A . 9 ILE HA 1 1 16 5015 1 1 9 ILE HB H 12.250 12.117 7.319 1.00 . A A . 9 ILE HB 1 1 16 5016 1 1 9 ILE HD11 H 14.091 10.374 8.789 1.00 . A A . 9 ILE HD11 1 1 16 5017 1 1 9 ILE HD12 H 14.962 9.801 7.366 1.00 . A A . 9 ILE HD12 1 1 16 5018 1 1 9 ILE HD13 H 14.432 11.481 7.459 1.00 . A A . 9 ILE HD13 1 1 16 5019 1 1 9 ILE HG12 H 12.318 9.474 7.764 1.00 . A A . 9 ILE HG12 1 1 16 5020 1 1 9 ILE HG13 H 13.092 9.501 6.183 1.00 . A A . 9 ILE HG13 1 1 16 5021 1 1 9 ILE HG21 H 10.394 9.900 6.788 1.00 . A A . 9 ILE HG21 1 1 16 5022 1 1 9 ILE HG22 H 10.181 11.353 7.763 1.00 . A A . 9 ILE HG22 1 1 16 5023 1 1 9 ILE HG23 H 9.985 11.429 6.012 1.00 . A A . 9 ILE HG23 1 1 16 5024 1 1 9 ILE N N 11.601 10.894 4.257 1.00 . A A . 9 ILE N 1 1 16 5025 1 1 9 ILE O O 14.579 12.548 5.312 1.00 . A A . 9 ILE O 1 1 16 5026 1 1 10 THR C C 16.090 10.904 2.817 1.00 . A A . 10 THR C 1 1 16 5027 1 1 10 THR CA C 15.692 10.290 4.154 1.00 . A A . 10 THR CA 1 1 16 5028 1 1 10 THR CB C 16.045 8.791 4.143 1.00 . A A . 10 THR CB 1 1 16 5029 1 1 10 THR CG2 C 16.011 8.216 5.551 1.00 . A A . 10 THR CG2 1 1 16 5030 1 1 10 THR H H 13.633 9.799 4.194 1.00 . A A . 10 THR H 1 1 16 5031 1 1 10 THR HA H 16.259 10.766 4.941 1.00 . A A . 10 THR HA 1 1 16 5032 1 1 10 THR HB H 17.043 8.674 3.746 1.00 . A A . 10 THR HB 1 1 16 5033 1 1 10 THR HG1 H 15.606 7.639 2.603 1.00 . A A . 10 THR HG1 1 1 16 5034 1 1 10 THR HG21 H 16.731 8.734 6.168 1.00 . A A . 10 THR HG21 1 1 16 5035 1 1 10 THR HG22 H 16.256 7.165 5.517 1.00 . A A . 10 THR HG22 1 1 16 5036 1 1 10 THR HG23 H 15.023 8.343 5.968 1.00 . A A . 10 THR HG23 1 1 16 5037 1 1 10 THR N N 14.276 10.501 4.428 1.00 . A A . 10 THR N 1 1 16 5038 1 1 10 THR O O 15.545 10.549 1.772 1.00 . A A . 10 THR O 1 1 16 5039 1 1 10 THR OG1 O 15.125 8.077 3.309 1.00 . A A . 10 THR OG1 1 1 16 5040 1 1 11 LYS C C 19.008 12.235 1.434 1.00 . A A . 11 LYS C 1 1 16 5041 1 1 11 LYS CA C 17.519 12.491 1.647 1.00 . A A . 11 LYS CA 1 1 16 5042 1 1 11 LYS CB C 17.256 13.996 1.730 1.00 . A A . 11 LYS CB 1 1 16 5043 1 1 11 LYS CD C 16.520 14.551 4.067 1.00 . A A . 11 LYS CD 1 1 16 5044 1 1 11 LYS CE C 16.661 15.627 5.132 1.00 . A A . 11 LYS CE 1 1 16 5045 1 1 11 LYS CG C 17.656 14.611 3.060 1.00 . A A . 11 LYS CG 1 1 16 5046 1 1 11 LYS H H 17.441 12.068 3.720 1.00 . A A . 11 LYS H 1 1 16 5047 1 1 11 LYS HA H 16.973 12.084 0.810 1.00 . A A . 11 LYS HA 1 1 16 5048 1 1 11 LYS HB2 H 17.812 14.490 0.947 1.00 . A A . 11 LYS HB2 1 1 16 5049 1 1 11 LYS HB3 H 16.201 14.174 1.578 1.00 . A A . 11 LYS HB3 1 1 16 5050 1 1 11 LYS HD2 H 15.583 14.694 3.549 1.00 . A A . 11 LYS HD2 1 1 16 5051 1 1 11 LYS HD3 H 16.525 13.581 4.544 1.00 . A A . 11 LYS HD3 1 1 16 5052 1 1 11 LYS HE2 H 17.189 15.212 5.977 1.00 . A A . 11 LYS HE2 1 1 16 5053 1 1 11 LYS HE3 H 17.229 16.449 4.722 1.00 . A A . 11 LYS HE3 1 1 16 5054 1 1 11 LYS HG2 H 18.503 14.070 3.456 1.00 . A A . 11 LYS HG2 1 1 16 5055 1 1 11 LYS HG3 H 17.929 15.645 2.901 1.00 . A A . 11 LYS HG3 1 1 16 5056 1 1 11 LYS HZ1 H 15.215 15.949 6.605 1.00 . A A . 11 LYS HZ1 1 1 16 5057 1 1 11 LYS HZ2 H 14.574 15.656 5.068 1.00 . A A . 11 LYS HZ2 1 1 16 5058 1 1 11 LYS HZ3 H 15.269 17.157 5.422 1.00 . A A . 11 LYS HZ3 1 1 16 5059 1 1 11 LYS N N 17.045 11.828 2.856 1.00 . A A . 11 LYS N 1 1 16 5060 1 1 11 LYS NZ N 15.337 16.133 5.588 1.00 . A A . 11 LYS NZ 1 1 16 5061 1 1 11 LYS O O 19.660 12.923 0.650 1.00 . A A . 11 LYS O 1 1 16 5062 1 1 12 LYS C C 21.171 9.877 0.905 1.00 . A A . 12 LYS C 1 1 16 5063 1 1 12 LYS CA C 20.950 10.891 2.023 1.00 . A A . 12 LYS CA 1 1 16 5064 1 1 12 LYS CB C 21.464 10.324 3.349 1.00 . A A . 12 LYS CB 1 1 16 5065 1 1 12 LYS CD C 22.831 8.229 3.577 1.00 . A A . 12 LYS CD 1 1 16 5066 1 1 12 LYS CE C 23.298 7.964 4.999 1.00 . A A . 12 LYS CE 1 1 16 5067 1 1 12 LYS CG C 22.851 9.713 3.252 1.00 . A A . 12 LYS CG 1 1 16 5068 1 1 12 LYS H H 18.967 10.727 2.747 1.00 . A A . 12 LYS H 1 1 16 5069 1 1 12 LYS HA H 21.497 11.791 1.790 1.00 . A A . 12 LYS HA 1 1 16 5070 1 1 12 LYS HB2 H 21.494 11.120 4.079 1.00 . A A . 12 LYS HB2 1 1 16 5071 1 1 12 LYS HB3 H 20.780 9.560 3.690 1.00 . A A . 12 LYS HB3 1 1 16 5072 1 1 12 LYS HD2 H 21.823 7.859 3.466 1.00 . A A . 12 LYS HD2 1 1 16 5073 1 1 12 LYS HD3 H 23.485 7.710 2.890 1.00 . A A . 12 LYS HD3 1 1 16 5074 1 1 12 LYS HE2 H 24.065 8.680 5.252 1.00 . A A . 12 LYS HE2 1 1 16 5075 1 1 12 LYS HE3 H 22.459 8.084 5.668 1.00 . A A . 12 LYS HE3 1 1 16 5076 1 1 12 LYS HG2 H 23.224 9.846 2.246 1.00 . A A . 12 LYS HG2 1 1 16 5077 1 1 12 LYS HG3 H 23.506 10.217 3.949 1.00 . A A . 12 LYS HG3 1 1 16 5078 1 1 12 LYS HZ1 H 23.430 6.129 5.989 1.00 . A A . 12 LYS HZ1 1 1 16 5079 1 1 12 LYS HZ2 H 24.881 6.629 5.278 1.00 . A A . 12 LYS HZ2 1 1 16 5080 1 1 12 LYS HZ3 H 23.632 6.019 4.313 1.00 . A A . 12 LYS HZ3 1 1 16 5081 1 1 12 LYS N N 19.539 11.240 2.137 1.00 . A A . 12 LYS N 1 1 16 5082 1 1 12 LYS NZ N 23.849 6.589 5.155 1.00 . A A . 12 LYS NZ 1 1 16 5083 1 1 12 LYS O O 21.643 10.225 -0.176 1.00 . A A . 12 LYS O 1 1 16 5084 1 1 13 ASN C C 20.041 7.763 -0.992 1.00 . A A . 13 ASN C 1 1 16 5085 1 1 13 ASN CA C 20.985 7.558 0.189 1.00 . A A . 13 ASN CA 1 1 16 5086 1 1 13 ASN CB C 20.724 6.195 0.834 1.00 . A A . 13 ASN CB 1 1 16 5087 1 1 13 ASN CG C 21.972 5.335 0.891 1.00 . A A . 13 ASN CG 1 1 16 5088 1 1 13 ASN H H 20.453 8.406 2.054 1.00 . A A . 13 ASN H 1 1 16 5089 1 1 13 ASN HA H 22.003 7.588 -0.169 1.00 . A A . 13 ASN HA 1 1 16 5090 1 1 13 ASN HB2 H 20.366 6.343 1.842 1.00 . A A . 13 ASN HB2 1 1 16 5091 1 1 13 ASN HB3 H 19.973 5.670 0.262 1.00 . A A . 13 ASN HB3 1 1 16 5092 1 1 13 ASN HD21 H 22.272 5.855 2.787 1.00 . A A . 13 ASN HD21 1 1 16 5093 1 1 13 ASN HD22 H 23.436 4.771 2.112 1.00 . A A . 13 ASN HD22 1 1 16 5094 1 1 13 ASN N N 20.825 8.622 1.174 1.00 . A A . 13 ASN N 1 1 16 5095 1 1 13 ASN ND2 N 22.626 5.318 2.047 1.00 . A A . 13 ASN ND2 1 1 16 5096 1 1 13 ASN O O 20.243 7.197 -2.066 1.00 . A A . 13 ASN O 1 1 16 5097 1 1 13 ASN OD1 O 22.343 4.692 -0.091 1.00 . A A . 13 ASN OD1 1 1 16 5098 1 1 14 MET C C 18.715 9.477 -3.053 1.00 . A A . 14 MET C 1 1 16 5099 1 1 14 MET CA C 18.038 8.858 -1.834 1.00 . A A . 14 MET CA 1 1 16 5100 1 1 14 MET CB C 16.949 9.797 -1.310 1.00 . A A . 14 MET CB 1 1 16 5101 1 1 14 MET CE C 13.192 9.166 -2.987 1.00 . A A . 14 MET CE 1 1 16 5102 1 1 14 MET CG C 15.752 9.918 -2.239 1.00 . A A . 14 MET CG 1 1 16 5103 1 1 14 MET H H 18.903 8.999 0.093 1.00 . A A . 14 MET H 1 1 16 5104 1 1 14 MET HA H 17.584 7.923 -2.124 1.00 . A A . 14 MET HA 1 1 16 5105 1 1 14 MET HB2 H 16.601 9.429 -0.356 1.00 . A A . 14 MET HB2 1 1 16 5106 1 1 14 MET HB3 H 17.373 10.781 -1.174 1.00 . A A . 14 MET HB3 1 1 16 5107 1 1 14 MET HE1 H 12.847 8.160 -3.171 1.00 . A A . 14 MET HE1 1 1 16 5108 1 1 14 MET HE2 H 12.344 9.812 -2.812 1.00 . A A . 14 MET HE2 1 1 16 5109 1 1 14 MET HE3 H 13.743 9.520 -3.847 1.00 . A A . 14 MET HE3 1 1 16 5110 1 1 14 MET HG2 H 15.564 10.965 -2.427 1.00 . A A . 14 MET HG2 1 1 16 5111 1 1 14 MET HG3 H 15.986 9.423 -3.170 1.00 . A A . 14 MET HG3 1 1 16 5112 1 1 14 MET N N 19.011 8.577 -0.785 1.00 . A A . 14 MET N 1 1 16 5113 1 1 14 MET O O 18.561 8.991 -4.173 1.00 . A A . 14 MET O 1 1 16 5114 1 1 14 MET SD S 14.259 9.179 -1.549 1.00 . A A . 14 MET SD 1 1 16 5115 1 1 15 ALA C C 21.400 10.451 -4.341 1.00 . A A . 15 ALA C 1 1 16 5116 1 1 15 ALA CA C 20.165 11.234 -3.906 1.00 . A A . 15 ALA CA 1 1 16 5117 1 1 15 ALA CB C 20.555 12.641 -3.476 1.00 . A A . 15 ALA CB 1 1 16 5118 1 1 15 ALA H H 19.548 10.891 -1.912 1.00 . A A . 15 ALA H 1 1 16 5119 1 1 15 ALA HA H 19.489 11.315 -4.745 1.00 . A A . 15 ALA HA 1 1 16 5120 1 1 15 ALA HB1 H 20.891 13.199 -4.338 1.00 . A A . 15 ALA HB1 1 1 16 5121 1 1 15 ALA HB2 H 19.699 13.133 -3.039 1.00 . A A . 15 ALA HB2 1 1 16 5122 1 1 15 ALA HB3 H 21.351 12.587 -2.748 1.00 . A A . 15 ALA HB3 1 1 16 5123 1 1 15 ALA N N 19.464 10.551 -2.827 1.00 . A A . 15 ALA N 1 1 16 5124 1 1 15 ALA O O 22.126 10.868 -5.244 1.00 . A A . 15 ALA O 1 1 16 5125 1 1 16 HIS C C 22.347 7.243 -4.804 1.00 . A A . 16 HIS C 1 1 16 5126 1 1 16 HIS CA C 22.780 8.473 -4.012 1.00 . A A . 16 HIS CA 1 1 16 5127 1 1 16 HIS CB C 23.497 8.043 -2.732 1.00 . A A . 16 HIS CB 1 1 16 5128 1 1 16 HIS CD2 C 26.033 8.044 -2.190 1.00 . A A . 16 HIS CD2 1 1 16 5129 1 1 16 HIS CE1 C 26.464 10.137 -2.679 1.00 . A A . 16 HIS CE1 1 1 16 5130 1 1 16 HIS CG C 24.874 8.614 -2.596 1.00 . A A . 16 HIS CG 1 1 16 5131 1 1 16 HIS H H 21.018 9.035 -2.982 1.00 . A A . 16 HIS H 1 1 16 5132 1 1 16 HIS HA H 23.459 9.054 -4.617 1.00 . A A . 16 HIS HA 1 1 16 5133 1 1 16 HIS HB2 H 22.919 8.365 -1.878 1.00 . A A . 16 HIS HB2 1 1 16 5134 1 1 16 HIS HB3 H 23.580 6.966 -2.718 1.00 . A A . 16 HIS HB3 1 1 16 5135 1 1 16 HIS HD1 H 24.546 10.600 -3.217 1.00 . A A . 16 HIS HD1 1 1 16 5136 1 1 16 HIS HD2 H 26.168 7.018 -1.876 1.00 . A A . 16 HIS HD2 1 1 16 5137 1 1 16 HIS HE1 H 26.985 11.072 -2.827 1.00 . A A . 16 HIS HE1 1 1 16 5138 1 1 16 HIS N N 21.632 9.314 -3.692 1.00 . A A . 16 HIS N 1 1 16 5139 1 1 16 HIS ND1 N 25.178 9.926 -2.894 1.00 . A A . 16 HIS ND1 1 1 16 5140 1 1 16 HIS NE2 N 27.006 9.012 -2.250 1.00 . A A . 16 HIS NE2 1 1 16 5141 1 1 16 HIS O O 23.168 6.584 -5.444 1.00 . A A . 16 HIS O 1 1 16 5142 1 1 17 ILE C C 20.916 5.815 -6.941 1.00 . A A . 17 ILE C 1 1 16 5143 1 1 17 ILE CA C 20.514 5.788 -5.470 1.00 . A A . 17 ILE CA 1 1 16 5144 1 1 17 ILE CB C 18.978 5.735 -5.371 1.00 . A A . 17 ILE CB 1 1 16 5145 1 1 17 ILE CD1 C 16.921 7.180 -5.767 1.00 . A A . 17 ILE CD1 1 1 16 5146 1 1 17 ILE CG1 C 18.354 6.891 -6.155 1.00 . A A . 17 ILE CG1 1 1 16 5147 1 1 17 ILE CG2 C 18.540 5.778 -3.914 1.00 . A A . 17 ILE CG2 1 1 16 5148 1 1 17 ILE H H 20.450 7.502 -4.230 1.00 . A A . 17 ILE H 1 1 16 5149 1 1 17 ILE HA H 20.916 4.895 -5.014 1.00 . A A . 17 ILE HA 1 1 16 5150 1 1 17 ILE HB H 18.645 4.800 -5.794 1.00 . A A . 17 ILE HB 1 1 16 5151 1 1 17 ILE HD11 H 16.502 7.904 -6.450 1.00 . A A . 17 ILE HD11 1 1 16 5152 1 1 17 ILE HD12 H 16.345 6.268 -5.809 1.00 . A A . 17 ILE HD12 1 1 16 5153 1 1 17 ILE HD13 H 16.894 7.577 -4.762 1.00 . A A . 17 ILE HD13 1 1 16 5154 1 1 17 ILE HG12 H 18.930 7.786 -5.985 1.00 . A A . 17 ILE HG12 1 1 16 5155 1 1 17 ILE HG13 H 18.371 6.651 -7.209 1.00 . A A . 17 ILE HG13 1 1 16 5156 1 1 17 ILE HG21 H 17.539 5.383 -3.828 1.00 . A A . 17 ILE HG21 1 1 16 5157 1 1 17 ILE HG22 H 19.214 5.182 -3.318 1.00 . A A . 17 ILE HG22 1 1 16 5158 1 1 17 ILE HG23 H 18.556 6.799 -3.564 1.00 . A A . 17 ILE HG23 1 1 16 5159 1 1 17 ILE N N 21.055 6.939 -4.757 1.00 . A A . 17 ILE N 1 1 16 5160 1 1 17 ILE O O 21.236 4.780 -7.526 1.00 . A A . 17 ILE O 1 1 16 5161 1 1 18 ARG C C 22.779 7.152 -9.108 1.00 . A A . 18 ARG C 1 1 16 5162 1 1 18 ARG CA C 21.263 7.167 -8.934 1.00 . A A . 18 ARG CA 1 1 16 5163 1 1 18 ARG CB C 20.689 8.474 -9.485 1.00 . A A . 18 ARG CB 1 1 16 5164 1 1 18 ARG CD C 21.544 10.811 -9.835 1.00 . A A . 18 ARG CD 1 1 16 5165 1 1 18 ARG CG C 21.256 9.717 -8.819 1.00 . A A . 18 ARG CG 1 1 16 5166 1 1 18 ARG CZ C 24.001 10.893 -9.843 1.00 . A A . 18 ARG CZ 1 1 16 5167 1 1 18 ARG H H 20.635 7.793 -7.013 1.00 . A A . 18 ARG H 1 1 16 5168 1 1 18 ARG HA H 20.841 6.339 -9.484 1.00 . A A . 18 ARG HA 1 1 16 5169 1 1 18 ARG HB2 H 20.901 8.530 -10.542 1.00 . A A . 18 ARG HB2 1 1 16 5170 1 1 18 ARG HB3 H 19.619 8.471 -9.341 1.00 . A A . 18 ARG HB3 1 1 16 5171 1 1 18 ARG HD2 H 20.783 10.782 -10.600 1.00 . A A . 18 ARG HD2 1 1 16 5172 1 1 18 ARG HD3 H 21.514 11.766 -9.333 1.00 . A A . 18 ARG HD3 1 1 16 5173 1 1 18 ARG HE H 22.874 10.334 -11.391 1.00 . A A . 18 ARG HE 1 1 16 5174 1 1 18 ARG HG2 H 20.540 10.087 -8.100 1.00 . A A . 18 ARG HG2 1 1 16 5175 1 1 18 ARG HG3 H 22.174 9.455 -8.314 1.00 . A A . 18 ARG HG3 1 1 16 5176 1 1 18 ARG HH11 H 23.137 11.447 -8.103 1.00 . A A . 18 ARG HH11 1 1 16 5177 1 1 18 ARG HH12 H 24.869 11.500 -8.122 1.00 . A A . 18 ARG HH12 1 1 16 5178 1 1 18 ARG HH21 H 25.154 10.399 -11.428 1.00 . A A . 18 ARG HH21 1 1 16 5179 1 1 18 ARG HH22 H 26.015 10.905 -10.014 1.00 . A A . 18 ARG HH22 1 1 16 5180 1 1 18 ARG N N 20.899 7.005 -7.532 1.00 . A A . 18 ARG N 1 1 16 5181 1 1 18 ARG NE N 22.852 10.645 -10.462 1.00 . A A . 18 ARG NE 1 1 16 5182 1 1 18 ARG NH1 N 24.003 11.315 -8.586 1.00 . A A . 18 ARG NH1 1 1 16 5183 1 1 18 ARG NH2 N 25.151 10.718 -10.481 1.00 . A A . 18 ARG NH2 1 1 16 5184 1 1 18 ARG O O 23.336 7.961 -9.850 1.00 . A A . 18 ARG O 1 1 17 5185 1 1 1 PHE C C 5.429 -1.680 -2.302 1.00 . A A . 1 PHE C 1 1 17 5186 1 1 1 PHE CA C 5.523 -1.841 -3.817 1.00 . A A . 1 PHE CA 1 1 17 5187 1 1 1 PHE CB C 4.336 -1.148 -4.489 1.00 . A A . 1 PHE CB 1 1 17 5188 1 1 1 PHE CD1 C 4.190 1.273 -5.133 1.00 . A A . 1 PHE CD1 1 1 17 5189 1 1 1 PHE CD2 C 5.646 -0.145 -6.380 1.00 . A A . 1 PHE CD2 1 1 17 5190 1 1 1 PHE CE1 C 4.552 2.347 -5.924 1.00 . A A . 1 PHE CE1 1 1 17 5191 1 1 1 PHE CE2 C 6.012 0.926 -7.174 1.00 . A A . 1 PHE CE2 1 1 17 5192 1 1 1 PHE CG C 4.732 0.017 -5.351 1.00 . A A . 1 PHE CG 1 1 17 5193 1 1 1 PHE CZ C 5.464 2.173 -6.946 1.00 . A A . 1 PHE CZ 1 1 17 5194 1 1 1 PHE H1 H 4.951 -3.878 -3.750 1.00 . A A . 1 PHE H1 1 1 17 5195 1 1 1 PHE HA H 6.438 -1.383 -4.159 1.00 . A A . 1 PHE HA 1 1 17 5196 1 1 1 PHE HB2 H 3.819 -1.861 -5.113 1.00 . A A . 1 PHE HB2 1 1 17 5197 1 1 1 PHE HB3 H 3.662 -0.785 -3.728 1.00 . A A . 1 PHE HB3 1 1 17 5198 1 1 1 PHE HD1 H 3.477 1.410 -4.332 1.00 . A A . 1 PHE HD1 1 1 17 5199 1 1 1 PHE HD2 H 6.074 -1.120 -6.561 1.00 . A A . 1 PHE HD2 1 1 17 5200 1 1 1 PHE HE1 H 4.122 3.321 -5.742 1.00 . A A . 1 PHE HE1 1 1 17 5201 1 1 1 PHE HE2 H 6.724 0.786 -7.974 1.00 . A A . 1 PHE HE2 1 1 17 5202 1 1 1 PHE HZ H 5.749 3.011 -7.565 1.00 . A A . 1 PHE HZ 1 1 17 5203 1 1 1 PHE N N 5.563 -3.250 -4.189 1.00 . A A . 1 PHE N 1 1 17 5204 1 1 1 PHE O O 4.769 -2.468 -1.623 1.00 . A A . 1 PHE O 1 1 17 5205 1 1 2 LEU C C 5.988 1.106 -0.068 1.00 . A A . 2 LEU C 1 1 17 5206 1 1 2 LEU CA C 6.086 -0.391 -0.345 1.00 . A A . 2 LEU CA 1 1 17 5207 1 1 2 LEU CB C 7.349 -0.959 0.305 1.00 . A A . 2 LEU CB 1 1 17 5208 1 1 2 LEU CD1 C 9.834 -0.635 0.316 1.00 . A A . 2 LEU CD1 1 1 17 5209 1 1 2 LEU CD2 C 8.792 -2.238 -1.297 1.00 . A A . 2 LEU CD2 1 1 17 5210 1 1 2 LEU CG C 8.617 -0.925 -0.548 1.00 . A A . 2 LEU CG 1 1 17 5211 1 1 2 LEU H H 6.602 -0.063 -2.371 1.00 . A A . 2 LEU H 1 1 17 5212 1 1 2 LEU HA H 5.222 -0.881 0.078 1.00 . A A . 2 LEU HA 1 1 17 5213 1 1 2 LEU HB2 H 7.540 -0.395 1.205 1.00 . A A . 2 LEU HB2 1 1 17 5214 1 1 2 LEU HB3 H 7.151 -1.990 0.564 1.00 . A A . 2 LEU HB3 1 1 17 5215 1 1 2 LEU HD11 H 9.682 -1.047 1.302 1.00 . A A . 2 LEU HD11 1 1 17 5216 1 1 2 LEU HD12 H 9.977 0.433 0.390 1.00 . A A . 2 LEU HD12 1 1 17 5217 1 1 2 LEU HD13 H 10.709 -1.084 -0.132 1.00 . A A . 2 LEU HD13 1 1 17 5218 1 1 2 LEU HD21 H 9.491 -2.865 -0.763 1.00 . A A . 2 LEU HD21 1 1 17 5219 1 1 2 LEU HD22 H 9.173 -2.039 -2.288 1.00 . A A . 2 LEU HD22 1 1 17 5220 1 1 2 LEU HD23 H 7.840 -2.740 -1.370 1.00 . A A . 2 LEU HD23 1 1 17 5221 1 1 2 LEU HG H 8.531 -0.131 -1.278 1.00 . A A . 2 LEU HG 1 1 17 5222 1 1 2 LEU N N 6.094 -0.656 -1.780 1.00 . A A . 2 LEU N 1 1 17 5223 1 1 2 LEU O O 6.293 1.941 -0.920 1.00 . A A . 2 LEU O 1 1 17 5224 1 1 3 PRO C C 6.753 3.550 1.742 1.00 . A A . 3 PRO C 1 1 17 5225 1 1 3 PRO CA C 5.408 2.852 1.570 1.00 . A A . 3 PRO CA 1 1 17 5226 1 1 3 PRO CB C 4.685 2.746 2.915 1.00 . A A . 3 PRO CB 1 1 17 5227 1 1 3 PRO CD C 5.172 0.513 2.217 1.00 . A A . 3 PRO CD 1 1 17 5228 1 1 3 PRO CG C 5.036 1.393 3.429 1.00 . A A . 3 PRO CG 1 1 17 5229 1 1 3 PRO HA H 4.799 3.413 0.876 1.00 . A A . 3 PRO HA 1 1 17 5230 1 1 3 PRO HB2 H 5.036 3.525 3.578 1.00 . A A . 3 PRO HB2 1 1 17 5231 1 1 3 PRO HB3 H 3.620 2.847 2.765 1.00 . A A . 3 PRO HB3 1 1 17 5232 1 1 3 PRO HD2 H 5.944 -0.227 2.372 1.00 . A A . 3 PRO HD2 1 1 17 5233 1 1 3 PRO HD3 H 4.230 0.036 1.990 1.00 . A A . 3 PRO HD3 1 1 17 5234 1 1 3 PRO HG2 H 5.971 1.436 3.967 1.00 . A A . 3 PRO HG2 1 1 17 5235 1 1 3 PRO HG3 H 4.248 1.028 4.070 1.00 . A A . 3 PRO HG3 1 1 17 5236 1 1 3 PRO N N 5.554 1.455 1.152 1.00 . A A . 3 PRO N 1 1 17 5237 1 1 3 PRO O O 7.798 2.901 1.793 1.00 . A A . 3 PRO O 1 1 17 5238 1 1 4 LYS C C 7.904 6.440 3.310 1.00 . A A . 4 LYS C 1 1 17 5239 1 1 4 LYS CA C 7.936 5.661 1.999 1.00 . A A . 4 LYS CA 1 1 17 5240 1 1 4 LYS CB C 8.110 6.627 0.824 1.00 . A A . 4 LYS CB 1 1 17 5241 1 1 4 LYS CD C 6.885 8.297 -0.596 1.00 . A A . 4 LYS CD 1 1 17 5242 1 1 4 LYS CE C 7.984 8.318 -1.648 1.00 . A A . 4 LYS CE 1 1 17 5243 1 1 4 LYS CG C 6.812 6.951 0.106 1.00 . A A . 4 LYS CG 1 1 17 5244 1 1 4 LYS H H 5.856 5.336 1.783 1.00 . A A . 4 LYS H 1 1 17 5245 1 1 4 LYS HA H 8.772 4.979 2.020 1.00 . A A . 4 LYS HA 1 1 17 5246 1 1 4 LYS HB2 H 8.535 7.549 1.192 1.00 . A A . 4 LYS HB2 1 1 17 5247 1 1 4 LYS HB3 H 8.792 6.187 0.110 1.00 . A A . 4 LYS HB3 1 1 17 5248 1 1 4 LYS HD2 H 5.938 8.493 -1.078 1.00 . A A . 4 LYS HD2 1 1 17 5249 1 1 4 LYS HD3 H 7.085 9.065 0.137 1.00 . A A . 4 LYS HD3 1 1 17 5250 1 1 4 LYS HE2 H 8.763 8.990 -1.322 1.00 . A A . 4 LYS HE2 1 1 17 5251 1 1 4 LYS HE3 H 8.388 7.321 -1.747 1.00 . A A . 4 LYS HE3 1 1 17 5252 1 1 4 LYS HG2 H 6.616 6.184 -0.628 1.00 . A A . 4 LYS HG2 1 1 17 5253 1 1 4 LYS HG3 H 6.008 6.975 0.828 1.00 . A A . 4 LYS HG3 1 1 17 5254 1 1 4 LYS HZ1 H 6.471 9.028 -2.900 1.00 . A A . 4 LYS HZ1 1 1 17 5255 1 1 4 LYS HZ2 H 7.577 8.008 -3.673 1.00 . A A . 4 LYS HZ2 1 1 17 5256 1 1 4 LYS HZ3 H 8.013 9.598 -3.298 1.00 . A A . 4 LYS HZ3 1 1 17 5257 1 1 4 LYS N N 6.720 4.875 1.831 1.00 . A A . 4 LYS N 1 1 17 5258 1 1 4 LYS NZ N 7.476 8.770 -2.972 1.00 . A A . 4 LYS NZ 1 1 17 5259 1 1 4 LYS O O 8.392 7.568 3.386 1.00 . A A . 4 LYS O 1 1 17 5260 1 1 5 LEU C C 8.547 7.148 6.021 1.00 . A A . 5 LEU C 1 1 17 5261 1 1 5 LEU CA C 7.234 6.466 5.650 1.00 . A A . 5 LEU CA 1 1 17 5262 1 1 5 LEU CB C 6.864 5.433 6.715 1.00 . A A . 5 LEU CB 1 1 17 5263 1 1 5 LEU CD1 C 4.977 4.082 7.662 1.00 . A A . 5 LEU CD1 1 1 17 5264 1 1 5 LEU CD2 C 5.261 6.473 8.338 1.00 . A A . 5 LEU CD2 1 1 17 5265 1 1 5 LEU CG C 5.417 5.465 7.209 1.00 . A A . 5 LEU CG 1 1 17 5266 1 1 5 LEU H H 6.958 4.932 4.219 1.00 . A A . 5 LEU H 1 1 17 5267 1 1 5 LEU HA H 6.456 7.214 5.600 1.00 . A A . 5 LEU HA 1 1 17 5268 1 1 5 LEU HB2 H 7.051 4.453 6.304 1.00 . A A . 5 LEU HB2 1 1 17 5269 1 1 5 LEU HB3 H 7.509 5.592 7.568 1.00 . A A . 5 LEU HB3 1 1 17 5270 1 1 5 LEU HD11 H 3.921 3.960 7.472 1.00 . A A . 5 LEU HD11 1 1 17 5271 1 1 5 LEU HD12 H 5.167 3.971 8.719 1.00 . A A . 5 LEU HD12 1 1 17 5272 1 1 5 LEU HD13 H 5.530 3.331 7.116 1.00 . A A . 5 LEU HD13 1 1 17 5273 1 1 5 LEU HD21 H 4.537 7.222 8.054 1.00 . A A . 5 LEU HD21 1 1 17 5274 1 1 5 LEU HD22 H 6.213 6.948 8.531 1.00 . A A . 5 LEU HD22 1 1 17 5275 1 1 5 LEU HD23 H 4.925 5.965 9.230 1.00 . A A . 5 LEU HD23 1 1 17 5276 1 1 5 LEU HG H 4.773 5.770 6.396 1.00 . A A . 5 LEU HG 1 1 17 5277 1 1 5 LEU N N 7.328 5.830 4.341 1.00 . A A . 5 LEU N 1 1 17 5278 1 1 5 LEU O O 8.553 8.230 6.608 1.00 . A A . 5 LEU O 1 1 17 5279 1 1 6 PHE C C 11.795 7.221 4.689 1.00 . A A . 6 PHE C 1 1 17 5280 1 1 6 PHE CA C 10.979 7.053 5.967 1.00 . A A . 6 PHE CA 1 1 17 5281 1 1 6 PHE CB C 11.723 6.142 6.945 1.00 . A A . 6 PHE CB 1 1 17 5282 1 1 6 PHE CD1 C 13.958 6.878 7.815 1.00 . A A . 6 PHE CD1 1 1 17 5283 1 1 6 PHE CD2 C 12.000 7.602 8.967 1.00 . A A . 6 PHE CD2 1 1 17 5284 1 1 6 PHE CE1 C 14.748 7.565 8.718 1.00 . A A . 6 PHE CE1 1 1 17 5285 1 1 6 PHE CE2 C 12.784 8.291 9.873 1.00 . A A . 6 PHE CE2 1 1 17 5286 1 1 6 PHE CG C 12.578 6.889 7.928 1.00 . A A . 6 PHE CG 1 1 17 5287 1 1 6 PHE CZ C 14.159 8.272 9.749 1.00 . A A . 6 PHE CZ 1 1 17 5288 1 1 6 PHE H H 9.589 5.648 5.206 1.00 . A A . 6 PHE H 1 1 17 5289 1 1 6 PHE HA H 10.843 8.021 6.422 1.00 . A A . 6 PHE HA 1 1 17 5290 1 1 6 PHE HB2 H 11.004 5.562 7.504 1.00 . A A . 6 PHE HB2 1 1 17 5291 1 1 6 PHE HB3 H 12.363 5.474 6.387 1.00 . A A . 6 PHE HB3 1 1 17 5292 1 1 6 PHE HD1 H 14.420 6.325 7.009 1.00 . A A . 6 PHE HD1 1 1 17 5293 1 1 6 PHE HD2 H 10.924 7.617 9.065 1.00 . A A . 6 PHE HD2 1 1 17 5294 1 1 6 PHE HE1 H 15.823 7.548 8.619 1.00 . A A . 6 PHE HE1 1 1 17 5295 1 1 6 PHE HE2 H 12.321 8.842 10.678 1.00 . A A . 6 PHE HE2 1 1 17 5296 1 1 6 PHE HZ H 14.774 8.809 10.455 1.00 . A A . 6 PHE HZ 1 1 17 5297 1 1 6 PHE N N 9.659 6.508 5.672 1.00 . A A . 6 PHE N 1 1 17 5298 1 1 6 PHE O O 12.871 7.819 4.701 1.00 . A A . 6 PHE O 1 1 17 5299 1 1 7 ALA C C 11.890 8.198 1.745 1.00 . A A . 7 ALA C 1 1 17 5300 1 1 7 ALA CA C 11.955 6.780 2.301 1.00 . A A . 7 ALA CA 1 1 17 5301 1 1 7 ALA CB C 11.348 5.795 1.312 1.00 . A A . 7 ALA CB 1 1 17 5302 1 1 7 ALA H H 10.415 6.223 3.641 1.00 . A A . 7 ALA H 1 1 17 5303 1 1 7 ALA HA H 12.991 6.510 2.450 1.00 . A A . 7 ALA HA 1 1 17 5304 1 1 7 ALA HB1 H 10.716 6.328 0.617 1.00 . A A . 7 ALA HB1 1 1 17 5305 1 1 7 ALA HB2 H 12.138 5.295 0.772 1.00 . A A . 7 ALA HB2 1 1 17 5306 1 1 7 ALA HB3 H 10.759 5.065 1.847 1.00 . A A . 7 ALA HB3 1 1 17 5307 1 1 7 ALA N N 11.276 6.688 3.587 1.00 . A A . 7 ALA N 1 1 17 5308 1 1 7 ALA O O 12.768 8.624 0.995 1.00 . A A . 7 ALA O 1 1 17 5309 1 1 8 LYS C C 11.343 11.283 2.601 1.00 . A A . 8 LYS C 1 1 17 5310 1 1 8 LYS CA C 10.661 10.298 1.657 1.00 . A A . 8 LYS CA 1 1 17 5311 1 1 8 LYS CB C 9.171 10.629 1.548 1.00 . A A . 8 LYS CB 1 1 17 5312 1 1 8 LYS CD C 7.656 11.694 3.245 1.00 . A A . 8 LYS CD 1 1 17 5313 1 1 8 LYS CE C 6.309 11.364 3.871 1.00 . A A . 8 LYS CE 1 1 17 5314 1 1 8 LYS CG C 8.408 10.435 2.847 1.00 . A A . 8 LYS CG 1 1 17 5315 1 1 8 LYS H H 10.175 8.532 2.717 1.00 . A A . 8 LYS H 1 1 17 5316 1 1 8 LYS HA H 11.112 10.383 0.680 1.00 . A A . 8 LYS HA 1 1 17 5317 1 1 8 LYS HB2 H 9.064 11.659 1.242 1.00 . A A . 8 LYS HB2 1 1 17 5318 1 1 8 LYS HB3 H 8.727 9.992 0.796 1.00 . A A . 8 LYS HB3 1 1 17 5319 1 1 8 LYS HD2 H 8.247 12.246 3.960 1.00 . A A . 8 LYS HD2 1 1 17 5320 1 1 8 LYS HD3 H 7.495 12.300 2.364 1.00 . A A . 8 LYS HD3 1 1 17 5321 1 1 8 LYS HE2 H 5.848 12.281 4.206 1.00 . A A . 8 LYS HE2 1 1 17 5322 1 1 8 LYS HE3 H 5.684 10.899 3.123 1.00 . A A . 8 LYS HE3 1 1 17 5323 1 1 8 LYS HG2 H 7.700 9.630 2.722 1.00 . A A . 8 LYS HG2 1 1 17 5324 1 1 8 LYS HG3 H 9.108 10.183 3.631 1.00 . A A . 8 LYS HG3 1 1 17 5325 1 1 8 LYS HZ1 H 5.939 10.821 5.853 1.00 . A A . 8 LYS HZ1 1 1 17 5326 1 1 8 LYS HZ2 H 7.451 10.327 5.279 1.00 . A A . 8 LYS HZ2 1 1 17 5327 1 1 8 LYS HZ3 H 6.054 9.507 4.793 1.00 . A A . 8 LYS HZ3 1 1 17 5328 1 1 8 LYS N N 10.842 8.927 2.117 1.00 . A A . 8 LYS N 1 1 17 5329 1 1 8 LYS NZ N 6.448 10.440 5.030 1.00 . A A . 8 LYS NZ 1 1 17 5330 1 1 8 LYS O O 11.845 12.322 2.171 1.00 . A A . 8 LYS O 1 1 17 5331 1 1 9 ILE C C 13.503 11.743 4.796 1.00 . A A . 9 ILE C 1 1 17 5332 1 1 9 ILE CA C 11.982 11.804 4.890 1.00 . A A . 9 ILE CA 1 1 17 5333 1 1 9 ILE CB C 11.551 11.407 6.314 1.00 . A A . 9 ILE CB 1 1 17 5334 1 1 9 ILE CD1 C 13.631 10.652 7.571 1.00 . A A . 9 ILE CD1 1 1 17 5335 1 1 9 ILE CG1 C 12.390 10.230 6.816 1.00 . A A . 9 ILE CG1 1 1 17 5336 1 1 9 ILE CG2 C 10.070 11.058 6.341 1.00 . A A . 9 ILE CG2 1 1 17 5337 1 1 9 ILE H H 10.942 10.108 4.168 1.00 . A A . 9 ILE H 1 1 17 5338 1 1 9 ILE HA H 11.661 12.820 4.708 1.00 . A A . 9 ILE HA 1 1 17 5339 1 1 9 ILE HB H 11.708 12.255 6.963 1.00 . A A . 9 ILE HB 1 1 17 5340 1 1 9 ILE HD11 H 13.882 11.670 7.312 1.00 . A A . 9 ILE HD11 1 1 17 5341 1 1 9 ILE HD12 H 13.448 10.584 8.632 1.00 . A A . 9 ILE HD12 1 1 17 5342 1 1 9 ILE HD13 H 14.453 10.002 7.305 1.00 . A A . 9 ILE HD13 1 1 17 5343 1 1 9 ILE HG12 H 11.791 9.624 7.476 1.00 . A A . 9 ILE HG12 1 1 17 5344 1 1 9 ILE HG13 H 12.702 9.634 5.970 1.00 . A A . 9 ILE HG13 1 1 17 5345 1 1 9 ILE HG21 H 9.623 11.455 7.241 1.00 . A A . 9 ILE HG21 1 1 17 5346 1 1 9 ILE HG22 H 9.584 11.488 5.479 1.00 . A A . 9 ILE HG22 1 1 17 5347 1 1 9 ILE HG23 H 9.953 9.985 6.324 1.00 . A A . 9 ILE HG23 1 1 17 5348 1 1 9 ILE N N 11.359 10.949 3.887 1.00 . A A . 9 ILE N 1 1 17 5349 1 1 9 ILE O O 14.198 12.692 5.161 1.00 . A A . 9 ILE O 1 1 17 5350 1 1 10 THR C C 15.957 11.028 2.848 1.00 . A A . 10 THR C 1 1 17 5351 1 1 10 THR CA C 15.454 10.435 4.159 1.00 . A A . 10 THR CA 1 1 17 5352 1 1 10 THR CB C 15.836 8.943 4.215 1.00 . A A . 10 THR CB 1 1 17 5353 1 1 10 THR CG2 C 15.690 8.400 5.628 1.00 . A A . 10 THR CG2 1 1 17 5354 1 1 10 THR H H 13.410 9.899 4.029 1.00 . A A . 10 THR H 1 1 17 5355 1 1 10 THR HA H 15.939 10.940 4.982 1.00 . A A . 10 THR HA 1 1 17 5356 1 1 10 THR HB H 16.868 8.841 3.910 1.00 . A A . 10 THR HB 1 1 17 5357 1 1 10 THR HG1 H 15.392 8.206 2.440 1.00 . A A . 10 THR HG1 1 1 17 5358 1 1 10 THR HG21 H 16.341 8.947 6.294 1.00 . A A . 10 THR HG21 1 1 17 5359 1 1 10 THR HG22 H 15.958 7.354 5.641 1.00 . A A . 10 THR HG22 1 1 17 5360 1 1 10 THR HG23 H 14.667 8.513 5.953 1.00 . A A . 10 THR HG23 1 1 17 5361 1 1 10 THR N N 14.015 10.620 4.302 1.00 . A A . 10 THR N 1 1 17 5362 1 1 10 THR O O 15.514 10.638 1.767 1.00 . A A . 10 THR O 1 1 17 5363 1 1 10 THR OG1 O 15.008 8.192 3.321 1.00 . A A . 10 THR OG1 1 1 17 5364 1 1 11 LYS C C 18.956 12.383 1.691 1.00 . A A . 11 LYS C 1 1 17 5365 1 1 11 LYS CA C 17.451 12.619 1.772 1.00 . A A . 11 LYS CA 1 1 17 5366 1 1 11 LYS CB C 17.162 14.122 1.801 1.00 . A A . 11 LYS CB 1 1 17 5367 1 1 11 LYS CD C 18.828 14.827 3.544 1.00 . A A . 11 LYS CD 1 1 17 5368 1 1 11 LYS CE C 19.069 15.834 4.658 1.00 . A A . 11 LYS CE 1 1 17 5369 1 1 11 LYS CG C 17.357 14.753 3.169 1.00 . A A . 11 LYS CG 1 1 17 5370 1 1 11 LYS H H 17.199 12.241 3.839 1.00 . A A . 11 LYS H 1 1 17 5371 1 1 11 LYS HA H 16.984 12.188 0.900 1.00 . A A . 11 LYS HA 1 1 17 5372 1 1 11 LYS HB2 H 17.820 14.617 1.102 1.00 . A A . 11 LYS HB2 1 1 17 5373 1 1 11 LYS HB3 H 16.138 14.285 1.496 1.00 . A A . 11 LYS HB3 1 1 17 5374 1 1 11 LYS HD2 H 19.155 13.853 3.877 1.00 . A A . 11 LYS HD2 1 1 17 5375 1 1 11 LYS HD3 H 19.397 15.122 2.674 1.00 . A A . 11 LYS HD3 1 1 17 5376 1 1 11 LYS HE2 H 19.927 16.436 4.401 1.00 . A A . 11 LYS HE2 1 1 17 5377 1 1 11 LYS HE3 H 18.198 16.467 4.747 1.00 . A A . 11 LYS HE3 1 1 17 5378 1 1 11 LYS HG2 H 16.949 15.752 3.156 1.00 . A A . 11 LYS HG2 1 1 17 5379 1 1 11 LYS HG3 H 16.837 14.158 3.907 1.00 . A A . 11 LYS HG3 1 1 17 5380 1 1 11 LYS HZ1 H 19.161 15.836 6.744 1.00 . A A . 11 LYS HZ1 1 1 17 5381 1 1 11 LYS HZ2 H 20.300 14.824 6.010 1.00 . A A . 11 LYS HZ2 1 1 17 5382 1 1 11 LYS HZ3 H 18.675 14.357 6.082 1.00 . A A . 11 LYS HZ3 1 1 17 5383 1 1 11 LYS N N 16.885 11.973 2.950 1.00 . A A . 11 LYS N 1 1 17 5384 1 1 11 LYS NZ N 19.319 15.166 5.965 1.00 . A A . 11 LYS NZ 1 1 17 5385 1 1 11 LYS O O 19.665 13.069 0.954 1.00 . A A . 11 LYS O 1 1 17 5386 1 1 12 LYS C C 21.189 10.050 1.387 1.00 . A A . 12 LYS C 1 1 17 5387 1 1 12 LYS CA C 20.858 11.076 2.466 1.00 . A A . 12 LYS CA 1 1 17 5388 1 1 12 LYS CB C 21.265 10.537 3.839 1.00 . A A . 12 LYS CB 1 1 17 5389 1 1 12 LYS CD C 22.635 8.465 4.214 1.00 . A A . 12 LYS CD 1 1 17 5390 1 1 12 LYS CE C 22.982 8.226 5.676 1.00 . A A . 12 LYS CE 1 1 17 5391 1 1 12 LYS CG C 22.663 9.945 3.870 1.00 . A A . 12 LYS CG 1 1 17 5392 1 1 12 LYS H H 18.823 10.894 3.019 1.00 . A A . 12 LYS H 1 1 17 5393 1 1 12 LYS HA H 21.411 11.981 2.266 1.00 . A A . 12 LYS HA 1 1 17 5394 1 1 12 LYS HB2 H 21.221 11.343 4.556 1.00 . A A . 12 LYS HB2 1 1 17 5395 1 1 12 LYS HB3 H 20.565 9.767 4.132 1.00 . A A . 12 LYS HB3 1 1 17 5396 1 1 12 LYS HD2 H 21.645 8.078 4.023 1.00 . A A . 12 LYS HD2 1 1 17 5397 1 1 12 LYS HD3 H 23.352 7.947 3.594 1.00 . A A . 12 LYS HD3 1 1 17 5398 1 1 12 LYS HE2 H 23.281 7.196 5.798 1.00 . A A . 12 LYS HE2 1 1 17 5399 1 1 12 LYS HE3 H 23.803 8.873 5.948 1.00 . A A . 12 LYS HE3 1 1 17 5400 1 1 12 LYS HG2 H 23.119 10.069 2.899 1.00 . A A . 12 LYS HG2 1 1 17 5401 1 1 12 LYS HG3 H 23.249 10.467 4.614 1.00 . A A . 12 LYS HG3 1 1 17 5402 1 1 12 LYS HZ1 H 20.933 8.358 6.060 1.00 . A A . 12 LYS HZ1 1 1 17 5403 1 1 12 LYS HZ2 H 21.863 9.489 6.907 1.00 . A A . 12 LYS HZ2 1 1 17 5404 1 1 12 LYS HZ3 H 21.850 7.869 7.395 1.00 . A A . 12 LYS HZ3 1 1 17 5405 1 1 12 LYS N N 19.438 11.406 2.452 1.00 . A A . 12 LYS N 1 1 17 5406 1 1 12 LYS NZ N 21.826 8.505 6.573 1.00 . A A . 12 LYS NZ 1 1 17 5407 1 1 12 LYS O O 21.747 10.389 0.345 1.00 . A A . 12 LYS O 1 1 17 5408 1 1 13 ASN C C 20.278 7.910 -0.581 1.00 . A A . 13 ASN C 1 1 17 5409 1 1 13 ASN CA C 21.096 7.719 0.693 1.00 . A A . 13 ASN CA 1 1 17 5410 1 1 13 ASN CB C 20.770 6.363 1.323 1.00 . A A . 13 ASN CB 1 1 17 5411 1 1 13 ASN CG C 22.004 5.504 1.518 1.00 . A A . 13 ASN CG 1 1 17 5412 1 1 13 ASN H H 20.395 8.585 2.492 1.00 . A A . 13 ASN H 1 1 17 5413 1 1 13 ASN HA H 22.145 7.745 0.440 1.00 . A A . 13 ASN HA 1 1 17 5414 1 1 13 ASN HB2 H 20.311 6.523 2.288 1.00 . A A . 13 ASN HB2 1 1 17 5415 1 1 13 ASN HB3 H 20.080 5.832 0.685 1.00 . A A . 13 ASN HB3 1 1 17 5416 1 1 13 ASN HD21 H 21.844 4.810 -0.339 1.00 . A A . 13 ASN HD21 1 1 17 5417 1 1 13 ASN HD22 H 23.172 4.197 0.580 1.00 . A A . 13 ASN HD22 1 1 17 5418 1 1 13 ASN N N 20.838 8.794 1.643 1.00 . A A . 13 ASN N 1 1 17 5419 1 1 13 ASN ND2 N 22.378 4.762 0.482 1.00 . A A . 13 ASN ND2 1 1 17 5420 1 1 13 ASN O O 20.588 7.331 -1.622 1.00 . A A . 13 ASN O 1 1 17 5421 1 1 13 ASN OD1 O 22.614 5.507 2.587 1.00 . A A . 13 ASN OD1 1 1 17 5422 1 1 14 MET C C 19.169 9.598 -2.785 1.00 . A A . 14 MET C 1 1 17 5423 1 1 14 MET CA C 18.371 8.994 -1.634 1.00 . A A . 14 MET CA 1 1 17 5424 1 1 14 MET CB C 17.236 9.939 -1.235 1.00 . A A . 14 MET CB 1 1 17 5425 1 1 14 MET CE C 13.549 9.622 -3.170 1.00 . A A . 14 MET CE 1 1 17 5426 1 1 14 MET CG C 16.140 10.049 -2.283 1.00 . A A . 14 MET CG 1 1 17 5427 1 1 14 MET H H 19.036 9.158 0.368 1.00 . A A . 14 MET H 1 1 17 5428 1 1 14 MET HA H 17.949 8.055 -1.959 1.00 . A A . 14 MET HA 1 1 17 5429 1 1 14 MET HB2 H 16.792 9.582 -0.317 1.00 . A A . 14 MET HB2 1 1 17 5430 1 1 14 MET HB3 H 17.644 10.924 -1.068 1.00 . A A . 14 MET HB3 1 1 17 5431 1 1 14 MET HE1 H 12.510 9.538 -2.887 1.00 . A A . 14 MET HE1 1 1 17 5432 1 1 14 MET HE2 H 13.741 10.616 -3.547 1.00 . A A . 14 MET HE2 1 1 17 5433 1 1 14 MET HE3 H 13.774 8.896 -3.937 1.00 . A A . 14 MET HE3 1 1 17 5434 1 1 14 MET HG2 H 15.973 11.093 -2.502 1.00 . A A . 14 MET HG2 1 1 17 5435 1 1 14 MET HG3 H 16.466 9.543 -3.179 1.00 . A A . 14 MET HG3 1 1 17 5436 1 1 14 MET N N 19.233 8.725 -0.489 1.00 . A A . 14 MET N 1 1 17 5437 1 1 14 MET O O 19.130 9.099 -3.909 1.00 . A A . 14 MET O 1 1 17 5438 1 1 14 MET SD S 14.584 9.318 -1.739 1.00 . A A . 14 MET SD 1 1 17 5439 1 1 15 ALA C C 21.973 10.558 -3.805 1.00 . A A . 15 ALA C 1 1 17 5440 1 1 15 ALA CA C 20.701 11.346 -3.507 1.00 . A A . 15 ALA CA 1 1 17 5441 1 1 15 ALA CB C 21.046 12.758 -3.056 1.00 . A A . 15 ALA CB 1 1 17 5442 1 1 15 ALA H H 19.883 11.026 -1.582 1.00 . A A . 15 ALA H 1 1 17 5443 1 1 15 ALA HA H 20.114 11.417 -4.412 1.00 . A A . 15 ALA HA 1 1 17 5444 1 1 15 ALA HB1 H 20.155 13.369 -3.078 1.00 . A A . 15 ALA HB1 1 1 17 5445 1 1 15 ALA HB2 H 21.439 12.728 -2.051 1.00 . A A . 15 ALA HB2 1 1 17 5446 1 1 15 ALA HB3 H 21.787 13.177 -3.721 1.00 . A A . 15 ALA HB3 1 1 17 5447 1 1 15 ALA N N 19.893 10.675 -2.497 1.00 . A A . 15 ALA N 1 1 17 5448 1 1 15 ALA O O 22.787 10.965 -4.634 1.00 . A A . 15 ALA O 1 1 17 5449 1 1 16 HIS C C 22.960 7.345 -4.131 1.00 . A A . 16 HIS C 1 1 17 5450 1 1 16 HIS CA C 23.310 8.584 -3.314 1.00 . A A . 16 HIS CA 1 1 17 5451 1 1 16 HIS CB C 23.893 8.170 -1.962 1.00 . A A . 16 HIS CB 1 1 17 5452 1 1 16 HIS CD2 C 26.365 8.777 -2.461 1.00 . A A . 16 HIS CD2 1 1 17 5453 1 1 16 HIS CE1 C 26.839 9.773 -0.566 1.00 . A A . 16 HIS CE1 1 1 17 5454 1 1 16 HIS CG C 25.250 8.743 -1.694 1.00 . A A . 16 HIS CG 1 1 17 5455 1 1 16 HIS H H 21.453 9.158 -2.475 1.00 . A A . 16 HIS H 1 1 17 5456 1 1 16 HIS HA H 24.048 9.159 -3.853 1.00 . A A . 16 HIS HA 1 1 17 5457 1 1 16 HIS HB2 H 23.231 8.502 -1.176 1.00 . A A . 16 HIS HB2 1 1 17 5458 1 1 16 HIS HB3 H 23.974 7.093 -1.927 1.00 . A A . 16 HIS HB3 1 1 17 5459 1 1 16 HIS HD1 H 24.981 9.511 0.250 1.00 . A A . 16 HIS HD1 1 1 17 5460 1 1 16 HIS HD2 H 26.470 8.372 -3.458 1.00 . A A . 16 HIS HD2 1 1 17 5461 1 1 16 HIS HE1 H 27.370 10.296 0.215 1.00 . A A . 16 HIS HE1 1 1 17 5462 1 1 16 HIS N N 22.137 9.429 -3.122 1.00 . A A . 16 HIS N 1 1 17 5463 1 1 16 HIS ND1 N 25.580 9.374 -0.513 1.00 . A A . 16 HIS ND1 1 1 17 5464 1 1 16 HIS NE2 N 27.337 9.422 -1.738 1.00 . A A . 16 HIS NE2 1 1 17 5465 1 1 16 HIS O O 23.841 6.679 -4.676 1.00 . A A . 16 HIS O 1 1 17 5466 1 1 17 ILE C C 21.753 5.891 -6.386 1.00 . A A . 17 ILE C 1 1 17 5467 1 1 17 ILE CA C 21.203 5.882 -4.963 1.00 . A A . 17 ILE CA 1 1 17 5468 1 1 17 ILE CB C 19.665 5.829 -5.020 1.00 . A A . 17 ILE CB 1 1 17 5469 1 1 17 ILE CD1 C 17.660 7.270 -5.640 1.00 . A A . 17 ILE CD1 1 1 17 5470 1 1 17 ILE CG1 C 19.125 6.976 -5.877 1.00 . A A . 17 ILE CG1 1 1 17 5471 1 1 17 ILE CG2 C 19.080 5.889 -3.617 1.00 . A A . 17 ILE CG2 1 1 17 5472 1 1 17 ILE H H 21.014 7.610 -3.756 1.00 . A A . 17 ILE H 1 1 17 5473 1 1 17 ILE HA H 21.555 4.994 -4.458 1.00 . A A . 17 ILE HA 1 1 17 5474 1 1 17 ILE HB H 19.375 4.890 -5.465 1.00 . A A . 17 ILE HB 1 1 17 5475 1 1 17 ILE HD11 H 17.530 7.677 -4.648 1.00 . A A . 17 ILE HD11 1 1 17 5476 1 1 17 ILE HD12 H 17.312 7.984 -6.371 1.00 . A A . 17 ILE HD12 1 1 17 5477 1 1 17 ILE HD13 H 17.090 6.356 -5.730 1.00 . A A . 17 ILE HD13 1 1 17 5478 1 1 17 ILE HG12 H 19.682 7.873 -5.660 1.00 . A A . 17 ILE HG12 1 1 17 5479 1 1 17 ILE HG13 H 19.248 6.724 -6.921 1.00 . A A . 17 ILE HG13 1 1 17 5480 1 1 17 ILE HG21 H 19.061 6.915 -3.278 1.00 . A A . 17 ILE HG21 1 1 17 5481 1 1 17 ILE HG22 H 18.075 5.497 -3.629 1.00 . A A . 17 ILE HG22 1 1 17 5482 1 1 17 ILE HG23 H 19.689 5.301 -2.947 1.00 . A A . 17 ILE HG23 1 1 17 5483 1 1 17 ILE N N 21.669 7.041 -4.212 1.00 . A A . 17 ILE N 1 1 17 5484 1 1 17 ILE O O 22.130 4.850 -6.923 1.00 . A A . 17 ILE O 1 1 17 5485 1 1 18 ARG C C 23.813 7.434 -8.348 1.00 . A A . 18 ARG C 1 1 17 5486 1 1 18 ARG CA C 22.302 7.220 -8.349 1.00 . A A . 18 ARG CA 1 1 17 5487 1 1 18 ARG CB C 21.611 8.391 -9.050 1.00 . A A . 18 ARG CB 1 1 17 5488 1 1 18 ARG CD C 20.164 8.606 -11.093 1.00 . A A . 18 ARG CD 1 1 17 5489 1 1 18 ARG CG C 21.541 8.241 -10.561 1.00 . A A . 18 ARG CG 1 1 17 5490 1 1 18 ARG CZ C 18.468 10.347 -10.723 1.00 . A A . 18 ARG CZ 1 1 17 5491 1 1 18 ARG H H 21.482 7.869 -6.509 1.00 . A A . 18 ARG H 1 1 17 5492 1 1 18 ARG HA H 22.080 6.309 -8.885 1.00 . A A . 18 ARG HA 1 1 17 5493 1 1 18 ARG HB2 H 20.603 8.478 -8.672 1.00 . A A . 18 ARG HB2 1 1 17 5494 1 1 18 ARG HB3 H 22.151 9.298 -8.825 1.00 . A A . 18 ARG HB3 1 1 17 5495 1 1 18 ARG HD2 H 20.205 8.631 -12.172 1.00 . A A . 18 ARG HD2 1 1 17 5496 1 1 18 ARG HD3 H 19.459 7.851 -10.777 1.00 . A A . 18 ARG HD3 1 1 17 5497 1 1 18 ARG HE H 20.379 10.482 -10.171 1.00 . A A . 18 ARG HE 1 1 17 5498 1 1 18 ARG HG2 H 22.274 8.893 -11.013 1.00 . A A . 18 ARG HG2 1 1 17 5499 1 1 18 ARG HG3 H 21.758 7.216 -10.822 1.00 . A A . 18 ARG HG3 1 1 17 5500 1 1 18 ARG HH11 H 17.794 8.689 -11.661 1.00 . A A . 18 ARG HH11 1 1 17 5501 1 1 18 ARG HH12 H 16.609 9.924 -11.394 1.00 . A A . 18 ARG HH12 1 1 17 5502 1 1 18 ARG HH21 H 18.828 12.115 -9.813 1.00 . A A . 18 ARG HH21 1 1 17 5503 1 1 18 ARG HH22 H 17.198 11.873 -10.343 1.00 . A A . 18 ARG HH22 1 1 17 5504 1 1 18 ARG N N 21.797 7.075 -6.989 1.00 . A A . 18 ARG N 1 1 17 5505 1 1 18 ARG NE N 19.716 9.908 -10.606 1.00 . A A . 18 ARG NE 1 1 17 5506 1 1 18 ARG NH1 N 17.548 9.592 -11.308 1.00 . A A . 18 ARG NH1 1 1 17 5507 1 1 18 ARG NH2 N 18.137 11.543 -10.255 1.00 . A A . 18 ARG NH2 1 1 17 5508 1 1 18 ARG O O 24.393 7.830 -7.337 1.00 . A A . 18 ARG O 1 1 18 5509 1 1 1 PHE C C 3.713 2.045 -3.005 1.00 . A A . 1 PHE C 1 1 18 5510 1 1 1 PHE CA C 2.991 3.058 -3.889 1.00 . A A . 1 PHE CA 1 1 18 5511 1 1 1 PHE CB C 3.688 3.155 -5.247 1.00 . A A . 1 PHE CB 1 1 18 5512 1 1 1 PHE CD1 C 2.132 1.850 -6.721 1.00 . A A . 1 PHE CD1 1 1 18 5513 1 1 1 PHE CD2 C 2.477 4.159 -7.202 1.00 . A A . 1 PHE CD2 1 1 18 5514 1 1 1 PHE CE1 C 1.265 1.752 -7.793 1.00 . A A . 1 PHE CE1 1 1 18 5515 1 1 1 PHE CE2 C 1.611 4.068 -8.275 1.00 . A A . 1 PHE CE2 1 1 18 5516 1 1 1 PHE CG C 2.747 3.053 -6.413 1.00 . A A . 1 PHE CG 1 1 18 5517 1 1 1 PHE CZ C 1.005 2.863 -8.571 1.00 . A A . 1 PHE CZ 1 1 18 5518 1 1 1 PHE H1 H 2.209 4.574 -2.635 1.00 . A A . 1 PHE H1 1 1 18 5519 1 1 1 PHE HA H 1.974 2.727 -4.038 1.00 . A A . 1 PHE HA 1 1 18 5520 1 1 1 PHE HB2 H 4.198 4.104 -5.315 1.00 . A A . 1 PHE HB2 1 1 18 5521 1 1 1 PHE HB3 H 4.410 2.356 -5.331 1.00 . A A . 1 PHE HB3 1 1 18 5522 1 1 1 PHE HD1 H 2.335 0.980 -6.112 1.00 . A A . 1 PHE HD1 1 1 18 5523 1 1 1 PHE HD2 H 2.951 5.102 -6.972 1.00 . A A . 1 PHE HD2 1 1 18 5524 1 1 1 PHE HE1 H 0.793 0.808 -8.022 1.00 . A A . 1 PHE HE1 1 1 18 5525 1 1 1 PHE HE2 H 1.409 4.938 -8.882 1.00 . A A . 1 PHE HE2 1 1 18 5526 1 1 1 PHE HZ H 0.327 2.789 -9.409 1.00 . A A . 1 PHE HZ 1 1 18 5527 1 1 1 PHE N N 2.945 4.367 -3.249 1.00 . A A . 1 PHE N 1 1 18 5528 1 1 1 PHE O O 3.201 0.955 -2.744 1.00 . A A . 1 PHE O 1 1 18 5529 1 1 2 LEU C C 5.927 2.171 -0.325 1.00 . A A . 2 LEU C 1 1 18 5530 1 1 2 LEU CA C 5.698 1.536 -1.692 1.00 . A A . 2 LEU CA 1 1 18 5531 1 1 2 LEU CB C 7.042 1.226 -2.355 1.00 . A A . 2 LEU CB 1 1 18 5532 1 1 2 LEU CD1 C 6.817 0.334 -4.686 1.00 . A A . 2 LEU CD1 1 1 18 5533 1 1 2 LEU CD2 C 8.427 -0.728 -3.094 1.00 . A A . 2 LEU CD2 1 1 18 5534 1 1 2 LEU CG C 7.085 -0.025 -3.233 1.00 . A A . 2 LEU CG 1 1 18 5535 1 1 2 LEU H H 5.259 3.292 -2.789 1.00 . A A . 2 LEU H 1 1 18 5536 1 1 2 LEU HA H 5.150 0.615 -1.561 1.00 . A A . 2 LEU HA 1 1 18 5537 1 1 2 LEU HB2 H 7.310 2.071 -2.970 1.00 . A A . 2 LEU HB2 1 1 18 5538 1 1 2 LEU HB3 H 7.776 1.107 -1.571 1.00 . A A . 2 LEU HB3 1 1 18 5539 1 1 2 LEU HD11 H 5.908 0.912 -4.753 1.00 . A A . 2 LEU HD11 1 1 18 5540 1 1 2 LEU HD12 H 6.712 -0.570 -5.267 1.00 . A A . 2 LEU HD12 1 1 18 5541 1 1 2 LEU HD13 H 7.642 0.915 -5.072 1.00 . A A . 2 LEU HD13 1 1 18 5542 1 1 2 LEU HD21 H 8.384 -1.424 -2.269 1.00 . A A . 2 LEU HD21 1 1 18 5543 1 1 2 LEU HD22 H 9.199 0.004 -2.908 1.00 . A A . 2 LEU HD22 1 1 18 5544 1 1 2 LEU HD23 H 8.648 -1.264 -4.005 1.00 . A A . 2 LEU HD23 1 1 18 5545 1 1 2 LEU HG H 6.312 -0.709 -2.911 1.00 . A A . 2 LEU HG 1 1 18 5546 1 1 2 LEU N N 4.904 2.412 -2.547 1.00 . A A . 2 LEU N 1 1 18 5547 1 1 2 LEU O O 5.797 3.383 -0.146 1.00 . A A . 2 LEU O 1 1 18 5548 1 1 3 PRO C C 7.817 2.616 2.138 1.00 . A A . 3 PRO C 1 1 18 5549 1 1 3 PRO CA C 6.537 1.795 2.033 1.00 . A A . 3 PRO CA 1 1 18 5550 1 1 3 PRO CB C 6.671 0.491 2.824 1.00 . A A . 3 PRO CB 1 1 18 5551 1 1 3 PRO CD C 6.453 -0.119 0.523 1.00 . A A . 3 PRO CD 1 1 18 5552 1 1 3 PRO CG C 7.103 -0.519 1.818 1.00 . A A . 3 PRO CG 1 1 18 5553 1 1 3 PRO HA H 5.709 2.370 2.421 1.00 . A A . 3 PRO HA 1 1 18 5554 1 1 3 PRO HB2 H 7.409 0.615 3.604 1.00 . A A . 3 PRO HB2 1 1 18 5555 1 1 3 PRO HB3 H 5.718 0.231 3.260 1.00 . A A . 3 PRO HB3 1 1 18 5556 1 1 3 PRO HD2 H 7.099 -0.350 -0.311 1.00 . A A . 3 PRO HD2 1 1 18 5557 1 1 3 PRO HD3 H 5.499 -0.612 0.411 1.00 . A A . 3 PRO HD3 1 1 18 5558 1 1 3 PRO HG2 H 8.178 -0.503 1.720 1.00 . A A . 3 PRO HG2 1 1 18 5559 1 1 3 PRO HG3 H 6.767 -1.501 2.117 1.00 . A A . 3 PRO HG3 1 1 18 5560 1 1 3 PRO N N 6.279 1.337 0.664 1.00 . A A . 3 PRO N 1 1 18 5561 1 1 3 PRO O O 8.921 2.076 2.069 1.00 . A A . 3 PRO O 1 1 18 5562 1 1 4 LYS C C 8.948 5.339 3.851 1.00 . A A . 4 LYS C 1 1 18 5563 1 1 4 LYS CA C 8.806 4.822 2.424 1.00 . A A . 4 LYS CA 1 1 18 5564 1 1 4 LYS CB C 8.659 5.998 1.456 1.00 . A A . 4 LYS CB 1 1 18 5565 1 1 4 LYS CD C 7.116 7.476 0.135 1.00 . A A . 4 LYS CD 1 1 18 5566 1 1 4 LYS CE C 6.484 8.748 0.679 1.00 . A A . 4 LYS CE 1 1 18 5567 1 1 4 LYS CG C 7.217 6.403 1.206 1.00 . A A . 4 LYS CG 1 1 18 5568 1 1 4 LYS H H 6.757 4.297 2.355 1.00 . A A . 4 LYS H 1 1 18 5569 1 1 4 LYS HA H 9.694 4.263 2.166 1.00 . A A . 4 LYS HA 1 1 18 5570 1 1 4 LYS HB2 H 9.185 6.850 1.861 1.00 . A A . 4 LYS HB2 1 1 18 5571 1 1 4 LYS HB3 H 9.104 5.728 0.509 1.00 . A A . 4 LYS HB3 1 1 18 5572 1 1 4 LYS HD2 H 8.108 7.707 -0.226 1.00 . A A . 4 LYS HD2 1 1 18 5573 1 1 4 LYS HD3 H 6.512 7.104 -0.680 1.00 . A A . 4 LYS HD3 1 1 18 5574 1 1 4 LYS HE2 H 5.423 8.719 0.483 1.00 . A A . 4 LYS HE2 1 1 18 5575 1 1 4 LYS HE3 H 6.652 8.791 1.745 1.00 . A A . 4 LYS HE3 1 1 18 5576 1 1 4 LYS HG2 H 6.659 5.536 0.883 1.00 . A A . 4 LYS HG2 1 1 18 5577 1 1 4 LYS HG3 H 6.794 6.783 2.125 1.00 . A A . 4 LYS HG3 1 1 18 5578 1 1 4 LYS HZ1 H 6.647 10.111 -0.896 1.00 . A A . 4 LYS HZ1 1 1 18 5579 1 1 4 LYS HZ2 H 8.090 9.867 -0.050 1.00 . A A . 4 LYS HZ2 1 1 18 5580 1 1 4 LYS HZ3 H 6.858 10.803 0.633 1.00 . A A . 4 LYS HZ3 1 1 18 5581 1 1 4 LYS N N 7.663 3.925 2.307 1.00 . A A . 4 LYS N 1 1 18 5582 1 1 4 LYS NZ N 7.060 9.968 0.048 1.00 . A A . 4 LYS NZ 1 1 18 5583 1 1 4 LYS O O 9.250 6.513 4.070 1.00 . A A . 4 LYS O 1 1 18 5584 1 1 5 LEU C C 10.082 5.667 6.479 1.00 . A A . 5 LEU C 1 1 18 5585 1 1 5 LEU CA C 8.836 4.824 6.228 1.00 . A A . 5 LEU CA 1 1 18 5586 1 1 5 LEU CB C 8.872 3.568 7.101 1.00 . A A . 5 LEU CB 1 1 18 5587 1 1 5 LEU CD1 C 7.240 4.205 8.895 1.00 . A A . 5 LEU CD1 1 1 18 5588 1 1 5 LEU CD2 C 6.424 3.122 6.793 1.00 . A A . 5 LEU CD2 1 1 18 5589 1 1 5 LEU CG C 7.563 3.200 7.800 1.00 . A A . 5 LEU CG 1 1 18 5590 1 1 5 LEU H H 8.494 3.535 4.584 1.00 . A A . 5 LEU H 1 1 18 5591 1 1 5 LEU HA H 7.964 5.406 6.484 1.00 . A A . 5 LEU HA 1 1 18 5592 1 1 5 LEU HB2 H 9.157 2.737 6.475 1.00 . A A . 5 LEU HB2 1 1 18 5593 1 1 5 LEU HB3 H 9.624 3.718 7.863 1.00 . A A . 5 LEU HB3 1 1 18 5594 1 1 5 LEU HD11 H 6.626 3.733 9.647 1.00 . A A . 5 LEU HD11 1 1 18 5595 1 1 5 LEU HD12 H 6.708 5.042 8.469 1.00 . A A . 5 LEU HD12 1 1 18 5596 1 1 5 LEU HD13 H 8.158 4.553 9.345 1.00 . A A . 5 LEU HD13 1 1 18 5597 1 1 5 LEU HD21 H 6.006 4.106 6.647 1.00 . A A . 5 LEU HD21 1 1 18 5598 1 1 5 LEU HD22 H 5.659 2.457 7.166 1.00 . A A . 5 LEU HD22 1 1 18 5599 1 1 5 LEU HD23 H 6.801 2.747 5.853 1.00 . A A . 5 LEU HD23 1 1 18 5600 1 1 5 LEU HG H 7.670 2.227 8.261 1.00 . A A . 5 LEU HG 1 1 18 5601 1 1 5 LEU N N 8.731 4.456 4.820 1.00 . A A . 5 LEU N 1 1 18 5602 1 1 5 LEU O O 10.062 6.600 7.282 1.00 . A A . 5 LEU O 1 1 18 5603 1 1 6 PHE C C 12.891 6.611 4.588 1.00 . A A . 6 PHE C 1 1 18 5604 1 1 6 PHE CA C 12.421 6.061 5.931 1.00 . A A . 6 PHE CA 1 1 18 5605 1 1 6 PHE CB C 13.497 5.150 6.526 1.00 . A A . 6 PHE CB 1 1 18 5606 1 1 6 PHE CD1 C 15.750 6.133 7.029 1.00 . A A . 6 PHE CD1 1 1 18 5607 1 1 6 PHE CD2 C 14.055 6.273 8.700 1.00 . A A . 6 PHE CD2 1 1 18 5608 1 1 6 PHE CE1 C 16.632 6.793 7.864 1.00 . A A . 6 PHE CE1 1 1 18 5609 1 1 6 PHE CE2 C 14.932 6.933 9.539 1.00 . A A . 6 PHE CE2 1 1 18 5610 1 1 6 PHE CG C 14.453 5.866 7.437 1.00 . A A . 6 PHE CG 1 1 18 5611 1 1 6 PHE CZ C 16.223 7.192 9.121 1.00 . A A . 6 PHE CZ 1 1 18 5612 1 1 6 PHE H H 11.120 4.580 5.160 1.00 . A A . 6 PHE H 1 1 18 5613 1 1 6 PHE HA H 12.248 6.887 6.604 1.00 . A A . 6 PHE HA 1 1 18 5614 1 1 6 PHE HB2 H 13.020 4.367 7.097 1.00 . A A . 6 PHE HB2 1 1 18 5615 1 1 6 PHE HB3 H 14.068 4.708 5.724 1.00 . A A . 6 PHE HB3 1 1 18 5616 1 1 6 PHE HD1 H 16.071 5.821 6.045 1.00 . A A . 6 PHE HD1 1 1 18 5617 1 1 6 PHE HD2 H 13.046 6.070 9.029 1.00 . A A . 6 PHE HD2 1 1 18 5618 1 1 6 PHE HE1 H 17.641 6.994 7.534 1.00 . A A . 6 PHE HE1 1 1 18 5619 1 1 6 PHE HE2 H 14.610 7.244 10.522 1.00 . A A . 6 PHE HE2 1 1 18 5620 1 1 6 PHE HZ H 16.910 7.708 9.775 1.00 . A A . 6 PHE HZ 1 1 18 5621 1 1 6 PHE N N 11.166 5.334 5.785 1.00 . A A . 6 PHE N 1 1 18 5622 1 1 6 PHE O O 13.836 7.396 4.523 1.00 . A A . 6 PHE O 1 1 18 5623 1 1 7 ALA C C 12.165 8.098 1.963 1.00 . A A . 7 ALA C 1 1 18 5624 1 1 7 ALA CA C 12.571 6.643 2.176 1.00 . A A . 7 ALA CA 1 1 18 5625 1 1 7 ALA CB C 11.913 5.752 1.133 1.00 . A A . 7 ALA CB 1 1 18 5626 1 1 7 ALA H H 11.479 5.566 3.634 1.00 . A A . 7 ALA H 1 1 18 5627 1 1 7 ALA HA H 13.642 6.558 2.062 1.00 . A A . 7 ALA HA 1 1 18 5628 1 1 7 ALA HB1 H 11.112 6.294 0.651 1.00 . A A . 7 ALA HB1 1 1 18 5629 1 1 7 ALA HB2 H 12.645 5.461 0.395 1.00 . A A . 7 ALA HB2 1 1 18 5630 1 1 7 ALA HB3 H 11.514 4.871 1.613 1.00 . A A . 7 ALA HB3 1 1 18 5631 1 1 7 ALA N N 12.223 6.192 3.518 1.00 . A A . 7 ALA N 1 1 18 5632 1 1 7 ALA O O 12.792 8.822 1.190 1.00 . A A . 7 ALA O 1 1 18 5633 1 1 8 LYS C C 11.340 10.806 3.526 1.00 . A A . 8 LYS C 1 1 18 5634 1 1 8 LYS CA C 10.621 9.889 2.542 1.00 . A A . 8 LYS CA 1 1 18 5635 1 1 8 LYS CB C 9.113 9.934 2.795 1.00 . A A . 8 LYS CB 1 1 18 5636 1 1 8 LYS CD C 7.881 10.378 4.939 1.00 . A A . 8 LYS CD 1 1 18 5637 1 1 8 LYS CE C 6.461 10.478 4.402 1.00 . A A . 8 LYS CE 1 1 18 5638 1 1 8 LYS CG C 8.705 9.376 4.147 1.00 . A A . 8 LYS CG 1 1 18 5639 1 1 8 LYS H H 10.652 7.896 3.255 1.00 . A A . 8 LYS H 1 1 18 5640 1 1 8 LYS HA H 10.820 10.231 1.538 1.00 . A A . 8 LYS HA 1 1 18 5641 1 1 8 LYS HB2 H 8.781 10.961 2.737 1.00 . A A . 8 LYS HB2 1 1 18 5642 1 1 8 LYS HB3 H 8.614 9.360 2.027 1.00 . A A . 8 LYS HB3 1 1 18 5643 1 1 8 LYS HD2 H 7.842 10.063 5.971 1.00 . A A . 8 LYS HD2 1 1 18 5644 1 1 8 LYS HD3 H 8.351 11.349 4.873 1.00 . A A . 8 LYS HD3 1 1 18 5645 1 1 8 LYS HE2 H 6.503 10.731 3.354 1.00 . A A . 8 LYS HE2 1 1 18 5646 1 1 8 LYS HE3 H 5.977 9.521 4.522 1.00 . A A . 8 LYS HE3 1 1 18 5647 1 1 8 LYS HG2 H 8.118 8.483 3.996 1.00 . A A . 8 LYS HG2 1 1 18 5648 1 1 8 LYS HG3 H 9.596 9.133 4.709 1.00 . A A . 8 LYS HG3 1 1 18 5649 1 1 8 LYS HZ1 H 6.156 12.433 5.071 1.00 . A A . 8 LYS HZ1 1 1 18 5650 1 1 8 LYS HZ2 H 5.555 11.250 6.119 1.00 . A A . 8 LYS HZ2 1 1 18 5651 1 1 8 LYS HZ3 H 4.729 11.610 4.687 1.00 . A A . 8 LYS HZ3 1 1 18 5652 1 1 8 LYS N N 11.111 8.520 2.654 1.00 . A A . 8 LYS N 1 1 18 5653 1 1 8 LYS NZ N 5.669 11.515 5.120 1.00 . A A . 8 LYS NZ 1 1 18 5654 1 1 8 LYS O O 11.562 11.984 3.242 1.00 . A A . 8 LYS O 1 1 18 5655 1 1 9 ILE C C 13.848 11.288 5.308 1.00 . A A . 9 ILE C 1 1 18 5656 1 1 9 ILE CA C 12.399 11.029 5.705 1.00 . A A . 9 ILE CA 1 1 18 5657 1 1 9 ILE CB C 12.372 10.309 7.066 1.00 . A A . 9 ILE CB 1 1 18 5658 1 1 9 ILE CD1 C 14.777 9.797 7.721 1.00 . A A . 9 ILE CD1 1 1 18 5659 1 1 9 ILE CG1 C 13.487 9.264 7.137 1.00 . A A . 9 ILE CG1 1 1 18 5660 1 1 9 ILE CG2 C 11.015 9.659 7.295 1.00 . A A . 9 ILE CG2 1 1 18 5661 1 1 9 ILE H H 11.498 9.316 4.849 1.00 . A A . 9 ILE H 1 1 18 5662 1 1 9 ILE HA H 11.891 11.977 5.812 1.00 . A A . 9 ILE HA 1 1 18 5663 1 1 9 ILE HB H 12.527 11.044 7.840 1.00 . A A . 9 ILE HB 1 1 18 5664 1 1 9 ILE HD11 H 15.615 9.398 7.168 1.00 . A A . 9 ILE HD11 1 1 18 5665 1 1 9 ILE HD12 H 14.784 10.874 7.658 1.00 . A A . 9 ILE HD12 1 1 18 5666 1 1 9 ILE HD13 H 14.855 9.496 8.756 1.00 . A A . 9 ILE HD13 1 1 18 5667 1 1 9 ILE HG12 H 13.162 8.440 7.751 1.00 . A A . 9 ILE HG12 1 1 18 5668 1 1 9 ILE HG13 H 13.697 8.904 6.140 1.00 . A A . 9 ILE HG13 1 1 18 5669 1 1 9 ILE HG21 H 10.731 9.774 8.331 1.00 . A A . 9 ILE HG21 1 1 18 5670 1 1 9 ILE HG22 H 10.278 10.135 6.666 1.00 . A A . 9 ILE HG22 1 1 18 5671 1 1 9 ILE HG23 H 11.073 8.609 7.052 1.00 . A A . 9 ILE HG23 1 1 18 5672 1 1 9 ILE N N 11.702 10.260 4.681 1.00 . A A . 9 ILE N 1 1 18 5673 1 1 9 ILE O O 14.454 12.273 5.731 1.00 . A A . 9 ILE O 1 1 18 5674 1 1 10 THR C C 15.868 11.435 2.812 1.00 . A A . 10 THR C 1 1 18 5675 1 1 10 THR CA C 15.778 10.528 4.034 1.00 . A A . 10 THR CA 1 1 18 5676 1 1 10 THR CB C 16.388 9.157 3.688 1.00 . A A . 10 THR CB 1 1 18 5677 1 1 10 THR CG2 C 16.674 8.358 4.951 1.00 . A A . 10 THR CG2 1 1 18 5678 1 1 10 THR H H 13.866 9.633 4.186 1.00 . A A . 10 THR H 1 1 18 5679 1 1 10 THR HA H 16.354 10.964 4.837 1.00 . A A . 10 THR HA 1 1 18 5680 1 1 10 THR HB H 17.319 9.317 3.162 1.00 . A A . 10 THR HB 1 1 18 5681 1 1 10 THR HG1 H 15.994 7.780 2.332 1.00 . A A . 10 THR HG1 1 1 18 5682 1 1 10 THR HG21 H 15.755 8.205 5.496 1.00 . A A . 10 THR HG21 1 1 18 5683 1 1 10 THR HG22 H 17.373 8.901 5.569 1.00 . A A . 10 THR HG22 1 1 18 5684 1 1 10 THR HG23 H 17.097 7.402 4.683 1.00 . A A . 10 THR HG23 1 1 18 5685 1 1 10 THR N N 14.400 10.397 4.489 1.00 . A A . 10 THR N 1 1 18 5686 1 1 10 THR O O 15.265 11.159 1.775 1.00 . A A . 10 THR O 1 1 18 5687 1 1 10 THR OG1 O 15.495 8.422 2.844 1.00 . A A . 10 THR OG1 1 1 18 5688 1 1 11 LYS C C 18.271 13.593 1.462 1.00 . A A . 11 LYS C 1 1 18 5689 1 1 11 LYS CA C 16.800 13.465 1.844 1.00 . A A . 11 LYS CA 1 1 18 5690 1 1 11 LYS CB C 16.243 14.836 2.236 1.00 . A A . 11 LYS CB 1 1 18 5691 1 1 11 LYS CD C 15.783 14.827 4.706 1.00 . A A . 11 LYS CD 1 1 18 5692 1 1 11 LYS CE C 15.836 15.742 5.920 1.00 . A A . 11 LYS CE 1 1 18 5693 1 1 11 LYS CG C 16.707 15.313 3.602 1.00 . A A . 11 LYS CG 1 1 18 5694 1 1 11 LYS H H 17.084 12.684 3.791 1.00 . A A . 11 LYS H 1 1 18 5695 1 1 11 LYS HA H 16.250 13.093 0.994 1.00 . A A . 11 LYS HA 1 1 18 5696 1 1 11 LYS HB2 H 16.555 15.562 1.500 1.00 . A A . 11 LYS HB2 1 1 18 5697 1 1 11 LYS HB3 H 15.164 14.784 2.244 1.00 . A A . 11 LYS HB3 1 1 18 5698 1 1 11 LYS HD2 H 14.771 14.803 4.332 1.00 . A A . 11 LYS HD2 1 1 18 5699 1 1 11 LYS HD3 H 16.083 13.832 5.002 1.00 . A A . 11 LYS HD3 1 1 18 5700 1 1 11 LYS HE2 H 16.596 15.379 6.595 1.00 . A A . 11 LYS HE2 1 1 18 5701 1 1 11 LYS HE3 H 16.093 16.739 5.592 1.00 . A A . 11 LYS HE3 1 1 18 5702 1 1 11 LYS HG2 H 17.702 14.934 3.787 1.00 . A A . 11 LYS HG2 1 1 18 5703 1 1 11 LYS HG3 H 16.725 16.394 3.609 1.00 . A A . 11 LYS HG3 1 1 18 5704 1 1 11 LYS HZ1 H 13.792 15.337 6.062 1.00 . A A . 11 LYS HZ1 1 1 18 5705 1 1 11 LYS HZ2 H 14.259 16.775 6.819 1.00 . A A . 11 LYS HZ2 1 1 18 5706 1 1 11 LYS HZ3 H 14.605 15.287 7.545 1.00 . A A . 11 LYS HZ3 1 1 18 5707 1 1 11 LYS N N 16.627 12.518 2.939 1.00 . A A . 11 LYS N 1 1 18 5708 1 1 11 LYS NZ N 14.532 15.789 6.637 1.00 . A A . 11 LYS NZ 1 1 18 5709 1 1 11 LYS O O 18.671 14.552 0.801 1.00 . A A . 11 LYS O 1 1 18 5710 1 1 12 LYS C C 20.886 11.385 0.771 1.00 . A A . 12 LYS C 1 1 18 5711 1 1 12 LYS CA C 20.499 12.620 1.578 1.00 . A A . 12 LYS CA 1 1 18 5712 1 1 12 LYS CB C 21.314 12.672 2.872 1.00 . A A . 12 LYS CB 1 1 18 5713 1 1 12 LYS CD C 21.525 11.665 5.164 1.00 . A A . 12 LYS CD 1 1 18 5714 1 1 12 LYS CE C 21.009 12.003 6.554 1.00 . A A . 12 LYS CE 1 1 18 5715 1 1 12 LYS CG C 20.568 12.141 4.084 1.00 . A A . 12 LYS CG 1 1 18 5716 1 1 12 LYS H H 18.695 11.881 2.403 1.00 . A A . 12 LYS H 1 1 18 5717 1 1 12 LYS HA H 20.714 13.500 0.992 1.00 . A A . 12 LYS HA 1 1 18 5718 1 1 12 LYS HB2 H 22.212 12.086 2.743 1.00 . A A . 12 LYS HB2 1 1 18 5719 1 1 12 LYS HB3 H 21.591 13.699 3.068 1.00 . A A . 12 LYS HB3 1 1 18 5720 1 1 12 LYS HD2 H 21.638 10.594 5.086 1.00 . A A . 12 LYS HD2 1 1 18 5721 1 1 12 LYS HD3 H 22.484 12.142 5.019 1.00 . A A . 12 LYS HD3 1 1 18 5722 1 1 12 LYS HE2 H 20.734 13.047 6.577 1.00 . A A . 12 LYS HE2 1 1 18 5723 1 1 12 LYS HE3 H 20.138 11.397 6.758 1.00 . A A . 12 LYS HE3 1 1 18 5724 1 1 12 LYS HG2 H 19.949 12.928 4.488 1.00 . A A . 12 LYS HG2 1 1 18 5725 1 1 12 LYS HG3 H 19.945 11.313 3.776 1.00 . A A . 12 LYS HG3 1 1 18 5726 1 1 12 LYS HZ1 H 22.610 10.921 7.347 1.00 . A A . 12 LYS HZ1 1 1 18 5727 1 1 12 LYS HZ2 H 21.572 11.565 8.517 1.00 . A A . 12 LYS HZ2 1 1 18 5728 1 1 12 LYS HZ3 H 22.658 12.574 7.702 1.00 . A A . 12 LYS HZ3 1 1 18 5729 1 1 12 LYS N N 19.073 12.619 1.879 1.00 . A A . 12 LYS N 1 1 18 5730 1 1 12 LYS NZ N 22.034 11.749 7.603 1.00 . A A . 12 LYS NZ 1 1 18 5731 1 1 12 LYS O O 21.073 11.459 -0.442 1.00 . A A . 12 LYS O 1 1 18 5732 1 1 13 ASN C C 20.473 8.738 -0.410 1.00 . A A . 13 ASN C 1 1 18 5733 1 1 13 ASN CA C 21.365 8.999 0.799 1.00 . A A . 13 ASN CA 1 1 18 5734 1 1 13 ASN CB C 21.260 7.834 1.786 1.00 . A A . 13 ASN CB 1 1 18 5735 1 1 13 ASN CG C 22.600 7.174 2.047 1.00 . A A . 13 ASN CG 1 1 18 5736 1 1 13 ASN H H 20.840 10.254 2.420 1.00 . A A . 13 ASN H 1 1 18 5737 1 1 13 ASN HA H 22.388 9.084 0.465 1.00 . A A . 13 ASN HA 1 1 18 5738 1 1 13 ASN HB2 H 20.872 8.200 2.725 1.00 . A A . 13 ASN HB2 1 1 18 5739 1 1 13 ASN HB3 H 20.585 7.091 1.387 1.00 . A A . 13 ASN HB3 1 1 18 5740 1 1 13 ASN HD21 H 22.532 6.276 0.274 1.00 . A A . 13 ASN HD21 1 1 18 5741 1 1 13 ASN HD22 H 23.933 5.947 1.229 1.00 . A A . 13 ASN HD22 1 1 18 5742 1 1 13 ASN N N 21.002 10.250 1.454 1.00 . A A . 13 ASN N 1 1 18 5743 1 1 13 ASN ND2 N 23.069 6.386 1.086 1.00 . A A . 13 ASN ND2 1 1 18 5744 1 1 13 ASN O O 20.886 8.090 -1.371 1.00 . A A . 13 ASN O 1 1 18 5745 1 1 13 ASN OD1 O 23.207 7.371 3.100 1.00 . A A . 13 ASN OD1 1 1 18 5746 1 1 14 MET C C 18.837 9.671 -2.740 1.00 . A A . 14 MET C 1 1 18 5747 1 1 14 MET CA C 18.296 9.072 -1.446 1.00 . A A . 14 MET CA 1 1 18 5748 1 1 14 MET CB C 16.955 9.718 -1.092 1.00 . A A . 14 MET CB 1 1 18 5749 1 1 14 MET CE C 15.228 6.670 -1.657 1.00 . A A . 14 MET CE 1 1 18 5750 1 1 14 MET CG C 15.831 9.347 -2.046 1.00 . A A . 14 MET CG 1 1 18 5751 1 1 14 MET H H 18.974 9.755 0.439 1.00 . A A . 14 MET H 1 1 18 5752 1 1 14 MET HA H 18.148 8.012 -1.588 1.00 . A A . 14 MET HA 1 1 18 5753 1 1 14 MET HB2 H 16.671 9.408 -0.098 1.00 . A A . 14 MET HB2 1 1 18 5754 1 1 14 MET HB3 H 17.071 10.791 -1.107 1.00 . A A . 14 MET HB3 1 1 18 5755 1 1 14 MET HE1 H 14.435 6.052 -2.049 1.00 . A A . 14 MET HE1 1 1 18 5756 1 1 14 MET HE2 H 16.014 6.758 -2.392 1.00 . A A . 14 MET HE2 1 1 18 5757 1 1 14 MET HE3 H 15.624 6.221 -0.757 1.00 . A A . 14 MET HE3 1 1 18 5758 1 1 14 MET HG2 H 15.355 10.253 -2.391 1.00 . A A . 14 MET HG2 1 1 18 5759 1 1 14 MET HG3 H 16.253 8.822 -2.890 1.00 . A A . 14 MET HG3 1 1 18 5760 1 1 14 MET N N 19.247 9.248 -0.354 1.00 . A A . 14 MET N 1 1 18 5761 1 1 14 MET O O 18.893 9.000 -3.770 1.00 . A A . 14 MET O 1 1 18 5762 1 1 14 MET SD S 14.584 8.298 -1.276 1.00 . A A . 14 MET SD 1 1 18 5763 1 1 15 ALA C C 21.198 11.181 -4.138 1.00 . A A . 15 ALA C 1 1 18 5764 1 1 15 ALA CA C 19.770 11.627 -3.847 1.00 . A A . 15 ALA CA 1 1 18 5765 1 1 15 ALA CB C 19.717 13.134 -3.641 1.00 . A A . 15 ALA CB 1 1 18 5766 1 1 15 ALA H H 19.162 11.421 -1.830 1.00 . A A . 15 ALA H 1 1 18 5767 1 1 15 ALA HA H 19.147 11.383 -4.695 1.00 . A A . 15 ALA HA 1 1 18 5768 1 1 15 ALA HB1 H 20.715 13.506 -3.457 1.00 . A A . 15 ALA HB1 1 1 18 5769 1 1 15 ALA HB2 H 19.315 13.604 -4.525 1.00 . A A . 15 ALA HB2 1 1 18 5770 1 1 15 ALA HB3 H 19.087 13.360 -2.794 1.00 . A A . 15 ALA HB3 1 1 18 5771 1 1 15 ALA N N 19.232 10.939 -2.680 1.00 . A A . 15 ALA N 1 1 18 5772 1 1 15 ALA O O 21.825 11.651 -5.088 1.00 . A A . 15 ALA O 1 1 18 5773 1 1 16 HIS C C 23.046 8.355 -4.078 1.00 . A A . 16 HIS C 1 1 18 5774 1 1 16 HIS CA C 23.064 9.760 -3.484 1.00 . A A . 16 HIS CA 1 1 18 5775 1 1 16 HIS CB C 23.799 9.750 -2.143 1.00 . A A . 16 HIS CB 1 1 18 5776 1 1 16 HIS CD2 C 26.270 10.497 -1.884 1.00 . A A . 16 HIS CD2 1 1 18 5777 1 1 16 HIS CE1 C 25.979 12.656 -2.132 1.00 . A A . 16 HIS CE1 1 1 18 5778 1 1 16 HIS CG C 24.948 10.710 -2.082 1.00 . A A . 16 HIS CG 1 1 18 5779 1 1 16 HIS H H 21.160 9.934 -2.576 1.00 . A A . 16 HIS H 1 1 18 5780 1 1 16 HIS HA H 23.583 10.418 -4.164 1.00 . A A . 16 HIS HA 1 1 18 5781 1 1 16 HIS HB2 H 23.106 10.013 -1.358 1.00 . A A . 16 HIS HB2 1 1 18 5782 1 1 16 HIS HB3 H 24.185 8.758 -1.959 1.00 . A A . 16 HIS HB3 1 1 18 5783 1 1 16 HIS HD1 H 23.953 12.541 -2.392 1.00 . A A . 16 HIS HD1 1 1 18 5784 1 1 16 HIS HD2 H 26.750 9.541 -1.727 1.00 . A A . 16 HIS HD2 1 1 18 5785 1 1 16 HIS HE1 H 26.169 13.716 -2.209 1.00 . A A . 16 HIS HE1 1 1 18 5786 1 1 16 HIS N N 21.708 10.271 -3.314 1.00 . A A . 16 HIS N 1 1 18 5787 1 1 16 HIS ND1 N 24.798 12.072 -2.233 1.00 . A A . 16 HIS ND1 1 1 18 5788 1 1 16 HIS NE2 N 26.889 11.723 -1.919 1.00 . A A . 16 HIS NE2 1 1 18 5789 1 1 16 HIS O O 24.055 7.877 -4.596 1.00 . A A . 16 HIS O 1 1 18 5790 1 1 17 ILE C C 22.204 6.276 -5.981 1.00 . A A . 17 ILE C 1 1 18 5791 1 1 17 ILE CA C 21.744 6.350 -4.529 1.00 . A A . 17 ILE CA 1 1 18 5792 1 1 17 ILE CB C 20.283 5.869 -4.441 1.00 . A A . 17 ILE CB 1 1 18 5793 1 1 17 ILE CD1 C 17.926 6.582 -5.082 1.00 . A A . 17 ILE CD1 1 1 18 5794 1 1 17 ILE CG1 C 19.401 6.666 -5.404 1.00 . A A . 17 ILE CG1 1 1 18 5795 1 1 17 ILE CG2 C 19.769 5.996 -3.015 1.00 . A A . 17 ILE CG2 1 1 18 5796 1 1 17 ILE H H 21.124 8.134 -3.575 1.00 . A A . 17 ILE H 1 1 18 5797 1 1 17 ILE HA H 22.357 5.689 -3.934 1.00 . A A . 17 ILE HA 1 1 18 5798 1 1 17 ILE HB H 20.254 4.826 -4.717 1.00 . A A . 17 ILE HB 1 1 18 5799 1 1 17 ILE HD11 H 17.635 5.546 -4.990 1.00 . A A . 17 ILE HD11 1 1 18 5800 1 1 17 ILE HD12 H 17.730 7.096 -4.153 1.00 . A A . 17 ILE HD12 1 1 18 5801 1 1 17 ILE HD13 H 17.357 7.046 -5.876 1.00 . A A . 17 ILE HD13 1 1 18 5802 1 1 17 ILE HG12 H 19.689 7.705 -5.370 1.00 . A A . 17 ILE HG12 1 1 18 5803 1 1 17 ILE HG13 H 19.545 6.290 -6.407 1.00 . A A . 17 ILE HG13 1 1 18 5804 1 1 17 ILE HG21 H 18.915 5.348 -2.881 1.00 . A A . 17 ILE HG21 1 1 18 5805 1 1 17 ILE HG22 H 20.549 5.709 -2.325 1.00 . A A . 17 ILE HG22 1 1 18 5806 1 1 17 ILE HG23 H 19.479 7.018 -2.826 1.00 . A A . 17 ILE HG23 1 1 18 5807 1 1 17 ILE N N 21.893 7.700 -3.999 1.00 . A A . 17 ILE N 1 1 18 5808 1 1 17 ILE O O 22.839 5.305 -6.393 1.00 . A A . 17 ILE O 1 1 18 5809 1 1 18 ARG C C 22.625 8.787 -8.571 1.00 . A A . 18 ARG C 1 1 18 5810 1 1 18 ARG CA C 22.264 7.362 -8.158 1.00 . A A . 18 ARG CA 1 1 18 5811 1 1 18 ARG CB C 21.127 6.838 -9.037 1.00 . A A . 18 ARG CB 1 1 18 5812 1 1 18 ARG CD C 20.674 5.613 -11.184 1.00 . A A . 18 ARG CD 1 1 18 5813 1 1 18 ARG CG C 21.510 6.683 -10.500 1.00 . A A . 18 ARG CG 1 1 18 5814 1 1 18 ARG CZ C 20.161 3.224 -10.915 1.00 . A A . 18 ARG CZ 1 1 18 5815 1 1 18 ARG H H 21.376 8.055 -6.366 1.00 . A A . 18 ARG H 1 1 18 5816 1 1 18 ARG HA H 23.130 6.732 -8.291 1.00 . A A . 18 ARG HA 1 1 18 5817 1 1 18 ARG HB2 H 20.817 5.872 -8.665 1.00 . A A . 18 ARG HB2 1 1 18 5818 1 1 18 ARG HB3 H 20.296 7.523 -8.975 1.00 . A A . 18 ARG HB3 1 1 18 5819 1 1 18 ARG HD2 H 19.632 5.886 -11.108 1.00 . A A . 18 ARG HD2 1 1 18 5820 1 1 18 ARG HD3 H 20.958 5.564 -12.225 1.00 . A A . 18 ARG HD3 1 1 18 5821 1 1 18 ARG HE H 21.552 4.213 -9.885 1.00 . A A . 18 ARG HE 1 1 18 5822 1 1 18 ARG HG2 H 21.353 7.625 -11.005 1.00 . A A . 18 ARG HG2 1 1 18 5823 1 1 18 ARG HG3 H 22.552 6.408 -10.562 1.00 . A A . 18 ARG HG3 1 1 18 5824 1 1 18 ARG HH11 H 19.048 4.182 -12.302 1.00 . A A . 18 ARG HH11 1 1 18 5825 1 1 18 ARG HH12 H 18.696 2.497 -12.103 1.00 . A A . 18 ARG HH12 1 1 18 5826 1 1 18 ARG HH21 H 21.098 1.995 -9.613 1.00 . A A . 18 ARG HH21 1 1 18 5827 1 1 18 ARG HH22 H 19.862 1.254 -10.573 1.00 . A A . 18 ARG HH22 1 1 18 5828 1 1 18 ARG N N 21.883 7.310 -6.752 1.00 . A A . 18 ARG N 1 1 18 5829 1 1 18 ARG NE N 20.865 4.298 -10.578 1.00 . A A . 18 ARG NE 1 1 18 5830 1 1 18 ARG NH1 N 19.224 3.308 -11.850 1.00 . A A . 18 ARG NH1 1 1 18 5831 1 1 18 ARG NH2 N 20.393 2.062 -10.318 1.00 . A A . 18 ARG NH2 1 1 18 5832 1 1 18 ARG O O 21.914 9.414 -9.356 1.00 . A A . 18 ARG O 1 1 19 5833 1 1 1 PHE C C 3.350 1.754 -2.750 1.00 . A A . 1 PHE C 1 1 19 5834 1 1 1 PHE CA C 2.586 2.631 -3.738 1.00 . A A . 1 PHE CA 1 1 19 5835 1 1 1 PHE CB C 2.625 2.001 -5.132 1.00 . A A . 1 PHE CB 1 1 19 5836 1 1 1 PHE CD1 C 0.788 0.927 -6.462 1.00 . A A . 1 PHE CD1 1 1 19 5837 1 1 1 PHE CD2 C 0.589 3.240 -5.917 1.00 . A A . 1 PHE CD2 1 1 19 5838 1 1 1 PHE CE1 C -0.424 0.975 -7.125 1.00 . A A . 1 PHE CE1 1 1 19 5839 1 1 1 PHE CE2 C -0.624 3.293 -6.578 1.00 . A A . 1 PHE CE2 1 1 19 5840 1 1 1 PHE CG C 1.307 2.057 -5.851 1.00 . A A . 1 PHE CG 1 1 19 5841 1 1 1 PHE CZ C -1.130 2.160 -7.184 1.00 . A A . 1 PHE CZ 1 1 19 5842 1 1 1 PHE H1 H 3.642 4.311 -3.000 1.00 . A A . 1 PHE H1 1 1 19 5843 1 1 1 PHE HA H 1.560 2.706 -3.415 1.00 . A A . 1 PHE HA 1 1 19 5844 1 1 1 PHE HB2 H 3.353 2.522 -5.735 1.00 . A A . 1 PHE HB2 1 1 19 5845 1 1 1 PHE HB3 H 2.912 0.965 -5.043 1.00 . A A . 1 PHE HB3 1 1 19 5846 1 1 1 PHE HD1 H 1.341 -0.001 -6.417 1.00 . A A . 1 PHE HD1 1 1 19 5847 1 1 1 PHE HD2 H 0.983 4.127 -5.445 1.00 . A A . 1 PHE HD2 1 1 19 5848 1 1 1 PHE HE1 H -0.816 0.086 -7.597 1.00 . A A . 1 PHE HE1 1 1 19 5849 1 1 1 PHE HE2 H -1.175 4.221 -6.623 1.00 . A A . 1 PHE HE2 1 1 19 5850 1 1 1 PHE HZ H -2.078 2.199 -7.700 1.00 . A A . 1 PHE HZ 1 1 19 5851 1 1 1 PHE N N 3.143 3.978 -3.775 1.00 . A A . 1 PHE N 1 1 19 5852 1 1 1 PHE O O 2.760 0.936 -2.043 1.00 . A A . 1 PHE O 1 1 19 5853 1 1 2 LEU C C 5.714 1.886 -0.484 1.00 . A A . 2 LEU C 1 1 19 5854 1 1 2 LEU CA C 5.513 1.154 -1.808 1.00 . A A . 2 LEU CA 1 1 19 5855 1 1 2 LEU CB C 6.868 0.878 -2.462 1.00 . A A . 2 LEU CB 1 1 19 5856 1 1 2 LEU CD1 C 6.641 -0.255 -4.686 1.00 . A A . 2 LEU CD1 1 1 19 5857 1 1 2 LEU CD2 C 8.395 -1.014 -3.073 1.00 . A A . 2 LEU CD2 1 1 19 5858 1 1 2 LEU CG C 6.991 -0.445 -3.219 1.00 . A A . 2 LEU CG 1 1 19 5859 1 1 2 LEU H H 5.079 2.596 -3.295 1.00 . A A . 2 LEU H 1 1 19 5860 1 1 2 LEU HA H 5.018 0.215 -1.614 1.00 . A A . 2 LEU HA 1 1 19 5861 1 1 2 LEU HB2 H 7.068 1.677 -3.159 1.00 . A A . 2 LEU HB2 1 1 19 5862 1 1 2 LEU HB3 H 7.618 0.886 -1.683 1.00 . A A . 2 LEU HB3 1 1 19 5863 1 1 2 LEU HD11 H 6.783 0.780 -4.959 1.00 . A A . 2 LEU HD11 1 1 19 5864 1 1 2 LEU HD12 H 5.609 -0.531 -4.849 1.00 . A A . 2 LEU HD12 1 1 19 5865 1 1 2 LEU HD13 H 7.280 -0.879 -5.293 1.00 . A A . 2 LEU HD13 1 1 19 5866 1 1 2 LEU HD21 H 8.503 -1.873 -3.719 1.00 . A A . 2 LEU HD21 1 1 19 5867 1 1 2 LEU HD22 H 8.557 -1.312 -2.047 1.00 . A A . 2 LEU HD22 1 1 19 5868 1 1 2 LEU HD23 H 9.119 -0.262 -3.349 1.00 . A A . 2 LEU HD23 1 1 19 5869 1 1 2 LEU HG H 6.295 -1.158 -2.800 1.00 . A A . 2 LEU HG 1 1 19 5870 1 1 2 LEU N N 4.666 1.929 -2.708 1.00 . A A . 2 LEU N 1 1 19 5871 1 1 2 LEU O O 5.517 3.097 -0.380 1.00 . A A . 2 LEU O 1 1 19 5872 1 1 3 PRO C C 7.590 2.588 1.928 1.00 . A A . 3 PRO C 1 1 19 5873 1 1 3 PRO CA C 6.357 1.692 1.886 1.00 . A A . 3 PRO CA 1 1 19 5874 1 1 3 PRO CB C 6.568 0.450 2.756 1.00 . A A . 3 PRO CB 1 1 19 5875 1 1 3 PRO CD C 6.372 -0.314 0.499 1.00 . A A . 3 PRO CD 1 1 19 5876 1 1 3 PRO CG C 7.051 -0.596 1.811 1.00 . A A . 3 PRO CG 1 1 19 5877 1 1 3 PRO HA H 5.500 2.243 2.246 1.00 . A A . 3 PRO HA 1 1 19 5878 1 1 3 PRO HB2 H 7.303 0.663 3.520 1.00 . A A . 3 PRO HB2 1 1 19 5879 1 1 3 PRO HB3 H 5.634 0.165 3.216 1.00 . A A . 3 PRO HB3 1 1 19 5880 1 1 3 PRO HD2 H 7.025 -0.562 -0.324 1.00 . A A . 3 PRO HD2 1 1 19 5881 1 1 3 PRO HD3 H 5.446 -0.865 0.427 1.00 . A A . 3 PRO HD3 1 1 19 5882 1 1 3 PRO HG2 H 8.122 -0.526 1.702 1.00 . A A . 3 PRO HG2 1 1 19 5883 1 1 3 PRO HG3 H 6.772 -1.575 2.174 1.00 . A A . 3 PRO HG3 1 1 19 5884 1 1 3 PRO N N 6.118 1.135 0.551 1.00 . A A . 3 PRO N 1 1 19 5885 1 1 3 PRO O O 8.705 2.139 1.662 1.00 . A A . 3 PRO O 1 1 19 5886 1 1 4 LYS C C 8.615 5.369 3.759 1.00 . A A . 4 LYS C 1 1 19 5887 1 1 4 LYS CA C 8.478 4.816 2.344 1.00 . A A . 4 LYS CA 1 1 19 5888 1 1 4 LYS CB C 8.250 5.963 1.356 1.00 . A A . 4 LYS CB 1 1 19 5889 1 1 4 LYS CD C 6.518 7.603 0.570 1.00 . A A . 4 LYS CD 1 1 19 5890 1 1 4 LYS CE C 7.327 7.989 -0.660 1.00 . A A . 4 LYS CE 1 1 19 5891 1 1 4 LYS CG C 6.791 6.168 0.988 1.00 . A A . 4 LYS CG 1 1 19 5892 1 1 4 LYS H H 6.470 4.154 2.466 1.00 . A A . 4 LYS H 1 1 19 5893 1 1 4 LYS HA H 9.390 4.301 2.081 1.00 . A A . 4 LYS HA 1 1 19 5894 1 1 4 LYS HB2 H 8.622 6.878 1.794 1.00 . A A . 4 LYS HB2 1 1 19 5895 1 1 4 LYS HB3 H 8.803 5.757 0.451 1.00 . A A . 4 LYS HB3 1 1 19 5896 1 1 4 LYS HD2 H 5.468 7.709 0.343 1.00 . A A . 4 LYS HD2 1 1 19 5897 1 1 4 LYS HD3 H 6.781 8.263 1.384 1.00 . A A . 4 LYS HD3 1 1 19 5898 1 1 4 LYS HE2 H 8.318 8.276 -0.346 1.00 . A A . 4 LYS HE2 1 1 19 5899 1 1 4 LYS HE3 H 7.390 7.133 -1.315 1.00 . A A . 4 LYS HE3 1 1 19 5900 1 1 4 LYS HG2 H 6.540 5.512 0.168 1.00 . A A . 4 LYS HG2 1 1 19 5901 1 1 4 LYS HG3 H 6.176 5.929 1.844 1.00 . A A . 4 LYS HG3 1 1 19 5902 1 1 4 LYS HZ1 H 5.668 9.044 -1.364 1.00 . A A . 4 LYS HZ1 1 1 19 5903 1 1 4 LYS HZ2 H 7.007 9.107 -2.394 1.00 . A A . 4 LYS HZ2 1 1 19 5904 1 1 4 LYS HZ3 H 6.989 10.026 -0.974 1.00 . A A . 4 LYS HZ3 1 1 19 5905 1 1 4 LYS N N 7.383 3.856 2.265 1.00 . A A . 4 LYS N 1 1 19 5906 1 1 4 LYS NZ N 6.704 9.121 -1.400 1.00 . A A . 4 LYS NZ 1 1 19 5907 1 1 4 LYS O O 8.976 6.532 3.949 1.00 . A A . 4 LYS O 1 1 19 5908 1 1 5 LEU C C 9.681 5.757 6.392 1.00 . A A . 5 LEU C 1 1 19 5909 1 1 5 LEU CA C 8.420 4.936 6.146 1.00 . A A . 5 LEU CA 1 1 19 5910 1 1 5 LEU CB C 8.413 3.706 7.055 1.00 . A A . 5 LEU CB 1 1 19 5911 1 1 5 LEU CD1 C 7.208 2.345 8.782 1.00 . A A . 5 LEU CD1 1 1 19 5912 1 1 5 LEU CD2 C 7.938 4.676 9.317 1.00 . A A . 5 LEU CD2 1 1 19 5913 1 1 5 LEU CG C 7.431 3.743 8.227 1.00 . A A . 5 LEU CG 1 1 19 5914 1 1 5 LEU H H 8.045 3.617 4.533 1.00 . A A . 5 LEU H 1 1 19 5915 1 1 5 LEU HA H 7.558 5.545 6.372 1.00 . A A . 5 LEU HA 1 1 19 5916 1 1 5 LEU HB2 H 8.169 2.847 6.448 1.00 . A A . 5 LEU HB2 1 1 19 5917 1 1 5 LEU HB3 H 9.408 3.588 7.459 1.00 . A A . 5 LEU HB3 1 1 19 5918 1 1 5 LEU HD11 H 7.083 2.398 9.852 1.00 . A A . 5 LEU HD11 1 1 19 5919 1 1 5 LEU HD12 H 8.062 1.725 8.549 1.00 . A A . 5 LEU HD12 1 1 19 5920 1 1 5 LEU HD13 H 6.322 1.918 8.335 1.00 . A A . 5 LEU HD13 1 1 19 5921 1 1 5 LEU HD21 H 9.014 4.602 9.383 1.00 . A A . 5 LEU HD21 1 1 19 5922 1 1 5 LEU HD22 H 7.500 4.395 10.264 1.00 . A A . 5 LEU HD22 1 1 19 5923 1 1 5 LEU HD23 H 7.661 5.692 9.079 1.00 . A A . 5 LEU HD23 1 1 19 5924 1 1 5 LEU HG H 6.479 4.119 7.880 1.00 . A A . 5 LEU HG 1 1 19 5925 1 1 5 LEU N N 8.327 4.531 4.747 1.00 . A A . 5 LEU N 1 1 19 5926 1 1 5 LEU O O 9.667 6.722 7.157 1.00 . A A . 5 LEU O 1 1 19 5927 1 1 6 PHE C C 12.555 6.553 4.532 1.00 . A A . 6 PHE C 1 1 19 5928 1 1 6 PHE CA C 12.041 6.070 5.885 1.00 . A A . 6 PHE CA 1 1 19 5929 1 1 6 PHE CB C 13.079 5.156 6.540 1.00 . A A . 6 PHE CB 1 1 19 5930 1 1 6 PHE CD1 C 15.320 6.117 7.132 1.00 . A A . 6 PHE CD1 1 1 19 5931 1 1 6 PHE CD2 C 13.549 6.312 8.717 1.00 . A A . 6 PHE CD2 1 1 19 5932 1 1 6 PHE CE1 C 16.172 6.779 7.997 1.00 . A A . 6 PHE CE1 1 1 19 5933 1 1 6 PHE CE2 C 14.396 6.975 9.585 1.00 . A A . 6 PHE CE2 1 1 19 5934 1 1 6 PHE CG C 14.001 5.876 7.482 1.00 . A A . 6 PHE CG 1 1 19 5935 1 1 6 PHE CZ C 15.709 7.208 9.225 1.00 . A A . 6 PHE CZ 1 1 19 5936 1 1 6 PHE H H 10.719 4.592 5.142 1.00 . A A . 6 PHE H 1 1 19 5937 1 1 6 PHE HA H 11.875 6.926 6.520 1.00 . A A . 6 PHE HA 1 1 19 5938 1 1 6 PHE HB2 H 12.569 4.387 7.100 1.00 . A A . 6 PHE HB2 1 1 19 5939 1 1 6 PHE HB3 H 13.681 4.697 5.771 1.00 . A A . 6 PHE HB3 1 1 19 5940 1 1 6 PHE HD1 H 15.684 5.781 6.171 1.00 . A A . 6 PHE HD1 1 1 19 5941 1 1 6 PHE HD2 H 12.523 6.130 9.001 1.00 . A A . 6 PHE HD2 1 1 19 5942 1 1 6 PHE HE1 H 17.198 6.959 7.712 1.00 . A A . 6 PHE HE1 1 1 19 5943 1 1 6 PHE HE2 H 14.032 7.310 10.545 1.00 . A A . 6 PHE HE2 1 1 19 5944 1 1 6 PHE HZ H 16.372 7.727 9.902 1.00 . A A . 6 PHE HZ 1 1 19 5945 1 1 6 PHE N N 10.771 5.369 5.738 1.00 . A A . 6 PHE N 1 1 19 5946 1 1 6 PHE O O 13.537 7.291 4.457 1.00 . A A . 6 PHE O 1 1 19 5947 1 1 7 ALA C C 11.935 7.987 1.850 1.00 . A A . 7 ALA C 1 1 19 5948 1 1 7 ALA CA C 12.270 6.523 2.115 1.00 . A A . 7 ALA CA 1 1 19 5949 1 1 7 ALA CB C 11.586 5.629 1.091 1.00 . A A . 7 ALA CB 1 1 19 5950 1 1 7 ALA H H 11.108 5.546 3.590 1.00 . A A . 7 ALA H 1 1 19 5951 1 1 7 ALA HA H 13.337 6.385 2.021 1.00 . A A . 7 ALA HA 1 1 19 5952 1 1 7 ALA HB1 H 11.252 4.721 1.573 1.00 . A A . 7 ALA HB1 1 1 19 5953 1 1 7 ALA HB2 H 10.737 6.148 0.671 1.00 . A A . 7 ALA HB2 1 1 19 5954 1 1 7 ALA HB3 H 12.284 5.384 0.305 1.00 . A A . 7 ALA HB3 1 1 19 5955 1 1 7 ALA N N 11.883 6.132 3.465 1.00 . A A . 7 ALA N 1 1 19 5956 1 1 7 ALA O O 12.605 8.655 1.062 1.00 . A A . 7 ALA O 1 1 19 5957 1 1 8 LYS C C 11.205 10.778 3.327 1.00 . A A . 8 LYS C 1 1 19 5958 1 1 8 LYS CA C 10.470 9.866 2.350 1.00 . A A . 8 LYS CA 1 1 19 5959 1 1 8 LYS CB C 8.959 9.986 2.561 1.00 . A A . 8 LYS CB 1 1 19 5960 1 1 8 LYS CD C 7.588 10.358 4.633 1.00 . A A . 8 LYS CD 1 1 19 5961 1 1 8 LYS CE C 8.342 11.621 5.020 1.00 . A A . 8 LYS CE 1 1 19 5962 1 1 8 LYS CG C 8.479 9.389 3.873 1.00 . A A . 8 LYS CG 1 1 19 5963 1 1 8 LYS H H 10.400 7.898 3.128 1.00 . A A . 8 LYS H 1 1 19 5964 1 1 8 LYS HA H 10.710 10.170 1.342 1.00 . A A . 8 LYS HA 1 1 19 5965 1 1 8 LYS HB2 H 8.688 11.031 2.544 1.00 . A A . 8 LYS HB2 1 1 19 5966 1 1 8 LYS HB3 H 8.453 9.479 1.752 1.00 . A A . 8 LYS HB3 1 1 19 5967 1 1 8 LYS HD2 H 6.751 10.629 4.008 1.00 . A A . 8 LYS HD2 1 1 19 5968 1 1 8 LYS HD3 H 7.229 9.874 5.530 1.00 . A A . 8 LYS HD3 1 1 19 5969 1 1 8 LYS HE2 H 8.122 11.854 6.051 1.00 . A A . 8 LYS HE2 1 1 19 5970 1 1 8 LYS HE3 H 9.401 11.441 4.909 1.00 . A A . 8 LYS HE3 1 1 19 5971 1 1 8 LYS HG2 H 7.919 8.490 3.665 1.00 . A A . 8 LYS HG2 1 1 19 5972 1 1 8 LYS HG3 H 9.337 9.148 4.484 1.00 . A A . 8 LYS HG3 1 1 19 5973 1 1 8 LYS HZ1 H 7.122 12.540 3.595 1.00 . A A . 8 LYS HZ1 1 1 19 5974 1 1 8 LYS HZ2 H 8.739 13.033 3.533 1.00 . A A . 8 LYS HZ2 1 1 19 5975 1 1 8 LYS HZ3 H 7.728 13.601 4.764 1.00 . A A . 8 LYS HZ3 1 1 19 5976 1 1 8 LYS N N 10.894 8.480 2.513 1.00 . A A . 8 LYS N 1 1 19 5977 1 1 8 LYS NZ N 7.956 12.780 4.169 1.00 . A A . 8 LYS NZ 1 1 19 5978 1 1 8 LYS O O 11.516 11.925 3.005 1.00 . A A . 8 LYS O 1 1 19 5979 1 1 9 ILE C C 13.648 11.226 5.172 1.00 . A A . 9 ILE C 1 1 19 5980 1 1 9 ILE CA C 12.182 11.029 5.541 1.00 . A A . 9 ILE CA 1 1 19 5981 1 1 9 ILE CB C 12.099 10.342 6.917 1.00 . A A . 9 ILE CB 1 1 19 5982 1 1 9 ILE CD1 C 14.460 9.704 7.619 1.00 . A A . 9 ILE CD1 1 1 19 5983 1 1 9 ILE CG1 C 13.151 9.236 7.024 1.00 . A A . 9 ILE CG1 1 1 19 5984 1 1 9 ILE CG2 C 10.704 9.777 7.144 1.00 . A A . 9 ILE CG2 1 1 19 5985 1 1 9 ILE H H 11.208 9.341 4.716 1.00 . A A . 9 ILE H 1 1 19 5986 1 1 9 ILE HA H 11.707 11.996 5.614 1.00 . A A . 9 ILE HA 1 1 19 5987 1 1 9 ILE HB H 12.288 11.085 7.677 1.00 . A A . 9 ILE HB 1 1 19 5988 1 1 9 ILE HD11 H 14.578 10.763 7.444 1.00 . A A . 9 ILE HD11 1 1 19 5989 1 1 9 ILE HD12 H 14.463 9.511 8.681 1.00 . A A . 9 ILE HD12 1 1 19 5990 1 1 9 ILE HD13 H 15.278 9.171 7.154 1.00 . A A . 9 ILE HD13 1 1 19 5991 1 1 9 ILE HG12 H 12.769 8.443 7.648 1.00 . A A . 9 ILE HG12 1 1 19 5992 1 1 9 ILE HG13 H 13.354 8.847 6.037 1.00 . A A . 9 ILE HG13 1 1 19 5993 1 1 9 ILE HG21 H 10.712 8.713 6.958 1.00 . A A . 9 ILE HG21 1 1 19 5994 1 1 9 ILE HG22 H 10.403 9.962 8.164 1.00 . A A . 9 ILE HG22 1 1 19 5995 1 1 9 ILE HG23 H 10.008 10.255 6.471 1.00 . A A . 9 ILE HG23 1 1 19 5996 1 1 9 ILE N N 11.481 10.261 4.519 1.00 . A A . 9 ILE N 1 1 19 5997 1 1 9 ILE O O 14.278 12.201 5.582 1.00 . A A . 9 ILE O 1 1 19 5998 1 1 10 THR C C 15.729 11.235 2.722 1.00 . A A . 10 THR C 1 1 19 5999 1 1 10 THR CA C 15.579 10.365 3.965 1.00 . A A . 10 THR CA 1 1 19 6000 1 1 10 THR CB C 16.148 8.964 3.670 1.00 . A A . 10 THR CB 1 1 19 6001 1 1 10 THR CG2 C 16.360 8.183 4.958 1.00 . A A . 10 THR CG2 1 1 19 6002 1 1 10 THR H H 13.633 9.541 4.096 1.00 . A A . 10 THR H 1 1 19 6003 1 1 10 THR HA H 16.152 10.801 4.770 1.00 . A A . 10 THR HA 1 1 19 6004 1 1 10 THR HB H 17.101 9.077 3.173 1.00 . A A . 10 THR HB 1 1 19 6005 1 1 10 THR HG1 H 15.437 7.303 2.878 1.00 . A A . 10 THR HG1 1 1 19 6006 1 1 10 THR HG21 H 17.070 8.705 5.582 1.00 . A A . 10 THR HG21 1 1 19 6007 1 1 10 THR HG22 H 16.739 7.200 4.724 1.00 . A A . 10 THR HG22 1 1 19 6008 1 1 10 THR HG23 H 15.420 8.092 5.482 1.00 . A A . 10 THR HG23 1 1 19 6009 1 1 10 THR N N 14.187 10.294 4.391 1.00 . A A . 10 THR N 1 1 19 6010 1 1 10 THR O O 15.141 10.952 1.678 1.00 . A A . 10 THR O 1 1 19 6011 1 1 10 THR OG1 O 15.256 8.244 2.811 1.00 . A A . 10 THR OG1 1 1 19 6012 1 1 11 LYS C C 18.236 13.278 1.381 1.00 . A A . 11 LYS C 1 1 19 6013 1 1 11 LYS CA C 16.752 13.206 1.726 1.00 . A A . 11 LYS CA 1 1 19 6014 1 1 11 LYS CB C 16.228 14.603 2.066 1.00 . A A . 11 LYS CB 1 1 19 6015 1 1 11 LYS CD C 17.887 15.274 3.830 1.00 . A A . 11 LYS CD 1 1 19 6016 1 1 11 LYS CE C 18.383 16.504 3.086 1.00 . A A . 11 LYS CE 1 1 19 6017 1 1 11 LYS CG C 16.426 14.989 3.522 1.00 . A A . 11 LYS CG 1 1 19 6018 1 1 11 LYS H H 16.963 12.468 3.699 1.00 . A A . 11 LYS H 1 1 19 6019 1 1 11 LYS HA H 16.214 12.827 0.871 1.00 . A A . 11 LYS HA 1 1 19 6020 1 1 11 LYS HB2 H 16.742 15.327 1.450 1.00 . A A . 11 LYS HB2 1 1 19 6021 1 1 11 LYS HB3 H 15.171 14.641 1.846 1.00 . A A . 11 LYS HB3 1 1 19 6022 1 1 11 LYS HD2 H 17.996 15.440 4.891 1.00 . A A . 11 LYS HD2 1 1 19 6023 1 1 11 LYS HD3 H 18.481 14.421 3.534 1.00 . A A . 11 LYS HD3 1 1 19 6024 1 1 11 LYS HE2 H 17.612 16.835 2.408 1.00 . A A . 11 LYS HE2 1 1 19 6025 1 1 11 LYS HE3 H 18.589 17.284 3.805 1.00 . A A . 11 LYS HE3 1 1 19 6026 1 1 11 LYS HG2 H 15.846 15.875 3.732 1.00 . A A . 11 LYS HG2 1 1 19 6027 1 1 11 LYS HG3 H 16.087 14.177 4.149 1.00 . A A . 11 LYS HG3 1 1 19 6028 1 1 11 LYS HZ1 H 19.379 15.943 1.338 1.00 . A A . 11 LYS HZ1 1 1 19 6029 1 1 11 LYS HZ2 H 20.154 15.446 2.757 1.00 . A A . 11 LYS HZ2 1 1 19 6030 1 1 11 LYS HZ3 H 20.225 17.067 2.277 1.00 . A A . 11 LYS HZ3 1 1 19 6031 1 1 11 LYS N N 16.522 12.295 2.841 1.00 . A A . 11 LYS N 1 1 19 6032 1 1 11 LYS NZ N 19.622 16.220 2.310 1.00 . A A . 11 LYS NZ 1 1 19 6033 1 1 11 LYS O O 18.674 14.176 0.661 1.00 . A A . 11 LYS O 1 1 19 6034 1 1 12 LYS C C 20.827 10.981 0.940 1.00 . A A . 12 LYS C 1 1 19 6035 1 1 12 LYS CA C 20.441 12.280 1.641 1.00 . A A . 12 LYS CA 1 1 19 6036 1 1 12 LYS CB C 21.218 12.414 2.953 1.00 . A A . 12 LYS CB 1 1 19 6037 1 1 12 LYS CD C 21.340 11.578 5.318 1.00 . A A . 12 LYS CD 1 1 19 6038 1 1 12 LYS CE C 20.761 11.978 6.667 1.00 . A A . 12 LYS CE 1 1 19 6039 1 1 12 LYS CG C 20.425 11.988 4.176 1.00 . A A . 12 LYS CG 1 1 19 6040 1 1 12 LYS H H 18.599 11.638 2.464 1.00 . A A . 12 LYS H 1 1 19 6041 1 1 12 LYS HA H 20.691 13.110 0.998 1.00 . A A . 12 LYS HA 1 1 19 6042 1 1 12 LYS HB2 H 22.107 11.803 2.895 1.00 . A A . 12 LYS HB2 1 1 19 6043 1 1 12 LYS HB3 H 21.510 13.447 3.080 1.00 . A A . 12 LYS HB3 1 1 19 6044 1 1 12 LYS HD2 H 21.468 10.506 5.299 1.00 . A A . 12 LYS HD2 1 1 19 6045 1 1 12 LYS HD3 H 22.299 12.060 5.191 1.00 . A A . 12 LYS HD3 1 1 19 6046 1 1 12 LYS HE2 H 19.935 12.653 6.503 1.00 . A A . 12 LYS HE2 1 1 19 6047 1 1 12 LYS HE3 H 20.406 11.090 7.169 1.00 . A A . 12 LYS HE3 1 1 19 6048 1 1 12 LYS HG2 H 19.810 12.814 4.501 1.00 . A A . 12 LYS HG2 1 1 19 6049 1 1 12 LYS HG3 H 19.796 11.150 3.912 1.00 . A A . 12 LYS HG3 1 1 19 6050 1 1 12 LYS HZ1 H 21.720 13.682 7.401 1.00 . A A . 12 LYS HZ1 1 1 19 6051 1 1 12 LYS HZ2 H 22.729 12.330 7.272 1.00 . A A . 12 LYS HZ2 1 1 19 6052 1 1 12 LYS HZ3 H 21.599 12.425 8.527 1.00 . A A . 12 LYS HZ3 1 1 19 6053 1 1 12 LYS N N 19.006 12.327 1.897 1.00 . A A . 12 LYS N 1 1 19 6054 1 1 12 LYS NZ N 21.773 12.651 7.527 1.00 . A A . 12 LYS NZ 1 1 19 6055 1 1 12 LYS O O 21.055 10.962 -0.269 1.00 . A A . 12 LYS O 1 1 19 6056 1 1 13 ASN C C 20.410 8.273 -0.072 1.00 . A A . 13 ASN C 1 1 19 6057 1 1 13 ASN CA C 21.253 8.595 1.158 1.00 . A A . 13 ASN CA 1 1 19 6058 1 1 13 ASN CB C 21.070 7.505 2.216 1.00 . A A . 13 ASN CB 1 1 19 6059 1 1 13 ASN CG C 22.386 6.880 2.637 1.00 . A A . 13 ASN CG 1 1 19 6060 1 1 13 ASN H H 20.703 9.977 2.664 1.00 . A A . 13 ASN H 1 1 19 6061 1 1 13 ASN HA H 22.293 8.631 0.868 1.00 . A A . 13 ASN HA 1 1 19 6062 1 1 13 ASN HB2 H 20.603 7.936 3.090 1.00 . A A . 13 ASN HB2 1 1 19 6063 1 1 13 ASN HB3 H 20.433 6.729 1.819 1.00 . A A . 13 ASN HB3 1 1 19 6064 1 1 13 ASN HD21 H 21.873 7.030 4.552 1.00 . A A . 13 ASN HD21 1 1 19 6065 1 1 13 ASN HD22 H 23.422 6.331 4.242 1.00 . A A . 13 ASN HD22 1 1 19 6066 1 1 13 ASN N N 20.896 9.898 1.707 1.00 . A A . 13 ASN N 1 1 19 6067 1 1 13 ASN ND2 N 22.580 6.732 3.942 1.00 . A A . 13 ASN ND2 1 1 19 6068 1 1 13 ASN O O 20.857 7.567 -0.976 1.00 . A A . 13 ASN O 1 1 19 6069 1 1 13 ASN OD1 O 23.217 6.533 1.797 1.00 . A A . 13 ASN OD1 1 1 19 6070 1 1 14 MET C C 18.880 9.094 -2.518 1.00 . A A . 14 MET C 1 1 19 6071 1 1 14 MET CA C 18.283 8.565 -1.218 1.00 . A A . 14 MET CA 1 1 19 6072 1 1 14 MET CB C 16.932 9.232 -0.955 1.00 . A A . 14 MET CB 1 1 19 6073 1 1 14 MET CE C 14.820 6.242 -2.010 1.00 . A A . 14 MET CE 1 1 19 6074 1 1 14 MET CG C 15.847 8.815 -1.934 1.00 . A A . 14 MET CG 1 1 19 6075 1 1 14 MET H H 18.888 9.350 0.652 1.00 . A A . 14 MET H 1 1 19 6076 1 1 14 MET HA H 18.136 7.499 -1.310 1.00 . A A . 14 MET HA 1 1 19 6077 1 1 14 MET HB2 H 16.605 8.976 0.042 1.00 . A A . 14 MET HB2 1 1 19 6078 1 1 14 MET HB3 H 17.053 10.303 -1.021 1.00 . A A . 14 MET HB3 1 1 19 6079 1 1 14 MET HE1 H 14.966 6.423 -3.064 1.00 . A A . 14 MET HE1 1 1 19 6080 1 1 14 MET HE2 H 15.692 5.750 -1.604 1.00 . A A . 14 MET HE2 1 1 19 6081 1 1 14 MET HE3 H 13.953 5.614 -1.869 1.00 . A A . 14 MET HE3 1 1 19 6082 1 1 14 MET HG2 H 15.386 9.703 -2.340 1.00 . A A . 14 MET HG2 1 1 19 6083 1 1 14 MET HG3 H 16.302 8.251 -2.735 1.00 . A A . 14 MET HG3 1 1 19 6084 1 1 14 MET N N 19.188 8.795 -0.098 1.00 . A A . 14 MET N 1 1 19 6085 1 1 14 MET O O 18.977 8.369 -3.507 1.00 . A A . 14 MET O 1 1 19 6086 1 1 14 MET SD S 14.569 7.802 -1.165 1.00 . A A . 14 MET SD 1 1 19 6087 1 1 15 ALA C C 21.305 10.520 -3.894 1.00 . A A . 15 ALA C 1 1 19 6088 1 1 15 ALA CA C 19.868 10.987 -3.685 1.00 . A A . 15 ALA CA 1 1 19 6089 1 1 15 ALA CB C 19.816 12.503 -3.560 1.00 . A A . 15 ALA CB 1 1 19 6090 1 1 15 ALA H H 19.175 10.889 -1.688 1.00 . A A . 15 ALA H 1 1 19 6091 1 1 15 ALA HA H 19.279 10.701 -4.545 1.00 . A A . 15 ALA HA 1 1 19 6092 1 1 15 ALA HB1 H 18.795 12.814 -3.391 1.00 . A A . 15 ALA HB1 1 1 19 6093 1 1 15 ALA HB2 H 20.431 12.816 -2.729 1.00 . A A . 15 ALA HB2 1 1 19 6094 1 1 15 ALA HB3 H 20.184 12.951 -4.470 1.00 . A A . 15 ALA HB3 1 1 19 6095 1 1 15 ALA N N 19.279 10.362 -2.507 1.00 . A A . 15 ALA N 1 1 19 6096 1 1 15 ALA O O 21.973 10.939 -4.840 1.00 . A A . 15 ALA O 1 1 19 6097 1 1 16 HIS C C 23.131 7.695 -3.614 1.00 . A A . 16 HIS C 1 1 19 6098 1 1 16 HIS CA C 23.133 9.128 -3.091 1.00 . A A . 16 HIS CA 1 1 19 6099 1 1 16 HIS CB C 23.812 9.183 -1.722 1.00 . A A . 16 HIS CB 1 1 19 6100 1 1 16 HIS CD2 C 26.283 9.953 -1.893 1.00 . A A . 16 HIS CD2 1 1 19 6101 1 1 16 HIS CE1 C 26.000 12.060 -1.358 1.00 . A A . 16 HIS CE1 1 1 19 6102 1 1 16 HIS CG C 24.963 10.140 -1.662 1.00 . A A . 16 HIS CG 1 1 19 6103 1 1 16 HIS H H 21.194 9.356 -2.272 1.00 . A A . 16 HIS H 1 1 19 6104 1 1 16 HIS HA H 23.684 9.749 -3.781 1.00 . A A . 16 HIS HA 1 1 19 6105 1 1 16 HIS HB2 H 23.088 9.488 -0.981 1.00 . A A . 16 HIS HB2 1 1 19 6106 1 1 16 HIS HB3 H 24.184 8.199 -1.472 1.00 . A A . 16 HIS HB3 1 1 19 6107 1 1 16 HIS HD1 H 23.975 11.915 -1.104 1.00 . A A . 16 HIS HD1 1 1 19 6108 1 1 16 HIS HD2 H 26.759 9.025 -2.179 1.00 . A A . 16 HIS HD2 1 1 19 6109 1 1 16 HIS HE1 H 26.193 13.100 -1.142 1.00 . A A . 16 HIS HE1 1 1 19 6110 1 1 16 HIS N N 21.775 9.652 -3.004 1.00 . A A . 16 HIS N 1 1 19 6111 1 1 16 HIS ND1 N 24.818 11.470 -1.328 1.00 . A A . 16 HIS ND1 1 1 19 6112 1 1 16 HIS NE2 N 26.906 11.161 -1.698 1.00 . A A . 16 HIS NE2 1 1 19 6113 1 1 16 HIS O O 24.158 7.187 -4.065 1.00 . A A . 16 HIS O 1 1 19 6114 1 1 17 ILE C C 22.356 5.526 -5.443 1.00 . A A . 17 ILE C 1 1 19 6115 1 1 17 ILE CA C 21.836 5.675 -4.017 1.00 . A A . 17 ILE CA 1 1 19 6116 1 1 17 ILE CB C 20.371 5.204 -3.964 1.00 . A A . 17 ILE CB 1 1 19 6117 1 1 17 ILE CD1 C 18.046 5.894 -4.736 1.00 . A A . 17 ILE CD1 1 1 19 6118 1 1 17 ILE CG1 C 19.534 5.955 -5.002 1.00 . A A . 17 ILE CG1 1 1 19 6119 1 1 17 ILE CG2 C 19.800 5.405 -2.569 1.00 . A A . 17 ILE CG2 1 1 19 6120 1 1 17 ILE H H 21.189 7.507 -3.180 1.00 . A A . 17 ILE H 1 1 19 6121 1 1 17 ILE HA H 22.421 5.042 -3.364 1.00 . A A . 17 ILE HA 1 1 19 6122 1 1 17 ILE HB H 20.347 4.149 -4.188 1.00 . A A . 17 ILE HB 1 1 19 6123 1 1 17 ILE HD11 H 17.745 4.865 -4.604 1.00 . A A . 17 ILE HD11 1 1 19 6124 1 1 17 ILE HD12 H 17.816 6.455 -3.843 1.00 . A A . 17 ILE HD12 1 1 19 6125 1 1 17 ILE HD13 H 17.513 6.319 -5.575 1.00 . A A . 17 ILE HD13 1 1 19 6126 1 1 17 ILE HG12 H 19.826 6.993 -5.009 1.00 . A A . 17 ILE HG12 1 1 19 6127 1 1 17 ILE HG13 H 19.715 5.527 -5.977 1.00 . A A . 17 ILE HG13 1 1 19 6128 1 1 17 ILE HG21 H 18.936 4.770 -2.438 1.00 . A A . 17 ILE HG21 1 1 19 6129 1 1 17 ILE HG22 H 20.548 5.148 -1.834 1.00 . A A . 17 ILE HG22 1 1 19 6130 1 1 17 ILE HG23 H 19.510 6.437 -2.443 1.00 . A A . 17 ILE HG23 1 1 19 6131 1 1 17 ILE N N 21.972 7.049 -3.550 1.00 . A A . 17 ILE N 1 1 19 6132 1 1 17 ILE O O 23.000 4.532 -5.779 1.00 . A A . 17 ILE O 1 1 19 6133 1 1 18 ARG C C 23.956 6.975 -7.788 1.00 . A A . 18 ARG C 1 1 19 6134 1 1 18 ARG CA C 22.511 6.500 -7.668 1.00 . A A . 18 ARG CA 1 1 19 6135 1 1 18 ARG CB C 21.600 7.381 -8.525 1.00 . A A . 18 ARG CB 1 1 19 6136 1 1 18 ARG CD C 21.936 8.667 -10.658 1.00 . A A . 18 ARG CD 1 1 19 6137 1 1 18 ARG CG C 21.890 7.290 -10.014 1.00 . A A . 18 ARG CG 1 1 19 6138 1 1 18 ARG CZ C 19.976 8.672 -12.142 1.00 . A A . 18 ARG CZ 1 1 19 6139 1 1 18 ARG H H 21.554 7.286 -5.951 1.00 . A A . 18 ARG H 1 1 19 6140 1 1 18 ARG HA H 22.448 5.482 -8.021 1.00 . A A . 18 ARG HA 1 1 19 6141 1 1 18 ARG HB2 H 20.574 7.085 -8.362 1.00 . A A . 18 ARG HB2 1 1 19 6142 1 1 18 ARG HB3 H 21.722 8.409 -8.219 1.00 . A A . 18 ARG HB3 1 1 19 6143 1 1 18 ARG HD2 H 22.346 9.368 -9.947 1.00 . A A . 18 ARG HD2 1 1 19 6144 1 1 18 ARG HD3 H 22.575 8.621 -11.527 1.00 . A A . 18 ARG HD3 1 1 19 6145 1 1 18 ARG HE H 20.174 9.803 -10.511 1.00 . A A . 18 ARG HE 1 1 19 6146 1 1 18 ARG HG2 H 22.846 6.806 -10.156 1.00 . A A . 18 ARG HG2 1 1 19 6147 1 1 18 ARG HG3 H 21.115 6.706 -10.487 1.00 . A A . 18 ARG HG3 1 1 19 6148 1 1 18 ARG HH11 H 21.449 7.400 -12.684 1.00 . A A . 18 ARG HH11 1 1 19 6149 1 1 18 ARG HH12 H 20.061 7.413 -13.721 1.00 . A A . 18 ARG HH12 1 1 19 6150 1 1 18 ARG HH21 H 18.342 9.830 -11.869 1.00 . A A . 18 ARG HH21 1 1 19 6151 1 1 18 ARG HH22 H 18.295 8.796 -13.257 1.00 . A A . 18 ARG HH22 1 1 19 6152 1 1 18 ARG N N 22.072 6.520 -6.277 1.00 . A A . 18 ARG N 1 1 19 6153 1 1 18 ARG NE N 20.611 9.124 -11.066 1.00 . A A . 18 ARG NE 1 1 19 6154 1 1 18 ARG NH1 N 20.542 7.753 -12.912 1.00 . A A . 18 ARG NH1 1 1 19 6155 1 1 18 ARG NH2 N 18.772 9.137 -12.448 1.00 . A A . 18 ARG NH2 1 1 19 6156 1 1 18 ARG O O 24.214 8.157 -8.014 1.00 . A A . 18 ARG O 1 1 20 6157 1 1 1 PHE C C 3.601 1.179 -2.104 1.00 . A A . 1 PHE C 1 1 20 6158 1 1 1 PHE CA C 2.454 0.175 -2.173 1.00 . A A . 1 PHE CA 1 1 20 6159 1 1 1 PHE CB C 1.816 0.208 -3.564 1.00 . A A . 1 PHE CB 1 1 20 6160 1 1 1 PHE CD1 C -0.309 1.534 -3.712 1.00 . A A . 1 PHE CD1 1 1 20 6161 1 1 1 PHE CD2 C 1.744 2.617 -4.261 1.00 . A A . 1 PHE CD2 1 1 20 6162 1 1 1 PHE CE1 C -1.000 2.702 -3.975 1.00 . A A . 1 PHE CE1 1 1 20 6163 1 1 1 PHE CE2 C 1.058 3.788 -4.524 1.00 . A A . 1 PHE CE2 1 1 20 6164 1 1 1 PHE CG C 1.069 1.478 -3.851 1.00 . A A . 1 PHE CG 1 1 20 6165 1 1 1 PHE CZ C -0.315 3.830 -4.383 1.00 . A A . 1 PHE CZ 1 1 20 6166 1 1 1 PHE H1 H 1.124 -0.275 -0.588 1.00 . A A . 1 PHE H1 1 1 20 6167 1 1 1 PHE HA H 2.845 -0.814 -1.989 1.00 . A A . 1 PHE HA 1 1 20 6168 1 1 1 PHE HB2 H 2.590 0.103 -4.309 1.00 . A A . 1 PHE HB2 1 1 20 6169 1 1 1 PHE HB3 H 1.122 -0.614 -3.653 1.00 . A A . 1 PHE HB3 1 1 20 6170 1 1 1 PHE HD1 H -0.845 0.652 -3.393 1.00 . A A . 1 PHE HD1 1 1 20 6171 1 1 1 PHE HD2 H 2.817 2.586 -4.373 1.00 . A A . 1 PHE HD2 1 1 20 6172 1 1 1 PHE HE1 H -2.073 2.731 -3.863 1.00 . A A . 1 PHE HE1 1 1 20 6173 1 1 1 PHE HE2 H 1.596 4.669 -4.844 1.00 . A A . 1 PHE HE2 1 1 20 6174 1 1 1 PHE HZ H -0.853 4.744 -4.588 1.00 . A A . 1 PHE HZ 1 1 20 6175 1 1 1 PHE N N 1.453 0.458 -1.151 1.00 . A A . 1 PHE N 1 1 20 6176 1 1 1 PHE O O 3.404 2.340 -1.741 1.00 . A A . 1 PHE O 1 1 20 6177 1 1 2 LEU C C 6.187 2.185 -1.045 1.00 . A A . 2 LEU C 1 1 20 6178 1 1 2 LEU CA C 5.979 1.581 -2.430 1.00 . A A . 2 LEU CA 1 1 20 6179 1 1 2 LEU CB C 5.845 2.695 -3.470 1.00 . A A . 2 LEU CB 1 1 20 6180 1 1 2 LEU CD1 C 7.733 1.958 -4.945 1.00 . A A . 2 LEU CD1 1 1 20 6181 1 1 2 LEU CD2 C 5.400 1.200 -5.433 1.00 . A A . 2 LEU CD2 1 1 20 6182 1 1 2 LEU CG C 6.261 2.335 -4.897 1.00 . A A . 2 LEU CG 1 1 20 6183 1 1 2 LEU H H 4.893 -0.210 -2.733 1.00 . A A . 2 LEU H 1 1 20 6184 1 1 2 LEU HA H 6.836 0.971 -2.676 1.00 . A A . 2 LEU HA 1 1 20 6185 1 1 2 LEU HB2 H 4.811 3.001 -3.494 1.00 . A A . 2 LEU HB2 1 1 20 6186 1 1 2 LEU HB3 H 6.457 3.525 -3.145 1.00 . A A . 2 LEU HB3 1 1 20 6187 1 1 2 LEU HD11 H 7.828 0.909 -5.179 1.00 . A A . 2 LEU HD11 1 1 20 6188 1 1 2 LEU HD12 H 8.187 2.155 -3.985 1.00 . A A . 2 LEU HD12 1 1 20 6189 1 1 2 LEU HD13 H 8.230 2.544 -5.704 1.00 . A A . 2 LEU HD13 1 1 20 6190 1 1 2 LEU HD21 H 5.630 1.036 -6.475 1.00 . A A . 2 LEU HD21 1 1 20 6191 1 1 2 LEU HD22 H 4.356 1.462 -5.332 1.00 . A A . 2 LEU HD22 1 1 20 6192 1 1 2 LEU HD23 H 5.602 0.300 -4.872 1.00 . A A . 2 LEU HD23 1 1 20 6193 1 1 2 LEU HG H 6.116 3.196 -5.535 1.00 . A A . 2 LEU HG 1 1 20 6194 1 1 2 LEU N N 4.799 0.724 -2.453 1.00 . A A . 2 LEU N 1 1 20 6195 1 1 2 LEU O O 5.969 3.376 -0.821 1.00 . A A . 2 LEU O 1 1 20 6196 1 1 3 PRO C C 8.087 2.688 1.398 1.00 . A A . 3 PRO C 1 1 20 6197 1 1 3 PRO CA C 6.871 1.776 1.287 1.00 . A A . 3 PRO CA 1 1 20 6198 1 1 3 PRO CB C 7.119 0.460 2.028 1.00 . A A . 3 PRO CB 1 1 20 6199 1 1 3 PRO CD C 6.902 -0.086 -0.289 1.00 . A A . 3 PRO CD 1 1 20 6200 1 1 3 PRO CG C 7.606 -0.480 0.980 1.00 . A A . 3 PRO CG 1 1 20 6201 1 1 3 PRO HA H 6.010 2.272 1.709 1.00 . A A . 3 PRO HA 1 1 20 6202 1 1 3 PRO HB2 H 7.862 0.613 2.799 1.00 . A A . 3 PRO HB2 1 1 20 6203 1 1 3 PRO HB3 H 6.198 0.113 2.472 1.00 . A A . 3 PRO HB3 1 1 20 6204 1 1 3 PRO HD2 H 7.546 -0.239 -1.142 1.00 . A A . 3 PRO HD2 1 1 20 6205 1 1 3 PRO HD3 H 5.985 -0.646 -0.401 1.00 . A A . 3 PRO HD3 1 1 20 6206 1 1 3 PRO HG2 H 8.674 -0.378 0.863 1.00 . A A . 3 PRO HG2 1 1 20 6207 1 1 3 PRO HG3 H 7.352 -1.494 1.250 1.00 . A A . 3 PRO HG3 1 1 20 6208 1 1 3 PRO N N 6.621 1.346 -0.093 1.00 . A A . 3 PRO N 1 1 20 6209 1 1 3 PRO O O 9.219 2.262 1.168 1.00 . A A . 3 PRO O 1 1 20 6210 1 1 4 LYS C C 8.995 5.443 3.329 1.00 . A A . 4 LYS C 1 1 20 6211 1 1 4 LYS CA C 8.924 4.919 1.898 1.00 . A A . 4 LYS CA 1 1 20 6212 1 1 4 LYS CB C 8.719 6.084 0.927 1.00 . A A . 4 LYS CB 1 1 20 6213 1 1 4 LYS CD C 6.994 7.692 0.061 1.00 . A A . 4 LYS CD 1 1 20 6214 1 1 4 LYS CE C 7.867 8.109 -1.113 1.00 . A A . 4 LYS CE 1 1 20 6215 1 1 4 LYS CG C 7.277 6.260 0.483 1.00 . A A . 4 LYS CG 1 1 20 6216 1 1 4 LYS H H 6.923 4.226 1.924 1.00 . A A . 4 LYS H 1 1 20 6217 1 1 4 LYS HA H 9.853 4.423 1.662 1.00 . A A . 4 LYS HA 1 1 20 6218 1 1 4 LYS HB2 H 9.040 6.997 1.406 1.00 . A A . 4 LYS HB2 1 1 20 6219 1 1 4 LYS HB3 H 9.326 5.915 0.049 1.00 . A A . 4 LYS HB3 1 1 20 6220 1 1 4 LYS HD2 H 5.957 7.775 -0.229 1.00 . A A . 4 LYS HD2 1 1 20 6221 1 1 4 LYS HD3 H 7.190 8.349 0.896 1.00 . A A . 4 LYS HD3 1 1 20 6222 1 1 4 LYS HE2 H 8.883 8.222 -0.767 1.00 . A A . 4 LYS HE2 1 1 20 6223 1 1 4 LYS HE3 H 7.826 7.337 -1.867 1.00 . A A . 4 LYS HE3 1 1 20 6224 1 1 4 LYS HG2 H 7.085 5.605 -0.353 1.00 . A A . 4 LYS HG2 1 1 20 6225 1 1 4 LYS HG3 H 6.623 6.000 1.304 1.00 . A A . 4 LYS HG3 1 1 20 6226 1 1 4 LYS HZ1 H 7.223 9.270 -2.726 1.00 . A A . 4 LYS HZ1 1 1 20 6227 1 1 4 LYS HZ2 H 8.148 10.122 -1.595 1.00 . A A . 4 LYS HZ2 1 1 20 6228 1 1 4 LYS HZ3 H 6.543 9.720 -1.243 1.00 . A A . 4 LYS HZ3 1 1 20 6229 1 1 4 LYS N N 7.848 3.946 1.754 1.00 . A A . 4 LYS N 1 1 20 6230 1 1 4 LYS NZ N 7.413 9.396 -1.711 1.00 . A A . 4 LYS NZ 1 1 20 6231 1 1 4 LYS O O 9.291 6.616 3.557 1.00 . A A . 4 LYS O 1 1 20 6232 1 1 5 LEU C C 9.985 5.794 6.005 1.00 . A A . 5 LEU C 1 1 20 6233 1 1 5 LEU CA C 8.759 4.939 5.699 1.00 . A A . 5 LEU CA 1 1 20 6234 1 1 5 LEU CB C 8.764 3.688 6.579 1.00 . A A . 5 LEU CB 1 1 20 6235 1 1 5 LEU CD1 C 6.956 2.209 7.490 1.00 . A A . 5 LEU CD1 1 1 20 6236 1 1 5 LEU CD2 C 8.132 3.818 9.001 1.00 . A A . 5 LEU CD2 1 1 20 6237 1 1 5 LEU CG C 7.622 3.573 7.589 1.00 . A A . 5 LEU CG 1 1 20 6238 1 1 5 LEU H H 8.495 3.645 4.046 1.00 . A A . 5 LEU H 1 1 20 6239 1 1 5 LEU HA H 7.871 5.515 5.911 1.00 . A A . 5 LEU HA 1 1 20 6240 1 1 5 LEU HB2 H 8.718 2.827 5.929 1.00 . A A . 5 LEU HB2 1 1 20 6241 1 1 5 LEU HB3 H 9.695 3.674 7.127 1.00 . A A . 5 LEU HB3 1 1 20 6242 1 1 5 LEU HD11 H 6.203 2.120 8.258 1.00 . A A . 5 LEU HD11 1 1 20 6243 1 1 5 LEU HD12 H 7.699 1.436 7.621 1.00 . A A . 5 LEU HD12 1 1 20 6244 1 1 5 LEU HD13 H 6.495 2.104 6.519 1.00 . A A . 5 LEU HD13 1 1 20 6245 1 1 5 LEU HD21 H 8.467 2.885 9.430 1.00 . A A . 5 LEU HD21 1 1 20 6246 1 1 5 LEU HD22 H 7.335 4.227 9.606 1.00 . A A . 5 LEU HD22 1 1 20 6247 1 1 5 LEU HD23 H 8.956 4.516 8.970 1.00 . A A . 5 LEU HD23 1 1 20 6248 1 1 5 LEU HG H 6.876 4.325 7.367 1.00 . A A . 5 LEU HG 1 1 20 6249 1 1 5 LEU N N 8.724 4.566 4.289 1.00 . A A . 5 LEU N 1 1 20 6250 1 1 5 LEU O O 9.914 6.740 6.791 1.00 . A A . 5 LEU O 1 1 20 6251 1 1 6 PHE C C 12.881 6.739 4.260 1.00 . A A . 6 PHE C 1 1 20 6252 1 1 6 PHE CA C 12.348 6.195 5.582 1.00 . A A . 6 PHE CA 1 1 20 6253 1 1 6 PHE CB C 13.398 5.296 6.238 1.00 . A A . 6 PHE CB 1 1 20 6254 1 1 6 PHE CD1 C 15.601 6.302 6.897 1.00 . A A . 6 PHE CD1 1 1 20 6255 1 1 6 PHE CD2 C 13.793 6.418 8.448 1.00 . A A . 6 PHE CD2 1 1 20 6256 1 1 6 PHE CE1 C 16.416 6.968 7.792 1.00 . A A . 6 PHE CE1 1 1 20 6257 1 1 6 PHE CE2 C 14.604 7.085 9.346 1.00 . A A . 6 PHE CE2 1 1 20 6258 1 1 6 PHE CG C 14.282 6.020 7.213 1.00 . A A . 6 PHE CG 1 1 20 6259 1 1 6 PHE CZ C 15.917 7.359 9.019 1.00 . A A . 6 PHE CZ 1 1 20 6260 1 1 6 PHE H H 11.100 4.694 4.763 1.00 . A A . 6 PHE H 1 1 20 6261 1 1 6 PHE HA H 12.135 7.025 6.239 1.00 . A A . 6 PHE HA 1 1 20 6262 1 1 6 PHE HB2 H 12.899 4.501 6.771 1.00 . A A . 6 PHE HB2 1 1 20 6263 1 1 6 PHE HB3 H 14.027 4.871 5.471 1.00 . A A . 6 PHE HB3 1 1 20 6264 1 1 6 PHE HD1 H 15.992 5.996 5.936 1.00 . A A . 6 PHE HD1 1 1 20 6265 1 1 6 PHE HD2 H 12.767 6.204 8.706 1.00 . A A . 6 PHE HD2 1 1 20 6266 1 1 6 PHE HE1 H 17.443 7.181 7.532 1.00 . A A . 6 PHE HE1 1 1 20 6267 1 1 6 PHE HE2 H 14.212 7.390 10.305 1.00 . A A . 6 PHE HE2 1 1 20 6268 1 1 6 PHE HZ H 16.553 7.881 9.719 1.00 . A A . 6 PHE HZ 1 1 20 6269 1 1 6 PHE N N 11.107 5.458 5.378 1.00 . A A . 6 PHE N 1 1 20 6270 1 1 6 PHE O O 13.824 7.529 4.237 1.00 . A A . 6 PHE O 1 1 20 6271 1 1 7 ALA C C 12.280 8.202 1.592 1.00 . A A . 7 ALA C 1 1 20 6272 1 1 7 ALA CA C 12.683 6.752 1.835 1.00 . A A . 7 ALA CA 1 1 20 6273 1 1 7 ALA CB C 12.083 5.850 0.766 1.00 . A A . 7 ALA CB 1 1 20 6274 1 1 7 ALA H H 11.525 5.678 3.244 1.00 . A A . 7 ALA H 1 1 20 6275 1 1 7 ALA HA H 13.759 6.672 1.775 1.00 . A A . 7 ALA HA 1 1 20 6276 1 1 7 ALA HB1 H 12.837 5.617 0.028 1.00 . A A . 7 ALA HB1 1 1 20 6277 1 1 7 ALA HB2 H 11.732 4.936 1.223 1.00 . A A . 7 ALA HB2 1 1 20 6278 1 1 7 ALA HB3 H 11.257 6.356 0.291 1.00 . A A . 7 ALA HB3 1 1 20 6279 1 1 7 ALA N N 12.271 6.308 3.161 1.00 . A A . 7 ALA N 1 1 20 6280 1 1 7 ALA O O 12.927 8.917 0.826 1.00 . A A . 7 ALA O 1 1 20 6281 1 1 8 LYS C C 11.384 10.924 3.118 1.00 . A A . 8 LYS C 1 1 20 6282 1 1 8 LYS CA C 10.718 9.998 2.104 1.00 . A A . 8 LYS CA 1 1 20 6283 1 1 8 LYS CB C 9.199 10.038 2.281 1.00 . A A . 8 LYS CB 1 1 20 6284 1 1 8 LYS CD C 7.855 10.476 4.358 1.00 . A A . 8 LYS CD 1 1 20 6285 1 1 8 LYS CE C 6.716 9.782 5.089 1.00 . A A . 8 LYS CE 1 1 20 6286 1 1 8 LYS CG C 8.726 9.479 3.612 1.00 . A A . 8 LYS CG 1 1 20 6287 1 1 8 LYS H H 10.734 8.015 2.845 1.00 . A A . 8 LYS H 1 1 20 6288 1 1 8 LYS HA H 10.966 10.336 1.109 1.00 . A A . 8 LYS HA 1 1 20 6289 1 1 8 LYS HB2 H 8.867 11.063 2.207 1.00 . A A . 8 LYS HB2 1 1 20 6290 1 1 8 LYS HB3 H 8.741 9.463 1.490 1.00 . A A . 8 LYS HB3 1 1 20 6291 1 1 8 LYS HD2 H 8.462 11.002 5.079 1.00 . A A . 8 LYS HD2 1 1 20 6292 1 1 8 LYS HD3 H 7.442 11.180 3.650 1.00 . A A . 8 LYS HD3 1 1 20 6293 1 1 8 LYS HE2 H 5.813 9.894 4.508 1.00 . A A . 8 LYS HE2 1 1 20 6294 1 1 8 LYS HE3 H 6.954 8.733 5.187 1.00 . A A . 8 LYS HE3 1 1 20 6295 1 1 8 LYS HG2 H 8.154 8.581 3.432 1.00 . A A . 8 LYS HG2 1 1 20 6296 1 1 8 LYS HG3 H 9.589 9.243 4.219 1.00 . A A . 8 LYS HG3 1 1 20 6297 1 1 8 LYS HZ1 H 7.226 11.067 6.655 1.00 . A A . 8 LYS HZ1 1 1 20 6298 1 1 8 LYS HZ2 H 6.538 9.607 7.163 1.00 . A A . 8 LYS HZ2 1 1 20 6299 1 1 8 LYS HZ3 H 5.561 10.814 6.491 1.00 . A A . 8 LYS HZ3 1 1 20 6300 1 1 8 LYS N N 11.208 8.632 2.248 1.00 . A A . 8 LYS N 1 1 20 6301 1 1 8 LYS NZ N 6.494 10.358 6.444 1.00 . A A . 8 LYS NZ 1 1 20 6302 1 1 8 LYS O O 11.617 12.100 2.838 1.00 . A A . 8 LYS O 1 1 20 6303 1 1 9 ILE C C 13.796 11.422 5.023 1.00 . A A . 9 ILE C 1 1 20 6304 1 1 9 ILE CA C 12.328 11.163 5.347 1.00 . A A . 9 ILE CA 1 1 20 6305 1 1 9 ILE CB C 12.232 10.452 6.710 1.00 . A A . 9 ILE CB 1 1 20 6306 1 1 9 ILE CD1 C 14.601 9.928 7.479 1.00 . A A . 9 ILE CD1 1 1 20 6307 1 1 9 ILE CG1 C 13.336 9.400 6.840 1.00 . A A . 9 ILE CG1 1 1 20 6308 1 1 9 ILE CG2 C 10.861 9.813 6.878 1.00 . A A . 9 ILE CG2 1 1 20 6309 1 1 9 ILE H H 11.477 9.442 4.457 1.00 . A A . 9 ILE H 1 1 20 6310 1 1 9 ILE HA H 11.814 12.111 5.420 1.00 . A A . 9 ILE HA 1 1 20 6311 1 1 9 ILE HB H 12.356 11.192 7.486 1.00 . A A . 9 ILE HB 1 1 20 6312 1 1 9 ILE HD11 H 14.627 9.639 8.519 1.00 . A A . 9 ILE HD11 1 1 20 6313 1 1 9 ILE HD12 H 15.460 9.520 6.969 1.00 . A A . 9 ILE HD12 1 1 20 6314 1 1 9 ILE HD13 H 14.618 11.006 7.406 1.00 . A A . 9 ILE HD13 1 1 20 6315 1 1 9 ILE HG12 H 12.976 8.583 7.444 1.00 . A A . 9 ILE HG12 1 1 20 6316 1 1 9 ILE HG13 H 13.588 9.031 5.856 1.00 . A A . 9 ILE HG13 1 1 20 6317 1 1 9 ILE HG21 H 10.161 10.279 6.200 1.00 . A A . 9 ILE HG21 1 1 20 6318 1 1 9 ILE HG22 H 10.927 8.759 6.657 1.00 . A A . 9 ILE HG22 1 1 20 6319 1 1 9 ILE HG23 H 10.523 9.949 7.894 1.00 . A A . 9 ILE HG23 1 1 20 6320 1 1 9 ILE N N 11.687 10.385 4.294 1.00 . A A . 9 ILE N 1 1 20 6321 1 1 9 ILE O O 14.376 12.413 5.468 1.00 . A A . 9 ILE O 1 1 20 6322 1 1 10 THR C C 15.945 11.558 2.642 1.00 . A A . 10 THR C 1 1 20 6323 1 1 10 THR CA C 15.792 10.655 3.860 1.00 . A A . 10 THR CA 1 1 20 6324 1 1 10 THR CB C 16.420 9.283 3.550 1.00 . A A . 10 THR CB 1 1 20 6325 1 1 10 THR CG2 C 16.629 8.483 4.827 1.00 . A A . 10 THR CG2 1 1 20 6326 1 1 10 THR H H 13.876 9.756 3.921 1.00 . A A . 10 THR H 1 1 20 6327 1 1 10 THR HA H 16.326 11.093 4.691 1.00 . A A . 10 THR HA 1 1 20 6328 1 1 10 THR HB H 17.380 9.442 3.081 1.00 . A A . 10 THR HB 1 1 20 6329 1 1 10 THR HG1 H 16.121 8.050 2.041 1.00 . A A . 10 THR HG1 1 1 20 6330 1 1 10 THR HG21 H 17.298 9.020 5.483 1.00 . A A . 10 THR HG21 1 1 20 6331 1 1 10 THR HG22 H 17.057 7.522 4.584 1.00 . A A . 10 THR HG22 1 1 20 6332 1 1 10 THR HG23 H 15.680 8.340 5.321 1.00 . A A . 10 THR HG23 1 1 20 6333 1 1 10 THR N N 14.392 10.524 4.244 1.00 . A A . 10 THR N 1 1 20 6334 1 1 10 THR O O 15.391 11.283 1.578 1.00 . A A . 10 THR O 1 1 20 6335 1 1 10 THR OG1 O 15.577 8.550 2.654 1.00 . A A . 10 THR OG1 1 1 20 6336 1 1 11 LYS C C 18.419 13.696 1.399 1.00 . A A . 11 LYS C 1 1 20 6337 1 1 11 LYS CA C 16.931 13.582 1.716 1.00 . A A . 11 LYS CA 1 1 20 6338 1 1 11 LYS CB C 16.371 14.959 2.082 1.00 . A A . 11 LYS CB 1 1 20 6339 1 1 11 LYS CD C 15.771 14.950 4.521 1.00 . A A . 11 LYS CD 1 1 20 6340 1 1 11 LYS CE C 15.783 15.849 5.748 1.00 . A A . 11 LYS CE 1 1 20 6341 1 1 11 LYS CG C 16.763 15.425 3.473 1.00 . A A . 11 LYS CG 1 1 20 6342 1 1 11 LYS H H 17.118 12.804 3.676 1.00 . A A . 11 LYS H 1 1 20 6343 1 1 11 LYS HA H 16.416 13.214 0.843 1.00 . A A . 11 LYS HA 1 1 20 6344 1 1 11 LYS HB2 H 16.732 15.683 1.367 1.00 . A A . 11 LYS HB2 1 1 20 6345 1 1 11 LYS HB3 H 15.292 14.921 2.029 1.00 . A A . 11 LYS HB3 1 1 20 6346 1 1 11 LYS HD2 H 14.779 14.956 4.094 1.00 . A A . 11 LYS HD2 1 1 20 6347 1 1 11 LYS HD3 H 16.031 13.944 4.820 1.00 . A A . 11 LYS HD3 1 1 20 6348 1 1 11 LYS HE2 H 16.808 16.046 6.024 1.00 . A A . 11 LYS HE2 1 1 20 6349 1 1 11 LYS HE3 H 15.292 16.779 5.501 1.00 . A A . 11 LYS HE3 1 1 20 6350 1 1 11 LYS HG2 H 17.740 15.032 3.713 1.00 . A A . 11 LYS HG2 1 1 20 6351 1 1 11 LYS HG3 H 16.796 16.506 3.485 1.00 . A A . 11 LYS HG3 1 1 20 6352 1 1 11 LYS HZ1 H 14.052 15.269 6.762 1.00 . A A . 11 LYS HZ1 1 1 20 6353 1 1 11 LYS HZ2 H 15.322 15.722 7.781 1.00 . A A . 11 LYS HZ2 1 1 20 6354 1 1 11 LYS HZ3 H 15.363 14.226 6.993 1.00 . A A . 11 LYS HZ3 1 1 20 6355 1 1 11 LYS N N 16.702 12.638 2.804 1.00 . A A . 11 LYS N 1 1 20 6356 1 1 11 LYS NZ N 15.081 15.222 6.902 1.00 . A A . 11 LYS NZ 1 1 20 6357 1 1 11 LYS O O 18.854 14.643 0.744 1.00 . A A . 11 LYS O 1 1 20 6358 1 1 12 LYS C C 21.049 11.454 0.870 1.00 . A A . 12 LYS C 1 1 20 6359 1 1 12 LYS CA C 20.633 12.711 1.628 1.00 . A A . 12 LYS CA 1 1 20 6360 1 1 12 LYS CB C 21.390 12.792 2.956 1.00 . A A . 12 LYS CB 1 1 20 6361 1 1 12 LYS CD C 19.777 11.961 4.693 1.00 . A A . 12 LYS CD 1 1 20 6362 1 1 12 LYS CE C 19.758 11.974 6.214 1.00 . A A . 12 LYS CE 1 1 20 6363 1 1 12 LYS CG C 20.510 13.170 4.135 1.00 . A A . 12 LYS CG 1 1 20 6364 1 1 12 LYS H H 18.789 11.993 2.380 1.00 . A A . 12 LYS H 1 1 20 6365 1 1 12 LYS HA H 20.878 13.575 1.030 1.00 . A A . 12 LYS HA 1 1 20 6366 1 1 12 LYS HB2 H 21.838 11.831 3.161 1.00 . A A . 12 LYS HB2 1 1 20 6367 1 1 12 LYS HB3 H 22.172 13.532 2.866 1.00 . A A . 12 LYS HB3 1 1 20 6368 1 1 12 LYS HD2 H 18.759 11.970 4.332 1.00 . A A . 12 LYS HD2 1 1 20 6369 1 1 12 LYS HD3 H 20.273 11.062 4.355 1.00 . A A . 12 LYS HD3 1 1 20 6370 1 1 12 LYS HE2 H 19.878 12.991 6.554 1.00 . A A . 12 LYS HE2 1 1 20 6371 1 1 12 LYS HE3 H 18.807 11.592 6.552 1.00 . A A . 12 LYS HE3 1 1 20 6372 1 1 12 LYS HG2 H 21.128 13.593 4.913 1.00 . A A . 12 LYS HG2 1 1 20 6373 1 1 12 LYS HG3 H 19.784 13.902 3.811 1.00 . A A . 12 LYS HG3 1 1 20 6374 1 1 12 LYS HZ1 H 20.447 10.307 7.267 1.00 . A A . 12 LYS HZ1 1 1 20 6375 1 1 12 LYS HZ2 H 21.395 11.691 7.481 1.00 . A A . 12 LYS HZ2 1 1 20 6376 1 1 12 LYS HZ3 H 21.489 10.818 6.035 1.00 . A A . 12 LYS HZ3 1 1 20 6377 1 1 12 LYS N N 19.194 12.723 1.864 1.00 . A A . 12 LYS N 1 1 20 6378 1 1 12 LYS NZ N 20.849 11.139 6.789 1.00 . A A . 12 LYS NZ 1 1 20 6379 1 1 12 LYS O O 21.390 11.515 -0.311 1.00 . A A . 12 LYS O 1 1 20 6380 1 1 13 ASN C C 20.582 8.792 -0.321 1.00 . A A . 13 ASN C 1 1 20 6381 1 1 13 ASN CA C 21.392 9.046 0.947 1.00 . A A . 13 ASN CA 1 1 20 6382 1 1 13 ASN CB C 21.181 7.899 1.938 1.00 . A A . 13 ASN CB 1 1 20 6383 1 1 13 ASN CG C 22.489 7.352 2.476 1.00 . A A . 13 ASN CG 1 1 20 6384 1 1 13 ASN H H 20.738 10.332 2.495 1.00 . A A . 13 ASN H 1 1 20 6385 1 1 13 ASN HA H 22.438 9.097 0.687 1.00 . A A . 13 ASN HA 1 1 20 6386 1 1 13 ASN HB2 H 20.592 8.256 2.771 1.00 . A A . 13 ASN HB2 1 1 20 6387 1 1 13 ASN HB3 H 20.651 7.098 1.445 1.00 . A A . 13 ASN HB3 1 1 20 6388 1 1 13 ASN HD21 H 22.444 8.654 3.978 1.00 . A A . 13 ASN HD21 1 1 20 6389 1 1 13 ASN HD22 H 23.804 7.588 3.948 1.00 . A A . 13 ASN HD22 1 1 20 6390 1 1 13 ASN N N 21.018 10.317 1.556 1.00 . A A . 13 ASN N 1 1 20 6391 1 1 13 ASN ND2 N 22.959 7.922 3.579 1.00 . A A . 13 ASN ND2 1 1 20 6392 1 1 13 ASN O O 21.016 8.060 -1.211 1.00 . A A . 13 ASN O 1 1 20 6393 1 1 13 ASN OD1 O 23.068 6.427 1.906 1.00 . A A . 13 ASN OD1 1 1 20 6394 1 1 14 MET C C 19.235 9.711 -2.829 1.00 . A A . 14 MET C 1 1 20 6395 1 1 14 MET CA C 18.534 9.244 -1.557 1.00 . A A . 14 MET CA 1 1 20 6396 1 1 14 MET CB C 17.236 10.027 -1.358 1.00 . A A . 14 MET CB 1 1 20 6397 1 1 14 MET CE C 13.709 8.639 -3.108 1.00 . A A . 14 MET CE 1 1 20 6398 1 1 14 MET CG C 16.165 9.699 -2.386 1.00 . A A . 14 MET CG 1 1 20 6399 1 1 14 MET H H 19.112 9.973 0.345 1.00 . A A . 14 MET H 1 1 20 6400 1 1 14 MET HA H 18.300 8.194 -1.654 1.00 . A A . 14 MET HA 1 1 20 6401 1 1 14 MET HB2 H 16.842 9.807 -0.377 1.00 . A A . 14 MET HB2 1 1 20 6402 1 1 14 MET HB3 H 17.453 11.083 -1.421 1.00 . A A . 14 MET HB3 1 1 20 6403 1 1 14 MET HE1 H 13.778 9.523 -3.725 1.00 . A A . 14 MET HE1 1 1 20 6404 1 1 14 MET HE2 H 14.030 7.778 -3.676 1.00 . A A . 14 MET HE2 1 1 20 6405 1 1 14 MET HE3 H 12.685 8.501 -2.791 1.00 . A A . 14 MET HE3 1 1 20 6406 1 1 14 MET HG2 H 15.813 10.620 -2.827 1.00 . A A . 14 MET HG2 1 1 20 6407 1 1 14 MET HG3 H 16.601 9.079 -3.154 1.00 . A A . 14 MET HG3 1 1 20 6408 1 1 14 MET N N 19.404 9.402 -0.397 1.00 . A A . 14 MET N 1 1 20 6409 1 1 14 MET O O 19.313 8.974 -3.812 1.00 . A A . 14 MET O 1 1 20 6410 1 1 14 MET SD S 14.757 8.829 -1.669 1.00 . A A . 14 MET SD 1 1 20 6411 1 1 15 ALA C C 21.837 10.915 -4.091 1.00 . A A . 15 ALA C 1 1 20 6412 1 1 15 ALA CA C 20.437 11.503 -3.953 1.00 . A A . 15 ALA CA 1 1 20 6413 1 1 15 ALA CB C 20.508 13.018 -3.836 1.00 . A A . 15 ALA CB 1 1 20 6414 1 1 15 ALA H H 19.648 11.478 -1.990 1.00 . A A . 15 ALA H 1 1 20 6415 1 1 15 ALA HA H 19.867 11.261 -4.839 1.00 . A A . 15 ALA HA 1 1 20 6416 1 1 15 ALA HB1 H 21.252 13.397 -4.522 1.00 . A A . 15 ALA HB1 1 1 20 6417 1 1 15 ALA HB2 H 19.545 13.443 -4.079 1.00 . A A . 15 ALA HB2 1 1 20 6418 1 1 15 ALA HB3 H 20.777 13.289 -2.826 1.00 . A A . 15 ALA HB3 1 1 20 6419 1 1 15 ALA N N 19.742 10.939 -2.803 1.00 . A A . 15 ALA N 1 1 20 6420 1 1 15 ALA O O 22.582 11.268 -5.006 1.00 . A A . 15 ALA O 1 1 20 6421 1 1 16 HIS C C 23.403 7.947 -3.708 1.00 . A A . 16 HIS C 1 1 20 6422 1 1 16 HIS CA C 23.503 9.381 -3.196 1.00 . A A . 16 HIS CA 1 1 20 6423 1 1 16 HIS CB C 24.120 9.394 -1.797 1.00 . A A . 16 HIS CB 1 1 20 6424 1 1 16 HIS CD2 C 25.479 11.597 -1.637 1.00 . A A . 16 HIS CD2 1 1 20 6425 1 1 16 HIS CE1 C 27.489 10.727 -1.538 1.00 . A A . 16 HIS CE1 1 1 20 6426 1 1 16 HIS CG C 25.343 10.251 -1.690 1.00 . A A . 16 HIS CG 1 1 20 6427 1 1 16 HIS H H 21.553 9.778 -2.471 1.00 . A A . 16 HIS H 1 1 20 6428 1 1 16 HIS HA H 24.135 9.945 -3.864 1.00 . A A . 16 HIS HA 1 1 20 6429 1 1 16 HIS HB2 H 23.391 9.767 -1.092 1.00 . A A . 16 HIS HB2 1 1 20 6430 1 1 16 HIS HB3 H 24.396 8.386 -1.523 1.00 . A A . 16 HIS HB3 1 1 20 6431 1 1 16 HIS HD1 H 26.855 8.785 -1.643 1.00 . A A . 16 HIS HD1 1 1 20 6432 1 1 16 HIS HD2 H 24.680 12.325 -1.663 1.00 . A A . 16 HIS HD2 1 1 20 6433 1 1 16 HIS HE1 H 28.562 10.624 -1.473 1.00 . A A . 16 HIS HE1 1 1 20 6434 1 1 16 HIS N N 22.190 10.018 -3.176 1.00 . A A . 16 HIS N 1 1 20 6435 1 1 16 HIS ND1 N 26.621 9.736 -1.627 1.00 . A A . 16 HIS ND1 1 1 20 6436 1 1 16 HIS NE2 N 26.822 11.867 -1.543 1.00 . A A . 16 HIS NE2 1 1 20 6437 1 1 16 HIS O O 24.403 7.350 -4.106 1.00 . A A . 16 HIS O 1 1 20 6438 1 1 17 ILE C C 22.535 5.830 -5.554 1.00 . A A . 17 ILE C 1 1 20 6439 1 1 17 ILE CA C 21.962 6.039 -4.156 1.00 . A A . 17 ILE CA 1 1 20 6440 1 1 17 ILE CB C 20.462 5.694 -4.171 1.00 . A A . 17 ILE CB 1 1 20 6441 1 1 17 ILE CD1 C 18.243 6.567 -5.061 1.00 . A A . 17 ILE CD1 1 1 20 6442 1 1 17 ILE CG1 C 19.741 6.501 -5.254 1.00 . A A . 17 ILE CG1 1 1 20 6443 1 1 17 ILE CG2 C 19.844 5.959 -2.807 1.00 . A A . 17 ILE CG2 1 1 20 6444 1 1 17 ILE H H 21.434 7.929 -3.364 1.00 . A A . 17 ILE H 1 1 20 6445 1 1 17 ILE HA H 22.459 5.367 -3.471 1.00 . A A . 17 ILE HA 1 1 20 6446 1 1 17 ILE HB H 20.359 4.642 -4.388 1.00 . A A . 17 ILE HB 1 1 20 6447 1 1 17 ILE HD11 H 17.850 5.569 -4.938 1.00 . A A . 17 ILE HD11 1 1 20 6448 1 1 17 ILE HD12 H 18.017 7.155 -4.184 1.00 . A A . 17 ILE HD12 1 1 20 6449 1 1 17 ILE HD13 H 17.789 7.026 -5.928 1.00 . A A . 17 ILE HD13 1 1 20 6450 1 1 17 ILE HG12 H 20.120 7.511 -5.253 1.00 . A A . 17 ILE HG12 1 1 20 6451 1 1 17 ILE HG13 H 19.934 6.049 -6.216 1.00 . A A . 17 ILE HG13 1 1 20 6452 1 1 17 ILE HG21 H 20.534 5.656 -2.034 1.00 . A A . 17 ILE HG21 1 1 20 6453 1 1 17 ILE HG22 H 19.633 7.013 -2.706 1.00 . A A . 17 ILE HG22 1 1 20 6454 1 1 17 ILE HG23 H 18.927 5.397 -2.711 1.00 . A A . 17 ILE HG23 1 1 20 6455 1 1 17 ILE N N 22.192 7.402 -3.693 1.00 . A A . 17 ILE N 1 1 20 6456 1 1 17 ILE O O 23.108 4.781 -5.851 1.00 . A A . 17 ILE O 1 1 20 6457 1 1 18 ARG C C 24.262 7.396 -7.882 1.00 . A A . 18 ARG C 1 1 20 6458 1 1 18 ARG CA C 22.878 6.762 -7.776 1.00 . A A . 18 ARG CA 1 1 20 6459 1 1 18 ARG CB C 21.911 7.459 -8.735 1.00 . A A . 18 ARG CB 1 1 20 6460 1 1 18 ARG CD C 20.557 5.407 -9.258 1.00 . A A . 18 ARG CD 1 1 20 6461 1 1 18 ARG CG C 21.380 6.551 -9.831 1.00 . A A . 18 ARG CG 1 1 20 6462 1 1 18 ARG CZ C 21.261 3.542 -10.697 1.00 . A A . 18 ARG CZ 1 1 20 6463 1 1 18 ARG H H 21.911 7.645 -6.113 1.00 . A A . 18 ARG H 1 1 20 6464 1 1 18 ARG HA H 22.951 5.720 -8.047 1.00 . A A . 18 ARG HA 1 1 20 6465 1 1 18 ARG HB2 H 21.070 7.834 -8.170 1.00 . A A . 18 ARG HB2 1 1 20 6466 1 1 18 ARG HB3 H 22.420 8.289 -9.200 1.00 . A A . 18 ARG HB3 1 1 20 6467 1 1 18 ARG HD2 H 20.453 5.555 -8.194 1.00 . A A . 18 ARG HD2 1 1 20 6468 1 1 18 ARG HD3 H 19.581 5.418 -9.720 1.00 . A A . 18 ARG HD3 1 1 20 6469 1 1 18 ARG HE H 21.560 3.638 -8.727 1.00 . A A . 18 ARG HE 1 1 20 6470 1 1 18 ARG HG2 H 20.757 7.130 -10.496 1.00 . A A . 18 ARG HG2 1 1 20 6471 1 1 18 ARG HG3 H 22.214 6.142 -10.382 1.00 . A A . 18 ARG HG3 1 1 20 6472 1 1 18 ARG HH11 H 20.319 5.048 -11.658 1.00 . A A . 18 ARG HH11 1 1 20 6473 1 1 18 ARG HH12 H 20.821 3.728 -12.661 1.00 . A A . 18 ARG HH12 1 1 20 6474 1 1 18 ARG HH21 H 22.226 1.893 -10.037 1.00 . A A . 18 ARG HH21 1 1 20 6475 1 1 18 ARG HH22 H 21.905 1.933 -11.737 1.00 . A A . 18 ARG HH22 1 1 20 6476 1 1 18 ARG N N 22.377 6.835 -6.409 1.00 . A A . 18 ARG N 1 1 20 6477 1 1 18 ARG NE N 21.182 4.109 -9.498 1.00 . A A . 18 ARG NE 1 1 20 6478 1 1 18 ARG NH1 N 20.758 4.156 -11.759 1.00 . A A . 18 ARG NH1 1 1 20 6479 1 1 18 ARG NH2 N 21.845 2.359 -10.835 1.00 . A A . 18 ARG NH2 1 1 20 6480 1 1 18 ARG O O 25.131 7.158 -7.043 1.00 . A A . 18 ARG O 1 1 stop_ save_
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