NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | program | type | subtype | item_count |
625614 | 5z5x | cing | 4-filtered-FRED | STAR | entry | full | 119 |
data_FRED_restraints_with_modified_coordinates_PDB_code_5z5x # This FRED archive file contains, for PDB entry <5z5x>: # # - 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_5z5x _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 5z5x _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 2255.66 loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 . 1 $Peptide_from_Prothrombin A . 1 1 stop_ save_ save_Peptide_from_Prothrombin _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Peptide from Prothrombin" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code HVFRLKKWIQKVIDQFGE _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 HIS . 1 1 2 VAL . 1 1 3 PHE . 1 1 4 ARG . 1 1 5 LEU . 1 1 6 LYS . 1 1 7 LYS . 1 1 8 TRP . 1 1 9 ILE . 1 1 10 GLN . 1 1 11 LYS . 1 1 12 VAL . 1 1 13 ILE . 1 1 14 ASP . 1 1 15 GLN . 1 1 16 PHE . 1 1 17 GLY . 1 1 18 GLU . 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 HIS 1 1 1 1 VAL 2 2 1 1 PHE 3 3 1 1 ARG 4 4 1 1 LEU 5 5 1 1 LYS 6 6 1 1 LYS 7 7 1 1 TRP 8 8 1 1 ILE 9 9 1 1 GLN 10 10 1 1 LYS 11 11 1 1 VAL 12 12 1 1 ILE 13 13 1 1 ASP 14 14 1 1 GLN 15 15 1 1 PHE 16 16 1 1 GLY 17 17 1 1 GLU 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 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 2 VAL H . 2 VAL H 1 1 1 1 2 1 1 3 PHE H . 3 PHE H 1 1 2 1 1 1 1 2 VAL HA . 2 VAL HA 1 1 2 1 2 1 1 3 PHE H . 3 PHE H 1 1 3 1 1 1 1 2 VAL HB . 2 VAL HB 1 1 3 1 2 1 1 3 PHE H . 3 PHE H 1 1 4 1 1 1 1 2 VAL QG . 2 VAL QQG 1 1 4 1 2 1 1 3 PHE H . 3 PHE H 1 1 5 1 1 1 1 3 PHE H . 3 PHE H 1 1 5 1 2 1 1 3 PHE QB . 3 PHE QB 1 1 6 1 1 1 1 3 PHE H . 3 PHE H 1 1 6 1 2 1 1 4 ARG H . 4 ARG H 1 1 7 1 1 1 1 3 PHE H . 3 PHE H 1 1 7 1 2 1 1 5 LEU H . 5 LEU H 1 1 8 1 1 1 1 3 PHE HA . 3 PHE HA 1 1 8 1 2 1 1 4 ARG H . 4 ARG H 1 1 9 1 1 1 1 3 PHE QB . 3 PHE QB 1 1 9 1 2 1 1 4 ARG H . 4 ARG H 1 1 10 1 1 1 1 3 PHE QB . 3 PHE QB 1 1 10 1 2 1 1 5 LEU H . 5 LEU H 1 1 11 1 1 1 1 4 ARG H . 4 ARG H 1 1 11 1 2 1 1 4 ARG QD . 4 ARG QD 1 1 12 1 1 1 1 4 ARG H . 4 ARG H 1 1 12 1 2 1 1 5 LEU H . 5 LEU H 1 1 13 1 1 1 1 4 ARG QB . 4 ARG QB 1 1 13 1 2 1 1 5 LEU H . 5 LEU H 1 1 14 1 1 1 1 4 ARG QD . 4 ARG QD 1 1 14 1 2 1 1 5 LEU H . 5 LEU H 1 1 15 1 1 1 1 5 LEU H . 5 LEU H 1 1 15 1 2 1 1 5 LEU QB . 5 LEU QB 1 1 16 1 1 1 1 5 LEU H . 5 LEU H 1 1 16 1 2 1 1 5 LEU QD . 5 LEU QQD 1 1 17 1 1 1 1 5 LEU HA . 5 LEU HA 1 1 17 1 2 1 1 6 LYS H . 6 LYS H 1 1 18 1 1 1 1 5 LEU QB . 5 LEU QB 1 1 18 1 2 1 1 6 LYS H . 6 LYS H 1 1 19 1 1 1 1 5 LEU QB . 5 LEU QB 1 1 19 1 2 1 1 9 ILE H . 9 ILE H 1 1 20 1 1 1 1 5 LEU QD . 5 LEU QQD 1 1 20 1 2 1 1 6 LYS H . 6 LYS H 1 1 21 1 1 1 1 5 LEU QD . 5 LEU QQD 1 1 21 1 2 1 1 9 ILE H . 9 ILE H 1 1 22 1 1 1 1 6 LYS H . 6 LYS H 1 1 22 1 2 1 1 6 LYS QD . 6 LYS QD 1 1 23 1 1 1 1 6 LYS H . 6 LYS H 1 1 23 1 2 1 1 6 LYS QE . 6 LYS QE 1 1 24 1 1 1 1 6 LYS H . 6 LYS H 1 1 24 1 2 1 1 6 LYS QG . 6 LYS QG 1 1 25 1 1 1 1 6 LYS QD . 6 LYS QD 1 1 25 1 2 1 1 10 GLN H . 10 GLN H 1 1 26 1 1 1 1 6 LYS QE . 6 LYS QE 1 1 26 1 2 1 1 10 GLN H . 10 GLN H 1 1 27 1 1 1 1 7 LYS H . 7 LYS H 1 1 27 1 2 1 1 7 LYS QE . 7 LYS QE 1 1 28 1 1 1 1 7 LYS H . 7 LYS H 1 1 28 1 2 1 1 7 LYS QG . 7 LYS QG 1 1 29 1 1 1 1 7 LYS HA . 7 LYS HA 1 1 29 1 2 1 1 7 LYS QZ . 7 LYS QZ 1 1 30 1 1 1 1 7 LYS HA . 7 LYS HA 1 1 30 1 2 1 1 9 ILE H . 9 ILE H 1 1 31 1 1 1 1 7 LYS QB . 7 LYS QB 1 1 31 1 2 1 1 7 LYS QZ . 7 LYS QZ 1 1 32 1 1 1 1 7 LYS QB . 7 LYS QB 1 1 32 1 2 1 1 9 ILE H . 9 ILE H 1 1 33 1 1 1 1 8 TRP H . 8 TRP H 1 1 33 1 2 1 1 8 TRP QB . 8 TRP QB 1 1 34 1 1 1 1 8 TRP H . 8 TRP H 1 1 34 1 2 1 1 9 ILE H . 9 ILE H 1 1 35 1 1 1 1 8 TRP HA . 8 TRP HA 1 1 35 1 2 1 1 8 TRP HD1 . 8 TRP HD1 1 1 36 1 1 1 1 8 TRP HA . 8 TRP HA 1 1 36 1 2 1 1 8 TRP HE1 . 8 TRP HE1 1 1 37 1 1 1 1 8 TRP HA . 8 TRP HA 1 1 37 1 2 1 1 9 ILE H . 9 ILE H 1 1 38 1 1 1 1 8 TRP QB . 8 TRP QB 1 1 38 1 2 1 1 9 ILE H . 9 ILE H 1 1 39 1 1 1 1 9 ILE H . 9 ILE H 1 1 39 1 2 1 1 9 ILE HB . 9 ILE HB 1 1 40 1 1 1 1 9 ILE H . 9 ILE H 1 1 40 1 2 1 1 9 ILE MD . 9 ILE QD1 1 1 41 1 1 1 1 9 ILE H . 9 ILE H 1 1 41 1 2 1 1 9 ILE QG . 9 ILE QG1 1 1 42 1 1 1 1 9 ILE H . 9 ILE H 1 1 42 1 2 1 1 9 ILE MG . 9 ILE QG2 1 1 43 1 1 1 1 9 ILE H . 9 ILE H 1 1 43 1 2 1 1 10 GLN H . 10 GLN H 1 1 44 1 1 1 1 9 ILE H . 9 ILE H 1 1 44 1 2 1 1 11 LYS H . 11 LYS H 1 1 45 1 1 1 1 9 ILE HA . 9 ILE HA 1 1 45 1 2 1 1 10 GLN H . 10 GLN H 1 1 46 1 1 1 1 9 ILE HA . 9 ILE HA 1 1 46 1 2 1 1 12 VAL H . 12 VAL H 1 1 47 1 1 1 1 9 ILE HA . 9 ILE HA 1 1 47 1 2 1 1 12 VAL HB . 12 VAL QB 1 1 48 1 1 1 1 9 ILE HB . 9 ILE HB 1 1 48 1 2 1 1 11 LYS H . 11 LYS H 1 1 49 1 1 1 1 9 ILE HB . 9 ILE HB 1 1 49 1 2 1 1 13 ILE H . 13 ILE H 1 1 50 1 1 1 1 9 ILE MD . 9 ILE QD1 1 1 50 1 2 1 1 10 GLN H . 10 GLN H 1 1 51 1 1 1 1 9 ILE MD . 9 ILE QD1 1 1 51 1 2 1 1 12 VAL H . 12 VAL H 1 1 52 1 1 1 1 9 ILE MD . 9 ILE QD1 1 1 52 1 2 1 1 13 ILE H . 13 ILE H 1 1 53 1 1 1 1 9 ILE QG . 9 ILE QG1 1 1 53 1 2 1 1 10 GLN H . 10 GLN H 1 1 54 1 1 1 1 9 ILE MG . 9 ILE QG2 1 1 54 1 2 1 1 10 GLN H . 10 GLN H 1 1 55 1 1 1 1 9 ILE MG . 9 ILE QG2 1 1 55 1 2 1 1 12 VAL H . 12 VAL H 1 1 56 1 1 1 1 9 ILE MG . 9 ILE QG2 1 1 56 1 2 1 1 13 ILE H . 13 ILE H 1 1 57 1 1 1 1 10 GLN H . 10 GLN H 1 1 57 1 2 1 1 10 GLN QB . 10 GLN QB 1 1 58 1 1 1 1 10 GLN H . 10 GLN H 1 1 58 1 2 1 1 10 GLN QG . 10 GLN QG 1 1 59 1 1 1 1 10 GLN H . 10 GLN H 1 1 59 1 2 1 1 11 LYS H . 11 LYS H 1 1 60 1 1 1 1 10 GLN H . 10 GLN H 1 1 60 1 2 1 1 12 VAL H . 12 VAL H 1 1 61 1 1 1 1 10 GLN HA . 10 GLN HA 1 1 61 1 2 1 1 13 ILE HB . 13 ILE QB 1 1 62 1 1 1 1 10 GLN HA . 10 GLN HA 1 1 62 1 2 1 1 14 ASP H . 14 ASP H 1 1 63 1 1 1 1 10 GLN QB . 10 GLN QB 1 1 63 1 2 1 1 14 ASP H . 14 ASP H 1 1 64 1 1 1 1 10 GLN QG . 10 GLN QG 1 1 64 1 2 1 1 11 LYS H . 11 LYS H 1 1 65 1 1 1 1 10 GLN QG . 10 GLN QG 1 1 65 1 2 1 1 14 ASP H . 14 ASP H 1 1 66 1 1 1 1 11 LYS H . 11 LYS H 1 1 66 1 2 1 1 11 LYS QB . 11 LYS QB 1 1 67 1 1 1 1 11 LYS H . 11 LYS H 1 1 67 1 2 1 1 13 ILE H . 13 ILE H 1 1 68 1 1 1 1 11 LYS HA . 11 LYS HA 1 1 68 1 2 1 1 14 ASP QB . 14 ASP QB 1 1 69 1 1 1 1 11 LYS QB . 11 LYS QB 1 1 69 1 2 1 1 14 ASP H . 14 ASP H 1 1 70 1 1 1 1 11 LYS QD . 11 LYS QD 1 1 70 1 2 1 1 13 ILE H . 13 ILE H 1 1 71 1 1 1 1 12 VAL H . 12 VAL H 1 1 71 1 2 1 1 12 VAL HB . 12 VAL HB 1 1 72 1 1 1 1 12 VAL H . 12 VAL H 1 1 72 1 2 1 1 13 ILE H . 13 ILE H 1 1 73 1 1 1 1 12 VAL H . 12 VAL H 1 1 73 1 2 1 1 14 ASP H . 14 ASP H 1 1 74 1 1 1 1 12 VAL HA . 12 VAL HA 1 1 74 1 2 1 1 13 ILE H . 13 ILE H 1 1 75 1 1 1 1 12 VAL HA . 12 VAL HA 1 1 75 1 2 1 1 14 ASP H . 14 ASP H 1 1 76 1 1 1 1 12 VAL HA . 12 VAL HA 1 1 76 1 2 1 1 15 GLN H . 15 GLN H 1 1 77 1 1 1 1 12 VAL HA . 12 VAL HA 1 1 77 1 2 1 1 15 GLN QB . 15 GLN QB 1 1 78 1 1 1 1 12 VAL HA . 12 VAL HA 1 1 78 1 2 1 1 16 PHE H . 16 PHE H 1 1 79 1 1 1 1 12 VAL HB . 12 VAL HB 1 1 79 1 2 1 1 14 ASP H . 14 ASP H 1 1 80 1 1 1 1 12 VAL MG1 . 12 VAL QG1 1 1 80 1 2 1 1 14 ASP H . 14 ASP H 1 1 81 1 1 1 1 12 VAL MG1 . 12 VAL QG1 1 1 81 1 2 1 1 15 GLN H . 15 GLN H 1 1 82 1 1 1 1 13 ILE H . 13 ILE H 1 1 82 1 2 1 1 13 ILE HB . 13 ILE HB 1 1 83 1 1 1 1 13 ILE H . 13 ILE H 1 1 83 1 2 1 1 13 ILE QG . 13 ILE QG1 1 1 84 1 1 1 1 13 ILE H . 13 ILE H 1 1 84 1 2 1 1 13 ILE MG . 13 ILE QG2 1 1 85 1 1 1 1 13 ILE H . 13 ILE H 1 1 85 1 2 1 1 14 ASP H . 14 ASP H 1 1 86 1 1 1 1 13 ILE H . 13 ILE H 1 1 86 1 2 1 1 15 GLN H . 15 GLN H 1 1 87 1 1 1 1 13 ILE HA . 13 ILE HA 1 1 87 1 2 1 1 14 ASP H . 14 ASP H 1 1 88 1 1 1 1 13 ILE HA . 13 ILE HA 1 1 88 1 2 1 1 16 PHE H . 16 PHE H 1 1 89 1 1 1 1 13 ILE HA . 13 ILE HA 1 1 89 1 2 1 1 16 PHE QB . 16 PHE QB 1 1 90 1 1 1 1 13 ILE HB . 13 ILE HB 1 1 90 1 2 1 1 14 ASP H . 14 ASP H 1 1 91 1 1 1 1 13 ILE HB . 13 ILE HB 1 1 91 1 2 1 1 16 PHE H . 16 PHE H 1 1 92 1 1 1 1 13 ILE QG . 13 ILE QG1 1 1 92 1 2 1 1 14 ASP H . 14 ASP H 1 1 93 1 1 1 1 13 ILE QG . 13 ILE QG1 1 1 93 1 2 1 1 16 PHE H . 16 PHE H 1 1 94 1 1 1 1 13 ILE MG . 13 ILE QG2 1 1 94 1 2 1 1 14 ASP H . 14 ASP H 1 1 95 1 1 1 1 13 ILE MG . 13 ILE QG2 1 1 95 1 2 1 1 15 GLN H . 15 GLN H 1 1 96 1 1 1 1 13 ILE MG . 13 ILE QG2 1 1 96 1 2 1 1 16 PHE H . 16 PHE H 1 1 97 1 1 1 1 14 ASP H . 14 ASP H 1 1 97 1 2 1 1 14 ASP QB . 14 ASP QB 1 1 98 1 1 1 1 14 ASP H . 14 ASP H 1 1 98 1 2 1 1 15 GLN H . 15 GLN H 1 1 99 1 1 1 1 14 ASP H . 14 ASP H 1 1 99 1 2 1 1 16 PHE H . 16 PHE H 1 1 100 1 1 1 1 14 ASP HA . 14 ASP HA 1 1 100 1 2 1 1 15 GLN H . 15 GLN H 1 1 101 1 1 1 1 14 ASP HA . 14 ASP HA 1 1 101 1 2 1 1 16 PHE H . 16 PHE H 1 1 102 1 1 1 1 14 ASP QB . 14 ASP QB 1 1 102 1 2 1 1 15 GLN H . 15 GLN H 1 1 103 1 1 1 1 14 ASP QB . 14 ASP QB 1 1 103 1 2 1 1 16 PHE H . 16 PHE H 1 1 104 1 1 1 1 15 GLN H . 15 GLN H 1 1 104 1 2 1 1 15 GLN QB . 15 GLN QB 1 1 105 1 1 1 1 15 GLN H . 15 GLN H 1 1 105 1 2 1 1 15 GLN QG . 15 GLN QG 1 1 106 1 1 1 1 15 GLN H . 15 GLN H 1 1 106 1 2 1 1 16 PHE H . 16 PHE H 1 1 107 1 1 1 1 15 GLN HA . 15 GLN HA 1 1 107 1 2 1 1 16 PHE H . 16 PHE H 1 1 108 1 1 1 1 15 GLN QB . 15 GLN QB 1 1 108 1 2 1 1 16 PHE H . 16 PHE H 1 1 109 1 1 1 1 15 GLN QG . 15 GLN QG 1 1 109 1 2 1 1 16 PHE H . 16 PHE H 1 1 110 1 1 1 1 16 PHE H . 16 PHE H 1 1 110 1 2 1 1 16 PHE QB . 16 PHE QB 1 1 111 1 1 1 1 16 PHE H . 16 PHE H 1 1 111 1 2 1 1 17 GLY H . 17 GLY H 1 1 112 1 1 1 1 16 PHE H . 16 PHE H 1 1 112 1 2 1 1 17 GLY QA . 17 GLY QA 1 1 113 1 1 1 1 16 PHE HA . 16 PHE HA 1 1 113 1 2 1 1 16 PHE HD1 . 16 PHE HD1 1 1 114 1 1 1 1 16 PHE HA . 16 PHE HA 1 1 114 1 2 1 1 17 GLY H . 17 GLY H 1 1 115 1 1 1 1 16 PHE QB . 16 PHE QB 1 1 115 1 2 1 1 16 PHE HE1 . 16 PHE HE1 1 1 116 1 1 1 1 16 PHE QB . 16 PHE QB 1 1 116 1 2 1 1 17 GLY H . 17 GLY H 1 1 117 1 1 1 1 17 GLY H . 17 GLY H 1 1 117 1 2 1 1 18 GLU H . 18 GLU H 1 1 118 1 1 1 1 17 GLY QA . 17 GLY QA 1 1 118 1 2 1 1 18 GLU H . 18 GLU H 1 1 119 1 1 1 1 18 GLU H . 18 GLU H 1 1 119 1 2 1 1 18 GLU QG . 18 GLU QG 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 . . . . . . . 3.9 1 1 2 1 . . . . . . . 3.8 1 1 3 1 . . . . . . . 4.3 1 1 4 1 . . . . . . . 4.5 1 1 5 1 . . . . . . . 3.6 1 1 6 1 . . . . . . . 3.9 1 1 7 1 . . . . . . . 4.5 1 1 8 1 . . . . . . . 3.8 1 1 9 1 . . . . . . . 4.5 1 1 10 1 . . . . . . . 4.9 1 1 11 1 . . . . . . . 4.5 1 1 12 1 . . . . . . . 3.9 1 1 13 1 . . . . . . . 4.4 1 1 14 1 . . . . . . . 4.95 1 1 15 1 . . . . . . . 3.9 1 1 16 1 . . . . . . . 4.3 1 1 17 1 . . . . . . . 4.0 1 1 18 1 . . . . . . . 3.95 1 1 19 1 . . . . . . . 4.8 1 1 20 1 . . . . . . . 4.8 1 1 21 1 . . . . . . . 4.8 1 1 22 1 . . . . . . . 3.7 1 1 23 1 . . . . . . . 4.1 1 1 24 1 . . . . . . . 3.7 1 1 25 1 . . . . . . . 5.3 1 1 26 1 . . . . . . . 4.9 1 1 27 1 . . . . . . . 4.8 1 1 28 1 . . . . . . . 4.2 1 1 29 1 . . . . . . . 3.85 1 1 30 1 . . . . . . . 4.6 1 1 31 1 . . . . . . . 4.9 1 1 32 1 . . . . . . . 4.7 1 1 33 1 . . . . . . . 3.8 1 1 34 1 . . . . . . . 3.9 1 1 35 1 . . . . . . . 4.3 1 1 36 1 . . . . . . . 5.38 1 1 37 1 . . . . . . . 3.8 1 1 38 1 . . . . . . . 4.3 1 1 39 1 . . . . . . . 3.8 1 1 40 1 . . . . . . . 3.8 1 1 41 1 . . . . . . . 3.8 1 1 42 1 . . . . . . . 3.8 1 1 43 1 . . . . . . . 3.9 1 1 44 1 . . . . . . . 4.5 1 1 45 1 . . . . . . . 3.8 1 1 46 1 . . . . . . . 4.8 1 1 47 1 . . . . . . . 4.8 1 1 48 1 . . . . . . . 4.2 1 1 49 1 . . . . . . . 4.8 1 1 50 1 . . . . . . . 3.9 1 1 51 1 . . . . . . . 4.8 1 1 52 1 . . . . . . . 4.9 1 1 53 1 . . . . . . . 4.2 1 1 54 1 . . . . . . . 4.5 1 1 55 1 . . . . . . . 5.0 1 1 56 1 . . . . . . . 5.0 1 1 57 1 . . . . . . . 3.6 1 1 58 1 . . . . . . . 4.3 1 1 59 1 . . . . . . . 3.9 1 1 60 1 . . . . . . . 4.9 1 1 61 1 . . . . . . . 4.2 1 1 62 1 . . . . . . . 5.1 1 1 63 1 . . . . . . . 4.6 1 1 64 1 . . . . . . . 4.6 1 1 65 1 . . . . . . . 4.6 1 1 66 1 . . . . . . . 3.6 1 1 67 1 . . . . . . . 4.5 1 1 68 1 . . . . . . . 3.8 1 1 69 1 . . . . . . . 4.9 1 1 70 1 . . . . . . . 4.9 1 1 71 1 . . . . . . . 3.7 1 1 72 1 . . . . . . . 3.9 1 1 73 1 . . . . . . . 4.5 1 1 74 1 . . . . . . . 3.8 1 1 75 1 . . . . . . . 4.6 1 1 76 1 . . . . . . . 4.34 1 1 77 1 . . . . . . . 3.8 1 1 78 1 . . . . . . . 4.95 1 1 79 1 . . . . . . . 5.2 1 1 80 1 . . . . . . . 4.7 1 1 81 1 . . . . . . . 4.6 1 1 82 1 . . . . . . . 4.0 1 1 83 1 . . . . . . . 4.0 1 1 84 1 . . . . . . . 4.0 1 1 85 1 . . . . . . . 3.9 1 1 86 1 . . . . . . . 4.5 1 1 87 1 . . . . . . . 3.5 1 1 88 1 . . . . . . . 3.65 1 1 89 1 . . . . . . . 3.8 1 1 90 1 . . . . . . . 4.3 1 1 91 1 . . . . . . . 5.0 1 1 92 1 . . . . . . . 4.9 1 1 93 1 . . . . . . . 4.5 1 1 94 1 . . . . . . . 4.3 1 1 95 1 . . . . . . . 5.1 1 1 96 1 . . . . . . . 5.2 1 1 97 1 . . . . . . . 3.8 1 1 98 1 . . . . . . . 3.9 1 1 99 1 . . . . . . . 4.5 1 1 100 1 . . . . . . . 3.7 1 1 101 1 . . . . . . . 4.8 1 1 102 1 . . . . . . . 4.2 1 1 103 1 . . . . . . . 4.9 1 1 104 1 . . . . . . . 3.8 1 1 105 1 . . . . . . . 4.8 1 1 106 1 . . . . . . . 3.9 1 1 107 1 . . . . . . . 3.8 1 1 108 1 . . . . . . . 4.5 1 1 109 1 . . . . . . . 4.6 1 1 110 1 . . . . . . . 3.8 1 1 111 1 . . . . . . . 3.9 1 1 112 1 . . . . . . . 4.8 1 1 113 1 . . . . . . . 4.5 1 1 114 1 . . . . . . . 3.8 1 1 115 1 . . . . . . . 4.6 1 1 116 1 . . . . . . . 4.5 1 1 117 1 . . . . . . . 3.9 1 1 118 1 . . . . . . . 4.5 1 1 119 1 . . . . . . . 4.6 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 HIS C C 2.747 -1.360 -1.477 1.00 . A A . 1 HIS C 1 1 1 2 1 1 1 HIS CA C 2.094 -0.001 -1.242 1.00 . A A . 1 HIS CA 1 1 1 3 1 1 1 HIS CB C 3.162 1.092 -1.209 1.00 . A A . 1 HIS CB 1 1 1 4 1 1 1 HIS CD2 C 3.291 3.443 -2.298 1.00 . A A . 1 HIS CD2 1 1 1 5 1 1 1 HIS CE1 C 1.222 4.074 -1.944 1.00 . A A . 1 HIS CE1 1 1 1 6 1 1 1 HIS CG C 2.662 2.432 -1.654 1.00 . A A . 1 HIS CG 1 1 1 7 1 1 1 HIS H1 H 1.807 0.000 0.855 1.00 . A A . 1 HIS H1 1 1 1 8 1 1 1 HIS HA H 1.410 0.201 -2.053 1.00 . A A . 1 HIS HA 1 1 1 9 1 1 1 HIS HB2 H 3.531 1.195 -0.199 1.00 . A A . 1 HIS HB2 1 1 1 10 1 1 1 HIS HB3 H 3.978 0.809 -1.859 1.00 . A A . 1 HIS HB3 1 1 1 11 1 1 1 HIS HD1 H 0.661 2.347 -1.002 1.00 . A A . 1 HIS HD1 1 1 1 12 1 1 1 HIS HD2 H 4.323 3.455 -2.620 1.00 . A A . 1 HIS HD2 1 1 1 13 1 1 1 HIS HE1 H 0.315 4.660 -1.927 1.00 . A A . 1 HIS HE1 1 1 1 14 1 1 1 HIS N N 1.329 0.000 0.000 1.00 . A A . 1 HIS N 1 1 1 15 1 1 1 HIS ND1 N 1.368 2.859 -1.446 1.00 . A A . 1 HIS ND1 1 1 1 16 1 1 1 HIS NE2 N 2.375 4.451 -2.466 1.00 . A A . 1 HIS NE2 1 1 1 17 1 1 1 HIS O O 2.925 -1.785 -2.619 1.00 . A A . 1 HIS O 1 1 1 18 1 1 2 VAL C C 2.779 -4.381 -1.063 1.00 . A A . 2 VAL C 1 1 1 19 1 1 2 VAL CA C 3.735 -3.347 -0.477 1.00 . A A . 2 VAL CA 1 1 1 20 1 1 2 VAL CB C 4.214 -3.832 0.904 1.00 . A A . 2 VAL CB 1 1 1 21 1 1 2 VAL CG1 C 4.881 -5.195 0.790 1.00 . A A . 2 VAL CG1 1 1 1 22 1 1 2 VAL CG2 C 5.161 -2.817 1.526 1.00 . A A . 2 VAL CG2 1 1 1 23 1 1 2 VAL H H 2.933 -1.645 0.493 1.00 . A A . 2 VAL H 1 1 1 24 1 1 2 VAL HA H 4.596 -3.260 -1.124 1.00 . A A . 2 VAL HA 1 1 1 25 1 1 2 VAL HB H 3.352 -3.931 1.548 1.00 . A A . 2 VAL HB 1 1 1 26 1 1 2 VAL HG11 H 5.684 -5.263 1.509 1.00 . A A . 2 VAL HG11 1 1 1 27 1 1 2 VAL HG12 H 4.154 -5.969 0.985 1.00 . A A . 2 VAL HG12 1 1 1 28 1 1 2 VAL HG13 H 5.280 -5.317 -0.207 1.00 . A A . 2 VAL HG13 1 1 1 29 1 1 2 VAL HG21 H 5.221 -1.945 0.892 1.00 . A A . 2 VAL HG21 1 1 1 30 1 1 2 VAL HG22 H 4.791 -2.530 2.499 1.00 . A A . 2 VAL HG22 1 1 1 31 1 1 2 VAL HG23 H 6.143 -3.255 1.629 1.00 . A A . 2 VAL HG23 1 1 1 32 1 1 2 VAL N N 3.102 -2.037 -0.389 1.00 . A A . 2 VAL N 1 1 1 33 1 1 2 VAL O O 3.003 -4.898 -2.158 1.00 . A A . 2 VAL O 1 1 1 34 1 1 3 PHE C C -0.658 -5.008 -0.884 1.00 . A A . 3 PHE C 1 1 1 35 1 1 3 PHE CA C 0.722 -5.649 -0.774 1.00 . A A . 3 PHE CA 1 1 1 36 1 1 3 PHE CB C 0.670 -6.836 0.191 1.00 . A A . 3 PHE CB 1 1 1 37 1 1 3 PHE CD1 C 1.997 -8.901 -0.328 1.00 . A A . 3 PHE CD1 1 1 1 38 1 1 3 PHE CD2 C -0.178 -8.683 -1.279 1.00 . A A . 3 PHE CD2 1 1 1 39 1 1 3 PHE CE1 C 2.150 -10.126 -0.950 1.00 . A A . 3 PHE CE1 1 1 1 40 1 1 3 PHE CE2 C -0.031 -9.908 -1.903 1.00 . A A . 3 PHE CE2 1 1 1 41 1 1 3 PHE CG C 0.833 -8.167 -0.486 1.00 . A A . 3 PHE CG 1 1 1 42 1 1 3 PHE CZ C 1.135 -10.630 -1.739 1.00 . A A . 3 PHE CZ 1 1 1 43 1 1 3 PHE H H 1.590 -4.231 0.537 1.00 . A A . 3 PHE H 1 1 1 44 1 1 3 PHE HA H 1.021 -6.002 -1.749 1.00 . A A . 3 PHE HA 1 1 1 45 1 1 3 PHE HB2 H 1.463 -6.734 0.918 1.00 . A A . 3 PHE HB2 1 1 1 46 1 1 3 PHE HB3 H -0.282 -6.835 0.700 1.00 . A A . 3 PHE HB3 1 1 1 47 1 1 3 PHE HD1 H 2.793 -8.507 0.289 1.00 . A A . 3 PHE HD1 1 1 1 48 1 1 3 PHE HD2 H -1.090 -8.119 -1.410 1.00 . A A . 3 PHE HD2 1 1 1 49 1 1 3 PHE HE1 H 3.063 -10.688 -0.819 1.00 . A A . 3 PHE HE1 1 1 1 50 1 1 3 PHE HE2 H -0.827 -10.299 -2.519 1.00 . A A . 3 PHE HE2 1 1 1 51 1 1 3 PHE HZ H 1.252 -11.587 -2.224 1.00 . A A . 3 PHE HZ 1 1 1 52 1 1 3 PHE N N 1.713 -4.677 -0.327 1.00 . A A . 3 PHE N 1 1 1 53 1 1 3 PHE O O -1.258 -4.983 -1.959 1.00 . A A . 3 PHE O 1 1 1 54 1 1 4 ARG C C -2.404 -2.522 1.011 1.00 . A A . 4 ARG C 1 1 1 55 1 1 4 ARG CA C -2.465 -3.852 0.265 1.00 . A A . 4 ARG CA 1 1 1 56 1 1 4 ARG CB C -3.491 -4.774 0.928 1.00 . A A . 4 ARG CB 1 1 1 57 1 1 4 ARG CD C -5.365 -4.511 -0.726 1.00 . A A . 4 ARG CD 1 1 1 58 1 1 4 ARG CG C -4.930 -4.332 0.720 1.00 . A A . 4 ARG CG 1 1 1 59 1 1 4 ARG CZ C -7.793 -4.802 -0.474 1.00 . A A . 4 ARG CZ 1 1 1 60 1 1 4 ARG H H -0.629 -4.543 1.060 1.00 . A A . 4 ARG H 1 1 1 61 1 1 4 ARG HA H -2.767 -3.666 -0.754 1.00 . A A . 4 ARG HA 1 1 1 62 1 1 4 ARG HB2 H -3.381 -5.768 0.520 1.00 . A A . 4 ARG HB2 1 1 1 63 1 1 4 ARG HB3 H -3.296 -4.805 1.989 1.00 . A A . 4 ARG HB3 1 1 1 64 1 1 4 ARG HD2 H -5.515 -3.536 -1.166 1.00 . A A . 4 ARG HD2 1 1 1 65 1 1 4 ARG HD3 H -4.585 -5.031 -1.260 1.00 . A A . 4 ARG HD3 1 1 1 66 1 1 4 ARG HE H -6.548 -6.184 -1.192 1.00 . A A . 4 ARG HE 1 1 1 67 1 1 4 ARG HG2 H -5.574 -4.924 1.354 1.00 . A A . 4 ARG HG2 1 1 1 68 1 1 4 ARG HG3 H -5.019 -3.289 0.988 1.00 . A A . 4 ARG HG3 1 1 1 69 1 1 4 ARG HH11 H -7.087 -3.002 0.112 1.00 . A A . 4 ARG HH11 1 1 1 70 1 1 4 ARG HH12 H -8.798 -3.220 0.284 1.00 . A A . 4 ARG HH12 1 1 1 71 1 1 4 ARG HH21 H -9.770 -5.201 -0.331 1.00 . A A . 4 ARG HH21 1 1 1 72 1 1 4 ARG HH22 H -8.798 -6.484 -0.971 1.00 . A A . 4 ARG HH22 1 1 1 73 1 1 4 ARG N N -1.155 -4.492 0.235 1.00 . A A . 4 ARG N 1 1 1 74 1 1 4 ARG NE N -6.605 -5.274 -0.834 1.00 . A A . 4 ARG NE 1 1 1 75 1 1 4 ARG NH1 N -7.902 -3.574 0.014 1.00 . A A . 4 ARG NH1 1 1 1 76 1 1 4 ARG NH2 N -8.876 -5.558 -0.603 1.00 . A A . 4 ARG NH2 1 1 1 77 1 1 4 ARG O O -2.884 -1.500 0.520 1.00 . A A . 4 ARG O 1 1 1 78 1 1 5 LEU C C -0.702 -1.556 4.159 1.00 . A A . 5 LEU C 1 1 1 79 1 1 5 LEU CA C -1.687 -1.340 3.015 1.00 . A A . 5 LEU CA 1 1 1 80 1 1 5 LEU CB C -3.053 -0.935 3.572 1.00 . A A . 5 LEU CB 1 1 1 81 1 1 5 LEU CD1 C -5.131 0.278 2.869 1.00 . A A . 5 LEU CD1 1 1 1 82 1 1 5 LEU CD2 C -3.281 1.525 4.001 1.00 . A A . 5 LEU CD2 1 1 1 83 1 1 5 LEU CG C -3.625 0.385 3.053 1.00 . A A . 5 LEU CG 1 1 1 84 1 1 5 LEU H H -1.448 -3.388 2.539 1.00 . A A . 5 LEU H 1 1 1 85 1 1 5 LEU HA H -1.316 -0.548 2.381 1.00 . A A . 5 LEU HA 1 1 1 86 1 1 5 LEU HB2 H -3.754 -1.718 3.329 1.00 . A A . 5 LEU HB2 1 1 1 87 1 1 5 LEU HB3 H -2.961 -0.857 4.646 1.00 . A A . 5 LEU HB3 1 1 1 88 1 1 5 LEU HD11 H -5.623 0.476 3.808 1.00 . A A . 5 LEU HD11 1 1 1 89 1 1 5 LEU HD12 H -5.382 -0.717 2.533 1.00 . A A . 5 LEU HD12 1 1 1 90 1 1 5 LEU HD13 H -5.455 0.999 2.132 1.00 . A A . 5 LEU HD13 1 1 1 91 1 1 5 LEU HD21 H -2.479 2.113 3.581 1.00 . A A . 5 LEU HD21 1 1 1 92 1 1 5 LEU HD22 H -2.971 1.119 4.953 1.00 . A A . 5 LEU HD22 1 1 1 93 1 1 5 LEU HD23 H -4.151 2.150 4.142 1.00 . A A . 5 LEU HD23 1 1 1 94 1 1 5 LEU HG H -3.186 0.606 2.090 1.00 . A A . 5 LEU HG 1 1 1 95 1 1 5 LEU N N -1.811 -2.544 2.200 1.00 . A A . 5 LEU N 1 1 1 96 1 1 5 LEU O O -0.555 -2.669 4.665 1.00 . A A . 5 LEU O 1 1 1 97 1 1 6 LYS C C 0.500 0.310 6.829 1.00 . A A . 6 LYS C 1 1 1 98 1 1 6 LYS CA C 0.940 -0.554 5.651 1.00 . A A . 6 LYS CA 1 1 1 99 1 1 6 LYS CB C 2.319 -0.104 5.162 1.00 . A A . 6 LYS CB 1 1 1 100 1 1 6 LYS CD C 1.855 2.355 4.947 1.00 . A A . 6 LYS CD 1 1 1 101 1 1 6 LYS CE C 2.833 2.710 6.056 1.00 . A A . 6 LYS CE 1 1 1 102 1 1 6 LYS CG C 2.271 1.087 4.221 1.00 . A A . 6 LYS CG 1 1 1 103 1 1 6 LYS H H -0.190 0.376 4.121 1.00 . A A . 6 LYS H 1 1 1 104 1 1 6 LYS HA H 1.000 -1.581 5.976 1.00 . A A . 6 LYS HA 1 1 1 105 1 1 6 LYS HB2 H 2.921 0.163 6.018 1.00 . A A . 6 LYS HB2 1 1 1 106 1 1 6 LYS HB3 H 2.790 -0.927 4.644 1.00 . A A . 6 LYS HB3 1 1 1 107 1 1 6 LYS HD2 H 1.821 3.170 4.239 1.00 . A A . 6 LYS HD2 1 1 1 108 1 1 6 LYS HD3 H 0.874 2.208 5.377 1.00 . A A . 6 LYS HD3 1 1 1 109 1 1 6 LYS HE2 H 2.336 2.594 7.007 1.00 . A A . 6 LYS HE2 1 1 1 110 1 1 6 LYS HE3 H 3.674 2.034 6.005 1.00 . A A . 6 LYS HE3 1 1 1 111 1 1 6 LYS HG2 H 3.252 1.236 3.793 1.00 . A A . 6 LYS HG2 1 1 1 112 1 1 6 LYS HG3 H 1.560 0.884 3.433 1.00 . A A . 6 LYS HG3 1 1 1 113 1 1 6 LYS HZ1 H 3.534 4.499 6.876 1.00 . A A . 6 LYS HZ1 1 1 1 114 1 1 6 LYS HZ2 H 2.608 4.703 5.474 1.00 . A A . 6 LYS HZ2 1 1 1 115 1 1 6 LYS HZ3 H 4.196 4.132 5.363 1.00 . A A . 6 LYS HZ3 1 1 1 116 1 1 6 LYS N N -0.029 -0.484 4.564 1.00 . A A . 6 LYS N 1 1 1 117 1 1 6 LYS NZ N 3.328 4.109 5.934 1.00 . A A . 6 LYS NZ 1 1 1 118 1 1 6 LYS O O 1.217 0.436 7.822 1.00 . A A . 6 LYS O 1 1 1 119 1 1 7 LYS C C -2.079 0.941 8.735 1.00 . A A . 7 LYS C 1 1 1 120 1 1 7 LYS CA C -1.222 1.752 7.768 1.00 . A A . 7 LYS CA 1 1 1 121 1 1 7 LYS CB C -2.051 2.888 7.164 1.00 . A A . 7 LYS CB 1 1 1 122 1 1 7 LYS CD C -1.729 5.346 7.570 1.00 . A A . 7 LYS CD 1 1 1 123 1 1 7 LYS CE C -0.216 5.408 7.712 1.00 . A A . 7 LYS CE 1 1 1 124 1 1 7 LYS CG C -2.287 4.044 8.121 1.00 . A A . 7 LYS CG 1 1 1 125 1 1 7 LYS H H -1.209 0.764 5.896 1.00 . A A . 7 LYS H 1 1 1 126 1 1 7 LYS HA H -0.390 2.174 8.310 1.00 . A A . 7 LYS HA 1 1 1 127 1 1 7 LYS HB2 H -1.539 3.267 6.293 1.00 . A A . 7 LYS HB2 1 1 1 128 1 1 7 LYS HB3 H -3.012 2.495 6.863 1.00 . A A . 7 LYS HB3 1 1 1 129 1 1 7 LYS HD2 H -1.985 5.423 6.523 1.00 . A A . 7 LYS HD2 1 1 1 130 1 1 7 LYS HD3 H -2.168 6.172 8.111 1.00 . A A . 7 LYS HD3 1 1 1 131 1 1 7 LYS HE2 H 0.029 6.079 8.521 1.00 . A A . 7 LYS HE2 1 1 1 132 1 1 7 LYS HE3 H 0.152 4.419 7.940 1.00 . A A . 7 LYS HE3 1 1 1 133 1 1 7 LYS HG2 H -3.349 4.158 8.278 1.00 . A A . 7 LYS HG2 1 1 1 134 1 1 7 LYS HG3 H -1.803 3.825 9.062 1.00 . A A . 7 LYS HG3 1 1 1 135 1 1 7 LYS HZ1 H 0.592 5.101 5.810 1.00 . A A . 7 LYS HZ1 1 1 1 136 1 1 7 LYS HZ2 H 1.356 6.327 6.690 1.00 . A A . 7 LYS HZ2 1 1 1 137 1 1 7 LYS HZ3 H -0.163 6.603 5.999 1.00 . A A . 7 LYS HZ3 1 1 1 138 1 1 7 LYS N N -0.684 0.902 6.712 1.00 . A A . 7 LYS N 1 1 1 139 1 1 7 LYS NZ N 0.438 5.894 6.465 1.00 . A A . 7 LYS NZ 1 1 1 140 1 1 7 LYS O O -2.168 1.264 9.920 1.00 . A A . 7 LYS O 1 1 1 141 1 1 8 TRP C C -2.756 -1.598 10.180 1.00 . A A . 8 TRP C 1 1 1 142 1 1 8 TRP CA C -3.554 -0.969 9.043 1.00 . A A . 8 TRP CA 1 1 1 143 1 1 8 TRP CB C -4.190 -2.063 8.184 1.00 . A A . 8 TRP CB 1 1 1 144 1 1 8 TRP CD1 C -6.347 -3.024 9.181 1.00 . A A . 8 TRP CD1 1 1 1 145 1 1 8 TRP CD2 C -6.672 -1.384 7.690 1.00 . A A . 8 TRP CD2 1 1 1 146 1 1 8 TRP CE2 C -7.927 -1.822 8.158 1.00 . A A . 8 TRP CE2 1 1 1 147 1 1 8 TRP CE3 C -6.627 -0.356 6.744 1.00 . A A . 8 TRP CE3 1 1 1 148 1 1 8 TRP CG C -5.675 -2.166 8.357 1.00 . A A . 8 TRP CG 1 1 1 149 1 1 8 TRP CH2 C -9.049 -0.262 6.784 1.00 . A A . 8 TRP CH2 1 1 1 150 1 1 8 TRP CZ2 C -9.123 -1.267 7.710 1.00 . A A . 8 TRP CZ2 1 1 1 151 1 1 8 TRP CZ3 C -7.815 0.193 6.301 1.00 . A A . 8 TRP CZ3 1 1 1 152 1 1 8 TRP H H -2.595 -0.318 7.271 1.00 . A A . 8 TRP H 1 1 1 153 1 1 8 TRP HA H -4.336 -0.354 9.464 1.00 . A A . 8 TRP HA 1 1 1 154 1 1 8 TRP HB2 H -3.989 -1.857 7.143 1.00 . A A . 8 TRP HB2 1 1 1 155 1 1 8 TRP HB3 H -3.756 -3.016 8.449 1.00 . A A . 8 TRP HB3 1 1 1 156 1 1 8 TRP HD1 H -5.870 -3.750 9.821 1.00 . A A . 8 TRP HD1 1 1 1 157 1 1 8 TRP HE1 H -8.393 -3.315 9.555 1.00 . A A . 8 TRP HE1 1 1 1 158 1 1 8 TRP HE3 H -5.686 0.008 6.360 1.00 . A A . 8 TRP HE3 1 1 1 159 1 1 8 TRP HH2 H -9.951 0.196 6.410 1.00 . A A . 8 TRP HH2 1 1 1 160 1 1 8 TRP HZ2 H -10.082 -1.606 8.073 1.00 . A A . 8 TRP HZ2 1 1 1 161 1 1 8 TRP HZ3 H -7.800 0.988 5.570 1.00 . A A . 8 TRP HZ3 1 1 1 162 1 1 8 TRP N N -2.705 -0.112 8.223 1.00 . A A . 8 TRP N 1 1 1 163 1 1 8 TRP NE1 N -7.701 -2.823 9.065 1.00 . A A . 8 TRP NE1 1 1 1 164 1 1 8 TRP O O -3.325 -2.044 11.176 1.00 . A A . 8 TRP O 1 1 1 165 1 1 9 ILE C C 0.830 -1.583 10.978 1.00 . A A . 9 ILE C 1 1 1 166 1 1 9 ILE CA C -0.562 -2.202 11.039 1.00 . A A . 9 ILE CA 1 1 1 167 1 1 9 ILE CB C -0.439 -3.729 10.880 1.00 . A A . 9 ILE CB 1 1 1 168 1 1 9 ILE CD1 C 0.790 -3.561 8.658 1.00 . A A . 9 ILE CD1 1 1 1 169 1 1 9 ILE CG1 C -0.410 -4.109 9.398 1.00 . A A . 9 ILE CG1 1 1 1 170 1 1 9 ILE CG2 C -1.589 -4.430 11.589 1.00 . A A . 9 ILE CG2 1 1 1 171 1 1 9 ILE H H -1.043 -1.258 9.208 1.00 . A A . 9 ILE H 1 1 1 172 1 1 9 ILE HA H -0.994 -1.995 12.007 1.00 . A A . 9 ILE HA 1 1 1 173 1 1 9 ILE HB H 0.483 -4.045 11.343 1.00 . A A . 9 ILE HB 1 1 1 174 1 1 9 ILE HD11 H 0.657 -2.501 8.493 1.00 . A A . 9 ILE HD11 1 1 1 175 1 1 9 ILE HD12 H 1.681 -3.723 9.245 1.00 . A A . 9 ILE HD12 1 1 1 176 1 1 9 ILE HD13 H 0.887 -4.063 7.707 1.00 . A A . 9 ILE HD13 1 1 1 177 1 1 9 ILE HG12 H -0.392 -5.183 9.308 1.00 . A A . 9 ILE HG12 1 1 1 178 1 1 9 ILE HG13 H -1.300 -3.727 8.919 1.00 . A A . 9 ILE HG13 1 1 1 179 1 1 9 ILE HG21 H -1.199 -5.217 12.216 1.00 . A A . 9 ILE HG21 1 1 1 180 1 1 9 ILE HG22 H -2.123 -3.716 12.198 1.00 . A A . 9 ILE HG22 1 1 1 181 1 1 9 ILE HG23 H -2.260 -4.852 10.856 1.00 . A A . 9 ILE HG23 1 1 1 182 1 1 9 ILE N N -1.437 -1.629 10.024 1.00 . A A . 9 ILE N 1 1 1 183 1 1 9 ILE O O 1.830 -2.253 11.238 1.00 . A A . 9 ILE O 1 1 1 184 1 1 10 GLN C C 2.993 0.198 11.799 1.00 . A A . 10 GLN C 1 1 1 185 1 1 10 GLN CA C 2.157 0.409 10.541 1.00 . A A . 10 GLN CA 1 1 1 186 1 1 10 GLN CB C 1.915 1.903 10.320 1.00 . A A . 10 GLN CB 1 1 1 187 1 1 10 GLN CD C 1.332 4.135 11.351 1.00 . A A . 10 GLN CD 1 1 1 188 1 1 10 GLN CG C 1.629 2.669 11.601 1.00 . A A . 10 GLN CG 1 1 1 189 1 1 10 GLN H H 0.056 0.179 10.439 1.00 . A A . 10 GLN H 1 1 1 190 1 1 10 GLN HA H 2.697 0.012 9.694 1.00 . A A . 10 GLN HA 1 1 1 191 1 1 10 GLN HB2 H 2.791 2.333 9.857 1.00 . A A . 10 GLN HB2 1 1 1 192 1 1 10 GLN HB3 H 1.071 2.025 9.657 1.00 . A A . 10 GLN HB3 1 1 1 193 1 1 10 GLN HE21 H 1.111 5.875 12.287 1.00 . A A . 10 GLN HE21 1 1 1 194 1 1 10 GLN HE22 H 1.469 4.520 13.297 1.00 . A A . 10 GLN HE22 1 1 1 195 1 1 10 GLN HG2 H 0.775 2.223 12.089 1.00 . A A . 10 GLN HG2 1 1 1 196 1 1 10 GLN HG3 H 2.491 2.597 12.249 1.00 . A A . 10 GLN HG3 1 1 1 197 1 1 10 GLN N N 0.887 -0.301 10.634 1.00 . A A . 10 GLN N 1 1 1 198 1 1 10 GLN NE2 N 1.300 4.923 12.419 1.00 . A A . 10 GLN NE2 1 1 1 199 1 1 10 GLN O O 4.221 0.288 11.764 1.00 . A A . 10 GLN O 1 1 1 200 1 1 10 GLN OE1 O 1.133 4.554 10.211 1.00 . A A . 10 GLN OE1 1 1 1 201 1 1 11 LYS C C 3.812 -1.600 14.141 1.00 . A A . 11 LYS C 1 1 1 202 1 1 11 LYS CA C 3.000 -0.309 14.180 1.00 . A A . 11 LYS CA 1 1 1 203 1 1 11 LYS CB C 1.984 -0.368 15.322 1.00 . A A . 11 LYS CB 1 1 1 204 1 1 11 LYS CD C 1.123 -2.666 15.857 1.00 . A A . 11 LYS CD 1 1 1 205 1 1 11 LYS CE C 0.692 -2.548 17.311 1.00 . A A . 11 LYS CE 1 1 1 206 1 1 11 LYS CG C 0.871 -1.376 15.095 1.00 . A A . 11 LYS CG 1 1 1 207 1 1 11 LYS H H 1.342 -0.142 12.874 1.00 . A A . 11 LYS H 1 1 1 208 1 1 11 LYS HA H 3.672 0.519 14.348 1.00 . A A . 11 LYS HA 1 1 1 209 1 1 11 LYS HB2 H 2.500 -0.631 16.234 1.00 . A A . 11 LYS HB2 1 1 1 210 1 1 11 LYS HB3 H 1.537 0.609 15.441 1.00 . A A . 11 LYS HB3 1 1 1 211 1 1 11 LYS HD2 H 0.565 -3.464 15.392 1.00 . A A . 11 LYS HD2 1 1 1 212 1 1 11 LYS HD3 H 2.179 -2.895 15.821 1.00 . A A . 11 LYS HD3 1 1 1 213 1 1 11 LYS HE2 H 1.452 -2.009 17.856 1.00 . A A . 11 LYS HE2 1 1 1 214 1 1 11 LYS HE3 H -0.237 -2.000 17.354 1.00 . A A . 11 LYS HE3 1 1 1 215 1 1 11 LYS HG2 H -0.063 -0.950 15.430 1.00 . A A . 11 LYS HG2 1 1 1 216 1 1 11 LYS HG3 H 0.809 -1.599 14.039 1.00 . A A . 11 LYS HG3 1 1 1 217 1 1 11 LYS HZ1 H 0.627 -3.814 18.971 1.00 . A A . 11 LYS HZ1 1 1 1 218 1 1 11 LYS HZ2 H 1.186 -4.562 17.561 1.00 . A A . 11 LYS HZ2 1 1 1 219 1 1 11 LYS HZ3 H -0.462 -4.233 17.747 1.00 . A A . 11 LYS HZ3 1 1 1 220 1 1 11 LYS N N 2.321 -0.084 12.909 1.00 . A A . 11 LYS N 1 1 1 221 1 1 11 LYS NZ N 0.497 -3.883 17.942 1.00 . A A . 11 LYS NZ 1 1 1 222 1 1 11 LYS O O 4.963 -1.635 14.577 1.00 . A A . 11 LYS O 1 1 1 223 1 1 12 VAL C C 5.080 -3.878 12.588 1.00 . A A . 12 VAL C 1 1 1 224 1 1 12 VAL CA C 3.873 -3.952 13.516 1.00 . A A . 12 VAL CA 1 1 1 225 1 1 12 VAL CB C 2.913 -5.042 13.006 1.00 . A A . 12 VAL CB 1 1 1 226 1 1 12 VAL CG1 C 3.671 -6.329 12.717 1.00 . A A . 12 VAL CG1 1 1 1 227 1 1 12 VAL CG2 C 1.799 -5.285 14.013 1.00 . A A . 12 VAL CG2 1 1 1 228 1 1 12 VAL H H 2.288 -2.570 13.284 1.00 . A A . 12 VAL H 1 1 1 229 1 1 12 VAL HA H 4.208 -4.231 14.505 1.00 . A A . 12 VAL HA 1 1 1 230 1 1 12 VAL HB H 2.468 -4.698 12.084 1.00 . A A . 12 VAL HB 1 1 1 231 1 1 12 VAL HG11 H 4.218 -6.630 13.598 1.00 . A A . 12 VAL HG11 1 1 1 232 1 1 12 VAL HG12 H 2.972 -7.106 12.443 1.00 . A A . 12 VAL HG12 1 1 1 233 1 1 12 VAL HG13 H 4.363 -6.164 11.904 1.00 . A A . 12 VAL HG13 1 1 1 234 1 1 12 VAL HG21 H 0.915 -4.744 13.710 1.00 . A A . 12 VAL HG21 1 1 1 235 1 1 12 VAL HG22 H 1.579 -6.341 14.057 1.00 . A A . 12 VAL HG22 1 1 1 236 1 1 12 VAL HG23 H 2.114 -4.942 14.988 1.00 . A A . 12 VAL HG23 1 1 1 237 1 1 12 VAL N N 3.206 -2.660 13.615 1.00 . A A . 12 VAL N 1 1 1 238 1 1 12 VAL O O 6.181 -4.294 12.950 1.00 . A A . 12 VAL O 1 1 1 239 1 1 13 ILE C C 6.992 -2.217 10.877 1.00 . A A . 13 ILE C 1 1 1 240 1 1 13 ILE CA C 5.937 -3.215 10.410 1.00 . A A . 13 ILE CA 1 1 1 241 1 1 13 ILE CB C 5.395 -2.767 9.040 1.00 . A A . 13 ILE CB 1 1 1 242 1 1 13 ILE CD1 C 6.003 -2.704 6.569 1.00 . A A . 13 ILE CD1 1 1 1 243 1 1 13 ILE CG1 C 6.509 -2.799 7.991 1.00 . A A . 13 ILE CG1 1 1 1 244 1 1 13 ILE CG2 C 4.793 -1.373 9.138 1.00 . A A . 13 ILE CG2 1 1 1 245 1 1 13 ILE H H 3.967 -3.031 11.160 1.00 . A A . 13 ILE H 1 1 1 246 1 1 13 ILE HA H 6.401 -4.184 10.292 1.00 . A A . 13 ILE HA 1 1 1 247 1 1 13 ILE HB H 4.614 -3.451 8.746 1.00 . A A . 13 ILE HB 1 1 1 248 1 1 13 ILE HD11 H 5.818 -1.669 6.321 1.00 . A A . 13 ILE HD11 1 1 1 249 1 1 13 ILE HD12 H 6.744 -3.108 5.895 1.00 . A A . 13 ILE HD12 1 1 1 250 1 1 13 ILE HD13 H 5.085 -3.265 6.475 1.00 . A A . 13 ILE HD13 1 1 1 251 1 1 13 ILE HG12 H 7.178 -1.969 8.160 1.00 . A A . 13 ILE HG12 1 1 1 252 1 1 13 ILE HG13 H 7.058 -3.724 8.088 1.00 . A A . 13 ILE HG13 1 1 1 253 1 1 13 ILE HG21 H 4.131 -1.207 8.301 1.00 . A A . 13 ILE HG21 1 1 1 254 1 1 13 ILE HG22 H 4.236 -1.287 10.059 1.00 . A A . 13 ILE HG22 1 1 1 255 1 1 13 ILE HG23 H 5.582 -0.637 9.124 1.00 . A A . 13 ILE HG23 1 1 1 256 1 1 13 ILE N N 4.866 -3.345 11.390 1.00 . A A . 13 ILE N 1 1 1 257 1 1 13 ILE O O 8.177 -2.367 10.581 1.00 . A A . 13 ILE O 1 1 1 258 1 1 14 ASP C C 8.641 -0.816 12.849 1.00 . A A . 14 ASP C 1 1 1 259 1 1 14 ASP CA C 7.459 -0.180 12.123 1.00 . A A . 14 ASP CA 1 1 1 260 1 1 14 ASP CB C 6.715 0.766 13.067 1.00 . A A . 14 ASP CB 1 1 1 261 1 1 14 ASP CG C 6.306 2.058 12.387 1.00 . A A . 14 ASP CG 1 1 1 262 1 1 14 ASP H H 5.596 -1.136 11.815 1.00 . A A . 14 ASP H 1 1 1 263 1 1 14 ASP HA H 7.832 0.385 11.282 1.00 . A A . 14 ASP HA 1 1 1 264 1 1 14 ASP HB2 H 5.824 0.275 13.431 1.00 . A A . 14 ASP HB2 1 1 1 265 1 1 14 ASP HB3 H 7.355 1.007 13.903 1.00 . A A . 14 ASP HB3 1 1 1 266 1 1 14 ASP N N 6.553 -1.201 11.611 1.00 . A A . 14 ASP N 1 1 1 267 1 1 14 ASP O O 9.726 -0.240 12.910 1.00 . A A . 14 ASP O 1 1 1 268 1 1 14 ASP OD1 O 6.200 2.066 11.143 1.00 . A A . 14 ASP OD1 1 1 1 269 1 1 14 ASP OD2 O 6.090 3.060 13.100 1.00 . A A . 14 ASP OD2 1 1 1 270 1 1 15 GLN C C 9.983 -3.901 13.305 1.00 . A A . 15 GLN C 1 1 1 271 1 1 15 GLN CA C 9.467 -2.720 14.119 1.00 . A A . 15 GLN CA 1 1 1 272 1 1 15 GLN CB C 8.942 -3.208 15.471 1.00 . A A . 15 GLN CB 1 1 1 273 1 1 15 GLN CD C 9.487 -4.363 17.650 1.00 . A A . 15 GLN CD 1 1 1 274 1 1 15 GLN CG C 9.928 -4.082 16.227 1.00 . A A . 15 GLN CG 1 1 1 275 1 1 15 GLN H H 7.534 -2.415 13.314 1.00 . A A . 15 GLN H 1 1 1 276 1 1 15 GLN HA H 10.282 -2.032 14.288 1.00 . A A . 15 GLN HA 1 1 1 277 1 1 15 GLN HB2 H 8.709 -2.350 16.084 1.00 . A A . 15 GLN HB2 1 1 1 278 1 1 15 GLN HB3 H 8.040 -3.779 15.308 1.00 . A A . 15 GLN HB3 1 1 1 279 1 1 15 GLN HE21 H 9.576 -3.631 19.496 1.00 . A A . 15 GLN HE21 1 1 1 280 1 1 15 GLN HE22 H 10.371 -2.697 18.279 1.00 . A A . 15 GLN HE22 1 1 1 281 1 1 15 GLN HG2 H 10.029 -5.023 15.706 1.00 . A A . 15 GLN HG2 1 1 1 282 1 1 15 GLN HG3 H 10.885 -3.583 16.254 1.00 . A A . 15 GLN HG3 1 1 1 283 1 1 15 GLN N N 8.421 -2.007 13.397 1.00 . A A . 15 GLN N 1 1 1 284 1 1 15 GLN NE2 N 9.848 -3.475 18.569 1.00 . A A . 15 GLN NE2 1 1 1 285 1 1 15 GLN O O 11.051 -4.445 13.588 1.00 . A A . 15 GLN O 1 1 1 286 1 1 15 GLN OE1 O 8.829 -5.368 17.922 1.00 . A A . 15 GLN OE1 1 1 1 287 1 1 16 PHE C C 10.629 -4.979 10.399 1.00 . A A . 16 PHE C 1 1 1 288 1 1 16 PHE CA C 9.597 -5.413 11.437 1.00 . A A . 16 PHE CA 1 1 1 289 1 1 16 PHE CB C 8.364 -5.988 10.736 1.00 . A A . 16 PHE CB 1 1 1 290 1 1 16 PHE CD1 C 8.626 -8.076 9.369 1.00 . A A . 16 PHE CD1 1 1 1 291 1 1 16 PHE CD2 C 8.192 -8.297 11.704 1.00 . A A . 16 PHE CD2 1 1 1 292 1 1 16 PHE CE1 C 8.655 -9.452 9.241 1.00 . A A . 16 PHE CE1 1 1 1 293 1 1 16 PHE CE2 C 8.221 -9.673 11.581 1.00 . A A . 16 PHE CE2 1 1 1 294 1 1 16 PHE CG C 8.395 -7.484 10.600 1.00 . A A . 16 PHE CG 1 1 1 295 1 1 16 PHE CZ C 8.451 -10.252 10.348 1.00 . A A . 16 PHE CZ 1 1 1 296 1 1 16 PHE H H 8.377 -3.822 12.116 1.00 . A A . 16 PHE H 1 1 1 297 1 1 16 PHE HA H 10.033 -6.176 12.063 1.00 . A A . 16 PHE HA 1 1 1 298 1 1 16 PHE HB2 H 7.483 -5.725 11.301 1.00 . A A . 16 PHE HB2 1 1 1 299 1 1 16 PHE HB3 H 8.292 -5.565 9.746 1.00 . A A . 16 PHE HB3 1 1 1 300 1 1 16 PHE HD1 H 8.785 -7.451 8.502 1.00 . A A . 16 PHE HD1 1 1 1 301 1 1 16 PHE HD2 H 8.011 -7.846 12.669 1.00 . A A . 16 PHE HD2 1 1 1 302 1 1 16 PHE HE1 H 8.835 -9.901 8.275 1.00 . A A . 16 PHE HE1 1 1 1 303 1 1 16 PHE HE2 H 8.061 -10.296 12.449 1.00 . A A . 16 PHE HE2 1 1 1 304 1 1 16 PHE HZ H 8.474 -11.327 10.250 1.00 . A A . 16 PHE HZ 1 1 1 305 1 1 16 PHE N N 9.218 -4.295 12.292 1.00 . A A . 16 PHE N 1 1 1 306 1 1 16 PHE O O 11.420 -5.789 9.918 1.00 . A A . 16 PHE O 1 1 1 307 1 1 17 GLY C C 12.030 -1.777 9.424 1.00 . A A . 17 GLY C 1 1 1 308 1 1 17 GLY CA C 11.551 -3.173 9.082 1.00 . A A . 17 GLY CA 1 1 1 309 1 1 17 GLY H H 9.960 -3.094 10.476 1.00 . A A . 17 GLY H 1 1 1 310 1 1 17 GLY HA2 H 12.404 -3.833 9.030 1.00 . A A . 17 GLY HA2 1 1 1 311 1 1 17 GLY HA3 H 11.068 -3.149 8.115 1.00 . A A . 17 GLY HA3 1 1 1 312 1 1 17 GLY N N 10.613 -3.694 10.060 1.00 . A A . 17 GLY N 1 1 1 313 1 1 17 GLY O O 12.342 -0.986 8.534 1.00 . A A . 17 GLY O 1 1 1 314 1 1 18 GLU C C 11.740 0.950 10.483 1.00 . A A . 18 GLU C 1 1 1 315 1 1 18 GLU CA C 12.528 -0.159 11.172 1.00 . A A . 18 GLU CA 1 1 1 316 1 1 18 GLU CB C 14.024 0.021 10.905 1.00 . A A . 18 GLU CB 1 1 1 317 1 1 18 GLU CD C 15.268 1.464 12.563 1.00 . A A . 18 GLU CD 1 1 1 318 1 1 18 GLU CG C 14.868 0.056 12.168 1.00 . A A . 18 GLU CG 1 1 1 319 1 1 18 GLU H H 11.824 -2.145 11.378 1.00 . A A . 18 GLU H 1 1 1 320 1 1 18 GLU HA H 12.353 -0.101 12.236 1.00 . A A . 18 GLU HA 1 1 1 321 1 1 18 GLU HB2 H 14.369 -0.797 10.289 1.00 . A A . 18 GLU HB2 1 1 1 322 1 1 18 GLU HB3 H 14.173 0.948 10.372 1.00 . A A . 18 GLU HB3 1 1 1 323 1 1 18 GLU HG2 H 14.302 -0.381 12.977 1.00 . A A . 18 GLU HG2 1 1 1 324 1 1 18 GLU HG3 H 15.764 -0.524 12.003 1.00 . A A . 18 GLU HG3 1 1 1 325 1 1 18 GLU N N 12.086 -1.472 10.716 1.00 . A A . 18 GLU N 1 1 1 326 1 1 18 GLU O O 10.593 1.221 10.835 1.00 . A A . 18 GLU O 1 1 1 327 1 1 18 GLU OE1 O 14.622 2.420 12.085 1.00 . A A . 18 GLU OE1 1 1 1 328 1 1 18 GLU OE2 O 16.227 1.611 13.350 1.00 . A A . 18 GLU OE2 1 1 2 329 1 1 1 HIS C C 2.692 -6.518 1.799 1.00 . A A . 1 HIS C 1 1 2 330 1 1 1 HIS CA C 1.990 -6.944 0.513 1.00 . A A . 1 HIS CA 1 1 2 331 1 1 1 HIS CB C 1.780 -5.732 -0.394 1.00 . A A . 1 HIS CB 1 1 2 332 1 1 1 HIS CD2 C 2.354 -6.354 -2.845 1.00 . A A . 1 HIS CD2 1 1 2 333 1 1 1 HIS CE1 C 4.308 -5.369 -2.977 1.00 . A A . 1 HIS CE1 1 1 2 334 1 1 1 HIS CG C 2.598 -5.772 -1.648 1.00 . A A . 1 HIS CG 1 1 2 335 1 1 1 HIS H1 H -0.071 -7.027 0.987 1.00 . A A . 1 HIS H1 1 1 2 336 1 1 1 HIS HA H 2.612 -7.663 0.000 1.00 . A A . 1 HIS HA 1 1 2 337 1 1 1 HIS HB2 H 0.739 -5.680 -0.678 1.00 . A A . 1 HIS HB2 1 1 2 338 1 1 1 HIS HB3 H 2.045 -4.835 0.148 1.00 . A A . 1 HIS HB3 1 1 2 339 1 1 1 HIS HD1 H 4.286 -4.657 -1.059 1.00 . A A . 1 HIS HD1 1 1 2 340 1 1 1 HIS HD2 H 1.475 -6.922 -3.116 1.00 . A A . 1 HIS HD2 1 1 2 341 1 1 1 HIS HE1 H 5.255 -5.010 -3.353 1.00 . A A . 1 HIS HE1 1 1 2 342 1 1 1 HIS N N 0.713 -7.585 0.807 1.00 . A A . 1 HIS N 1 1 2 343 1 1 1 HIS ND1 N 3.830 -5.164 -1.763 1.00 . A A . 1 HIS ND1 1 1 2 344 1 1 1 HIS NE2 N 3.432 -6.089 -3.654 1.00 . A A . 1 HIS NE2 1 1 2 345 1 1 1 HIS O O 2.272 -6.881 2.897 1.00 . A A . 1 HIS O 1 1 2 346 1 1 2 VAL C C 4.324 -3.772 3.012 1.00 . A A . 2 VAL C 1 1 2 347 1 1 2 VAL CA C 4.525 -5.269 2.803 1.00 . A A . 2 VAL CA 1 1 2 348 1 1 2 VAL CB C 6.029 -5.556 2.639 1.00 . A A . 2 VAL CB 1 1 2 349 1 1 2 VAL CG1 C 6.312 -7.039 2.821 1.00 . A A . 2 VAL CG1 1 1 2 350 1 1 2 VAL CG2 C 6.518 -5.074 1.282 1.00 . A A . 2 VAL CG2 1 1 2 351 1 1 2 VAL H H 4.050 -5.489 0.752 1.00 . A A . 2 VAL H 1 1 2 352 1 1 2 VAL HA H 4.172 -5.795 3.678 1.00 . A A . 2 VAL HA 1 1 2 353 1 1 2 VAL HB H 6.564 -5.014 3.405 1.00 . A A . 2 VAL HB 1 1 2 354 1 1 2 VAL HG11 H 5.389 -7.594 2.743 1.00 . A A . 2 VAL HG11 1 1 2 355 1 1 2 VAL HG12 H 6.999 -7.371 2.056 1.00 . A A . 2 VAL HG12 1 1 2 356 1 1 2 VAL HG13 H 6.750 -7.205 3.794 1.00 . A A . 2 VAL HG13 1 1 2 357 1 1 2 VAL HG21 H 7.468 -4.573 1.398 1.00 . A A . 2 VAL HG21 1 1 2 358 1 1 2 VAL HG22 H 6.635 -5.919 0.621 1.00 . A A . 2 VAL HG22 1 1 2 359 1 1 2 VAL HG23 H 5.798 -4.386 0.862 1.00 . A A . 2 VAL HG23 1 1 2 360 1 1 2 VAL N N 3.764 -5.745 1.654 1.00 . A A . 2 VAL N 1 1 2 361 1 1 2 VAL O O 4.455 -3.267 4.127 1.00 . A A . 2 VAL O 1 1 2 362 1 1 3 PHE C C 2.454 -1.249 1.354 1.00 . A A . 3 PHE C 1 1 2 363 1 1 3 PHE CA C 3.786 -1.626 1.997 1.00 . A A . 3 PHE CA 1 1 2 364 1 1 3 PHE CB C 4.929 -0.884 1.302 1.00 . A A . 3 PHE CB 1 1 2 365 1 1 3 PHE CD1 C 6.786 -0.255 2.868 1.00 . A A . 3 PHE CD1 1 1 2 366 1 1 3 PHE CD2 C 5.137 1.387 2.349 1.00 . A A . 3 PHE CD2 1 1 2 367 1 1 3 PHE CE1 C 7.435 0.650 3.687 1.00 . A A . 3 PHE CE1 1 1 2 368 1 1 3 PHE CE2 C 5.782 2.297 3.165 1.00 . A A . 3 PHE CE2 1 1 2 369 1 1 3 PHE CG C 5.631 0.102 2.190 1.00 . A A . 3 PHE CG 1 1 2 370 1 1 3 PHE CZ C 6.931 1.927 3.836 1.00 . A A . 3 PHE CZ 1 1 2 371 1 1 3 PHE H H 3.914 -3.526 1.071 1.00 . A A . 3 PHE H 1 1 2 372 1 1 3 PHE HA H 3.763 -1.342 3.037 1.00 . A A . 3 PHE HA 1 1 2 373 1 1 3 PHE HB2 H 5.660 -1.601 0.961 1.00 . A A . 3 PHE HB2 1 1 2 374 1 1 3 PHE HB3 H 4.535 -0.346 0.453 1.00 . A A . 3 PHE HB3 1 1 2 375 1 1 3 PHE HD1 H 7.180 -1.255 2.752 1.00 . A A . 3 PHE HD1 1 1 2 376 1 1 3 PHE HD2 H 4.237 1.677 1.826 1.00 . A A . 3 PHE HD2 1 1 2 377 1 1 3 PHE HE1 H 8.333 0.358 4.210 1.00 . A A . 3 PHE HE1 1 1 2 378 1 1 3 PHE HE2 H 5.386 3.295 3.281 1.00 . A A . 3 PHE HE2 1 1 2 379 1 1 3 PHE HZ H 7.437 2.636 4.474 1.00 . A A . 3 PHE HZ 1 1 2 380 1 1 3 PHE N N 4.005 -3.067 1.932 1.00 . A A . 3 PHE N 1 1 2 381 1 1 3 PHE O O 2.276 -0.125 0.884 1.00 . A A . 3 PHE O 1 1 2 382 1 1 4 ARG C C -0.897 -2.261 1.761 1.00 . A A . 4 ARG C 1 1 2 383 1 1 4 ARG CA C 0.208 -1.965 0.751 1.00 . A A . 4 ARG CA 1 1 2 384 1 1 4 ARG CB C 0.022 -2.833 -0.495 1.00 . A A . 4 ARG CB 1 1 2 385 1 1 4 ARG CD C 1.025 -1.381 -2.284 1.00 . A A . 4 ARG CD 1 1 2 386 1 1 4 ARG CG C 1.141 -2.687 -1.512 1.00 . A A . 4 ARG CG 1 1 2 387 1 1 4 ARG CZ C 1.136 -2.018 -4.656 1.00 . A A . 4 ARG CZ 1 1 2 388 1 1 4 ARG H H 1.724 -3.073 1.727 1.00 . A A . 4 ARG H 1 1 2 389 1 1 4 ARG HA H 0.150 -0.925 0.466 1.00 . A A . 4 ARG HA 1 1 2 390 1 1 4 ARG HB2 H -0.027 -3.870 -0.193 1.00 . A A . 4 ARG HB2 1 1 2 391 1 1 4 ARG HB3 H -0.908 -2.561 -0.972 1.00 . A A . 4 ARG HB3 1 1 2 392 1 1 4 ARG HD2 H 0.398 -0.703 -1.725 1.00 . A A . 4 ARG HD2 1 1 2 393 1 1 4 ARG HD3 H 2.010 -0.954 -2.392 1.00 . A A . 4 ARG HD3 1 1 2 394 1 1 4 ARG HE H -0.506 -1.374 -3.725 1.00 . A A . 4 ARG HE 1 1 2 395 1 1 4 ARG HG2 H 2.089 -2.703 -0.996 1.00 . A A . 4 ARG HG2 1 1 2 396 1 1 4 ARG HG3 H 1.093 -3.511 -2.208 1.00 . A A . 4 ARG HG3 1 1 2 397 1 1 4 ARG HH11 H 2.878 -2.189 -3.647 1.00 . A A . 4 ARG HH11 1 1 2 398 1 1 4 ARG HH12 H 2.943 -2.635 -5.320 1.00 . A A . 4 ARG HH12 1 1 2 399 1 1 4 ARG HH21 H 1.059 -2.502 -6.617 1.00 . A A . 4 ARG HH21 1 1 2 400 1 1 4 ARG HH22 H -0.433 -1.957 -5.929 1.00 . A A . 4 ARG HH22 1 1 2 401 1 1 4 ARG N N 1.523 -2.197 1.337 1.00 . A A . 4 ARG N 1 1 2 402 1 1 4 ARG NE N 0.445 -1.579 -3.610 1.00 . A A . 4 ARG NE 1 1 2 403 1 1 4 ARG NH1 N 2.425 -2.304 -4.531 1.00 . A A . 4 ARG NH1 1 1 2 404 1 1 4 ARG NH2 N 0.538 -2.172 -5.830 1.00 . A A . 4 ARG NH2 1 1 2 405 1 1 4 ARG O O -2.025 -2.583 1.386 1.00 . A A . 4 ARG O 1 1 2 406 1 1 5 LEU C C -2.334 -1.153 4.427 1.00 . A A . 5 LEU C 1 1 2 407 1 1 5 LEU CA C -1.529 -2.408 4.107 1.00 . A A . 5 LEU CA 1 1 2 408 1 1 5 LEU CB C -0.811 -2.901 5.364 1.00 . A A . 5 LEU CB 1 1 2 409 1 1 5 LEU CD1 C -2.525 -4.448 6.341 1.00 . A A . 5 LEU CD1 1 1 2 410 1 1 5 LEU CD2 C -0.920 -5.292 4.618 1.00 . A A . 5 LEU CD2 1 1 2 411 1 1 5 LEU CG C -1.112 -4.339 5.789 1.00 . A A . 5 LEU CG 1 1 2 412 1 1 5 LEU H H 0.349 -1.892 3.279 1.00 . A A . 5 LEU H 1 1 2 413 1 1 5 LEU HA H -2.205 -3.177 3.763 1.00 . A A . 5 LEU HA 1 1 2 414 1 1 5 LEU HB2 H 0.251 -2.824 5.190 1.00 . A A . 5 LEU HB2 1 1 2 415 1 1 5 LEU HB3 H -1.089 -2.249 6.180 1.00 . A A . 5 LEU HB3 1 1 2 416 1 1 5 LEU HD11 H -2.650 -3.744 7.150 1.00 . A A . 5 LEU HD11 1 1 2 417 1 1 5 LEU HD12 H -2.693 -5.450 6.706 1.00 . A A . 5 LEU HD12 1 1 2 418 1 1 5 LEU HD13 H -3.235 -4.227 5.557 1.00 . A A . 5 LEU HD13 1 1 2 419 1 1 5 LEU HD21 H -0.075 -4.971 4.028 1.00 . A A . 5 LEU HD21 1 1 2 420 1 1 5 LEU HD22 H -1.809 -5.292 4.005 1.00 . A A . 5 LEU HD22 1 1 2 421 1 1 5 LEU HD23 H -0.741 -6.290 4.992 1.00 . A A . 5 LEU HD23 1 1 2 422 1 1 5 LEU HG H -0.425 -4.628 6.573 1.00 . A A . 5 LEU HG 1 1 2 423 1 1 5 LEU N N -0.565 -2.152 3.042 1.00 . A A . 5 LEU N 1 1 2 424 1 1 5 LEU O O -1.950 -0.044 4.054 1.00 . A A . 5 LEU O 1 1 2 425 1 1 6 LYS C C -3.616 0.688 6.508 1.00 . A A . 6 LYS C 1 1 2 426 1 1 6 LYS CA C -4.311 -0.216 5.495 1.00 . A A . 6 LYS CA 1 1 2 427 1 1 6 LYS CB C -5.629 -0.732 6.076 1.00 . A A . 6 LYS CB 1 1 2 428 1 1 6 LYS CD C -4.415 -1.959 7.901 1.00 . A A . 6 LYS CD 1 1 2 429 1 1 6 LYS CE C -4.575 -2.563 9.288 1.00 . A A . 6 LYS CE 1 1 2 430 1 1 6 LYS CG C -5.565 -1.024 7.565 1.00 . A A . 6 LYS CG 1 1 2 431 1 1 6 LYS H H -3.706 -2.242 5.389 1.00 . A A . 6 LYS H 1 1 2 432 1 1 6 LYS HA H -4.519 0.355 4.603 1.00 . A A . 6 LYS HA 1 1 2 433 1 1 6 LYS HB2 H -6.397 0.009 5.909 1.00 . A A . 6 LYS HB2 1 1 2 434 1 1 6 LYS HB3 H -5.903 -1.643 5.564 1.00 . A A . 6 LYS HB3 1 1 2 435 1 1 6 LYS HD2 H -4.388 -2.757 7.175 1.00 . A A . 6 LYS HD2 1 1 2 436 1 1 6 LYS HD3 H -3.489 -1.404 7.864 1.00 . A A . 6 LYS HD3 1 1 2 437 1 1 6 LYS HE2 H -3.945 -2.021 9.977 1.00 . A A . 6 LYS HE2 1 1 2 438 1 1 6 LYS HE3 H -5.607 -2.466 9.592 1.00 . A A . 6 LYS HE3 1 1 2 439 1 1 6 LYS HG2 H -5.427 -0.095 8.100 1.00 . A A . 6 LYS HG2 1 1 2 440 1 1 6 LYS HG3 H -6.493 -1.484 7.873 1.00 . A A . 6 LYS HG3 1 1 2 441 1 1 6 LYS HZ1 H -4.263 -4.373 10.282 1.00 . A A . 6 LYS HZ1 1 1 2 442 1 1 6 LYS HZ2 H -3.217 -4.119 8.977 1.00 . A A . 6 LYS HZ2 1 1 2 443 1 1 6 LYS HZ3 H -4.829 -4.550 8.698 1.00 . A A . 6 LYS HZ3 1 1 2 444 1 1 6 LYS N N -3.452 -1.334 5.121 1.00 . A A . 6 LYS N 1 1 2 445 1 1 6 LYS NZ N -4.194 -4.002 9.313 1.00 . A A . 6 LYS NZ 1 1 2 446 1 1 6 LYS O O -2.473 0.442 6.895 1.00 . A A . 6 LYS O 1 1 2 447 1 1 7 LYS C C -4.267 2.362 9.310 1.00 . A A . 7 LYS C 1 1 2 448 1 1 7 LYS CA C -3.765 2.676 7.905 1.00 . A A . 7 LYS CA 1 1 2 449 1 1 7 LYS CB C -4.143 4.110 7.525 1.00 . A A . 7 LYS CB 1 1 2 450 1 1 7 LYS CD C -2.544 4.146 5.589 1.00 . A A . 7 LYS CD 1 1 2 451 1 1 7 LYS CE C -1.958 5.346 4.860 1.00 . A A . 7 LYS CE 1 1 2 452 1 1 7 LYS CG C -3.967 4.415 6.048 1.00 . A A . 7 LYS CG 1 1 2 453 1 1 7 LYS H H -5.220 1.879 6.589 1.00 . A A . 7 LYS H 1 1 2 454 1 1 7 LYS HA H -2.690 2.580 7.889 1.00 . A A . 7 LYS HA 1 1 2 455 1 1 7 LYS HB2 H -5.178 4.278 7.785 1.00 . A A . 7 LYS HB2 1 1 2 456 1 1 7 LYS HB3 H -3.524 4.794 8.088 1.00 . A A . 7 LYS HB3 1 1 2 457 1 1 7 LYS HD2 H -1.931 3.929 6.451 1.00 . A A . 7 LYS HD2 1 1 2 458 1 1 7 LYS HD3 H -2.544 3.296 4.921 1.00 . A A . 7 LYS HD3 1 1 2 459 1 1 7 LYS HE2 H -2.267 5.310 3.827 1.00 . A A . 7 LYS HE2 1 1 2 460 1 1 7 LYS HE3 H -2.336 6.248 5.318 1.00 . A A . 7 LYS HE3 1 1 2 461 1 1 7 LYS HG2 H -4.641 3.792 5.478 1.00 . A A . 7 LYS HG2 1 1 2 462 1 1 7 LYS HG3 H -4.202 5.455 5.874 1.00 . A A . 7 LYS HG3 1 1 2 463 1 1 7 LYS HZ1 H -0.122 6.338 4.961 1.00 . A A . 7 LYS HZ1 1 1 2 464 1 1 7 LYS HZ2 H -0.074 4.897 4.077 1.00 . A A . 7 LYS HZ2 1 1 2 465 1 1 7 LYS HZ3 H -0.142 4.850 5.766 1.00 . A A . 7 LYS HZ3 1 1 2 466 1 1 7 LYS N N -4.313 1.736 6.935 1.00 . A A . 7 LYS N 1 1 2 467 1 1 7 LYS NZ N -0.470 5.359 4.920 1.00 . A A . 7 LYS NZ 1 1 2 468 1 1 7 LYS O O -4.789 3.236 10.003 1.00 . A A . 7 LYS O 1 1 2 469 1 1 8 TRP C C -3.455 -0.136 11.741 1.00 . A A . 8 TRP C 1 1 2 470 1 1 8 TRP CA C -4.539 0.683 11.050 1.00 . A A . 8 TRP CA 1 1 2 471 1 1 8 TRP CB C -5.827 -0.136 10.946 1.00 . A A . 8 TRP CB 1 1 2 472 1 1 8 TRP CD1 C -7.379 1.636 11.957 1.00 . A A . 8 TRP CD1 1 1 2 473 1 1 8 TRP CD2 C -7.681 -0.427 12.775 1.00 . A A . 8 TRP CD2 1 1 2 474 1 1 8 TRP CE2 C -8.589 0.445 13.408 1.00 . A A . 8 TRP CE2 1 1 2 475 1 1 8 TRP CE3 C -7.688 -1.779 13.128 1.00 . A A . 8 TRP CE3 1 1 2 476 1 1 8 TRP CG C -6.918 0.355 11.850 1.00 . A A . 8 TRP CG 1 1 2 477 1 1 8 TRP CH2 C -9.476 -1.322 14.700 1.00 . A A . 8 TRP CH2 1 1 2 478 1 1 8 TRP CZ2 C -9.491 0.007 14.374 1.00 . A A . 8 TRP CZ2 1 1 2 479 1 1 8 TRP CZ3 C -8.584 -2.212 14.087 1.00 . A A . 8 TRP CZ3 1 1 2 480 1 1 8 TRP H H -3.681 0.460 9.128 1.00 . A A . 8 TRP H 1 1 2 481 1 1 8 TRP HA H -4.733 1.569 11.637 1.00 . A A . 8 TRP HA 1 1 2 482 1 1 8 TRP HB2 H -6.192 -0.094 9.931 1.00 . A A . 8 TRP HB2 1 1 2 483 1 1 8 TRP HB3 H -5.614 -1.162 11.207 1.00 . A A . 8 TRP HB3 1 1 2 484 1 1 8 TRP HD1 H -6.999 2.469 11.385 1.00 . A A . 8 TRP HD1 1 1 2 485 1 1 8 TRP HE1 H -8.875 2.507 13.147 1.00 . A A . 8 TRP HE1 1 1 2 486 1 1 8 TRP HE3 H -7.009 -2.480 12.666 1.00 . A A . 8 TRP HE3 1 1 2 487 1 1 8 TRP HH2 H -10.157 -1.704 15.444 1.00 . A A . 8 TRP HH2 1 1 2 488 1 1 8 TRP HZ2 H -10.185 0.680 14.855 1.00 . A A . 8 TRP HZ2 1 1 2 489 1 1 8 TRP HZ3 H -8.604 -3.254 14.373 1.00 . A A . 8 TRP HZ3 1 1 2 490 1 1 8 TRP N N -4.104 1.111 9.726 1.00 . A A . 8 TRP N 1 1 2 491 1 1 8 TRP NE1 N -8.384 1.697 12.892 1.00 . A A . 8 TRP NE1 1 1 2 492 1 1 8 TRP O O -3.689 -0.728 12.795 1.00 . A A . 8 TRP O 1 1 2 493 1 1 9 ILE C C 0.172 -0.199 11.442 1.00 . A A . 9 ILE C 1 1 2 494 1 1 9 ILE CA C -1.150 -0.914 11.701 1.00 . A A . 9 ILE CA 1 1 2 495 1 1 9 ILE CB C -1.074 -2.337 11.117 1.00 . A A . 9 ILE CB 1 1 2 496 1 1 9 ILE CD1 C -0.041 -1.793 8.856 1.00 . A A . 9 ILE CD1 1 1 2 497 1 1 9 ILE CG1 C -1.258 -2.299 9.598 1.00 . A A . 9 ILE CG1 1 1 2 498 1 1 9 ILE CG2 C -2.125 -3.230 11.760 1.00 . A A . 9 ILE CG2 1 1 2 499 1 1 9 ILE H H -2.145 0.325 10.303 1.00 . A A . 9 ILE H 1 1 2 500 1 1 9 ILE HA H -1.302 -0.991 12.768 1.00 . A A . 9 ILE HA 1 1 2 501 1 1 9 ILE HB H -0.102 -2.744 11.345 1.00 . A A . 9 ILE HB 1 1 2 502 1 1 9 ILE HD11 H -0.083 -0.715 8.788 1.00 . A A . 9 ILE HD11 1 1 2 503 1 1 9 ILE HD12 H 0.853 -2.084 9.387 1.00 . A A . 9 ILE HD12 1 1 2 504 1 1 9 ILE HD13 H -0.023 -2.215 7.862 1.00 . A A . 9 ILE HD13 1 1 2 505 1 1 9 ILE HG12 H -1.472 -3.294 9.243 1.00 . A A . 9 ILE HG12 1 1 2 506 1 1 9 ILE HG13 H -2.087 -1.649 9.360 1.00 . A A . 9 ILE HG13 1 1 2 507 1 1 9 ILE HG21 H -2.239 -4.130 11.175 1.00 . A A . 9 ILE HG21 1 1 2 508 1 1 9 ILE HG22 H -1.812 -3.489 12.761 1.00 . A A . 9 ILE HG22 1 1 2 509 1 1 9 ILE HG23 H -3.067 -2.705 11.802 1.00 . A A . 9 ILE HG23 1 1 2 510 1 1 9 ILE N N -2.270 -0.167 11.141 1.00 . A A . 9 ILE N 1 1 2 511 1 1 9 ILE O O 1.212 -0.837 11.280 1.00 . A A . 9 ILE O 1 1 2 512 1 1 10 GLN C C 2.442 1.526 12.114 1.00 . A A . 10 GLN C 1 1 2 513 1 1 10 GLN CA C 1.317 1.931 11.166 1.00 . A A . 10 GLN CA 1 1 2 514 1 1 10 GLN CB C 1.001 3.418 11.336 1.00 . A A . 10 GLN CB 1 1 2 515 1 1 10 GLN CD C 1.189 5.731 10.338 1.00 . A A . 10 GLN CD 1 1 2 516 1 1 10 GLN CG C 1.244 4.238 10.079 1.00 . A A . 10 GLN CG 1 1 2 517 1 1 10 GLN H H -0.736 1.580 11.541 1.00 . A A . 10 GLN H 1 1 2 518 1 1 10 GLN HA H 1.638 1.754 10.151 1.00 . A A . 10 GLN HA 1 1 2 519 1 1 10 GLN HB2 H -0.036 3.524 11.615 1.00 . A A . 10 GLN HB2 1 1 2 520 1 1 10 GLN HB3 H 1.621 3.817 12.125 1.00 . A A . 10 GLN HB3 1 1 2 521 1 1 10 GLN HE21 H 2.281 7.250 11.010 1.00 . A A . 10 GLN HE21 1 1 2 522 1 1 10 GLN HE22 H 3.063 5.710 11.002 1.00 . A A . 10 GLN HE22 1 1 2 523 1 1 10 GLN HG2 H 2.220 3.992 9.687 1.00 . A A . 10 GLN HG2 1 1 2 524 1 1 10 GLN HG3 H 0.490 3.986 9.349 1.00 . A A . 10 GLN HG3 1 1 2 525 1 1 10 GLN N N 0.123 1.129 11.405 1.00 . A A . 10 GLN N 1 1 2 526 1 1 10 GLN NE2 N 2.288 6.287 10.834 1.00 . A A . 10 GLN NE2 1 1 2 527 1 1 10 GLN O O 3.619 1.740 11.823 1.00 . A A . 10 GLN O 1 1 2 528 1 1 10 GLN OE1 O 0.170 6.378 10.094 1.00 . A A . 10 GLN OE1 1 1 2 529 1 1 11 LYS C C 3.867 -0.671 13.716 1.00 . A A . 11 LYS C 1 1 2 530 1 1 11 LYS CA C 3.049 0.506 14.239 1.00 . A A . 11 LYS CA 1 1 2 531 1 1 11 LYS CB C 2.346 0.115 15.541 1.00 . A A . 11 LYS CB 1 1 2 532 1 1 11 LYS CD C 3.650 -1.745 16.613 1.00 . A A . 11 LYS CD 1 1 2 533 1 1 11 LYS CE C 2.952 -2.516 17.723 1.00 . A A . 11 LYS CE 1 1 2 534 1 1 11 LYS CG C 3.302 -0.267 16.657 1.00 . A A . 11 LYS CG 1 1 2 535 1 1 11 LYS H H 1.118 0.799 13.423 1.00 . A A . 11 LYS H 1 1 2 536 1 1 11 LYS HA H 3.715 1.333 14.434 1.00 . A A . 11 LYS HA 1 1 2 537 1 1 11 LYS HB2 H 1.747 0.948 15.877 1.00 . A A . 11 LYS HB2 1 1 2 538 1 1 11 LYS HB3 H 1.698 -0.728 15.346 1.00 . A A . 11 LYS HB3 1 1 2 539 1 1 11 LYS HD2 H 3.342 -2.151 15.660 1.00 . A A . 11 LYS HD2 1 1 2 540 1 1 11 LYS HD3 H 4.719 -1.858 16.726 1.00 . A A . 11 LYS HD3 1 1 2 541 1 1 11 LYS HE2 H 3.129 -2.011 18.660 1.00 . A A . 11 LYS HE2 1 1 2 542 1 1 11 LYS HE3 H 1.891 -2.534 17.518 1.00 . A A . 11 LYS HE3 1 1 2 543 1 1 11 LYS HG2 H 4.210 0.309 16.554 1.00 . A A . 11 LYS HG2 1 1 2 544 1 1 11 LYS HG3 H 2.839 -0.044 17.608 1.00 . A A . 11 LYS HG3 1 1 2 545 1 1 11 LYS HZ1 H 3.775 -4.248 16.894 1.00 . A A . 11 LYS HZ1 1 1 2 546 1 1 11 LYS HZ2 H 2.689 -4.542 18.158 1.00 . A A . 11 LYS HZ2 1 1 2 547 1 1 11 LYS HZ3 H 4.242 -3.965 18.495 1.00 . A A . 11 LYS HZ3 1 1 2 548 1 1 11 LYS N N 2.072 0.942 13.248 1.00 . A A . 11 LYS N 1 1 2 549 1 1 11 LYS NZ N 3.449 -3.916 17.824 1.00 . A A . 11 LYS NZ 1 1 2 550 1 1 11 LYS O O 5.096 -0.662 13.779 1.00 . A A . 11 LYS O 1 1 2 551 1 1 12 VAL C C 4.731 -2.507 11.481 1.00 . A A . 12 VAL C 1 1 2 552 1 1 12 VAL CA C 3.838 -2.865 12.663 1.00 . A A . 12 VAL CA 1 1 2 553 1 1 12 VAL CB C 2.816 -3.927 12.218 1.00 . A A . 12 VAL CB 1 1 2 554 1 1 12 VAL CG1 C 3.515 -5.077 11.509 1.00 . A A . 12 VAL CG1 1 1 2 555 1 1 12 VAL CG2 C 2.018 -4.431 13.410 1.00 . A A . 12 VAL CG2 1 1 2 556 1 1 12 VAL H H 2.198 -1.631 13.178 1.00 . A A . 12 VAL H 1 1 2 557 1 1 12 VAL HA H 4.449 -3.290 13.447 1.00 . A A . 12 VAL HA 1 1 2 558 1 1 12 VAL HB H 2.130 -3.468 11.521 1.00 . A A . 12 VAL HB 1 1 2 559 1 1 12 VAL HG11 H 2.792 -5.842 11.265 1.00 . A A . 12 VAL HG11 1 1 2 560 1 1 12 VAL HG12 H 3.977 -4.715 10.603 1.00 . A A . 12 VAL HG12 1 1 2 561 1 1 12 VAL HG13 H 4.272 -5.493 12.158 1.00 . A A . 12 VAL HG13 1 1 2 562 1 1 12 VAL HG21 H 2.552 -5.240 13.886 1.00 . A A . 12 VAL HG21 1 1 2 563 1 1 12 VAL HG22 H 1.879 -3.626 14.116 1.00 . A A . 12 VAL HG22 1 1 2 564 1 1 12 VAL HG23 H 1.054 -4.786 13.075 1.00 . A A . 12 VAL HG23 1 1 2 565 1 1 12 VAL N N 3.176 -1.682 13.200 1.00 . A A . 12 VAL N 1 1 2 566 1 1 12 VAL O O 5.911 -2.858 11.452 1.00 . A A . 12 VAL O 1 1 2 567 1 1 13 ILE C C 6.044 -0.452 9.687 1.00 . A A . 13 ILE C 1 1 2 568 1 1 13 ILE CA C 4.905 -1.398 9.322 1.00 . A A . 13 ILE CA 1 1 2 569 1 1 13 ILE CB C 3.990 -0.709 8.292 1.00 . A A . 13 ILE CB 1 1 2 570 1 1 13 ILE CD1 C 3.811 -0.268 5.791 1.00 . A A . 13 ILE CD1 1 1 2 571 1 1 13 ILE CG1 C 4.730 -0.522 6.966 1.00 . A A . 13 ILE CG1 1 1 2 572 1 1 13 ILE CG2 C 3.504 0.629 8.827 1.00 . A A . 13 ILE CG2 1 1 2 573 1 1 13 ILE H H 3.216 -1.556 10.588 1.00 . A A . 13 ILE H 1 1 2 574 1 1 13 ILE HA H 5.320 -2.286 8.868 1.00 . A A . 13 ILE HA 1 1 2 575 1 1 13 ILE HB H 3.129 -1.339 8.130 1.00 . A A . 13 ILE HB 1 1 2 576 1 1 13 ILE HD11 H 3.731 0.796 5.620 1.00 . A A . 13 ILE HD11 1 1 2 577 1 1 13 ILE HD12 H 4.213 -0.745 4.909 1.00 . A A . 13 ILE HD12 1 1 2 578 1 1 13 ILE HD13 H 2.833 -0.672 6.006 1.00 . A A . 13 ILE HD13 1 1 2 579 1 1 13 ILE HG12 H 5.399 0.320 7.050 1.00 . A A . 13 ILE HG12 1 1 2 580 1 1 13 ILE HG13 H 5.303 -1.413 6.753 1.00 . A A . 13 ILE HG13 1 1 2 581 1 1 13 ILE HG21 H 3.195 0.515 9.855 1.00 . A A . 13 ILE HG21 1 1 2 582 1 1 13 ILE HG22 H 4.304 1.351 8.771 1.00 . A A . 13 ILE HG22 1 1 2 583 1 1 13 ILE HG23 H 2.667 0.971 8.236 1.00 . A A . 13 ILE HG23 1 1 2 584 1 1 13 ILE N N 4.160 -1.806 10.507 1.00 . A A . 13 ILE N 1 1 2 585 1 1 13 ILE O O 7.101 -0.465 9.056 1.00 . A A . 13 ILE O 1 1 2 586 1 1 14 ASP C C 8.173 0.626 11.372 1.00 . A A . 14 ASP C 1 1 2 587 1 1 14 ASP CA C 6.830 1.317 11.161 1.00 . A A . 14 ASP CA 1 1 2 588 1 1 14 ASP CB C 6.381 1.992 12.458 1.00 . A A . 14 ASP CB 1 1 2 589 1 1 14 ASP CG C 5.841 3.390 12.227 1.00 . A A . 14 ASP CG 1 1 2 590 1 1 14 ASP H H 4.958 0.329 11.172 1.00 . A A . 14 ASP H 1 1 2 591 1 1 14 ASP HA H 6.942 2.070 10.395 1.00 . A A . 14 ASP HA 1 1 2 592 1 1 14 ASP HB2 H 5.603 1.397 12.915 1.00 . A A . 14 ASP HB2 1 1 2 593 1 1 14 ASP HB3 H 7.222 2.057 13.133 1.00 . A A . 14 ASP HB3 1 1 2 594 1 1 14 ASP N N 5.821 0.366 10.710 1.00 . A A . 14 ASP N 1 1 2 595 1 1 14 ASP O O 9.228 1.246 11.239 1.00 . A A . 14 ASP O 1 1 2 596 1 1 14 ASP OD1 O 5.351 3.660 11.111 1.00 . A A . 14 ASP OD1 1 1 2 597 1 1 14 ASP OD2 O 5.909 4.214 13.163 1.00 . A A . 14 ASP OD2 1 1 2 598 1 1 15 GLN C C 9.547 -2.464 10.825 1.00 . A A . 15 GLN C 1 1 2 599 1 1 15 GLN CA C 9.339 -1.435 11.932 1.00 . A A . 15 GLN CA 1 1 2 600 1 1 15 GLN CB C 9.273 -2.135 13.290 1.00 . A A . 15 GLN CB 1 1 2 601 1 1 15 GLN CD C 9.392 -1.828 15.795 1.00 . A A . 15 GLN CD 1 1 2 602 1 1 15 GLN CG C 9.798 -1.288 14.438 1.00 . A A . 15 GLN CG 1 1 2 603 1 1 15 GLN H H 7.254 -1.099 11.792 1.00 . A A . 15 GLN H 1 1 2 604 1 1 15 GLN HA H 10.174 -0.751 11.930 1.00 . A A . 15 GLN HA 1 1 2 605 1 1 15 GLN HB2 H 8.245 -2.391 13.500 1.00 . A A . 15 GLN HB2 1 1 2 606 1 1 15 GLN HB3 H 9.858 -3.042 13.243 1.00 . A A . 15 GLN HB3 1 1 2 607 1 1 15 GLN HE21 H 8.153 -1.494 17.313 1.00 . A A . 15 GLN HE21 1 1 2 608 1 1 15 GLN HE22 H 8.049 -0.377 15.999 1.00 . A A . 15 GLN HE22 1 1 2 609 1 1 15 GLN HG2 H 10.876 -1.262 14.385 1.00 . A A . 15 GLN HG2 1 1 2 610 1 1 15 GLN HG3 H 9.409 -0.286 14.335 1.00 . A A . 15 GLN HG3 1 1 2 611 1 1 15 GLN N N 8.126 -0.661 11.701 1.00 . A A . 15 GLN N 1 1 2 612 1 1 15 GLN NE2 N 8.435 -1.166 16.434 1.00 . A A . 15 GLN NE2 1 1 2 613 1 1 15 GLN O O 10.634 -3.023 10.679 1.00 . A A . 15 GLN O 1 1 2 614 1 1 15 GLN OE1 O 9.934 -2.830 16.264 1.00 . A A . 15 GLN OE1 1 1 2 615 1 1 16 PHE C C 9.113 -5.011 9.443 1.00 . A A . 16 PHE C 1 1 2 616 1 1 16 PHE CA C 8.563 -3.674 8.956 1.00 . A A . 16 PHE CA 1 1 2 617 1 1 16 PHE CB C 9.438 -3.132 7.823 1.00 . A A . 16 PHE CB 1 1 2 618 1 1 16 PHE CD1 C 8.699 -4.588 5.918 1.00 . A A . 16 PHE CD1 1 1 2 619 1 1 16 PHE CD2 C 10.994 -4.643 6.561 1.00 . A A . 16 PHE CD2 1 1 2 620 1 1 16 PHE CE1 C 8.951 -5.516 4.925 1.00 . A A . 16 PHE CE1 1 1 2 621 1 1 16 PHE CE2 C 11.252 -5.571 5.570 1.00 . A A . 16 PHE CE2 1 1 2 622 1 1 16 PHE CG C 9.716 -4.141 6.746 1.00 . A A . 16 PHE CG 1 1 2 623 1 1 16 PHE CZ C 10.229 -6.009 4.752 1.00 . A A . 16 PHE CZ 1 1 2 624 1 1 16 PHE H H 7.657 -2.233 10.215 1.00 . A A . 16 PHE H 1 1 2 625 1 1 16 PHE HA H 7.561 -3.823 8.585 1.00 . A A . 16 PHE HA 1 1 2 626 1 1 16 PHE HB2 H 8.943 -2.289 7.367 1.00 . A A . 16 PHE HB2 1 1 2 627 1 1 16 PHE HB3 H 10.385 -2.812 8.231 1.00 . A A . 16 PHE HB3 1 1 2 628 1 1 16 PHE HD1 H 7.698 -4.203 6.053 1.00 . A A . 16 PHE HD1 1 1 2 629 1 1 16 PHE HD2 H 11.795 -4.303 7.201 1.00 . A A . 16 PHE HD2 1 1 2 630 1 1 16 PHE HE1 H 8.149 -5.856 4.287 1.00 . A A . 16 PHE HE1 1 1 2 631 1 1 16 PHE HE2 H 12.253 -5.955 5.437 1.00 . A A . 16 PHE HE2 1 1 2 632 1 1 16 PHE HZ H 10.429 -6.734 3.977 1.00 . A A . 16 PHE HZ 1 1 2 633 1 1 16 PHE N N 8.497 -2.710 10.049 1.00 . A A . 16 PHE N 1 1 2 634 1 1 16 PHE O O 10.314 -5.264 9.372 1.00 . A A . 16 PHE O 1 1 2 635 1 1 17 GLY C C 9.383 -7.971 9.387 1.00 . A A . 17 GLY C 1 1 2 636 1 1 17 GLY CA C 8.635 -7.166 10.431 1.00 . A A . 17 GLY CA 1 1 2 637 1 1 17 GLY H H 7.276 -5.609 9.970 1.00 . A A . 17 GLY H 1 1 2 638 1 1 17 GLY HA2 H 9.275 -7.027 11.290 1.00 . A A . 17 GLY HA2 1 1 2 639 1 1 17 GLY HA3 H 7.758 -7.719 10.734 1.00 . A A . 17 GLY HA3 1 1 2 640 1 1 17 GLY N N 8.222 -5.865 9.939 1.00 . A A . 17 GLY N 1 1 2 641 1 1 17 GLY O O 10.605 -7.876 9.279 1.00 . A A . 17 GLY O 1 1 2 642 1 1 18 GLU C C 9.221 -8.878 6.228 1.00 . A A . 18 GLU C 1 1 2 643 1 1 18 GLU CA C 9.250 -9.592 7.577 1.00 . A A . 18 GLU CA 1 1 2 644 1 1 18 GLU CB C 8.519 -10.932 7.472 1.00 . A A . 18 GLU CB 1 1 2 645 1 1 18 GLU CD C 10.283 -12.686 7.912 1.00 . A A . 18 GLU CD 1 1 2 646 1 1 18 GLU CG C 9.370 -12.046 6.885 1.00 . A A . 18 GLU CG 1 1 2 647 1 1 18 GLU H H 7.677 -8.798 8.750 1.00 . A A . 18 GLU H 1 1 2 648 1 1 18 GLU HA H 10.278 -9.774 7.852 1.00 . A A . 18 GLU HA 1 1 2 649 1 1 18 GLU HB2 H 8.200 -11.233 8.459 1.00 . A A . 18 GLU HB2 1 1 2 650 1 1 18 GLU HB3 H 7.649 -10.805 6.845 1.00 . A A . 18 GLU HB3 1 1 2 651 1 1 18 GLU HG2 H 8.718 -12.806 6.482 1.00 . A A . 18 GLU HG2 1 1 2 652 1 1 18 GLU HG3 H 9.978 -11.636 6.091 1.00 . A A . 18 GLU HG3 1 1 2 653 1 1 18 GLU N N 8.647 -8.766 8.616 1.00 . A A . 18 GLU N 1 1 2 654 1 1 18 GLU O O 8.264 -9.009 5.466 1.00 . A A . 18 GLU O 1 1 2 655 1 1 18 GLU OE1 O 10.883 -13.736 7.600 1.00 . A A . 18 GLU OE1 1 1 2 656 1 1 18 GLU OE2 O 10.397 -12.138 9.029 1.00 . A A . 18 GLU OE2 1 1 3 657 1 1 1 HIS C C -1.425 -3.271 -0.391 1.00 . A A . 1 HIS C 1 1 3 658 1 1 1 HIS CA C -1.606 -3.673 -1.852 1.00 . A A . 1 HIS CA 1 1 3 659 1 1 1 HIS CB C -3.073 -3.527 -2.255 1.00 . A A . 1 HIS CB 1 1 3 660 1 1 1 HIS CD2 C -4.027 -1.514 -3.583 1.00 . A A . 1 HIS CD2 1 1 3 661 1 1 1 HIS CE1 C -3.822 0.020 -2.030 1.00 . A A . 1 HIS CE1 1 1 3 662 1 1 1 HIS CG C -3.492 -2.109 -2.492 1.00 . A A . 1 HIS CG 1 1 3 663 1 1 1 HIS H1 H -0.782 -5.550 -1.323 1.00 . A A . 1 HIS H1 1 1 3 664 1 1 1 HIS HA H -1.006 -3.021 -2.468 1.00 . A A . 1 HIS HA 1 1 3 665 1 1 1 HIS HB2 H -3.245 -4.080 -3.167 1.00 . A A . 1 HIS HB2 1 1 3 666 1 1 1 HIS HB3 H -3.697 -3.932 -1.472 1.00 . A A . 1 HIS HB3 1 1 3 667 1 1 1 HIS HD1 H -3.020 -1.239 -0.632 1.00 . A A . 1 HIS HD1 1 1 3 668 1 1 1 HIS HD2 H -4.257 -1.990 -4.526 1.00 . A A . 1 HIS HD2 1 1 3 669 1 1 1 HIS HE1 H -3.855 0.965 -1.509 1.00 . A A . 1 HIS HE1 1 1 3 670 1 1 1 HIS N N -1.152 -5.041 -2.074 1.00 . A A . 1 HIS N 1 1 3 671 1 1 1 HIS ND1 N -3.375 -1.121 -1.537 1.00 . A A . 1 HIS ND1 1 1 3 672 1 1 1 HIS NE2 N -4.223 -0.191 -3.271 1.00 . A A . 1 HIS NE2 1 1 3 673 1 1 1 HIS O O -1.127 -2.116 -0.086 1.00 . A A . 1 HIS O 1 1 3 674 1 1 2 VAL C C -0.062 -3.486 2.271 1.00 . A A . 2 VAL C 1 1 3 675 1 1 2 VAL CA C -1.466 -3.979 1.938 1.00 . A A . 2 VAL CA 1 1 3 676 1 1 2 VAL CB C -1.764 -5.243 2.765 1.00 . A A . 2 VAL CB 1 1 3 677 1 1 2 VAL CG1 C -3.183 -5.728 2.507 1.00 . A A . 2 VAL CG1 1 1 3 678 1 1 2 VAL CG2 C -0.754 -6.336 2.449 1.00 . A A . 2 VAL CG2 1 1 3 679 1 1 2 VAL H H -1.845 -5.133 0.205 1.00 . A A . 2 VAL H 1 1 3 680 1 1 2 VAL HA H -2.180 -3.216 2.215 1.00 . A A . 2 VAL HA 1 1 3 681 1 1 2 VAL HB H -1.677 -4.993 3.812 1.00 . A A . 2 VAL HB 1 1 3 682 1 1 2 VAL HG11 H -3.585 -5.219 1.644 1.00 . A A . 2 VAL HG11 1 1 3 683 1 1 2 VAL HG12 H -3.173 -6.793 2.327 1.00 . A A . 2 VAL HG12 1 1 3 684 1 1 2 VAL HG13 H -3.798 -5.514 3.369 1.00 . A A . 2 VAL HG13 1 1 3 685 1 1 2 VAL HG21 H -0.629 -6.414 1.380 1.00 . A A . 2 VAL HG21 1 1 3 686 1 1 2 VAL HG22 H 0.194 -6.092 2.906 1.00 . A A . 2 VAL HG22 1 1 3 687 1 1 2 VAL HG23 H -1.108 -7.279 2.840 1.00 . A A . 2 VAL HG23 1 1 3 688 1 1 2 VAL N N -1.609 -4.232 0.509 1.00 . A A . 2 VAL N 1 1 3 689 1 1 2 VAL O O 0.136 -2.752 3.239 1.00 . A A . 2 VAL O 1 1 3 690 1 1 3 PHE C C 2.460 -1.988 1.503 1.00 . A A . 3 PHE C 1 1 3 691 1 1 3 PHE CA C 2.297 -3.495 1.671 1.00 . A A . 3 PHE CA 1 1 3 692 1 1 3 PHE CB C 3.215 -4.231 0.693 1.00 . A A . 3 PHE CB 1 1 3 693 1 1 3 PHE CD1 C 4.937 -5.829 1.574 1.00 . A A . 3 PHE CD1 1 1 3 694 1 1 3 PHE CD2 C 2.721 -6.635 1.218 1.00 . A A . 3 PHE CD2 1 1 3 695 1 1 3 PHE CE1 C 5.325 -7.080 2.016 1.00 . A A . 3 PHE CE1 1 1 3 696 1 1 3 PHE CE2 C 3.103 -7.888 1.659 1.00 . A A . 3 PHE CE2 1 1 3 697 1 1 3 PHE CG C 3.632 -5.592 1.171 1.00 . A A . 3 PHE CG 1 1 3 698 1 1 3 PHE CZ C 4.406 -8.111 2.057 1.00 . A A . 3 PHE CZ 1 1 3 699 1 1 3 PHE H H 0.689 -4.479 0.707 1.00 . A A . 3 PHE H 1 1 3 700 1 1 3 PHE HA H 2.570 -3.764 2.680 1.00 . A A . 3 PHE HA 1 1 3 701 1 1 3 PHE HB2 H 2.701 -4.355 -0.248 1.00 . A A . 3 PHE HB2 1 1 3 702 1 1 3 PHE HB3 H 4.107 -3.644 0.537 1.00 . A A . 3 PHE HB3 1 1 3 703 1 1 3 PHE HD1 H 5.656 -5.023 1.542 1.00 . A A . 3 PHE HD1 1 1 3 704 1 1 3 PHE HD2 H 1.701 -6.462 0.906 1.00 . A A . 3 PHE HD2 1 1 3 705 1 1 3 PHE HE1 H 6.345 -7.251 2.326 1.00 . A A . 3 PHE HE1 1 1 3 706 1 1 3 PHE HE2 H 2.383 -8.692 1.690 1.00 . A A . 3 PHE HE2 1 1 3 707 1 1 3 PHE HZ H 4.707 -9.089 2.402 1.00 . A A . 3 PHE HZ 1 1 3 708 1 1 3 PHE N N 0.910 -3.895 1.462 1.00 . A A . 3 PHE N 1 1 3 709 1 1 3 PHE O O 3.367 -1.383 2.074 1.00 . A A . 3 PHE O 1 1 3 710 1 1 4 ARG C C 0.824 0.808 1.525 1.00 . A A . 4 ARG C 1 1 3 711 1 1 4 ARG CA C 1.621 0.049 0.467 1.00 . A A . 4 ARG CA 1 1 3 712 1 1 4 ARG CB C 1.074 0.367 -0.925 1.00 . A A . 4 ARG CB 1 1 3 713 1 1 4 ARG CD C 1.813 -1.430 -2.519 1.00 . A A . 4 ARG CD 1 1 3 714 1 1 4 ARG CG C 2.026 0.002 -2.052 1.00 . A A . 4 ARG CG 1 1 3 715 1 1 4 ARG CZ C 1.726 -2.658 -4.646 1.00 . A A . 4 ARG CZ 1 1 3 716 1 1 4 ARG H H 0.875 -1.923 0.286 1.00 . A A . 4 ARG H 1 1 3 717 1 1 4 ARG HA H 2.653 0.361 0.519 1.00 . A A . 4 ARG HA 1 1 3 718 1 1 4 ARG HB2 H 0.153 -0.178 -1.070 1.00 . A A . 4 ARG HB2 1 1 3 719 1 1 4 ARG HB3 H 0.869 1.426 -0.985 1.00 . A A . 4 ARG HB3 1 1 3 720 1 1 4 ARG HD2 H 2.478 -2.077 -1.967 1.00 . A A . 4 ARG HD2 1 1 3 721 1 1 4 ARG HD3 H 0.790 -1.711 -2.318 1.00 . A A . 4 ARG HD3 1 1 3 722 1 1 4 ARG HE H 2.538 -0.853 -4.405 1.00 . A A . 4 ARG HE 1 1 3 723 1 1 4 ARG HG2 H 1.856 0.669 -2.885 1.00 . A A . 4 ARG HG2 1 1 3 724 1 1 4 ARG HG3 H 3.041 0.110 -1.702 1.00 . A A . 4 ARG HG3 1 1 3 725 1 1 4 ARG HH11 H 0.890 -3.617 -3.076 1.00 . A A . 4 ARG HH11 1 1 3 726 1 1 4 ARG HH12 H 0.836 -4.472 -4.582 1.00 . A A . 4 ARG HH12 1 1 3 727 1 1 4 ARG HH21 H 1.736 -3.534 -6.468 1.00 . A A . 4 ARG HH21 1 1 3 728 1 1 4 ARG HH22 H 2.472 -1.969 -6.394 1.00 . A A . 4 ARG HH22 1 1 3 729 1 1 4 ARG N N 1.575 -1.387 0.713 1.00 . A A . 4 ARG N 1 1 3 730 1 1 4 ARG NE N 2.076 -1.585 -3.947 1.00 . A A . 4 ARG NE 1 1 3 731 1 1 4 ARG NH1 N 1.100 -3.665 -4.053 1.00 . A A . 4 ARG NH1 1 1 3 732 1 1 4 ARG NH2 N 2.001 -2.726 -5.943 1.00 . A A . 4 ARG NH2 1 1 3 733 1 1 4 ARG O O 1.094 1.977 1.800 1.00 . A A . 4 ARG O 1 1 3 734 1 1 5 LEU C C -0.141 1.371 4.238 1.00 . A A . 5 LEU C 1 1 3 735 1 1 5 LEU CA C -0.995 0.745 3.141 1.00 . A A . 5 LEU CA 1 1 3 736 1 1 5 LEU CB C -1.937 -0.298 3.745 1.00 . A A . 5 LEU CB 1 1 3 737 1 1 5 LEU CD1 C -3.895 1.190 4.231 1.00 . A A . 5 LEU CD1 1 1 3 738 1 1 5 LEU CD2 C -3.731 0.024 2.023 1.00 . A A . 5 LEU CD2 1 1 3 739 1 1 5 LEU CG C -3.431 -0.068 3.512 1.00 . A A . 5 LEU CG 1 1 3 740 1 1 5 LEU H H -0.325 -0.795 1.852 1.00 . A A . 5 LEU H 1 1 3 741 1 1 5 LEU HA H -1.583 1.520 2.672 1.00 . A A . 5 LEU HA 1 1 3 742 1 1 5 LEU HB2 H -1.681 -1.258 3.323 1.00 . A A . 5 LEU HB2 1 1 3 743 1 1 5 LEU HB3 H -1.766 -0.319 4.812 1.00 . A A . 5 LEU HB3 1 1 3 744 1 1 5 LEU HD11 H -3.243 2.011 3.975 1.00 . A A . 5 LEU HD11 1 1 3 745 1 1 5 LEU HD12 H -3.867 1.026 5.298 1.00 . A A . 5 LEU HD12 1 1 3 746 1 1 5 LEU HD13 H -4.906 1.424 3.930 1.00 . A A . 5 LEU HD13 1 1 3 747 1 1 5 LEU HD21 H -4.508 -0.681 1.769 1.00 . A A . 5 LEU HD21 1 1 3 748 1 1 5 LEU HD22 H -2.838 -0.205 1.462 1.00 . A A . 5 LEU HD22 1 1 3 749 1 1 5 LEU HD23 H -4.059 1.026 1.784 1.00 . A A . 5 LEU HD23 1 1 3 750 1 1 5 LEU HG H -3.985 -0.905 3.915 1.00 . A A . 5 LEU HG 1 1 3 751 1 1 5 LEU N N -0.158 0.134 2.114 1.00 . A A . 5 LEU N 1 1 3 752 1 1 5 LEU O O -0.084 2.593 4.375 1.00 . A A . 5 LEU O 1 1 3 753 1 1 6 LYS C C 0.632 1.978 6.997 1.00 . A A . 6 LYS C 1 1 3 754 1 1 6 LYS CA C 1.379 0.995 6.102 1.00 . A A . 6 LYS CA 1 1 3 755 1 1 6 LYS CB C 2.637 1.658 5.536 1.00 . A A . 6 LYS CB 1 1 3 756 1 1 6 LYS CD C 3.956 -0.477 5.644 1.00 . A A . 6 LYS CD 1 1 3 757 1 1 6 LYS CE C 3.017 -1.660 5.463 1.00 . A A . 6 LYS CE 1 1 3 758 1 1 6 LYS CG C 3.541 0.701 4.778 1.00 . A A . 6 LYS CG 1 1 3 759 1 1 6 LYS H H 0.439 -0.439 4.860 1.00 . A A . 6 LYS H 1 1 3 760 1 1 6 LYS HA H 1.668 0.138 6.691 1.00 . A A . 6 LYS HA 1 1 3 761 1 1 6 LYS HB2 H 2.341 2.449 4.864 1.00 . A A . 6 LYS HB2 1 1 3 762 1 1 6 LYS HB3 H 3.203 2.084 6.352 1.00 . A A . 6 LYS HB3 1 1 3 763 1 1 6 LYS HD2 H 4.956 -0.780 5.369 1.00 . A A . 6 LYS HD2 1 1 3 764 1 1 6 LYS HD3 H 3.943 -0.173 6.681 1.00 . A A . 6 LYS HD3 1 1 3 765 1 1 6 LYS HE2 H 2.403 -1.754 6.345 1.00 . A A . 6 LYS HE2 1 1 3 766 1 1 6 LYS HE3 H 2.389 -1.475 4.604 1.00 . A A . 6 LYS HE3 1 1 3 767 1 1 6 LYS HG2 H 3.012 0.329 3.913 1.00 . A A . 6 LYS HG2 1 1 3 768 1 1 6 LYS HG3 H 4.427 1.232 4.460 1.00 . A A . 6 LYS HG3 1 1 3 769 1 1 6 LYS HZ1 H 3.405 -3.421 4.408 1.00 . A A . 6 LYS HZ1 1 1 3 770 1 1 6 LYS HZ2 H 3.643 -3.555 6.078 1.00 . A A . 6 LYS HZ2 1 1 3 771 1 1 6 LYS HZ3 H 4.775 -2.736 5.125 1.00 . A A . 6 LYS HZ3 1 1 3 772 1 1 6 LYS N N 0.524 0.525 5.018 1.00 . A A . 6 LYS N 1 1 3 773 1 1 6 LYS NZ N 3.762 -2.932 5.253 1.00 . A A . 6 LYS NZ 1 1 3 774 1 1 6 LYS O O 1.137 3.057 7.309 1.00 . A A . 6 LYS O 1 1 3 775 1 1 7 LYS C C -2.279 1.600 9.178 1.00 . A A . 7 LYS C 1 1 3 776 1 1 7 LYS CA C -1.388 2.444 8.272 1.00 . A A . 7 LYS CA 1 1 3 777 1 1 7 LYS CB C -2.249 3.388 7.429 1.00 . A A . 7 LYS CB 1 1 3 778 1 1 7 LYS CD C -2.763 5.598 8.507 1.00 . A A . 7 LYS CD 1 1 3 779 1 1 7 LYS CE C -2.543 5.160 9.947 1.00 . A A . 7 LYS CE 1 1 3 780 1 1 7 LYS CG C -1.849 4.848 7.552 1.00 . A A . 7 LYS CG 1 1 3 781 1 1 7 LYS H H -0.921 0.726 7.128 1.00 . A A . 7 LYS H 1 1 3 782 1 1 7 LYS HA H -0.723 3.031 8.887 1.00 . A A . 7 LYS HA 1 1 3 783 1 1 7 LYS HB2 H -2.166 3.100 6.391 1.00 . A A . 7 LYS HB2 1 1 3 784 1 1 7 LYS HB3 H -3.279 3.291 7.740 1.00 . A A . 7 LYS HB3 1 1 3 785 1 1 7 LYS HD2 H -2.561 6.656 8.430 1.00 . A A . 7 LYS HD2 1 1 3 786 1 1 7 LYS HD3 H -3.791 5.405 8.234 1.00 . A A . 7 LYS HD3 1 1 3 787 1 1 7 LYS HE2 H -3.432 4.660 10.298 1.00 . A A . 7 LYS HE2 1 1 3 788 1 1 7 LYS HE3 H -1.708 4.475 9.978 1.00 . A A . 7 LYS HE3 1 1 3 789 1 1 7 LYS HG2 H -0.836 4.905 7.921 1.00 . A A . 7 LYS HG2 1 1 3 790 1 1 7 LYS HG3 H -1.906 5.311 6.577 1.00 . A A . 7 LYS HG3 1 1 3 791 1 1 7 LYS HZ1 H -2.928 7.086 10.658 1.00 . A A . 7 LYS HZ1 1 1 3 792 1 1 7 LYS HZ2 H -1.289 6.667 10.669 1.00 . A A . 7 LYS HZ2 1 1 3 793 1 1 7 LYS HZ3 H -2.333 6.028 11.836 1.00 . A A . 7 LYS HZ3 1 1 3 794 1 1 7 LYS N N -0.572 1.598 7.410 1.00 . A A . 7 LYS N 1 1 3 795 1 1 7 LYS NZ N -2.253 6.316 10.840 1.00 . A A . 7 LYS NZ 1 1 3 796 1 1 7 LYS O O -2.368 1.846 10.381 1.00 . A A . 7 LYS O 1 1 3 797 1 1 8 TRP C C -3.026 -1.122 10.339 1.00 . A A . 8 TRP C 1 1 3 798 1 1 8 TRP CA C -3.819 -0.277 9.347 1.00 . A A . 8 TRP CA 1 1 3 799 1 1 8 TRP CB C -4.602 -1.184 8.397 1.00 . A A . 8 TRP CB 1 1 3 800 1 1 8 TRP CD1 C -7.003 -0.323 8.149 1.00 . A A . 8 TRP CD1 1 1 3 801 1 1 8 TRP CD2 C -6.796 -2.096 9.501 1.00 . A A . 8 TRP CD2 1 1 3 802 1 1 8 TRP CE2 C -8.154 -1.725 9.451 1.00 . A A . 8 TRP CE2 1 1 3 803 1 1 8 TRP CE3 C -6.425 -3.189 10.289 1.00 . A A . 8 TRP CE3 1 1 3 804 1 1 8 TRP CG C -6.078 -1.187 8.661 1.00 . A A . 8 TRP CG 1 1 3 805 1 1 8 TRP CH2 C -8.747 -3.474 10.924 1.00 . A A . 8 TRP CH2 1 1 3 806 1 1 8 TRP CZ2 C -9.139 -2.408 10.161 1.00 . A A . 8 TRP CZ2 1 1 3 807 1 1 8 TRP CZ3 C -7.403 -3.866 10.992 1.00 . A A . 8 TRP CZ3 1 1 3 808 1 1 8 TRP H H -2.824 0.459 7.629 1.00 . A A . 8 TRP H 1 1 3 809 1 1 8 TRP HA H -4.514 0.342 9.895 1.00 . A A . 8 TRP HA 1 1 3 810 1 1 8 TRP HB2 H -4.446 -0.852 7.382 1.00 . A A . 8 TRP HB2 1 1 3 811 1 1 8 TRP HB3 H -4.242 -2.197 8.500 1.00 . A A . 8 TRP HB3 1 1 3 812 1 1 8 TRP HD1 H -6.771 0.488 7.475 1.00 . A A . 8 TRP HD1 1 1 3 813 1 1 8 TRP HE1 H -9.083 -0.167 8.397 1.00 . A A . 8 TRP HE1 1 1 3 814 1 1 8 TRP HE3 H -5.395 -3.506 10.354 1.00 . A A . 8 TRP HE3 1 1 3 815 1 1 8 TRP HH2 H -9.477 -4.031 11.490 1.00 . A A . 8 TRP HH2 1 1 3 816 1 1 8 TRP HZ2 H -10.179 -2.118 10.118 1.00 . A A . 8 TRP HZ2 1 1 3 817 1 1 8 TRP HZ3 H -7.136 -4.713 11.607 1.00 . A A . 8 TRP HZ3 1 1 3 818 1 1 8 TRP N N -2.936 0.605 8.592 1.00 . A A . 8 TRP N 1 1 3 819 1 1 8 TRP NE1 N -8.254 -0.640 8.621 1.00 . A A . 8 TRP NE1 1 1 3 820 1 1 8 TRP O O -3.600 -1.756 11.225 1.00 . A A . 8 TRP O 1 1 3 821 1 1 9 ILE C C 0.614 -1.444 10.934 1.00 . A A . 9 ILE C 1 1 3 822 1 1 9 ILE CA C -0.837 -1.894 11.066 1.00 . A A . 9 ILE CA 1 1 3 823 1 1 9 ILE CB C -0.924 -3.403 10.770 1.00 . A A . 9 ILE CB 1 1 3 824 1 1 9 ILE CD1 C -0.200 -3.031 8.359 1.00 . A A . 9 ILE CD1 1 1 3 825 1 1 9 ILE CG1 C -1.227 -3.638 9.289 1.00 . A A . 9 ILE CG1 1 1 3 826 1 1 9 ILE CG2 C -1.986 -4.053 11.644 1.00 . A A . 9 ILE CG2 1 1 3 827 1 1 9 ILE H H -1.309 -0.602 9.458 1.00 . A A . 9 ILE H 1 1 3 828 1 1 9 ILE HA H -1.163 -1.727 12.082 1.00 . A A . 9 ILE HA 1 1 3 829 1 1 9 ILE HB H 0.029 -3.849 11.011 1.00 . A A . 9 ILE HB 1 1 3 830 1 1 9 ILE HD11 H 0.762 -3.009 8.850 1.00 . A A . 9 ILE HD11 1 1 3 831 1 1 9 ILE HD12 H -0.131 -3.627 7.461 1.00 . A A . 9 ILE HD12 1 1 3 832 1 1 9 ILE HD13 H -0.496 -2.025 8.102 1.00 . A A . 9 ILE HD13 1 1 3 833 1 1 9 ILE HG12 H -1.260 -4.699 9.099 1.00 . A A . 9 ILE HG12 1 1 3 834 1 1 9 ILE HG13 H -2.188 -3.204 9.053 1.00 . A A . 9 ILE HG13 1 1 3 835 1 1 9 ILE HG21 H -2.362 -3.330 12.353 1.00 . A A . 9 ILE HG21 1 1 3 836 1 1 9 ILE HG22 H -2.797 -4.403 11.023 1.00 . A A . 9 ILE HG22 1 1 3 837 1 1 9 ILE HG23 H -1.554 -4.887 12.176 1.00 . A A . 9 ILE HG23 1 1 3 838 1 1 9 ILE N N -1.707 -1.127 10.183 1.00 . A A . 9 ILE N 1 1 3 839 1 1 9 ILE O O 1.539 -2.218 11.183 1.00 . A A . 9 ILE O 1 1 3 840 1 1 10 GLN C C 2.989 0.125 11.628 1.00 . A A . 10 GLN C 1 1 3 841 1 1 10 GLN CA C 2.145 0.365 10.380 1.00 . A A . 10 GLN CA 1 1 3 842 1 1 10 GLN CB C 2.068 1.863 10.081 1.00 . A A . 10 GLN CB 1 1 3 843 1 1 10 GLN CD C 1.759 4.197 10.997 1.00 . A A . 10 GLN CD 1 1 3 844 1 1 10 GLN CG C 1.892 2.722 11.322 1.00 . A A . 10 GLN CG 1 1 3 845 1 1 10 GLN H H 0.029 0.379 10.360 1.00 . A A . 10 GLN H 1 1 3 846 1 1 10 GLN HA H 2.611 -0.136 9.545 1.00 . A A . 10 GLN HA 1 1 3 847 1 1 10 GLN HB2 H 2.978 2.166 9.585 1.00 . A A . 10 GLN HB2 1 1 3 848 1 1 10 GLN HB3 H 1.232 2.044 9.422 1.00 . A A . 10 GLN HB3 1 1 3 849 1 1 10 GLN HE21 H 2.818 5.872 10.838 1.00 . A A . 10 GLN HE21 1 1 3 850 1 1 10 GLN HE22 H 3.709 4.460 11.283 1.00 . A A . 10 GLN HE22 1 1 3 851 1 1 10 GLN HG2 H 1.001 2.403 11.842 1.00 . A A . 10 GLN HG2 1 1 3 852 1 1 10 GLN HG3 H 2.750 2.586 11.964 1.00 . A A . 10 GLN HG3 1 1 3 853 1 1 10 GLN N N 0.806 -0.188 10.543 1.00 . A A . 10 GLN N 1 1 3 854 1 1 10 GLN NE2 N 2.875 4.917 11.044 1.00 . A A . 10 GLN NE2 1 1 3 855 1 1 10 GLN O O 4.219 0.139 11.571 1.00 . A A . 10 GLN O 1 1 3 856 1 1 10 GLN OE1 O 0.667 4.685 10.706 1.00 . A A . 10 GLN OE1 1 1 3 857 1 1 11 LYS C C 3.722 -1.684 13.998 1.00 . A A . 11 LYS C 1 1 3 858 1 1 11 LYS CA C 3.007 -0.336 14.018 1.00 . A A . 11 LYS CA 1 1 3 859 1 1 11 LYS CB C 2.013 -0.292 15.180 1.00 . A A . 11 LYS CB 1 1 3 860 1 1 11 LYS CD C 2.730 -1.956 16.919 1.00 . A A . 11 LYS CD 1 1 3 861 1 1 11 LYS CE C 1.678 -2.316 17.957 1.00 . A A . 11 LYS CE 1 1 3 862 1 1 11 LYS CG C 2.658 -0.486 16.541 1.00 . A A . 11 LYS CG 1 1 3 863 1 1 11 LYS H H 1.340 -0.092 12.737 1.00 . A A . 11 LYS H 1 1 3 864 1 1 11 LYS HA H 3.740 0.445 14.152 1.00 . A A . 11 LYS HA 1 1 3 865 1 1 11 LYS HB2 H 1.514 0.666 15.175 1.00 . A A . 11 LYS HB2 1 1 3 866 1 1 11 LYS HB3 H 1.278 -1.072 15.039 1.00 . A A . 11 LYS HB3 1 1 3 867 1 1 11 LYS HD2 H 2.568 -2.555 16.036 1.00 . A A . 11 LYS HD2 1 1 3 868 1 1 11 LYS HD3 H 3.710 -2.167 17.324 1.00 . A A . 11 LYS HD3 1 1 3 869 1 1 11 LYS HE2 H 1.854 -1.732 18.847 1.00 . A A . 11 LYS HE2 1 1 3 870 1 1 11 LYS HE3 H 0.703 -2.080 17.558 1.00 . A A . 11 LYS HE3 1 1 3 871 1 1 11 LYS HG2 H 3.660 -0.083 16.515 1.00 . A A . 11 LYS HG2 1 1 3 872 1 1 11 LYS HG3 H 2.075 0.040 17.284 1.00 . A A . 11 LYS HG3 1 1 3 873 1 1 11 LYS HZ1 H 1.400 -3.901 19.290 1.00 . A A . 11 LYS HZ1 1 1 3 874 1 1 11 LYS HZ2 H 2.691 -4.124 18.219 1.00 . A A . 11 LYS HZ2 1 1 3 875 1 1 11 LYS HZ3 H 1.100 -4.304 17.675 1.00 . A A . 11 LYS HZ3 1 1 3 876 1 1 11 LYS N N 2.320 -0.093 12.755 1.00 . A A . 11 LYS N 1 1 3 877 1 1 11 LYS NZ N 1.720 -3.762 18.310 1.00 . A A . 11 LYS NZ 1 1 3 878 1 1 11 LYS O O 4.888 -1.785 14.380 1.00 . A A . 11 LYS O 1 1 3 879 1 1 12 VAL C C 4.778 -4.098 12.528 1.00 . A A . 12 VAL C 1 1 3 880 1 1 12 VAL CA C 3.584 -4.057 13.475 1.00 . A A . 12 VAL CA 1 1 3 881 1 1 12 VAL CB C 2.537 -5.086 13.009 1.00 . A A . 12 VAL CB 1 1 3 882 1 1 12 VAL CG1 C 3.194 -6.430 12.735 1.00 . A A . 12 VAL CG1 1 1 3 883 1 1 12 VAL CG2 C 1.430 -5.225 14.042 1.00 . A A . 12 VAL CG2 1 1 3 884 1 1 12 VAL H H 2.091 -2.573 13.257 1.00 . A A . 12 VAL H 1 1 3 885 1 1 12 VAL HA H 3.913 -4.334 14.466 1.00 . A A . 12 VAL HA 1 1 3 886 1 1 12 VAL HB H 2.099 -4.731 12.088 1.00 . A A . 12 VAL HB 1 1 3 887 1 1 12 VAL HG11 H 2.434 -7.160 12.496 1.00 . A A . 12 VAL HG11 1 1 3 888 1 1 12 VAL HG12 H 3.878 -6.335 11.904 1.00 . A A . 12 VAL HG12 1 1 3 889 1 1 12 VAL HG13 H 3.736 -6.751 13.612 1.00 . A A . 12 VAL HG13 1 1 3 890 1 1 12 VAL HG21 H 1.797 -5.782 14.891 1.00 . A A . 12 VAL HG21 1 1 3 891 1 1 12 VAL HG22 H 1.114 -4.244 14.364 1.00 . A A . 12 VAL HG22 1 1 3 892 1 1 12 VAL HG23 H 0.591 -5.747 13.604 1.00 . A A . 12 VAL HG23 1 1 3 893 1 1 12 VAL N N 3.016 -2.716 13.548 1.00 . A A . 12 VAL N 1 1 3 894 1 1 12 VAL O O 5.849 -4.590 12.884 1.00 . A A . 12 VAL O 1 1 3 895 1 1 13 ILE C C 6.783 -2.629 10.750 1.00 . A A . 13 ILE C 1 1 3 896 1 1 13 ILE CA C 5.648 -3.553 10.322 1.00 . A A . 13 ILE CA 1 1 3 897 1 1 13 ILE CB C 5.119 -3.096 8.950 1.00 . A A . 13 ILE CB 1 1 3 898 1 1 13 ILE CD1 C 5.954 -4.365 6.907 1.00 . A A . 13 ILE CD1 1 1 3 899 1 1 13 ILE CG1 C 6.209 -3.240 7.886 1.00 . A A . 13 ILE CG1 1 1 3 900 1 1 13 ILE CG2 C 4.629 -1.658 9.022 1.00 . A A . 13 ILE CG2 1 1 3 901 1 1 13 ILE H H 3.710 -3.201 11.096 1.00 . A A . 13 ILE H 1 1 3 902 1 1 13 ILE HA H 6.033 -4.557 10.222 1.00 . A A . 13 ILE HA 1 1 3 903 1 1 13 ILE HB H 4.282 -3.724 8.684 1.00 . A A . 13 ILE HB 1 1 3 904 1 1 13 ILE HD11 H 6.653 -5.168 7.090 1.00 . A A . 13 ILE HD11 1 1 3 905 1 1 13 ILE HD12 H 4.946 -4.731 7.034 1.00 . A A . 13 ILE HD12 1 1 3 906 1 1 13 ILE HD13 H 6.081 -4.001 5.898 1.00 . A A . 13 ILE HD13 1 1 3 907 1 1 13 ILE HG12 H 6.279 -2.322 7.324 1.00 . A A . 13 ILE HG12 1 1 3 908 1 1 13 ILE HG13 H 7.155 -3.432 8.373 1.00 . A A . 13 ILE HG13 1 1 3 909 1 1 13 ILE HG21 H 5.472 -0.986 8.953 1.00 . A A . 13 ILE HG21 1 1 3 910 1 1 13 ILE HG22 H 3.950 -1.468 8.205 1.00 . A A . 13 ILE HG22 1 1 3 911 1 1 13 ILE HG23 H 4.118 -1.498 9.960 1.00 . A A . 13 ILE HG23 1 1 3 912 1 1 13 ILE N N 4.586 -3.578 11.321 1.00 . A A . 13 ILE N 1 1 3 913 1 1 13 ILE O O 7.950 -2.882 10.448 1.00 . A A . 13 ILE O 1 1 3 914 1 1 14 ASP C C 8.550 -1.304 12.681 1.00 . A A . 14 ASP C 1 1 3 915 1 1 14 ASP CA C 7.424 -0.599 11.930 1.00 . A A . 14 ASP CA 1 1 3 916 1 1 14 ASP CB C 6.764 0.442 12.835 1.00 . A A . 14 ASP CB 1 1 3 917 1 1 14 ASP CG C 7.777 1.245 13.628 1.00 . A A . 14 ASP CG 1 1 3 918 1 1 14 ASP H H 5.488 -1.413 11.666 1.00 . A A . 14 ASP H 1 1 3 919 1 1 14 ASP HA H 7.841 -0.101 11.068 1.00 . A A . 14 ASP HA 1 1 3 920 1 1 14 ASP HB2 H 6.188 1.125 12.227 1.00 . A A . 14 ASP HB2 1 1 3 921 1 1 14 ASP HB3 H 6.106 -0.059 13.529 1.00 . A A . 14 ASP HB3 1 1 3 922 1 1 14 ASP N N 6.434 -1.560 11.457 1.00 . A A . 14 ASP N 1 1 3 923 1 1 14 ASP O O 9.678 -0.815 12.727 1.00 . A A . 14 ASP O 1 1 3 924 1 1 14 ASP OD1 O 8.255 2.276 13.109 1.00 . A A . 14 ASP OD1 1 1 3 925 1 1 14 ASP OD2 O 8.090 0.843 14.768 1.00 . A A . 14 ASP OD2 1 1 3 926 1 1 15 GLN C C 9.543 -4.532 13.306 1.00 . A A . 15 GLN C 1 1 3 927 1 1 15 GLN CA C 9.218 -3.224 14.018 1.00 . A A . 15 GLN CA 1 1 3 928 1 1 15 GLN CB C 8.703 -3.513 15.429 1.00 . A A . 15 GLN CB 1 1 3 929 1 1 15 GLN CD C 10.218 -2.714 17.287 1.00 . A A . 15 GLN CD 1 1 3 930 1 1 15 GLN CG C 9.008 -2.407 16.427 1.00 . A A . 15 GLN CG 1 1 3 931 1 1 15 GLN H H 7.317 -2.791 13.195 1.00 . A A . 15 GLN H 1 1 3 932 1 1 15 GLN HA H 10.118 -2.633 14.088 1.00 . A A . 15 GLN HA 1 1 3 933 1 1 15 GLN HB2 H 7.632 -3.646 15.389 1.00 . A A . 15 GLN HB2 1 1 3 934 1 1 15 GLN HB3 H 9.158 -4.425 15.786 1.00 . A A . 15 GLN HB3 1 1 3 935 1 1 15 GLN HE21 H 12.201 -2.843 17.221 1.00 . A A . 15 GLN HE21 1 1 3 936 1 1 15 GLN HE22 H 11.427 -2.409 15.738 1.00 . A A . 15 GLN HE22 1 1 3 937 1 1 15 GLN HG2 H 9.195 -1.492 15.884 1.00 . A A . 15 GLN HG2 1 1 3 938 1 1 15 GLN HG3 H 8.151 -2.274 17.070 1.00 . A A . 15 GLN HG3 1 1 3 939 1 1 15 GLN N N 8.233 -2.454 13.268 1.00 . A A . 15 GLN N 1 1 3 940 1 1 15 GLN NE2 N 11.402 -2.650 16.689 1.00 . A A . 15 GLN NE2 1 1 3 941 1 1 15 GLN O O 10.512 -5.212 13.646 1.00 . A A . 15 GLN O 1 1 3 942 1 1 15 GLN OE1 O 10.091 -3.007 18.476 1.00 . A A . 15 GLN OE1 1 1 3 943 1 1 16 PHE C C 10.043 -5.936 10.528 1.00 . A A . 16 PHE C 1 1 3 944 1 1 16 PHE CA C 8.929 -6.108 11.555 1.00 . A A . 16 PHE CA 1 1 3 945 1 1 16 PHE CB C 7.632 -6.516 10.854 1.00 . A A . 16 PHE CB 1 1 3 946 1 1 16 PHE CD1 C 7.276 -8.918 11.487 1.00 . A A . 16 PHE CD1 1 1 3 947 1 1 16 PHE CD2 C 7.804 -8.411 9.217 1.00 . A A . 16 PHE CD2 1 1 3 948 1 1 16 PHE CE1 C 7.218 -10.264 11.176 1.00 . A A . 16 PHE CE1 1 1 3 949 1 1 16 PHE CE2 C 7.746 -9.755 8.901 1.00 . A A . 16 PHE CE2 1 1 3 950 1 1 16 PHE CG C 7.569 -7.978 10.513 1.00 . A A . 16 PHE CG 1 1 3 951 1 1 16 PHE CZ C 7.454 -10.683 9.882 1.00 . A A . 16 PHE CZ 1 1 3 952 1 1 16 PHE H H 7.973 -4.297 12.091 1.00 . A A . 16 PHE H 1 1 3 953 1 1 16 PHE HA H 9.212 -6.884 12.250 1.00 . A A . 16 PHE HA 1 1 3 954 1 1 16 PHE HB2 H 6.796 -6.291 11.498 1.00 . A A . 16 PHE HB2 1 1 3 955 1 1 16 PHE HB3 H 7.535 -5.956 9.936 1.00 . A A . 16 PHE HB3 1 1 3 956 1 1 16 PHE HD1 H 7.092 -8.592 12.501 1.00 . A A . 16 PHE HD1 1 1 3 957 1 1 16 PHE HD2 H 8.033 -7.687 8.450 1.00 . A A . 16 PHE HD2 1 1 3 958 1 1 16 PHE HE1 H 6.989 -10.986 11.946 1.00 . A A . 16 PHE HE1 1 1 3 959 1 1 16 PHE HE2 H 7.931 -10.080 7.888 1.00 . A A . 16 PHE HE2 1 1 3 960 1 1 16 PHE HZ H 7.408 -11.733 9.637 1.00 . A A . 16 PHE HZ 1 1 3 961 1 1 16 PHE N N 8.728 -4.880 12.315 1.00 . A A . 16 PHE N 1 1 3 962 1 1 16 PHE O O 11.025 -6.678 10.530 1.00 . A A . 16 PHE O 1 1 3 963 1 1 17 GLY C C 10.575 -3.460 7.809 1.00 . A A . 17 GLY C 1 1 3 964 1 1 17 GLY CA C 10.883 -4.698 8.627 1.00 . A A . 17 GLY CA 1 1 3 965 1 1 17 GLY H H 9.080 -4.391 9.695 1.00 . A A . 17 GLY H 1 1 3 966 1 1 17 GLY HA2 H 11.844 -4.573 9.103 1.00 . A A . 17 GLY HA2 1 1 3 967 1 1 17 GLY HA3 H 10.928 -5.551 7.966 1.00 . A A . 17 GLY HA3 1 1 3 968 1 1 17 GLY N N 9.884 -4.951 9.649 1.00 . A A . 17 GLY N 1 1 3 969 1 1 17 GLY O O 9.981 -3.551 6.735 1.00 . A A . 17 GLY O 1 1 3 970 1 1 18 GLU C C 11.254 -1.099 6.191 1.00 . A A . 18 GLU C 1 1 3 971 1 1 18 GLU CA C 10.739 -1.039 7.627 1.00 . A A . 18 GLU CA 1 1 3 972 1 1 18 GLU CB C 11.414 0.113 8.374 1.00 . A A . 18 GLU CB 1 1 3 973 1 1 18 GLU CD C 11.661 2.626 8.458 1.00 . A A . 18 GLU CD 1 1 3 974 1 1 18 GLU CG C 10.743 1.458 8.152 1.00 . A A . 18 GLU CG 1 1 3 975 1 1 18 GLU H H 11.447 -2.293 9.178 1.00 . A A . 18 GLU H 1 1 3 976 1 1 18 GLU HA H 9.674 -0.868 7.608 1.00 . A A . 18 GLU HA 1 1 3 977 1 1 18 GLU HB2 H 11.401 -0.102 9.432 1.00 . A A . 18 GLU HB2 1 1 3 978 1 1 18 GLU HB3 H 12.440 0.188 8.044 1.00 . A A . 18 GLU HB3 1 1 3 979 1 1 18 GLU HG2 H 10.433 1.526 7.120 1.00 . A A . 18 GLU HG2 1 1 3 980 1 1 18 GLU HG3 H 9.876 1.524 8.792 1.00 . A A . 18 GLU HG3 1 1 3 981 1 1 18 GLU N N 10.979 -2.300 8.318 1.00 . A A . 18 GLU N 1 1 3 982 1 1 18 GLU O O 11.845 -0.142 5.693 1.00 . A A . 18 GLU O 1 1 3 983 1 1 18 GLU OE1 O 11.760 3.007 9.643 1.00 . A A . 18 GLU OE1 1 1 3 984 1 1 18 GLU OE2 O 12.280 3.158 7.513 1.00 . A A . 18 GLU OE2 1 1 4 985 1 1 1 HIS C C -0.899 5.088 -1.517 1.00 . A A . 1 HIS C 1 1 4 986 1 1 1 HIS CA C -0.607 6.500 -1.017 1.00 . A A . 1 HIS CA 1 1 4 987 1 1 1 HIS CB C -1.869 7.359 -1.114 1.00 . A A . 1 HIS CB 1 1 4 988 1 1 1 HIS CD2 C -2.384 9.486 0.278 1.00 . A A . 1 HIS CD2 1 1 4 989 1 1 1 HIS CE1 C -2.442 8.562 2.266 1.00 . A A . 1 HIS CE1 1 1 4 990 1 1 1 HIS CG C -2.141 8.164 0.120 1.00 . A A . 1 HIS CG 1 1 4 991 1 1 1 HIS H1 H 0.830 6.639 -2.565 1.00 . A A . 1 HIS H1 1 1 4 992 1 1 1 HIS HA H -0.298 6.445 0.015 1.00 . A A . 1 HIS HA 1 1 4 993 1 1 1 HIS HB2 H -1.766 8.045 -1.941 1.00 . A A . 1 HIS HB2 1 1 4 994 1 1 1 HIS HB3 H -2.721 6.717 -1.287 1.00 . A A . 1 HIS HB3 1 1 4 995 1 1 1 HIS HD1 H -2.045 6.668 1.601 1.00 . A A . 1 HIS HD1 1 1 4 996 1 1 1 HIS HD2 H -2.426 10.229 -0.506 1.00 . A A . 1 HIS HD2 1 1 4 997 1 1 1 HIS HE1 H -2.534 8.425 3.333 1.00 . A A . 1 HIS HE1 1 1 4 998 1 1 1 HIS N N 0.478 7.107 -1.779 1.00 . A A . 1 HIS N 1 1 4 999 1 1 1 HIS ND1 N -2.183 7.613 1.383 1.00 . A A . 1 HIS ND1 1 1 4 1000 1 1 1 HIS NE2 N -2.568 9.708 1.621 1.00 . A A . 1 HIS NE2 1 1 4 1001 1 1 1 HIS O O -1.369 4.901 -2.640 1.00 . A A . 1 HIS O 1 1 4 1002 1 1 2 VAL C C -2.177 2.206 -0.471 1.00 . A A . 2 VAL C 1 1 4 1003 1 1 2 VAL CA C -0.850 2.703 -1.033 1.00 . A A . 2 VAL CA 1 1 4 1004 1 1 2 VAL CB C 0.284 1.796 -0.520 1.00 . A A . 2 VAL CB 1 1 4 1005 1 1 2 VAL CG1 C 0.120 0.382 -1.056 1.00 . A A . 2 VAL CG1 1 1 4 1006 1 1 2 VAL CG2 C 1.639 2.368 -0.907 1.00 . A A . 2 VAL CG2 1 1 4 1007 1 1 2 VAL H H -0.245 4.310 0.204 1.00 . A A . 2 VAL H 1 1 4 1008 1 1 2 VAL HA H -0.878 2.634 -2.111 1.00 . A A . 2 VAL HA 1 1 4 1009 1 1 2 VAL HB H 0.227 1.758 0.558 1.00 . A A . 2 VAL HB 1 1 4 1010 1 1 2 VAL HG11 H 0.450 0.346 -2.084 1.00 . A A . 2 VAL HG11 1 1 4 1011 1 1 2 VAL HG12 H 0.713 -0.299 -0.462 1.00 . A A . 2 VAL HG12 1 1 4 1012 1 1 2 VAL HG13 H -0.920 0.095 -1.002 1.00 . A A . 2 VAL HG13 1 1 4 1013 1 1 2 VAL HG21 H 2.392 1.599 -0.822 1.00 . A A . 2 VAL HG21 1 1 4 1014 1 1 2 VAL HG22 H 1.601 2.725 -1.925 1.00 . A A . 2 VAL HG22 1 1 4 1015 1 1 2 VAL HG23 H 1.886 3.187 -0.247 1.00 . A A . 2 VAL HG23 1 1 4 1016 1 1 2 VAL N N -0.618 4.098 -0.677 1.00 . A A . 2 VAL N 1 1 4 1017 1 1 2 VAL O O -2.844 1.366 -1.075 1.00 . A A . 2 VAL O 1 1 4 1018 1 1 3 PHE C C -3.725 0.908 1.850 1.00 . A A . 3 PHE C 1 1 4 1019 1 1 3 PHE CA C -3.805 2.342 1.334 1.00 . A A . 3 PHE CA 1 1 4 1020 1 1 3 PHE CB C -4.973 2.479 0.356 1.00 . A A . 3 PHE CB 1 1 4 1021 1 1 3 PHE CD1 C -5.682 4.867 0.662 1.00 . A A . 3 PHE CD1 1 1 4 1022 1 1 3 PHE CD2 C -7.220 3.143 1.254 1.00 . A A . 3 PHE CD2 1 1 4 1023 1 1 3 PHE CE1 C -6.605 5.825 1.037 1.00 . A A . 3 PHE CE1 1 1 4 1024 1 1 3 PHE CE2 C -8.147 4.097 1.631 1.00 . A A . 3 PHE CE2 1 1 4 1025 1 1 3 PHE CG C -5.979 3.517 0.765 1.00 . A A . 3 PHE CG 1 1 4 1026 1 1 3 PHE CZ C -7.839 5.439 1.524 1.00 . A A . 3 PHE CZ 1 1 4 1027 1 1 3 PHE H H -1.982 3.398 1.122 1.00 . A A . 3 PHE H 1 1 4 1028 1 1 3 PHE HA H -3.966 3.005 2.170 1.00 . A A . 3 PHE HA 1 1 4 1029 1 1 3 PHE HB2 H -4.590 2.754 -0.615 1.00 . A A . 3 PHE HB2 1 1 4 1030 1 1 3 PHE HB3 H -5.484 1.531 0.282 1.00 . A A . 3 PHE HB3 1 1 4 1031 1 1 3 PHE HD1 H -4.717 5.170 0.282 1.00 . A A . 3 PHE HD1 1 1 4 1032 1 1 3 PHE HD2 H -7.462 2.094 1.340 1.00 . A A . 3 PHE HD2 1 1 4 1033 1 1 3 PHE HE1 H -6.361 6.873 0.952 1.00 . A A . 3 PHE HE1 1 1 4 1034 1 1 3 PHE HE2 H -9.111 3.792 2.011 1.00 . A A . 3 PHE HE2 1 1 4 1035 1 1 3 PHE HZ H -8.562 6.185 1.817 1.00 . A A . 3 PHE HZ 1 1 4 1036 1 1 3 PHE N N -2.556 2.732 0.689 1.00 . A A . 3 PHE N 1 1 4 1037 1 1 3 PHE O O -3.591 0.677 3.052 1.00 . A A . 3 PHE O 1 1 4 1038 1 1 4 ARG C C -2.463 -1.772 2.057 1.00 . A A . 4 ARG C 1 1 4 1039 1 1 4 ARG CA C -3.749 -1.461 1.295 1.00 . A A . 4 ARG CA 1 1 4 1040 1 1 4 ARG CB C -3.837 -2.335 0.043 1.00 . A A . 4 ARG CB 1 1 4 1041 1 1 4 ARG CD C -5.560 -3.496 -1.371 1.00 . A A . 4 ARG CD 1 1 4 1042 1 1 4 ARG CG C -5.032 -3.273 0.038 1.00 . A A . 4 ARG CG 1 1 4 1043 1 1 4 ARG CZ C -6.497 -5.762 -1.198 1.00 . A A . 4 ARG CZ 1 1 4 1044 1 1 4 ARG H H -3.915 0.197 -0.009 1.00 . A A . 4 ARG H 1 1 4 1045 1 1 4 ARG HA H -4.592 -1.677 1.934 1.00 . A A . 4 ARG HA 1 1 4 1046 1 1 4 ARG HB2 H -3.905 -1.695 -0.825 1.00 . A A . 4 ARG HB2 1 1 4 1047 1 1 4 ARG HB3 H -2.939 -2.931 -0.029 1.00 . A A . 4 ARG HB3 1 1 4 1048 1 1 4 ARG HD2 H -6.553 -3.079 -1.439 1.00 . A A . 4 ARG HD2 1 1 4 1049 1 1 4 ARG HD3 H -4.909 -2.990 -2.069 1.00 . A A . 4 ARG HD3 1 1 4 1050 1 1 4 ARG HE H -4.965 -5.249 -2.367 1.00 . A A . 4 ARG HE 1 1 4 1051 1 1 4 ARG HG2 H -4.734 -4.225 0.453 1.00 . A A . 4 ARG HG2 1 1 4 1052 1 1 4 ARG HG3 H -5.817 -2.845 0.643 1.00 . A A . 4 ARG HG3 1 1 4 1053 1 1 4 ARG HH11 H -7.402 -4.377 -0.039 1.00 . A A . 4 ARG HH11 1 1 4 1054 1 1 4 ARG HH12 H -8.054 -5.978 0.073 1.00 . A A . 4 ARG HH12 1 1 4 1055 1 1 4 ARG HH21 H -7.149 -7.675 -1.171 1.00 . A A . 4 ARG HH21 1 1 4 1056 1 1 4 ARG HH22 H -5.814 -7.361 -2.228 1.00 . A A . 4 ARG HH22 1 1 4 1057 1 1 4 ARG N N -3.809 -0.050 0.933 1.00 . A A . 4 ARG N 1 1 4 1058 1 1 4 ARG NE N -5.616 -4.914 -1.717 1.00 . A A . 4 ARG NE 1 1 4 1059 1 1 4 ARG NH1 N -7.391 -5.338 -0.315 1.00 . A A . 4 ARG NH1 1 1 4 1060 1 1 4 ARG NH2 N -6.486 -7.038 -1.562 1.00 . A A . 4 ARG NH2 1 1 4 1061 1 1 4 ARG O O -2.494 -2.388 3.123 1.00 . A A . 4 ARG O 1 1 4 1062 1 1 5 LEU C C 0.303 -3.063 2.137 1.00 . A A . 5 LEU C 1 1 4 1063 1 1 5 LEU CA C -0.038 -1.577 2.128 1.00 . A A . 5 LEU CA 1 1 4 1064 1 1 5 LEU CB C -0.034 -1.033 3.558 1.00 . A A . 5 LEU CB 1 1 4 1065 1 1 5 LEU CD1 C 0.452 0.943 5.022 1.00 . A A . 5 LEU CD1 1 1 4 1066 1 1 5 LEU CD2 C 2.336 -0.403 4.077 1.00 . A A . 5 LEU CD2 1 1 4 1067 1 1 5 LEU CG C 0.929 0.122 3.834 1.00 . A A . 5 LEU CG 1 1 4 1068 1 1 5 LEU H H -1.374 -0.859 0.652 1.00 . A A . 5 LEU H 1 1 4 1069 1 1 5 LEU HA H 0.708 -1.052 1.550 1.00 . A A . 5 LEU HA 1 1 4 1070 1 1 5 LEU HB2 H -1.033 -0.691 3.784 1.00 . A A . 5 LEU HB2 1 1 4 1071 1 1 5 LEU HB3 H 0.225 -1.847 4.220 1.00 . A A . 5 LEU HB3 1 1 4 1072 1 1 5 LEU HD11 H -0.178 0.333 5.651 1.00 . A A . 5 LEU HD11 1 1 4 1073 1 1 5 LEU HD12 H -0.110 1.795 4.668 1.00 . A A . 5 LEU HD12 1 1 4 1074 1 1 5 LEU HD13 H 1.305 1.285 5.589 1.00 . A A . 5 LEU HD13 1 1 4 1075 1 1 5 LEU HD21 H 2.963 0.399 4.436 1.00 . A A . 5 LEU HD21 1 1 4 1076 1 1 5 LEU HD22 H 2.740 -0.791 3.153 1.00 . A A . 5 LEU HD22 1 1 4 1077 1 1 5 LEU HD23 H 2.303 -1.193 4.814 1.00 . A A . 5 LEU HD23 1 1 4 1078 1 1 5 LEU HG H 0.958 0.772 2.970 1.00 . A A . 5 LEU HG 1 1 4 1079 1 1 5 LEU N N -1.335 -1.344 1.502 1.00 . A A . 5 LEU N 1 1 4 1080 1 1 5 LEU O O -0.532 -3.901 2.478 1.00 . A A . 5 LEU O 1 1 4 1081 1 1 6 LYS C C 1.713 -5.465 3.058 1.00 . A A . 6 LYS C 1 1 4 1082 1 1 6 LYS CA C 1.991 -4.769 1.729 1.00 . A A . 6 LYS CA 1 1 4 1083 1 1 6 LYS CB C 3.487 -4.829 1.413 1.00 . A A . 6 LYS CB 1 1 4 1084 1 1 6 LYS CD C 4.304 -2.935 2.846 1.00 . A A . 6 LYS CD 1 1 4 1085 1 1 6 LYS CE C 5.386 -2.491 3.818 1.00 . A A . 6 LYS CE 1 1 4 1086 1 1 6 LYS CG C 4.372 -4.429 2.581 1.00 . A A . 6 LYS CG 1 1 4 1087 1 1 6 LYS H H 2.157 -2.671 1.500 1.00 . A A . 6 LYS H 1 1 4 1088 1 1 6 LYS HA H 1.447 -5.279 0.948 1.00 . A A . 6 LYS HA 1 1 4 1089 1 1 6 LYS HB2 H 3.742 -5.839 1.125 1.00 . A A . 6 LYS HB2 1 1 4 1090 1 1 6 LYS HB3 H 3.696 -4.165 0.587 1.00 . A A . 6 LYS HB3 1 1 4 1091 1 1 6 LYS HD2 H 4.435 -2.406 1.913 1.00 . A A . 6 LYS HD2 1 1 4 1092 1 1 6 LYS HD3 H 3.336 -2.696 3.264 1.00 . A A . 6 LYS HD3 1 1 4 1093 1 1 6 LYS HE2 H 4.929 -2.276 4.772 1.00 . A A . 6 LYS HE2 1 1 4 1094 1 1 6 LYS HE3 H 6.099 -3.294 3.933 1.00 . A A . 6 LYS HE3 1 1 4 1095 1 1 6 LYS HG2 H 4.045 -4.956 3.466 1.00 . A A . 6 LYS HG2 1 1 4 1096 1 1 6 LYS HG3 H 5.394 -4.700 2.356 1.00 . A A . 6 LYS HG3 1 1 4 1097 1 1 6 LYS HZ1 H 7.121 -1.456 3.286 1.00 . A A . 6 LYS HZ1 1 1 4 1098 1 1 6 LYS HZ2 H 5.931 -0.482 3.990 1.00 . A A . 6 LYS HZ2 1 1 4 1099 1 1 6 LYS HZ3 H 5.755 -1.009 2.393 1.00 . A A . 6 LYS HZ3 1 1 4 1100 1 1 6 LYS N N 1.537 -3.384 1.761 1.00 . A A . 6 LYS N 1 1 4 1101 1 1 6 LYS NZ N 6.098 -1.275 3.338 1.00 . A A . 6 LYS NZ 1 1 4 1102 1 1 6 LYS O O 1.509 -6.678 3.105 1.00 . A A . 6 LYS O 1 1 4 1103 1 1 7 LYS C C 0.197 -4.604 6.075 1.00 . A A . 7 LYS C 1 1 4 1104 1 1 7 LYS CA C 1.448 -5.228 5.466 1.00 . A A . 7 LYS CA 1 1 4 1105 1 1 7 LYS CB C 2.651 -4.981 6.379 1.00 . A A . 7 LYS CB 1 1 4 1106 1 1 7 LYS CD C 3.350 -7.321 6.968 1.00 . A A . 7 LYS CD 1 1 4 1107 1 1 7 LYS CE C 3.017 -8.429 5.980 1.00 . A A . 7 LYS CE 1 1 4 1108 1 1 7 LYS CG C 3.736 -6.036 6.255 1.00 . A A . 7 LYS CG 1 1 4 1109 1 1 7 LYS H H 1.874 -3.728 4.034 1.00 . A A . 7 LYS H 1 1 4 1110 1 1 7 LYS HA H 1.294 -6.292 5.368 1.00 . A A . 7 LYS HA 1 1 4 1111 1 1 7 LYS HB2 H 3.081 -4.021 6.136 1.00 . A A . 7 LYS HB2 1 1 4 1112 1 1 7 LYS HB3 H 2.311 -4.964 7.405 1.00 . A A . 7 LYS HB3 1 1 4 1113 1 1 7 LYS HD2 H 4.175 -7.642 7.587 1.00 . A A . 7 LYS HD2 1 1 4 1114 1 1 7 LYS HD3 H 2.485 -7.132 7.588 1.00 . A A . 7 LYS HD3 1 1 4 1115 1 1 7 LYS HE2 H 2.225 -8.088 5.331 1.00 . A A . 7 LYS HE2 1 1 4 1116 1 1 7 LYS HE3 H 3.897 -8.644 5.392 1.00 . A A . 7 LYS HE3 1 1 4 1117 1 1 7 LYS HG2 H 3.897 -6.252 5.209 1.00 . A A . 7 LYS HG2 1 1 4 1118 1 1 7 LYS HG3 H 4.649 -5.654 6.690 1.00 . A A . 7 LYS HG3 1 1 4 1119 1 1 7 LYS HZ1 H 1.876 -9.448 7.402 1.00 . A A . 7 LYS HZ1 1 1 4 1120 1 1 7 LYS HZ2 H 3.394 -10.139 7.118 1.00 . A A . 7 LYS HZ2 1 1 4 1121 1 1 7 LYS HZ3 H 2.152 -10.330 5.985 1.00 . A A . 7 LYS HZ3 1 1 4 1122 1 1 7 LYS N N 1.704 -4.688 4.136 1.00 . A A . 7 LYS N 1 1 4 1123 1 1 7 LYS NZ N 2.579 -9.673 6.670 1.00 . A A . 7 LYS NZ 1 1 4 1124 1 1 7 LYS O O -0.044 -3.406 5.928 1.00 . A A . 7 LYS O 1 1 4 1125 1 1 8 TRP C C -1.520 -4.284 8.731 1.00 . A A . 8 TRP C 1 1 4 1126 1 1 8 TRP CA C -1.820 -4.949 7.392 1.00 . A A . 8 TRP CA 1 1 4 1127 1 1 8 TRP CB C -2.796 -6.109 7.592 1.00 . A A . 8 TRP CB 1 1 4 1128 1 1 8 TRP CD1 C -3.897 -6.357 5.291 1.00 . A A . 8 TRP CD1 1 1 4 1129 1 1 8 TRP CD2 C -2.719 -8.145 5.945 1.00 . A A . 8 TRP CD2 1 1 4 1130 1 1 8 TRP CE2 C -3.268 -8.409 4.675 1.00 . A A . 8 TRP CE2 1 1 4 1131 1 1 8 TRP CE3 C -1.936 -9.128 6.557 1.00 . A A . 8 TRP CE3 1 1 4 1132 1 1 8 TRP CG C -3.133 -6.827 6.320 1.00 . A A . 8 TRP CG 1 1 4 1133 1 1 8 TRP CH2 C -2.289 -10.558 4.632 1.00 . A A . 8 TRP CH2 1 1 4 1134 1 1 8 TRP CZ2 C -3.059 -9.614 4.009 1.00 . A A . 8 TRP CZ2 1 1 4 1135 1 1 8 TRP CZ3 C -1.730 -10.323 5.895 1.00 . A A . 8 TRP CZ3 1 1 4 1136 1 1 8 TRP H H -0.348 -6.368 6.841 1.00 . A A . 8 TRP H 1 1 4 1137 1 1 8 TRP HA H -2.271 -4.220 6.734 1.00 . A A . 8 TRP HA 1 1 4 1138 1 1 8 TRP HB2 H -2.361 -6.824 8.273 1.00 . A A . 8 TRP HB2 1 1 4 1139 1 1 8 TRP HB3 H -3.715 -5.728 8.014 1.00 . A A . 8 TRP HB3 1 1 4 1140 1 1 8 TRP HD1 H -4.361 -5.382 5.274 1.00 . A A . 8 TRP HD1 1 1 4 1141 1 1 8 TRP HE1 H -4.475 -7.201 3.456 1.00 . A A . 8 TRP HE1 1 1 4 1142 1 1 8 TRP HE3 H -1.497 -8.966 7.530 1.00 . A A . 8 TRP HE3 1 1 4 1143 1 1 8 TRP HH2 H -2.102 -11.506 4.152 1.00 . A A . 8 TRP HH2 1 1 4 1144 1 1 8 TRP HZ2 H -3.483 -9.809 3.035 1.00 . A A . 8 TRP HZ2 1 1 4 1145 1 1 8 TRP HZ3 H -1.129 -11.095 6.353 1.00 . A A . 8 TRP HZ3 1 1 4 1146 1 1 8 TRP N N -0.594 -5.422 6.759 1.00 . A A . 8 TRP N 1 1 4 1147 1 1 8 TRP NE1 N -3.983 -7.303 4.298 1.00 . A A . 8 TRP NE1 1 1 4 1148 1 1 8 TRP O O -2.432 -3.862 9.442 1.00 . A A . 8 TRP O 1 1 4 1149 1 1 9 ILE C C 1.604 -3.040 10.221 1.00 . A A . 9 ILE C 1 1 4 1150 1 1 9 ILE CA C 0.181 -3.579 10.321 1.00 . A A . 9 ILE CA 1 1 4 1151 1 1 9 ILE CB C 0.103 -4.578 11.491 1.00 . A A . 9 ILE CB 1 1 4 1152 1 1 9 ILE CD1 C 1.981 -6.044 10.596 1.00 . A A . 9 ILE CD1 1 1 4 1153 1 1 9 ILE CG1 C 0.534 -5.971 11.031 1.00 . A A . 9 ILE CG1 1 1 4 1154 1 1 9 ILE CG2 C -1.306 -4.615 12.063 1.00 . A A . 9 ILE CG2 1 1 4 1155 1 1 9 ILE H H 0.443 -4.549 8.459 1.00 . A A . 9 ILE H 1 1 4 1156 1 1 9 ILE HA H -0.490 -2.758 10.530 1.00 . A A . 9 ILE HA 1 1 4 1157 1 1 9 ILE HB H 0.772 -4.240 12.268 1.00 . A A . 9 ILE HB 1 1 4 1158 1 1 9 ILE HD11 H 2.611 -5.637 11.374 1.00 . A A . 9 ILE HD11 1 1 4 1159 1 1 9 ILE HD12 H 2.253 -7.074 10.417 1.00 . A A . 9 ILE HD12 1 1 4 1160 1 1 9 ILE HD13 H 2.115 -5.472 9.690 1.00 . A A . 9 ILE HD13 1 1 4 1161 1 1 9 ILE HG12 H 0.396 -6.670 11.841 1.00 . A A . 9 ILE HG12 1 1 4 1162 1 1 9 ILE HG13 H -0.080 -6.271 10.194 1.00 . A A . 9 ILE HG13 1 1 4 1163 1 1 9 ILE HG21 H -1.259 -4.541 13.140 1.00 . A A . 9 ILE HG21 1 1 4 1164 1 1 9 ILE HG22 H -1.875 -3.785 11.671 1.00 . A A . 9 ILE HG22 1 1 4 1165 1 1 9 ILE HG23 H -1.783 -5.543 11.786 1.00 . A A . 9 ILE HG23 1 1 4 1166 1 1 9 ILE N N -0.238 -4.194 9.068 1.00 . A A . 9 ILE N 1 1 4 1167 1 1 9 ILE O O 2.362 -3.078 11.190 1.00 . A A . 9 ILE O 1 1 4 1168 1 1 10 GLN C C 3.657 -0.983 9.903 1.00 . A A . 10 GLN C 1 1 4 1169 1 1 10 GLN CA C 3.291 -1.989 8.817 1.00 . A A . 10 GLN CA 1 1 4 1170 1 1 10 GLN CB C 3.364 -1.323 7.442 1.00 . A A . 10 GLN CB 1 1 4 1171 1 1 10 GLN CD C 1.423 0.234 7.878 1.00 . A A . 10 GLN CD 1 1 4 1172 1 1 10 GLN CG C 2.868 0.114 7.435 1.00 . A A . 10 GLN CG 1 1 4 1173 1 1 10 GLN H H 1.310 -2.535 8.309 1.00 . A A . 10 GLN H 1 1 4 1174 1 1 10 GLN HA H 3.995 -2.807 8.848 1.00 . A A . 10 GLN HA 1 1 4 1175 1 1 10 GLN HB2 H 4.391 -1.328 7.107 1.00 . A A . 10 GLN HB2 1 1 4 1176 1 1 10 GLN HB3 H 2.764 -1.892 6.747 1.00 . A A . 10 GLN HB3 1 1 4 1177 1 1 10 GLN HE21 H 0.180 1.418 8.881 1.00 . A A . 10 GLN HE21 1 1 4 1178 1 1 10 GLN HE22 H 1.815 1.965 8.773 1.00 . A A . 10 GLN HE22 1 1 4 1179 1 1 10 GLN HG2 H 3.482 0.697 8.104 1.00 . A A . 10 GLN HG2 1 1 4 1180 1 1 10 GLN HG3 H 2.956 0.506 6.432 1.00 . A A . 10 GLN HG3 1 1 4 1181 1 1 10 GLN N N 1.959 -2.538 9.043 1.00 . A A . 10 GLN N 1 1 4 1182 1 1 10 GLN NE2 N 1.107 1.314 8.582 1.00 . A A . 10 GLN NE2 1 1 4 1183 1 1 10 GLN O O 4.834 -0.758 10.184 1.00 . A A . 10 GLN O 1 1 4 1184 1 1 10 GLN OE1 O 0.599 -0.635 7.590 1.00 . A A . 10 GLN OE1 1 1 4 1185 1 1 11 LYS C C 3.448 -0.057 12.810 1.00 . A A . 11 LYS C 1 1 4 1186 1 1 11 LYS CA C 2.855 0.601 11.568 1.00 . A A . 11 LYS CA 1 1 4 1187 1 1 11 LYS CB C 1.537 1.293 11.923 1.00 . A A . 11 LYS CB 1 1 4 1188 1 1 11 LYS CD C 1.543 1.814 14.381 1.00 . A A . 11 LYS CD 1 1 4 1189 1 1 11 LYS CE C 0.193 2.164 14.988 1.00 . A A . 11 LYS CE 1 1 4 1190 1 1 11 LYS CG C 1.684 2.377 12.977 1.00 . A A . 11 LYS CG 1 1 4 1191 1 1 11 LYS H H 1.724 -0.603 10.243 1.00 . A A . 11 LYS H 1 1 4 1192 1 1 11 LYS HA H 3.551 1.339 11.199 1.00 . A A . 11 LYS HA 1 1 4 1193 1 1 11 LYS HB2 H 1.127 1.741 11.030 1.00 . A A . 11 LYS HB2 1 1 4 1194 1 1 11 LYS HB3 H 0.844 0.551 12.295 1.00 . A A . 11 LYS HB3 1 1 4 1195 1 1 11 LYS HD2 H 1.638 0.739 14.340 1.00 . A A . 11 LYS HD2 1 1 4 1196 1 1 11 LYS HD3 H 2.326 2.223 15.004 1.00 . A A . 11 LYS HD3 1 1 4 1197 1 1 11 LYS HE2 H -0.565 2.071 14.226 1.00 . A A . 11 LYS HE2 1 1 4 1198 1 1 11 LYS HE3 H -0.016 1.471 15.790 1.00 . A A . 11 LYS HE3 1 1 4 1199 1 1 11 LYS HG2 H 2.659 2.831 12.879 1.00 . A A . 11 LYS HG2 1 1 4 1200 1 1 11 LYS HG3 H 0.920 3.125 12.820 1.00 . A A . 11 LYS HG3 1 1 4 1201 1 1 11 LYS HZ1 H -0.769 3.974 15.391 1.00 . A A . 11 LYS HZ1 1 1 4 1202 1 1 11 LYS HZ2 H 0.878 4.136 15.039 1.00 . A A . 11 LYS HZ2 1 1 4 1203 1 1 11 LYS HZ3 H 0.390 3.543 16.545 1.00 . A A . 11 LYS HZ3 1 1 4 1204 1 1 11 LYS N N 2.641 -0.381 10.511 1.00 . A A . 11 LYS N 1 1 4 1205 1 1 11 LYS NZ N 0.171 3.551 15.529 1.00 . A A . 11 LYS NZ 1 1 4 1206 1 1 11 LYS O O 4.415 0.441 13.386 1.00 . A A . 11 LYS O 1 1 4 1207 1 1 12 VAL C C 4.758 -2.410 14.186 1.00 . A A . 12 VAL C 1 1 4 1208 1 1 12 VAL CA C 3.334 -1.906 14.389 1.00 . A A . 12 VAL CA 1 1 4 1209 1 1 12 VAL CB C 2.419 -3.102 14.713 1.00 . A A . 12 VAL CB 1 1 4 1210 1 1 12 VAL CG1 C 3.037 -3.968 15.800 1.00 . A A . 12 VAL CG1 1 1 4 1211 1 1 12 VAL CG2 C 1.037 -2.618 15.127 1.00 . A A . 12 VAL CG2 1 1 4 1212 1 1 12 VAL H H 2.095 -1.526 12.716 1.00 . A A . 12 VAL H 1 1 4 1213 1 1 12 VAL HA H 3.318 -1.229 15.231 1.00 . A A . 12 VAL HA 1 1 4 1214 1 1 12 VAL HB H 2.315 -3.702 13.821 1.00 . A A . 12 VAL HB 1 1 4 1215 1 1 12 VAL HG11 H 3.951 -4.411 15.431 1.00 . A A . 12 VAL HG11 1 1 4 1216 1 1 12 VAL HG12 H 3.255 -3.359 16.666 1.00 . A A . 12 VAL HG12 1 1 4 1217 1 1 12 VAL HG13 H 2.345 -4.749 16.075 1.00 . A A . 12 VAL HG13 1 1 4 1218 1 1 12 VAL HG21 H 0.347 -3.448 15.117 1.00 . A A . 12 VAL HG21 1 1 4 1219 1 1 12 VAL HG22 H 1.086 -2.201 16.122 1.00 . A A . 12 VAL HG22 1 1 4 1220 1 1 12 VAL HG23 H 0.699 -1.860 14.435 1.00 . A A . 12 VAL HG23 1 1 4 1221 1 1 12 VAL N N 2.862 -1.179 13.217 1.00 . A A . 12 VAL N 1 1 4 1222 1 1 12 VAL O O 5.628 -2.200 15.032 1.00 . A A . 12 VAL O 1 1 4 1223 1 1 13 ILE C C 7.315 -2.484 12.511 1.00 . A A . 13 ILE C 1 1 4 1224 1 1 13 ILE CA C 6.310 -3.607 12.745 1.00 . A A . 13 ILE CA 1 1 4 1225 1 1 13 ILE CB C 6.270 -4.512 11.499 1.00 . A A . 13 ILE CB 1 1 4 1226 1 1 13 ILE CD1 C 7.479 -6.576 10.631 1.00 . A A . 13 ILE CD1 1 1 4 1227 1 1 13 ILE CG1 C 7.605 -5.239 11.326 1.00 . A A . 13 ILE CG1 1 1 4 1228 1 1 13 ILE CG2 C 5.942 -3.693 10.260 1.00 . A A . 13 ILE CG2 1 1 4 1229 1 1 13 ILE H H 4.256 -3.210 12.424 1.00 . A A . 13 ILE H 1 1 4 1230 1 1 13 ILE HA H 6.638 -4.201 13.586 1.00 . A A . 13 ILE HA 1 1 4 1231 1 1 13 ILE HB H 5.486 -5.241 11.636 1.00 . A A . 13 ILE HB 1 1 4 1232 1 1 13 ILE HD11 H 8.218 -7.258 11.027 1.00 . A A . 13 ILE HD11 1 1 4 1233 1 1 13 ILE HD12 H 6.492 -6.979 10.800 1.00 . A A . 13 ILE HD12 1 1 4 1234 1 1 13 ILE HD13 H 7.640 -6.448 9.571 1.00 . A A . 13 ILE HD13 1 1 4 1235 1 1 13 ILE HG12 H 8.270 -4.623 10.742 1.00 . A A . 13 ILE HG12 1 1 4 1236 1 1 13 ILE HG13 H 8.042 -5.410 12.300 1.00 . A A . 13 ILE HG13 1 1 4 1237 1 1 13 ILE HG21 H 5.128 -3.017 10.480 1.00 . A A . 13 ILE HG21 1 1 4 1238 1 1 13 ILE HG22 H 6.811 -3.124 9.965 1.00 . A A . 13 ILE HG22 1 1 4 1239 1 1 13 ILE HG23 H 5.654 -4.354 9.456 1.00 . A A . 13 ILE HG23 1 1 4 1240 1 1 13 ILE N N 4.990 -3.075 13.059 1.00 . A A . 13 ILE N 1 1 4 1241 1 1 13 ILE O O 8.498 -2.622 12.822 1.00 . A A . 13 ILE O 1 1 4 1242 1 1 14 ASP C C 8.486 0.168 12.933 1.00 . A A . 14 ASP C 1 1 4 1243 1 1 14 ASP CA C 7.690 -0.224 11.691 1.00 . A A . 14 ASP CA 1 1 4 1244 1 1 14 ASP CB C 6.850 0.962 11.213 1.00 . A A . 14 ASP CB 1 1 4 1245 1 1 14 ASP CG C 7.616 2.269 11.259 1.00 . A A . 14 ASP CG 1 1 4 1246 1 1 14 ASP H H 5.882 -1.324 11.738 1.00 . A A . 14 ASP H 1 1 4 1247 1 1 14 ASP HA H 8.381 -0.502 10.910 1.00 . A A . 14 ASP HA 1 1 4 1248 1 1 14 ASP HB2 H 6.537 0.785 10.194 1.00 . A A . 14 ASP HB2 1 1 4 1249 1 1 14 ASP HB3 H 5.978 1.054 11.843 1.00 . A A . 14 ASP HB3 1 1 4 1250 1 1 14 ASP N N 6.835 -1.373 11.964 1.00 . A A . 14 ASP N 1 1 4 1251 1 1 14 ASP O O 9.575 0.732 12.830 1.00 . A A . 14 ASP O 1 1 4 1252 1 1 14 ASP OD1 O 7.333 3.092 12.155 1.00 . A A . 14 ASP OD1 1 1 4 1253 1 1 14 ASP OD2 O 8.499 2.470 10.399 1.00 . A A . 14 ASP OD2 1 1 4 1254 1 1 15 GLN C C 9.065 -1.077 16.070 1.00 . A A . 15 GLN C 1 1 4 1255 1 1 15 GLN CA C 8.591 0.189 15.364 1.00 . A A . 15 GLN CA 1 1 4 1256 1 1 15 GLN CB C 7.641 0.970 16.274 1.00 . A A . 15 GLN CB 1 1 4 1257 1 1 15 GLN CD C 7.079 3.250 17.204 1.00 . A A . 15 GLN CD 1 1 4 1258 1 1 15 GLN CG C 7.686 2.473 16.053 1.00 . A A . 15 GLN CG 1 1 4 1259 1 1 15 GLN H H 7.063 -0.583 14.119 1.00 . A A . 15 GLN H 1 1 4 1260 1 1 15 GLN HA H 9.449 0.805 15.141 1.00 . A A . 15 GLN HA 1 1 4 1261 1 1 15 GLN HB2 H 6.631 0.631 16.096 1.00 . A A . 15 GLN HB2 1 1 4 1262 1 1 15 GLN HB3 H 7.903 0.771 17.303 1.00 . A A . 15 GLN HB3 1 1 4 1263 1 1 15 GLN HE21 H 6.167 4.963 17.636 1.00 . A A . 15 GLN HE21 1 1 4 1264 1 1 15 GLN HE22 H 6.607 4.744 15.980 1.00 . A A . 15 GLN HE22 1 1 4 1265 1 1 15 GLN HG2 H 8.716 2.777 15.938 1.00 . A A . 15 GLN HG2 1 1 4 1266 1 1 15 GLN HG3 H 7.139 2.708 15.151 1.00 . A A . 15 GLN HG3 1 1 4 1267 1 1 15 GLN N N 7.933 -0.134 14.103 1.00 . A A . 15 GLN N 1 1 4 1268 1 1 15 GLN NE2 N 6.566 4.440 16.911 1.00 . A A . 15 GLN NE2 1 1 4 1269 1 1 15 GLN O O 9.857 -1.016 17.011 1.00 . A A . 15 GLN O 1 1 4 1270 1 1 15 GLN OE1 O 7.070 2.787 18.345 1.00 . A A . 15 GLN OE1 1 1 4 1271 1 1 16 PHE C C 10.334 -3.936 15.732 1.00 . A A . 16 PHE C 1 1 4 1272 1 1 16 PHE CA C 8.947 -3.505 16.200 1.00 . A A . 16 PHE CA 1 1 4 1273 1 1 16 PHE CB C 7.918 -4.576 15.835 1.00 . A A . 16 PHE CB 1 1 4 1274 1 1 16 PHE CD1 C 8.086 -7.031 16.326 1.00 . A A . 16 PHE CD1 1 1 4 1275 1 1 16 PHE CD2 C 7.693 -5.537 18.142 1.00 . A A . 16 PHE CD2 1 1 4 1276 1 1 16 PHE CE1 C 8.070 -8.102 17.200 1.00 . A A . 16 PHE CE1 1 1 4 1277 1 1 16 PHE CE2 C 7.676 -6.604 19.020 1.00 . A A . 16 PHE CE2 1 1 4 1278 1 1 16 PHE CG C 7.899 -5.738 16.787 1.00 . A A . 16 PHE CG 1 1 4 1279 1 1 16 PHE CZ C 7.863 -7.888 18.548 1.00 . A A . 16 PHE CZ 1 1 4 1280 1 1 16 PHE H H 7.947 -2.208 14.858 1.00 . A A . 16 PHE H 1 1 4 1281 1 1 16 PHE HA H 8.964 -3.383 17.272 1.00 . A A . 16 PHE HA 1 1 4 1282 1 1 16 PHE HB2 H 6.933 -4.133 15.833 1.00 . A A . 16 PHE HB2 1 1 4 1283 1 1 16 PHE HB3 H 8.139 -4.957 14.849 1.00 . A A . 16 PHE HB3 1 1 4 1284 1 1 16 PHE HD1 H 8.248 -7.200 15.271 1.00 . A A . 16 PHE HD1 1 1 4 1285 1 1 16 PHE HD2 H 7.545 -4.533 18.513 1.00 . A A . 16 PHE HD2 1 1 4 1286 1 1 16 PHE HE1 H 8.217 -9.105 16.827 1.00 . A A . 16 PHE HE1 1 1 4 1287 1 1 16 PHE HE2 H 7.514 -6.434 20.074 1.00 . A A . 16 PHE HE2 1 1 4 1288 1 1 16 PHE HZ H 7.851 -8.724 19.232 1.00 . A A . 16 PHE HZ 1 1 4 1289 1 1 16 PHE N N 8.575 -2.224 15.611 1.00 . A A . 16 PHE N 1 1 4 1290 1 1 16 PHE O O 11.050 -4.641 16.442 1.00 . A A . 16 PHE O 1 1 4 1291 1 1 17 GLY C C 11.910 -4.882 12.872 1.00 . A A . 17 GLY C 1 1 4 1292 1 1 17 GLY CA C 12.005 -3.858 13.986 1.00 . A A . 17 GLY CA 1 1 4 1293 1 1 17 GLY H H 10.094 -2.946 14.008 1.00 . A A . 17 GLY H 1 1 4 1294 1 1 17 GLY HA2 H 12.476 -2.965 13.601 1.00 . A A . 17 GLY HA2 1 1 4 1295 1 1 17 GLY HA3 H 12.617 -4.262 14.779 1.00 . A A . 17 GLY HA3 1 1 4 1296 1 1 17 GLY N N 10.707 -3.506 14.530 1.00 . A A . 17 GLY N 1 1 4 1297 1 1 17 GLY O O 11.560 -6.037 13.112 1.00 . A A . 17 GLY O 1 1 4 1298 1 1 18 GLU C C 13.547 -5.910 10.178 1.00 . A A . 18 GLU C 1 1 4 1299 1 1 18 GLU CA C 12.165 -5.346 10.497 1.00 . A A . 18 GLU CA 1 1 4 1300 1 1 18 GLU CB C 11.612 -4.602 9.279 1.00 . A A . 18 GLU CB 1 1 4 1301 1 1 18 GLU CD C 11.816 -2.529 7.850 1.00 . A A . 18 GLU CD 1 1 4 1302 1 1 18 GLU CG C 12.529 -3.503 8.769 1.00 . A A . 18 GLU CG 1 1 4 1303 1 1 18 GLU H H 12.492 -3.524 11.524 1.00 . A A . 18 GLU H 1 1 4 1304 1 1 18 GLU HA H 11.503 -6.163 10.739 1.00 . A A . 18 GLU HA 1 1 4 1305 1 1 18 GLU HB2 H 11.455 -5.312 8.480 1.00 . A A . 18 GLU HB2 1 1 4 1306 1 1 18 GLU HB3 H 10.664 -4.157 9.544 1.00 . A A . 18 GLU HB3 1 1 4 1307 1 1 18 GLU HG2 H 12.919 -2.956 9.614 1.00 . A A . 18 GLU HG2 1 1 4 1308 1 1 18 GLU HG3 H 13.345 -3.955 8.226 1.00 . A A . 18 GLU HG3 1 1 4 1309 1 1 18 GLU N N 12.220 -4.457 11.652 1.00 . A A . 18 GLU N 1 1 4 1310 1 1 18 GLU O O 14.196 -6.509 11.034 1.00 . A A . 18 GLU O 1 1 4 1311 1 1 18 GLU OE1 O 10.761 -1.998 8.254 1.00 . A A . 18 GLU OE1 1 1 4 1312 1 1 18 GLU OE2 O 12.314 -2.299 6.729 1.00 . A A . 18 GLU OE2 1 1 5 1313 1 1 1 HIS C C 2.356 -7.036 1.534 1.00 . A A . 1 HIS C 1 1 5 1314 1 1 1 HIS CA C 2.406 -7.770 2.870 1.00 . A A . 1 HIS CA 1 1 5 1315 1 1 1 HIS CB C 1.003 -7.856 3.471 1.00 . A A . 1 HIS CB 1 1 5 1316 1 1 1 HIS CD2 C 1.740 -9.416 5.408 1.00 . A A . 1 HIS CD2 1 1 5 1317 1 1 1 HIS CE1 C 0.294 -8.756 6.918 1.00 . A A . 1 HIS CE1 1 1 5 1318 1 1 1 HIS CG C 0.975 -8.451 4.845 1.00 . A A . 1 HIS CG 1 1 5 1319 1 1 1 HIS H1 H 2.959 -6.422 4.406 1.00 . A A . 1 HIS H1 1 1 5 1320 1 1 1 HIS HA H 2.779 -8.769 2.704 1.00 . A A . 1 HIS HA 1 1 5 1321 1 1 1 HIS HB2 H 0.583 -6.862 3.532 1.00 . A A . 1 HIS HB2 1 1 5 1322 1 1 1 HIS HB3 H 0.381 -8.466 2.832 1.00 . A A . 1 HIS HB3 1 1 5 1323 1 1 1 HIS HD1 H -0.612 -7.372 5.715 1.00 . A A . 1 HIS HD1 1 1 5 1324 1 1 1 HIS HD2 H 2.549 -9.952 4.932 1.00 . A A . 1 HIS HD2 1 1 5 1325 1 1 1 HIS HE1 H -0.256 -8.664 7.843 1.00 . A A . 1 HIS HE1 1 1 5 1326 1 1 1 HIS N N 3.314 -7.101 3.796 1.00 . A A . 1 HIS N 1 1 5 1327 1 1 1 HIS ND1 N 0.079 -8.059 5.817 1.00 . A A . 1 HIS ND1 1 1 5 1328 1 1 1 HIS NE2 N 1.297 -9.587 6.696 1.00 . A A . 1 HIS NE2 1 1 5 1329 1 1 1 HIS O O 3.052 -6.040 1.334 1.00 . A A . 1 HIS O 1 1 5 1330 1 1 2 VAL C C 0.274 -5.887 -0.706 1.00 . A A . 2 VAL C 1 1 5 1331 1 1 2 VAL CA C 1.388 -6.927 -0.697 1.00 . A A . 2 VAL CA 1 1 5 1332 1 1 2 VAL CB C 1.095 -7.987 -1.776 1.00 . A A . 2 VAL CB 1 1 5 1333 1 1 2 VAL CG1 C 1.261 -7.394 -3.167 1.00 . A A . 2 VAL CG1 1 1 5 1334 1 1 2 VAL CG2 C 1.997 -9.198 -1.592 1.00 . A A . 2 VAL CG2 1 1 5 1335 1 1 2 VAL H H 1.001 -8.331 0.838 1.00 . A A . 2 VAL H 1 1 5 1336 1 1 2 VAL HA H 2.322 -6.443 -0.943 1.00 . A A . 2 VAL HA 1 1 5 1337 1 1 2 VAL HB H 0.069 -8.308 -1.666 1.00 . A A . 2 VAL HB 1 1 5 1338 1 1 2 VAL HG11 H 0.407 -7.657 -3.774 1.00 . A A . 2 VAL HG11 1 1 5 1339 1 1 2 VAL HG12 H 1.334 -6.318 -3.093 1.00 . A A . 2 VAL HG12 1 1 5 1340 1 1 2 VAL HG13 H 2.159 -7.786 -3.620 1.00 . A A . 2 VAL HG13 1 1 5 1341 1 1 2 VAL HG21 H 3.023 -8.872 -1.501 1.00 . A A . 2 VAL HG21 1 1 5 1342 1 1 2 VAL HG22 H 1.707 -9.730 -0.699 1.00 . A A . 2 VAL HG22 1 1 5 1343 1 1 2 VAL HG23 H 1.902 -9.851 -2.448 1.00 . A A . 2 VAL HG23 1 1 5 1344 1 1 2 VAL N N 1.529 -7.535 0.620 1.00 . A A . 2 VAL N 1 1 5 1345 1 1 2 VAL O O -0.622 -5.928 -1.549 1.00 . A A . 2 VAL O 1 1 5 1346 1 1 3 PHE C C -0.008 -2.531 0.468 1.00 . A A . 3 PHE C 1 1 5 1347 1 1 3 PHE CA C -0.668 -3.901 0.340 1.00 . A A . 3 PHE CA 1 1 5 1348 1 1 3 PHE CB C -1.582 -4.153 1.541 1.00 . A A . 3 PHE CB 1 1 5 1349 1 1 3 PHE CD1 C -4.005 -4.641 1.107 1.00 . A A . 3 PHE CD1 1 1 5 1350 1 1 3 PHE CD2 C -2.466 -6.462 1.114 1.00 . A A . 3 PHE CD2 1 1 5 1351 1 1 3 PHE CE1 C -5.042 -5.513 0.838 1.00 . A A . 3 PHE CE1 1 1 5 1352 1 1 3 PHE CE2 C -3.500 -7.339 0.843 1.00 . A A . 3 PHE CE2 1 1 5 1353 1 1 3 PHE CG C -2.707 -5.104 1.248 1.00 . A A . 3 PHE CG 1 1 5 1354 1 1 3 PHE CZ C -4.790 -6.864 0.706 1.00 . A A . 3 PHE CZ 1 1 5 1355 1 1 3 PHE H H 1.076 -4.973 0.882 1.00 . A A . 3 PHE H 1 1 5 1356 1 1 3 PHE HA H -1.259 -3.920 -0.562 1.00 . A A . 3 PHE HA 1 1 5 1357 1 1 3 PHE HB2 H -0.998 -4.570 2.347 1.00 . A A . 3 PHE HB2 1 1 5 1358 1 1 3 PHE HB3 H -2.012 -3.216 1.860 1.00 . A A . 3 PHE HB3 1 1 5 1359 1 1 3 PHE HD1 H -4.204 -3.583 1.210 1.00 . A A . 3 PHE HD1 1 1 5 1360 1 1 3 PHE HD2 H -1.459 -6.836 1.222 1.00 . A A . 3 PHE HD2 1 1 5 1361 1 1 3 PHE HE1 H -6.050 -5.138 0.731 1.00 . A A . 3 PHE HE1 1 1 5 1362 1 1 3 PHE HE2 H -3.300 -8.396 0.742 1.00 . A A . 3 PHE HE2 1 1 5 1363 1 1 3 PHE HZ H -5.599 -7.547 0.495 1.00 . A A . 3 PHE HZ 1 1 5 1364 1 1 3 PHE N N 0.337 -4.953 0.238 1.00 . A A . 3 PHE N 1 1 5 1365 1 1 3 PHE O O -0.420 -1.569 -0.182 1.00 . A A . 3 PHE O 1 1 5 1366 1 1 4 ARG C C 0.787 -0.111 2.030 1.00 . A A . 4 ARG C 1 1 5 1367 1 1 4 ARG CA C 1.732 -1.198 1.525 1.00 . A A . 4 ARG CA 1 1 5 1368 1 1 4 ARG CB C 2.405 -0.742 0.230 1.00 . A A . 4 ARG CB 1 1 5 1369 1 1 4 ARG CD C 4.862 -0.997 0.694 1.00 . A A . 4 ARG CD 1 1 5 1370 1 1 4 ARG CG C 3.724 -0.018 0.451 1.00 . A A . 4 ARG CG 1 1 5 1371 1 1 4 ARG CZ C 6.794 0.274 -0.142 1.00 . A A . 4 ARG CZ 1 1 5 1372 1 1 4 ARG H H 1.298 -3.251 1.800 1.00 . A A . 4 ARG H 1 1 5 1373 1 1 4 ARG HA H 2.491 -1.374 2.273 1.00 . A A . 4 ARG HA 1 1 5 1374 1 1 4 ARG HB2 H 2.594 -1.607 -0.388 1.00 . A A . 4 ARG HB2 1 1 5 1375 1 1 4 ARG HB3 H 1.737 -0.075 -0.293 1.00 . A A . 4 ARG HB3 1 1 5 1376 1 1 4 ARG HD2 H 4.650 -1.561 1.590 1.00 . A A . 4 ARG HD2 1 1 5 1377 1 1 4 ARG HD3 H 4.926 -1.670 -0.148 1.00 . A A . 4 ARG HD3 1 1 5 1378 1 1 4 ARG HE H 6.539 -0.299 1.752 1.00 . A A . 4 ARG HE 1 1 5 1379 1 1 4 ARG HG2 H 3.951 0.572 -0.425 1.00 . A A . 4 ARG HG2 1 1 5 1380 1 1 4 ARG HG3 H 3.628 0.630 1.309 1.00 . A A . 4 ARG HG3 1 1 5 1381 1 1 4 ARG HH11 H 5.408 -0.183 -1.539 1.00 . A A . 4 ARG HH11 1 1 5 1382 1 1 4 ARG HH12 H 6.775 0.713 -2.114 1.00 . A A . 4 ARG HH12 1 1 5 1383 1 1 4 ARG HH21 H 8.444 1.317 -0.666 1.00 . A A . 4 ARG HH21 1 1 5 1384 1 1 4 ARG HH22 H 8.343 0.881 1.006 1.00 . A A . 4 ARG HH22 1 1 5 1385 1 1 4 ARG N N 1.016 -2.450 1.310 1.00 . A A . 4 ARG N 1 1 5 1386 1 1 4 ARG NE N 6.144 -0.316 0.855 1.00 . A A . 4 ARG NE 1 1 5 1387 1 1 4 ARG NH1 N 6.284 0.267 -1.366 1.00 . A A . 4 ARG NH1 1 1 5 1388 1 1 4 ARG NH2 N 7.956 0.874 0.085 1.00 . A A . 4 ARG NH2 1 1 5 1389 1 1 4 ARG O O 0.955 1.068 1.717 1.00 . A A . 4 ARG O 1 1 5 1390 1 1 5 LEU C C -0.870 0.739 4.819 1.00 . A A . 5 LEU C 1 1 5 1391 1 1 5 LEU CA C -1.181 0.422 3.360 1.00 . A A . 5 LEU CA 1 1 5 1392 1 1 5 LEU CB C -2.595 -0.150 3.240 1.00 . A A . 5 LEU CB 1 1 5 1393 1 1 5 LEU CD1 C -3.838 1.886 4.009 1.00 . A A . 5 LEU CD1 1 1 5 1394 1 1 5 LEU CD2 C -3.413 1.531 1.570 1.00 . A A . 5 LEU CD2 1 1 5 1395 1 1 5 LEU CG C -3.698 0.853 2.902 1.00 . A A . 5 LEU CG 1 1 5 1396 1 1 5 LEU H H -0.291 -1.468 3.026 1.00 . A A . 5 LEU H 1 1 5 1397 1 1 5 LEU HA H -1.121 1.335 2.785 1.00 . A A . 5 LEU HA 1 1 5 1398 1 1 5 LEU HB2 H -2.583 -0.902 2.466 1.00 . A A . 5 LEU HB2 1 1 5 1399 1 1 5 LEU HB3 H -2.844 -0.613 4.185 1.00 . A A . 5 LEU HB3 1 1 5 1400 1 1 5 LEU HD11 H -4.311 1.432 4.867 1.00 . A A . 5 LEU HD11 1 1 5 1401 1 1 5 LEU HD12 H -4.443 2.709 3.659 1.00 . A A . 5 LEU HD12 1 1 5 1402 1 1 5 LEU HD13 H -2.860 2.251 4.287 1.00 . A A . 5 LEU HD13 1 1 5 1403 1 1 5 LEU HD21 H -4.337 1.895 1.146 1.00 . A A . 5 LEU HD21 1 1 5 1404 1 1 5 LEU HD22 H -2.962 0.820 0.894 1.00 . A A . 5 LEU HD22 1 1 5 1405 1 1 5 LEU HD23 H -2.736 2.359 1.725 1.00 . A A . 5 LEU HD23 1 1 5 1406 1 1 5 LEU HG H -4.640 0.327 2.816 1.00 . A A . 5 LEU HG 1 1 5 1407 1 1 5 LEU N N -0.208 -0.516 2.812 1.00 . A A . 5 LEU N 1 1 5 1408 1 1 5 LEU O O -1.249 -0.007 5.722 1.00 . A A . 5 LEU O 1 1 5 1409 1 1 6 LYS C C -1.055 2.704 7.175 1.00 . A A . 6 LYS C 1 1 5 1410 1 1 6 LYS CA C 0.180 2.270 6.393 1.00 . A A . 6 LYS CA 1 1 5 1411 1 1 6 LYS CB C 1.192 3.417 6.341 1.00 . A A . 6 LYS CB 1 1 5 1412 1 1 6 LYS CD C 3.170 1.906 6.006 1.00 . A A . 6 LYS CD 1 1 5 1413 1 1 6 LYS CE C 2.647 0.614 5.398 1.00 . A A . 6 LYS CE 1 1 5 1414 1 1 6 LYS CG C 2.411 3.114 5.486 1.00 . A A . 6 LYS CG 1 1 5 1415 1 1 6 LYS H H 0.095 2.405 4.282 1.00 . A A . 6 LYS H 1 1 5 1416 1 1 6 LYS HA H 0.630 1.427 6.893 1.00 . A A . 6 LYS HA 1 1 5 1417 1 1 6 LYS HB2 H 0.705 4.293 5.939 1.00 . A A . 6 LYS HB2 1 1 5 1418 1 1 6 LYS HB3 H 1.528 3.631 7.345 1.00 . A A . 6 LYS HB3 1 1 5 1419 1 1 6 LYS HD2 H 4.215 2.011 5.753 1.00 . A A . 6 LYS HD2 1 1 5 1420 1 1 6 LYS HD3 H 3.061 1.858 7.081 1.00 . A A . 6 LYS HD3 1 1 5 1421 1 1 6 LYS HE2 H 2.049 0.101 6.135 1.00 . A A . 6 LYS HE2 1 1 5 1422 1 1 6 LYS HE3 H 2.033 0.857 4.543 1.00 . A A . 6 LYS HE3 1 1 5 1423 1 1 6 LYS HG2 H 2.089 2.916 4.474 1.00 . A A . 6 LYS HG2 1 1 5 1424 1 1 6 LYS HG3 H 3.068 3.973 5.495 1.00 . A A . 6 LYS HG3 1 1 5 1425 1 1 6 LYS HZ1 H 3.804 -1.116 5.582 1.00 . A A . 6 LYS HZ1 1 1 5 1426 1 1 6 LYS HZ2 H 4.660 0.224 5.004 1.00 . A A . 6 LYS HZ2 1 1 5 1427 1 1 6 LYS HZ3 H 3.591 -0.600 3.985 1.00 . A A . 6 LYS HZ3 1 1 5 1428 1 1 6 LYS N N -0.179 1.852 5.044 1.00 . A A . 6 LYS N 1 1 5 1429 1 1 6 LYS NZ N 3.753 -0.282 4.962 1.00 . A A . 6 LYS NZ 1 1 5 1430 1 1 6 LYS O O -1.364 3.893 7.260 1.00 . A A . 6 LYS O 1 1 5 1431 1 1 7 LYS C C -3.548 0.729 9.101 1.00 . A A . 7 LYS C 1 1 5 1432 1 1 7 LYS CA C -2.960 2.014 8.525 1.00 . A A . 7 LYS CA 1 1 5 1433 1 1 7 LYS CB C -4.003 2.719 7.655 1.00 . A A . 7 LYS CB 1 1 5 1434 1 1 7 LYS CD C -5.834 4.300 8.333 1.00 . A A . 7 LYS CD 1 1 5 1435 1 1 7 LYS CE C -4.956 5.170 9.219 1.00 . A A . 7 LYS CE 1 1 5 1436 1 1 7 LYS CG C -5.360 2.857 8.324 1.00 . A A . 7 LYS CG 1 1 5 1437 1 1 7 LYS H H -1.463 0.804 7.643 1.00 . A A . 7 LYS H 1 1 5 1438 1 1 7 LYS HA H -2.683 2.665 9.340 1.00 . A A . 7 LYS HA 1 1 5 1439 1 1 7 LYS HB2 H -3.643 3.708 7.413 1.00 . A A . 7 LYS HB2 1 1 5 1440 1 1 7 LYS HB3 H -4.131 2.158 6.741 1.00 . A A . 7 LYS HB3 1 1 5 1441 1 1 7 LYS HD2 H -5.803 4.687 7.325 1.00 . A A . 7 LYS HD2 1 1 5 1442 1 1 7 LYS HD3 H -6.849 4.334 8.702 1.00 . A A . 7 LYS HD3 1 1 5 1443 1 1 7 LYS HE2 H -5.453 5.314 10.166 1.00 . A A . 7 LYS HE2 1 1 5 1444 1 1 7 LYS HE3 H -4.016 4.663 9.380 1.00 . A A . 7 LYS HE3 1 1 5 1445 1 1 7 LYS HG2 H -6.079 2.256 7.786 1.00 . A A . 7 LYS HG2 1 1 5 1446 1 1 7 LYS HG3 H -5.286 2.505 9.343 1.00 . A A . 7 LYS HG3 1 1 5 1447 1 1 7 LYS HZ1 H -5.502 6.794 8.025 1.00 . A A . 7 LYS HZ1 1 1 5 1448 1 1 7 LYS HZ2 H -3.846 6.450 7.998 1.00 . A A . 7 LYS HZ2 1 1 5 1449 1 1 7 LYS HZ3 H -4.530 7.211 9.345 1.00 . A A . 7 LYS HZ3 1 1 5 1450 1 1 7 LYS N N -1.759 1.733 7.747 1.00 . A A . 7 LYS N 1 1 5 1451 1 1 7 LYS NZ N -4.690 6.499 8.604 1.00 . A A . 7 LYS NZ 1 1 5 1452 1 1 7 LYS O O -3.761 0.621 10.309 1.00 . A A . 7 LYS O 1 1 5 1453 1 1 8 TRP C C -3.364 -2.302 9.492 1.00 . A A . 8 TRP C 1 1 5 1454 1 1 8 TRP CA C -4.367 -1.518 8.654 1.00 . A A . 8 TRP CA 1 1 5 1455 1 1 8 TRP CB C -4.788 -2.341 7.436 1.00 . A A . 8 TRP CB 1 1 5 1456 1 1 8 TRP CD1 C -6.175 -4.483 7.676 1.00 . A A . 8 TRP CD1 1 1 5 1457 1 1 8 TRP CD2 C -7.358 -2.593 7.882 1.00 . A A . 8 TRP CD2 1 1 5 1458 1 1 8 TRP CE2 C -8.231 -3.688 8.033 1.00 . A A . 8 TRP CE2 1 1 5 1459 1 1 8 TRP CE3 C -7.878 -1.299 7.974 1.00 . A A . 8 TRP CE3 1 1 5 1460 1 1 8 TRP CG C -6.048 -3.124 7.655 1.00 . A A . 8 TRP CG 1 1 5 1461 1 1 8 TRP CH2 C -10.076 -2.248 8.354 1.00 . A A . 8 TRP CH2 1 1 5 1462 1 1 8 TRP CZ2 C -9.594 -3.526 8.269 1.00 . A A . 8 TRP CZ2 1 1 5 1463 1 1 8 TRP CZ3 C -9.231 -1.140 8.208 1.00 . A A . 8 TRP CZ3 1 1 5 1464 1 1 8 TRP H H -3.614 -0.093 7.281 1.00 . A A . 8 TRP H 1 1 5 1465 1 1 8 TRP HA H -5.239 -1.312 9.257 1.00 . A A . 8 TRP HA 1 1 5 1466 1 1 8 TRP HB2 H -4.949 -1.679 6.599 1.00 . A A . 8 TRP HB2 1 1 5 1467 1 1 8 TRP HB3 H -4.000 -3.039 7.193 1.00 . A A . 8 TRP HB3 1 1 5 1468 1 1 8 TRP HD1 H -5.357 -5.173 7.533 1.00 . A A . 8 TRP HD1 1 1 5 1469 1 1 8 TRP HE1 H -7.830 -5.746 7.962 1.00 . A A . 8 TRP HE1 1 1 5 1470 1 1 8 TRP HE3 H -7.243 -0.432 7.864 1.00 . A A . 8 TRP HE3 1 1 5 1471 1 1 8 TRP HH2 H -11.126 -2.077 8.536 1.00 . A A . 8 TRP HH2 1 1 5 1472 1 1 8 TRP HZ2 H -10.258 -4.370 8.385 1.00 . A A . 8 TRP HZ2 1 1 5 1473 1 1 8 TRP HZ3 H -9.651 -0.148 8.282 1.00 . A A . 8 TRP HZ3 1 1 5 1474 1 1 8 TRP N N -3.805 -0.240 8.231 1.00 . A A . 8 TRP N 1 1 5 1475 1 1 8 TRP NE1 N -7.486 -4.829 7.902 1.00 . A A . 8 TRP NE1 1 1 5 1476 1 1 8 TRP O O -3.708 -3.316 10.100 1.00 . A A . 8 TRP O 1 1 5 1477 1 1 9 ILE C C 0.148 -1.582 10.432 1.00 . A A . 9 ILE C 1 1 5 1478 1 1 9 ILE CA C -1.071 -2.486 10.285 1.00 . A A . 9 ILE CA 1 1 5 1479 1 1 9 ILE CB C -0.640 -3.809 9.626 1.00 . A A . 9 ILE CB 1 1 5 1480 1 1 9 ILE CD1 C -0.058 -2.624 7.450 1.00 . A A . 9 ILE CD1 1 1 5 1481 1 1 9 ILE CG1 C -0.839 -3.738 8.111 1.00 . A A . 9 ILE CG1 1 1 5 1482 1 1 9 ILE CG2 C -1.422 -4.974 10.215 1.00 . A A . 9 ILE CG2 1 1 5 1483 1 1 9 ILE H H -1.911 -1.016 9.015 1.00 . A A . 9 ILE H 1 1 5 1484 1 1 9 ILE HA H -1.463 -2.707 11.268 1.00 . A A . 9 ILE HA 1 1 5 1485 1 1 9 ILE HB H 0.407 -3.966 9.838 1.00 . A A . 9 ILE HB 1 1 5 1486 1 1 9 ILE HD11 H 0.083 -2.855 6.404 1.00 . A A . 9 ILE HD11 1 1 5 1487 1 1 9 ILE HD12 H -0.604 -1.697 7.542 1.00 . A A . 9 ILE HD12 1 1 5 1488 1 1 9 ILE HD13 H 0.904 -2.525 7.929 1.00 . A A . 9 ILE HD13 1 1 5 1489 1 1 9 ILE HG12 H -0.524 -4.670 7.669 1.00 . A A . 9 ILE HG12 1 1 5 1490 1 1 9 ILE HG13 H -1.887 -3.581 7.900 1.00 . A A . 9 ILE HG13 1 1 5 1491 1 1 9 ILE HG21 H -0.733 -5.712 10.599 1.00 . A A . 9 ILE HG21 1 1 5 1492 1 1 9 ILE HG22 H -2.049 -4.616 11.017 1.00 . A A . 9 ILE HG22 1 1 5 1493 1 1 9 ILE HG23 H -2.037 -5.419 9.447 1.00 . A A . 9 ILE HG23 1 1 5 1494 1 1 9 ILE N N -2.123 -1.828 9.520 1.00 . A A . 9 ILE N 1 1 5 1495 1 1 9 ILE O O 1.272 -2.061 10.586 1.00 . A A . 9 ILE O 1 1 5 1496 1 1 10 GLN C C 1.843 0.409 11.750 1.00 . A A . 10 GLN C 1 1 5 1497 1 1 10 GLN CA C 0.999 0.696 10.513 1.00 . A A . 10 GLN CA 1 1 5 1498 1 1 10 GLN CB C 0.432 2.115 10.586 1.00 . A A . 10 GLN CB 1 1 5 1499 1 1 10 GLN CD C -0.665 3.893 12.007 1.00 . A A . 10 GLN CD 1 1 5 1500 1 1 10 GLN CG C -0.057 2.505 11.971 1.00 . A A . 10 GLN CG 1 1 5 1501 1 1 10 GLN H H -0.999 0.046 10.259 1.00 . A A . 10 GLN H 1 1 5 1502 1 1 10 GLN HA H 1.625 0.613 9.638 1.00 . A A . 10 GLN HA 1 1 5 1503 1 1 10 GLN HB2 H 1.202 2.813 10.290 1.00 . A A . 10 GLN HB2 1 1 5 1504 1 1 10 GLN HB3 H -0.398 2.195 9.899 1.00 . A A . 10 GLN HB3 1 1 5 1505 1 1 10 GLN HE21 H -0.239 5.784 12.450 1.00 . A A . 10 GLN HE21 1 1 5 1506 1 1 10 GLN HE22 H 1.048 4.653 12.670 1.00 . A A . 10 GLN HE22 1 1 5 1507 1 1 10 GLN HG2 H -0.806 1.793 12.288 1.00 . A A . 10 GLN HG2 1 1 5 1508 1 1 10 GLN HG3 H 0.778 2.475 12.655 1.00 . A A . 10 GLN HG3 1 1 5 1509 1 1 10 GLN N N -0.082 -0.274 10.384 1.00 . A A . 10 GLN N 1 1 5 1510 1 1 10 GLN NE2 N 0.127 4.876 12.418 1.00 . A A . 10 GLN NE2 1 1 5 1511 1 1 10 GLN O O 2.999 0.825 11.836 1.00 . A A . 10 GLN O 1 1 5 1512 1 1 10 GLN OE1 O -1.834 4.080 11.669 1.00 . A A . 10 GLN OE1 1 1 5 1513 1 1 11 LYS C C 3.087 -1.637 13.668 1.00 . A A . 11 LYS C 1 1 5 1514 1 1 11 LYS CA C 1.957 -0.648 13.940 1.00 . A A . 11 LYS CA 1 1 5 1515 1 1 11 LYS CB C 0.979 -1.242 14.955 1.00 . A A . 11 LYS CB 1 1 5 1516 1 1 11 LYS CD C 2.167 -3.009 16.289 1.00 . A A . 11 LYS CD 1 1 5 1517 1 1 11 LYS CE C 1.265 -3.953 17.068 1.00 . A A . 11 LYS CE 1 1 5 1518 1 1 11 LYS CG C 1.621 -1.591 16.287 1.00 . A A . 11 LYS CG 1 1 5 1519 1 1 11 LYS H H 0.335 -0.607 12.580 1.00 . A A . 11 LYS H 1 1 5 1520 1 1 11 LYS HA H 2.379 0.259 14.347 1.00 . A A . 11 LYS HA 1 1 5 1521 1 1 11 LYS HB2 H 0.189 -0.528 15.136 1.00 . A A . 11 LYS HB2 1 1 5 1522 1 1 11 LYS HB3 H 0.550 -2.143 14.540 1.00 . A A . 11 LYS HB3 1 1 5 1523 1 1 11 LYS HD2 H 2.241 -3.358 15.269 1.00 . A A . 11 LYS HD2 1 1 5 1524 1 1 11 LYS HD3 H 3.149 -3.006 16.742 1.00 . A A . 11 LYS HD3 1 1 5 1525 1 1 11 LYS HE2 H 1.879 -4.686 17.567 1.00 . A A . 11 LYS HE2 1 1 5 1526 1 1 11 LYS HE3 H 0.718 -3.381 17.803 1.00 . A A . 11 LYS HE3 1 1 5 1527 1 1 11 LYS HG2 H 2.432 -0.904 16.476 1.00 . A A . 11 LYS HG2 1 1 5 1528 1 1 11 LYS HG3 H 0.880 -1.499 17.068 1.00 . A A . 11 LYS HG3 1 1 5 1529 1 1 11 LYS HZ1 H -0.284 -5.314 16.735 1.00 . A A . 11 LYS HZ1 1 1 5 1530 1 1 11 LYS HZ2 H 0.807 -5.189 15.448 1.00 . A A . 11 LYS HZ2 1 1 5 1531 1 1 11 LYS HZ3 H -0.328 -3.964 15.717 1.00 . A A . 11 LYS HZ3 1 1 5 1532 1 1 11 LYS N N 1.259 -0.304 12.707 1.00 . A A . 11 LYS N 1 1 5 1533 1 1 11 LYS NZ N 0.297 -4.654 16.180 1.00 . A A . 11 LYS NZ 1 1 5 1534 1 1 11 LYS O O 4.207 -1.461 14.146 1.00 . A A . 11 LYS O 1 1 5 1535 1 1 12 VAL C C 4.937 -3.086 11.777 1.00 . A A . 12 VAL C 1 1 5 1536 1 1 12 VAL CA C 3.775 -3.690 12.557 1.00 . A A . 12 VAL CA 1 1 5 1537 1 1 12 VAL CB C 3.152 -4.829 11.729 1.00 . A A . 12 VAL CB 1 1 5 1538 1 1 12 VAL CG1 C 4.232 -5.767 11.212 1.00 . A A . 12 VAL CG1 1 1 5 1539 1 1 12 VAL CG2 C 2.125 -5.589 12.555 1.00 . A A . 12 VAL CG2 1 1 5 1540 1 1 12 VAL H H 1.874 -2.761 12.543 1.00 . A A . 12 VAL H 1 1 5 1541 1 1 12 VAL HA H 4.153 -4.109 13.479 1.00 . A A . 12 VAL HA 1 1 5 1542 1 1 12 VAL HB H 2.648 -4.394 10.878 1.00 . A A . 12 VAL HB 1 1 5 1543 1 1 12 VAL HG11 H 3.771 -6.604 10.709 1.00 . A A . 12 VAL HG11 1 1 5 1544 1 1 12 VAL HG12 H 4.870 -5.237 10.521 1.00 . A A . 12 VAL HG12 1 1 5 1545 1 1 12 VAL HG13 H 4.822 -6.128 12.042 1.00 . A A . 12 VAL HG13 1 1 5 1546 1 1 12 VAL HG21 H 2.593 -6.449 13.010 1.00 . A A . 12 VAL HG21 1 1 5 1547 1 1 12 VAL HG22 H 1.735 -4.941 13.326 1.00 . A A . 12 VAL HG22 1 1 5 1548 1 1 12 VAL HG23 H 1.317 -5.915 11.916 1.00 . A A . 12 VAL HG23 1 1 5 1549 1 1 12 VAL N N 2.785 -2.675 12.895 1.00 . A A . 12 VAL N 1 1 5 1550 1 1 12 VAL O O 6.102 -3.285 12.124 1.00 . A A . 12 VAL O 1 1 5 1551 1 1 13 ILE C C 6.371 -0.627 10.666 1.00 . A A . 13 ILE C 1 1 5 1552 1 1 13 ILE CA C 5.630 -1.712 9.893 1.00 . A A . 13 ILE CA 1 1 5 1553 1 1 13 ILE CB C 5.015 -1.092 8.623 1.00 . A A . 13 ILE CB 1 1 5 1554 1 1 13 ILE CD1 C 6.259 -1.372 6.420 1.00 . A A . 13 ILE CD1 1 1 5 1555 1 1 13 ILE CG1 C 6.118 -0.574 7.697 1.00 . A A . 13 ILE CG1 1 1 5 1556 1 1 13 ILE CG2 C 4.056 0.029 8.993 1.00 . A A . 13 ILE CG2 1 1 5 1557 1 1 13 ILE H H 3.667 -2.225 10.495 1.00 . A A . 13 ILE H 1 1 5 1558 1 1 13 ILE HA H 6.337 -2.472 9.592 1.00 . A A . 13 ILE HA 1 1 5 1559 1 1 13 ILE HB H 4.455 -1.859 8.110 1.00 . A A . 13 ILE HB 1 1 5 1560 1 1 13 ILE HD11 H 7.162 -1.963 6.463 1.00 . A A . 13 ILE HD11 1 1 5 1561 1 1 13 ILE HD12 H 5.407 -2.026 6.308 1.00 . A A . 13 ILE HD12 1 1 5 1562 1 1 13 ILE HD13 H 6.310 -0.699 5.578 1.00 . A A . 13 ILE HD13 1 1 5 1563 1 1 13 ILE HG12 H 5.902 0.448 7.427 1.00 . A A . 13 ILE HG12 1 1 5 1564 1 1 13 ILE HG13 H 7.063 -0.612 8.220 1.00 . A A . 13 ILE HG13 1 1 5 1565 1 1 13 ILE HG21 H 3.489 -0.256 9.867 1.00 . A A . 13 ILE HG21 1 1 5 1566 1 1 13 ILE HG22 H 4.616 0.927 9.205 1.00 . A A . 13 ILE HG22 1 1 5 1567 1 1 13 ILE HG23 H 3.381 0.212 8.170 1.00 . A A . 13 ILE HG23 1 1 5 1568 1 1 13 ILE N N 4.613 -2.347 10.721 1.00 . A A . 13 ILE N 1 1 5 1569 1 1 13 ILE O O 7.561 -0.397 10.448 1.00 . A A . 13 ILE O 1 1 5 1570 1 1 14 ASP C C 7.528 0.611 13.063 1.00 . A A . 14 ASP C 1 1 5 1571 1 1 14 ASP CA C 6.252 1.095 12.382 1.00 . A A . 14 ASP CA 1 1 5 1572 1 1 14 ASP CB C 5.252 1.582 13.432 1.00 . A A . 14 ASP CB 1 1 5 1573 1 1 14 ASP CG C 5.906 2.429 14.505 1.00 . A A . 14 ASP CG 1 1 5 1574 1 1 14 ASP H H 4.716 -0.193 11.700 1.00 . A A . 14 ASP H 1 1 5 1575 1 1 14 ASP HA H 6.498 1.916 11.725 1.00 . A A . 14 ASP HA 1 1 5 1576 1 1 14 ASP HB2 H 4.490 2.175 12.947 1.00 . A A . 14 ASP HB2 1 1 5 1577 1 1 14 ASP HB3 H 4.791 0.727 13.904 1.00 . A A . 14 ASP HB3 1 1 5 1578 1 1 14 ASP N N 5.661 0.036 11.572 1.00 . A A . 14 ASP N 1 1 5 1579 1 1 14 ASP O O 8.420 1.403 13.365 1.00 . A A . 14 ASP O 1 1 5 1580 1 1 14 ASP OD1 O 6.205 1.886 15.590 1.00 . A A . 14 ASP OD1 1 1 5 1581 1 1 14 ASP OD2 O 6.120 3.635 14.261 1.00 . A A . 14 ASP OD2 1 1 5 1582 1 1 15 GLN C C 9.543 -2.172 12.978 1.00 . A A . 15 GLN C 1 1 5 1583 1 1 15 GLN CA C 8.773 -1.283 13.949 1.00 . A A . 15 GLN CA 1 1 5 1584 1 1 15 GLN CB C 8.348 -2.094 15.174 1.00 . A A . 15 GLN CB 1 1 5 1585 1 1 15 GLN CD C 8.983 -1.882 17.610 1.00 . A A . 15 GLN CD 1 1 5 1586 1 1 15 GLN CG C 8.237 -1.265 16.444 1.00 . A A . 15 GLN CG 1 1 5 1587 1 1 15 GLN H H 6.863 -1.274 13.037 1.00 . A A . 15 GLN H 1 1 5 1588 1 1 15 GLN HA H 9.417 -0.478 14.267 1.00 . A A . 15 GLN HA 1 1 5 1589 1 1 15 GLN HB2 H 7.385 -2.543 14.978 1.00 . A A . 15 GLN HB2 1 1 5 1590 1 1 15 GLN HB3 H 9.073 -2.876 15.343 1.00 . A A . 15 GLN HB3 1 1 5 1591 1 1 15 GLN HE21 H 10.284 -1.449 19.049 1.00 . A A . 15 GLN HE21 1 1 5 1592 1 1 15 GLN HE22 H 9.858 -0.141 18.005 1.00 . A A . 15 GLN HE22 1 1 5 1593 1 1 15 GLN HG2 H 8.646 -0.284 16.254 1.00 . A A . 15 GLN HG2 1 1 5 1594 1 1 15 GLN HG3 H 7.194 -1.174 16.709 1.00 . A A . 15 GLN HG3 1 1 5 1595 1 1 15 GLN N N 7.607 -0.694 13.302 1.00 . A A . 15 GLN N 1 1 5 1596 1 1 15 GLN NE2 N 9.791 -1.077 18.290 1.00 . A A . 15 GLN NE2 1 1 5 1597 1 1 15 GLN O O 10.673 -2.575 13.253 1.00 . A A . 15 GLN O 1 1 5 1598 1 1 15 GLN OE1 O 8.835 -3.071 17.898 1.00 . A A . 15 GLN OE1 1 1 5 1599 1 1 16 PHE C C 10.003 -2.487 9.634 1.00 . A A . 16 PHE C 1 1 5 1600 1 1 16 PHE CA C 9.550 -3.319 10.831 1.00 . A A . 16 PHE CA 1 1 5 1601 1 1 16 PHE CB C 8.578 -4.408 10.371 1.00 . A A . 16 PHE CB 1 1 5 1602 1 1 16 PHE CD1 C 9.914 -6.500 10.738 1.00 . A A . 16 PHE CD1 1 1 5 1603 1 1 16 PHE CD2 C 9.252 -5.954 8.513 1.00 . A A . 16 PHE CD2 1 1 5 1604 1 1 16 PHE CE1 C 10.544 -7.640 10.275 1.00 . A A . 16 PHE CE1 1 1 5 1605 1 1 16 PHE CE2 C 9.880 -7.092 8.044 1.00 . A A . 16 PHE CE2 1 1 5 1606 1 1 16 PHE CG C 9.262 -5.645 9.864 1.00 . A A . 16 PHE CG 1 1 5 1607 1 1 16 PHE CZ C 10.527 -7.936 8.926 1.00 . A A . 16 PHE CZ 1 1 5 1608 1 1 16 PHE H H 8.022 -2.124 11.681 1.00 . A A . 16 PHE H 1 1 5 1609 1 1 16 PHE HA H 10.414 -3.785 11.278 1.00 . A A . 16 PHE HA 1 1 5 1610 1 1 16 PHE HB2 H 7.950 -4.693 11.201 1.00 . A A . 16 PHE HB2 1 1 5 1611 1 1 16 PHE HB3 H 7.962 -4.017 9.575 1.00 . A A . 16 PHE HB3 1 1 5 1612 1 1 16 PHE HD1 H 9.928 -6.269 11.794 1.00 . A A . 16 PHE HD1 1 1 5 1613 1 1 16 PHE HD2 H 8.747 -5.295 7.822 1.00 . A A . 16 PHE HD2 1 1 5 1614 1 1 16 PHE HE1 H 11.049 -8.297 10.967 1.00 . A A . 16 PHE HE1 1 1 5 1615 1 1 16 PHE HE2 H 9.866 -7.322 6.989 1.00 . A A . 16 PHE HE2 1 1 5 1616 1 1 16 PHE HZ H 11.018 -8.826 8.562 1.00 . A A . 16 PHE HZ 1 1 5 1617 1 1 16 PHE N N 8.923 -2.475 11.842 1.00 . A A . 16 PHE N 1 1 5 1618 1 1 16 PHE O O 9.459 -2.609 8.538 1.00 . A A . 16 PHE O 1 1 5 1619 1 1 17 GLY C C 12.695 -1.424 8.071 1.00 . A A . 17 GLY C 1 1 5 1620 1 1 17 GLY CA C 11.513 -0.800 8.786 1.00 . A A . 17 GLY CA 1 1 5 1621 1 1 17 GLY H H 11.400 -1.585 10.750 1.00 . A A . 17 GLY H 1 1 5 1622 1 1 17 GLY HA2 H 10.723 -0.627 8.071 1.00 . A A . 17 GLY HA2 1 1 5 1623 1 1 17 GLY HA3 H 11.820 0.148 9.205 1.00 . A A . 17 GLY HA3 1 1 5 1624 1 1 17 GLY N N 11.004 -1.640 9.854 1.00 . A A . 17 GLY N 1 1 5 1625 1 1 17 GLY O O 13.639 -0.729 7.696 1.00 . A A . 17 GLY O 1 1 5 1626 1 1 18 GLU C C 13.162 -4.474 6.221 1.00 . A A . 18 GLU C 1 1 5 1627 1 1 18 GLU CA C 13.721 -3.457 7.212 1.00 . A A . 18 GLU CA 1 1 5 1628 1 1 18 GLU CB C 14.612 -4.162 8.236 1.00 . A A . 18 GLU CB 1 1 5 1629 1 1 18 GLU CD C 16.937 -4.965 8.811 1.00 . A A . 18 GLU CD 1 1 5 1630 1 1 18 GLU CG C 16.007 -4.472 7.720 1.00 . A A . 18 GLU CG 1 1 5 1631 1 1 18 GLU H H 11.865 -3.239 8.206 1.00 . A A . 18 GLU H 1 1 5 1632 1 1 18 GLU HA H 14.314 -2.734 6.671 1.00 . A A . 18 GLU HA 1 1 5 1633 1 1 18 GLU HB2 H 14.705 -3.533 9.109 1.00 . A A . 18 GLU HB2 1 1 5 1634 1 1 18 GLU HB3 H 14.142 -5.092 8.523 1.00 . A A . 18 GLU HB3 1 1 5 1635 1 1 18 GLU HG2 H 15.934 -5.235 6.959 1.00 . A A . 18 GLU HG2 1 1 5 1636 1 1 18 GLU HG3 H 16.425 -3.574 7.289 1.00 . A A . 18 GLU HG3 1 1 5 1637 1 1 18 GLU N N 12.645 -2.739 7.884 1.00 . A A . 18 GLU N 1 1 5 1638 1 1 18 GLU O O 12.141 -4.232 5.579 1.00 . A A . 18 GLU O 1 1 5 1639 1 1 18 GLU OE1 O 16.437 -5.332 9.895 1.00 . A A . 18 GLU OE1 1 1 5 1640 1 1 18 GLU OE2 O 18.164 -4.984 8.582 1.00 . A A . 18 GLU OE2 1 1 6 1641 1 1 1 HIS C C -0.953 -7.392 0.191 1.00 . A A . 1 HIS C 1 1 6 1642 1 1 1 HIS CA C -1.198 -7.874 1.618 1.00 . A A . 1 HIS CA 1 1 6 1643 1 1 1 HIS CB C -1.209 -9.402 1.658 1.00 . A A . 1 HIS CB 1 1 6 1644 1 1 1 HIS CD2 C 1.380 -9.557 1.657 1.00 . A A . 1 HIS CD2 1 1 6 1645 1 1 1 HIS CE1 C 1.587 -11.480 2.689 1.00 . A A . 1 HIS CE1 1 1 6 1646 1 1 1 HIS CG C 0.134 -10.003 1.939 1.00 . A A . 1 HIS CG 1 1 6 1647 1 1 1 HIS H1 H -3.266 -7.891 2.072 1.00 . A A . 1 HIS H1 1 1 6 1648 1 1 1 HIS HA H -0.401 -7.511 2.249 1.00 . A A . 1 HIS HA 1 1 6 1649 1 1 1 HIS HB2 H -1.887 -9.731 2.432 1.00 . A A . 1 HIS HB2 1 1 6 1650 1 1 1 HIS HB3 H -1.549 -9.779 0.704 1.00 . A A . 1 HIS HB3 1 1 6 1651 1 1 1 HIS HD1 H -0.423 -11.783 2.919 1.00 . A A . 1 HIS HD1 1 1 6 1652 1 1 1 HIS HD2 H 1.633 -8.636 1.150 1.00 . A A . 1 HIS HD2 1 1 6 1653 1 1 1 HIS HE1 H 2.014 -12.358 3.150 1.00 . A A . 1 HIS HE1 1 1 6 1654 1 1 1 HIS N N -2.455 -7.345 2.136 1.00 . A A . 1 HIS N 1 1 6 1655 1 1 1 HIS ND1 N 0.298 -11.210 2.585 1.00 . A A . 1 HIS ND1 1 1 6 1656 1 1 1 HIS NE2 N 2.266 -10.493 2.133 1.00 . A A . 1 HIS NE2 1 1 6 1657 1 1 1 HIS O O -1.562 -7.889 -0.756 1.00 . A A . 1 HIS O 1 1 6 1658 1 1 2 VAL C C 1.729 -5.438 -1.331 1.00 . A A . 2 VAL C 1 1 6 1659 1 1 2 VAL CA C 0.270 -5.873 -1.265 1.00 . A A . 2 VAL CA 1 1 6 1660 1 1 2 VAL CB C -0.629 -4.671 -1.610 1.00 . A A . 2 VAL CB 1 1 6 1661 1 1 2 VAL CG1 C -0.303 -4.141 -2.998 1.00 . A A . 2 VAL CG1 1 1 6 1662 1 1 2 VAL CG2 C -2.097 -5.057 -1.509 1.00 . A A . 2 VAL CG2 1 1 6 1663 1 1 2 VAL H H 0.397 -6.066 0.839 1.00 . A A . 2 VAL H 1 1 6 1664 1 1 2 VAL HA H 0.101 -6.645 -2.002 1.00 . A A . 2 VAL HA 1 1 6 1665 1 1 2 VAL HB H -0.435 -3.885 -0.895 1.00 . A A . 2 VAL HB 1 1 6 1666 1 1 2 VAL HG11 H -1.196 -3.727 -3.444 1.00 . A A . 2 VAL HG11 1 1 6 1667 1 1 2 VAL HG12 H 0.452 -3.372 -2.922 1.00 . A A . 2 VAL HG12 1 1 6 1668 1 1 2 VAL HG13 H 0.065 -4.948 -3.614 1.00 . A A . 2 VAL HG13 1 1 6 1669 1 1 2 VAL HG21 H -2.711 -4.219 -1.802 1.00 . A A . 2 VAL HG21 1 1 6 1670 1 1 2 VAL HG22 H -2.294 -5.894 -2.162 1.00 . A A . 2 VAL HG22 1 1 6 1671 1 1 2 VAL HG23 H -2.328 -5.333 -0.490 1.00 . A A . 2 VAL HG23 1 1 6 1672 1 1 2 VAL N N -0.057 -6.421 0.046 1.00 . A A . 2 VAL N 1 1 6 1673 1 1 2 VAL O O 2.518 -5.985 -2.102 1.00 . A A . 2 VAL O 1 1 6 1674 1 1 3 PHE C C 3.615 -2.902 0.625 1.00 . A A . 3 PHE C 1 1 6 1675 1 1 3 PHE CA C 3.449 -3.939 -0.482 1.00 . A A . 3 PHE CA 1 1 6 1676 1 1 3 PHE CB C 3.821 -3.324 -1.833 1.00 . A A . 3 PHE CB 1 1 6 1677 1 1 3 PHE CD1 C 5.908 -4.218 -2.900 1.00 . A A . 3 PHE CD1 1 1 6 1678 1 1 3 PHE CD2 C 6.085 -2.294 -1.502 1.00 . A A . 3 PHE CD2 1 1 6 1679 1 1 3 PHE CE1 C 7.270 -4.178 -3.134 1.00 . A A . 3 PHE CE1 1 1 6 1680 1 1 3 PHE CE2 C 7.447 -2.249 -1.732 1.00 . A A . 3 PHE CE2 1 1 6 1681 1 1 3 PHE CG C 5.301 -3.278 -2.084 1.00 . A A . 3 PHE CG 1 1 6 1682 1 1 3 PHE CZ C 8.041 -3.193 -2.548 1.00 . A A . 3 PHE CZ 1 1 6 1683 1 1 3 PHE H H 1.410 -4.053 0.075 1.00 . A A . 3 PHE H 1 1 6 1684 1 1 3 PHE HA H 4.108 -4.770 -0.282 1.00 . A A . 3 PHE HA 1 1 6 1685 1 1 3 PHE HB2 H 3.369 -3.906 -2.622 1.00 . A A . 3 PHE HB2 1 1 6 1686 1 1 3 PHE HB3 H 3.444 -2.313 -1.875 1.00 . A A . 3 PHE HB3 1 1 6 1687 1 1 3 PHE HD1 H 5.306 -4.989 -3.359 1.00 . A A . 3 PHE HD1 1 1 6 1688 1 1 3 PHE HD2 H 5.623 -1.556 -0.863 1.00 . A A . 3 PHE HD2 1 1 6 1689 1 1 3 PHE HE1 H 7.731 -4.917 -3.772 1.00 . A A . 3 PHE HE1 1 1 6 1690 1 1 3 PHE HE2 H 8.047 -1.478 -1.273 1.00 . A A . 3 PHE HE2 1 1 6 1691 1 1 3 PHE HZ H 9.104 -3.159 -2.729 1.00 . A A . 3 PHE HZ 1 1 6 1692 1 1 3 PHE N N 2.084 -4.449 -0.517 1.00 . A A . 3 PHE N 1 1 6 1693 1 1 3 PHE O O 4.646 -2.853 1.295 1.00 . A A . 3 PHE O 1 1 6 1694 1 1 4 ARG C C 1.555 -1.287 2.894 1.00 . A A . 4 ARG C 1 1 6 1695 1 1 4 ARG CA C 2.624 -1.037 1.834 1.00 . A A . 4 ARG CA 1 1 6 1696 1 1 4 ARG CB C 2.417 0.340 1.201 1.00 . A A . 4 ARG CB 1 1 6 1697 1 1 4 ARG CD C 2.848 0.746 -1.242 1.00 . A A . 4 ARG CD 1 1 6 1698 1 1 4 ARG CG C 3.458 0.690 0.150 1.00 . A A . 4 ARG CG 1 1 6 1699 1 1 4 ARG CZ C 1.302 2.191 -2.493 1.00 . A A . 4 ARG CZ 1 1 6 1700 1 1 4 ARG H H 1.796 -2.163 0.244 1.00 . A A . 4 ARG H 1 1 6 1701 1 1 4 ARG HA H 3.595 -1.065 2.305 1.00 . A A . 4 ARG HA 1 1 6 1702 1 1 4 ARG HB2 H 1.444 0.367 0.734 1.00 . A A . 4 ARG HB2 1 1 6 1703 1 1 4 ARG HB3 H 2.455 1.089 1.977 1.00 . A A . 4 ARG HB3 1 1 6 1704 1 1 4 ARG HD2 H 3.627 0.976 -1.953 1.00 . A A . 4 ARG HD2 1 1 6 1705 1 1 4 ARG HD3 H 2.424 -0.219 -1.473 1.00 . A A . 4 ARG HD3 1 1 6 1706 1 1 4 ARG HE H 1.457 2.139 -0.505 1.00 . A A . 4 ARG HE 1 1 6 1707 1 1 4 ARG HG2 H 3.883 1.655 0.384 1.00 . A A . 4 ARG HG2 1 1 6 1708 1 1 4 ARG HG3 H 4.235 -0.060 0.163 1.00 . A A . 4 ARG HG3 1 1 6 1709 1 1 4 ARG HH11 H 2.465 0.999 -3.636 1.00 . A A . 4 ARG HH11 1 1 6 1710 1 1 4 ARG HH12 H 1.370 2.023 -4.506 1.00 . A A . 4 ARG HH12 1 1 6 1711 1 1 4 ARG HH21 H -0.024 3.440 -3.369 1.00 . A A . 4 ARG HH21 1 1 6 1712 1 1 4 ARG HH22 H 0.011 3.491 -1.639 1.00 . A A . 4 ARG HH22 1 1 6 1713 1 1 4 ARG N N 2.592 -2.075 0.810 1.00 . A A . 4 ARG N 1 1 6 1714 1 1 4 ARG NE N 1.802 1.761 -1.340 1.00 . A A . 4 ARG NE 1 1 6 1715 1 1 4 ARG NH1 N 1.750 1.698 -3.639 1.00 . A A . 4 ARG NH1 1 1 6 1716 1 1 4 ARG NH2 N 0.351 3.117 -2.501 1.00 . A A . 4 ARG NH2 1 1 6 1717 1 1 4 ARG O O 1.695 -0.864 4.043 1.00 . A A . 4 ARG O 1 1 6 1718 1 1 5 LEU C C -1.311 -1.006 3.868 1.00 . A A . 5 LEU C 1 1 6 1719 1 1 5 LEU CA C -0.604 -2.281 3.418 1.00 . A A . 5 LEU CA 1 1 6 1720 1 1 5 LEU CB C -0.077 -3.042 4.635 1.00 . A A . 5 LEU CB 1 1 6 1721 1 1 5 LEU CD1 C 0.380 -5.276 5.676 1.00 . A A . 5 LEU CD1 1 1 6 1722 1 1 5 LEU CD2 C -1.979 -4.507 5.359 1.00 . A A . 5 LEU CD2 1 1 6 1723 1 1 5 LEU CG C -0.568 -4.482 4.790 1.00 . A A . 5 LEU CG 1 1 6 1724 1 1 5 LEU H H 0.434 -2.285 1.574 1.00 . A A . 5 LEU H 1 1 6 1725 1 1 5 LEU HA H -1.312 -2.904 2.892 1.00 . A A . 5 LEU HA 1 1 6 1726 1 1 5 LEU HB2 H 0.999 -3.065 4.570 1.00 . A A . 5 LEU HB2 1 1 6 1727 1 1 5 LEU HB3 H -0.372 -2.494 5.520 1.00 . A A . 5 LEU HB3 1 1 6 1728 1 1 5 LEU HD11 H 1.324 -5.405 5.169 1.00 . A A . 5 LEU HD11 1 1 6 1729 1 1 5 LEU HD12 H -0.051 -6.244 5.886 1.00 . A A . 5 LEU HD12 1 1 6 1730 1 1 5 LEU HD13 H 0.537 -4.744 6.603 1.00 . A A . 5 LEU HD13 1 1 6 1731 1 1 5 LEU HD21 H -2.684 -4.248 4.583 1.00 . A A . 5 LEU HD21 1 1 6 1732 1 1 5 LEU HD22 H -2.054 -3.793 6.166 1.00 . A A . 5 LEU HD22 1 1 6 1733 1 1 5 LEU HD23 H -2.200 -5.497 5.732 1.00 . A A . 5 LEU HD23 1 1 6 1734 1 1 5 LEU HG H -0.590 -4.955 3.818 1.00 . A A . 5 LEU HG 1 1 6 1735 1 1 5 LEU N N 0.489 -1.975 2.502 1.00 . A A . 5 LEU N 1 1 6 1736 1 1 5 LEU O O -0.710 0.068 3.909 1.00 . A A . 5 LEU O 1 1 6 1737 1 1 6 LYS C C -2.645 0.780 5.749 1.00 . A A . 6 LYS C 1 1 6 1738 1 1 6 LYS CA C -3.378 0.009 4.657 1.00 . A A . 6 LYS CA 1 1 6 1739 1 1 6 LYS CB C -4.740 -0.460 5.175 1.00 . A A . 6 LYS CB 1 1 6 1740 1 1 6 LYS CD C -4.515 -1.166 7.575 1.00 . A A . 6 LYS CD 1 1 6 1741 1 1 6 LYS CE C -4.051 -2.294 8.485 1.00 . A A . 6 LYS CE 1 1 6 1742 1 1 6 LYS CG C -4.654 -1.633 6.136 1.00 . A A . 6 LYS CG 1 1 6 1743 1 1 6 LYS H H -3.013 -2.015 4.152 1.00 . A A . 6 LYS H 1 1 6 1744 1 1 6 LYS HA H -3.530 0.662 3.811 1.00 . A A . 6 LYS HA 1 1 6 1745 1 1 6 LYS HB2 H -5.220 0.362 5.685 1.00 . A A . 6 LYS HB2 1 1 6 1746 1 1 6 LYS HB3 H -5.350 -0.755 4.333 1.00 . A A . 6 LYS HB3 1 1 6 1747 1 1 6 LYS HD2 H -3.792 -0.365 7.617 1.00 . A A . 6 LYS HD2 1 1 6 1748 1 1 6 LYS HD3 H -5.473 -0.806 7.922 1.00 . A A . 6 LYS HD3 1 1 6 1749 1 1 6 LYS HE2 H -3.322 -2.888 7.957 1.00 . A A . 6 LYS HE2 1 1 6 1750 1 1 6 LYS HE3 H -3.597 -1.864 9.365 1.00 . A A . 6 LYS HE3 1 1 6 1751 1 1 6 LYS HG2 H -5.552 -2.226 6.047 1.00 . A A . 6 LYS HG2 1 1 6 1752 1 1 6 LYS HG3 H -3.795 -2.236 5.878 1.00 . A A . 6 LYS HG3 1 1 6 1753 1 1 6 LYS HZ1 H -5.182 -4.044 8.337 1.00 . A A . 6 LYS HZ1 1 1 6 1754 1 1 6 LYS HZ2 H -6.086 -2.678 8.759 1.00 . A A . 6 LYS HZ2 1 1 6 1755 1 1 6 LYS HZ3 H -5.089 -3.419 9.906 1.00 . A A . 6 LYS HZ3 1 1 6 1756 1 1 6 LYS N N -2.589 -1.132 4.206 1.00 . A A . 6 LYS N 1 1 6 1757 1 1 6 LYS NZ N -5.181 -3.170 8.901 1.00 . A A . 6 LYS NZ 1 1 6 1758 1 1 6 LYS O O -1.864 0.208 6.510 1.00 . A A . 6 LYS O 1 1 6 1759 1 1 7 LYS C C -2.950 2.777 8.179 1.00 . A A . 7 LYS C 1 1 6 1760 1 1 7 LYS CA C -2.268 2.932 6.823 1.00 . A A . 7 LYS CA 1 1 6 1761 1 1 7 LYS CB C -2.314 4.396 6.381 1.00 . A A . 7 LYS CB 1 1 6 1762 1 1 7 LYS CD C -3.724 6.364 5.713 1.00 . A A . 7 LYS CD 1 1 6 1763 1 1 7 LYS CE C -2.721 6.745 4.635 1.00 . A A . 7 LYS CE 1 1 6 1764 1 1 7 LYS CG C -3.703 4.871 5.991 1.00 . A A . 7 LYS CG 1 1 6 1765 1 1 7 LYS H H -3.533 2.480 5.187 1.00 . A A . 7 LYS H 1 1 6 1766 1 1 7 LYS HA H -1.237 2.625 6.915 1.00 . A A . 7 LYS HA 1 1 6 1767 1 1 7 LYS HB2 H -1.958 5.016 7.191 1.00 . A A . 7 LYS HB2 1 1 6 1768 1 1 7 LYS HB3 H -1.661 4.523 5.529 1.00 . A A . 7 LYS HB3 1 1 6 1769 1 1 7 LYS HD2 H -4.713 6.647 5.385 1.00 . A A . 7 LYS HD2 1 1 6 1770 1 1 7 LYS HD3 H -3.481 6.895 6.623 1.00 . A A . 7 LYS HD3 1 1 6 1771 1 1 7 LYS HE2 H -2.946 7.742 4.289 1.00 . A A . 7 LYS HE2 1 1 6 1772 1 1 7 LYS HE3 H -1.730 6.727 5.063 1.00 . A A . 7 LYS HE3 1 1 6 1773 1 1 7 LYS HG2 H -4.017 4.345 5.102 1.00 . A A . 7 LYS HG2 1 1 6 1774 1 1 7 LYS HG3 H -4.387 4.654 6.800 1.00 . A A . 7 LYS HG3 1 1 6 1775 1 1 7 LYS HZ1 H -2.149 6.151 2.716 1.00 . A A . 7 LYS HZ1 1 1 6 1776 1 1 7 LYS HZ2 H -3.740 5.737 3.116 1.00 . A A . 7 LYS HZ2 1 1 6 1777 1 1 7 LYS HZ3 H -2.449 4.863 3.771 1.00 . A A . 7 LYS HZ3 1 1 6 1778 1 1 7 LYS N N -2.901 2.082 5.822 1.00 . A A . 7 LYS N 1 1 6 1779 1 1 7 LYS NZ N -2.768 5.809 3.479 1.00 . A A . 7 LYS NZ 1 1 6 1780 1 1 7 LYS O O -3.517 3.732 8.711 1.00 . A A . 7 LYS O 1 1 6 1781 1 1 8 TRP C C -2.739 0.199 10.764 1.00 . A A . 8 TRP C 1 1 6 1782 1 1 8 TRP CA C -3.502 1.294 10.026 1.00 . A A . 8 TRP CA 1 1 6 1783 1 1 8 TRP CB C -4.963 0.881 9.845 1.00 . A A . 8 TRP CB 1 1 6 1784 1 1 8 TRP CD1 C -5.964 2.821 11.189 1.00 . A A . 8 TRP CD1 1 1 6 1785 1 1 8 TRP CD2 C -6.854 0.820 11.658 1.00 . A A . 8 TRP CD2 1 1 6 1786 1 1 8 TRP CE2 C -7.486 1.792 12.458 1.00 . A A . 8 TRP CE2 1 1 6 1787 1 1 8 TRP CE3 C -7.251 -0.514 11.780 1.00 . A A . 8 TRP CE3 1 1 6 1788 1 1 8 TRP CG C -5.884 1.500 10.853 1.00 . A A . 8 TRP CG 1 1 6 1789 1 1 8 TRP CH2 C -8.861 0.156 13.464 1.00 . A A . 8 TRP CH2 1 1 6 1790 1 1 8 TRP CZ2 C -8.492 1.470 13.366 1.00 . A A . 8 TRP CZ2 1 1 6 1791 1 1 8 TRP CZ3 C -8.249 -0.832 12.681 1.00 . A A . 8 TRP CZ3 1 1 6 1792 1 1 8 TRP H H -2.424 0.851 8.258 1.00 . A A . 8 TRP H 1 1 6 1793 1 1 8 TRP HA H -3.463 2.200 10.612 1.00 . A A . 8 TRP HA 1 1 6 1794 1 1 8 TRP HB2 H -5.296 1.180 8.863 1.00 . A A . 8 TRP HB2 1 1 6 1795 1 1 8 TRP HB3 H -5.041 -0.192 9.936 1.00 . A A . 8 TRP HB3 1 1 6 1796 1 1 8 TRP HD1 H -5.353 3.597 10.752 1.00 . A A . 8 TRP HD1 1 1 6 1797 1 1 8 TRP HE1 H -7.170 3.864 12.556 1.00 . A A . 8 TRP HE1 1 1 6 1798 1 1 8 TRP HE3 H -6.792 -1.290 11.185 1.00 . A A . 8 TRP HE3 1 1 6 1799 1 1 8 TRP HH2 H -9.635 -0.138 14.155 1.00 . A A . 8 TRP HH2 1 1 6 1800 1 1 8 TRP HZ2 H -8.973 2.220 13.976 1.00 . A A . 8 TRP HZ2 1 1 6 1801 1 1 8 TRP HZ3 H -8.569 -1.858 12.789 1.00 . A A . 8 TRP HZ3 1 1 6 1802 1 1 8 TRP N N -2.890 1.572 8.732 1.00 . A A . 8 TRP N 1 1 6 1803 1 1 8 TRP NE1 N -6.925 3.004 12.153 1.00 . A A . 8 TRP NE1 1 1 6 1804 1 1 8 TRP O O -3.244 -0.381 11.727 1.00 . A A . 8 TRP O 1 1 6 1805 1 1 9 ILE C C 0.719 -0.587 11.186 1.00 . A A . 9 ILE C 1 1 6 1806 1 1 9 ILE CA C -0.692 -1.105 10.927 1.00 . A A . 9 ILE CA 1 1 6 1807 1 1 9 ILE CB C -0.609 -2.368 10.050 1.00 . A A . 9 ILE CB 1 1 6 1808 1 1 9 ILE CD1 C 0.462 -1.066 8.144 1.00 . A A . 9 ILE CD1 1 1 6 1809 1 1 9 ILE CG1 C -0.657 -1.991 8.568 1.00 . A A . 9 ILE CG1 1 1 6 1810 1 1 9 ILE CG2 C -1.740 -3.327 10.395 1.00 . A A . 9 ILE CG2 1 1 6 1811 1 1 9 ILE H H -1.176 0.416 9.538 1.00 . A A . 9 ILE H 1 1 6 1812 1 1 9 ILE HA H -1.143 -1.375 11.871 1.00 . A A . 9 ILE HA 1 1 6 1813 1 1 9 ILE HB H 0.327 -2.864 10.259 1.00 . A A . 9 ILE HB 1 1 6 1814 1 1 9 ILE HD11 H 1.293 -1.168 8.828 1.00 . A A . 9 ILE HD11 1 1 6 1815 1 1 9 ILE HD12 H 0.785 -1.324 7.147 1.00 . A A . 9 ILE HD12 1 1 6 1816 1 1 9 ILE HD13 H 0.111 -0.045 8.157 1.00 . A A . 9 ILE HD13 1 1 6 1817 1 1 9 ILE HG12 H -0.589 -2.887 7.972 1.00 . A A . 9 ILE HG12 1 1 6 1818 1 1 9 ILE HG13 H -1.595 -1.496 8.361 1.00 . A A . 9 ILE HG13 1 1 6 1819 1 1 9 ILE HG21 H -2.521 -2.790 10.913 1.00 . A A . 9 ILE HG21 1 1 6 1820 1 1 9 ILE HG22 H -2.138 -3.754 9.487 1.00 . A A . 9 ILE HG22 1 1 6 1821 1 1 9 ILE HG23 H -1.363 -4.115 11.029 1.00 . A A . 9 ILE HG23 1 1 6 1822 1 1 9 ILE N N -1.523 -0.080 10.308 1.00 . A A . 9 ILE N 1 1 6 1823 1 1 9 ILE O O 1.676 -1.359 11.230 1.00 . A A . 9 ILE O 1 1 6 1824 1 1 10 GLN C C 2.823 0.695 12.807 1.00 . A A . 10 GLN C 1 1 6 1825 1 1 10 GLN CA C 2.133 1.347 11.614 1.00 . A A . 10 GLN CA 1 1 6 1826 1 1 10 GLN CB C 1.962 2.846 11.865 1.00 . A A . 10 GLN CB 1 1 6 1827 1 1 10 GLN CD C 2.690 5.184 11.242 1.00 . A A . 10 GLN CD 1 1 6 1828 1 1 10 GLN CG C 2.680 3.719 10.849 1.00 . A A . 10 GLN CG 1 1 6 1829 1 1 10 GLN H H 0.039 1.289 11.311 1.00 . A A . 10 GLN H 1 1 6 1830 1 1 10 GLN HA H 2.747 1.206 10.737 1.00 . A A . 10 GLN HA 1 1 6 1831 1 1 10 GLN HB2 H 0.910 3.087 11.835 1.00 . A A . 10 GLN HB2 1 1 6 1832 1 1 10 GLN HB3 H 2.348 3.081 12.846 1.00 . A A . 10 GLN HB3 1 1 6 1833 1 1 10 GLN HE21 H 2.153 6.986 10.598 1.00 . A A . 10 GLN HE21 1 1 6 1834 1 1 10 GLN HE22 H 1.797 5.673 9.534 1.00 . A A . 10 GLN HE22 1 1 6 1835 1 1 10 GLN HG2 H 3.702 3.380 10.760 1.00 . A A . 10 GLN HG2 1 1 6 1836 1 1 10 GLN HG3 H 2.185 3.621 9.895 1.00 . A A . 10 GLN HG3 1 1 6 1837 1 1 10 GLN N N 0.839 0.726 11.358 1.00 . A A . 10 GLN N 1 1 6 1838 1 1 10 GLN NE2 N 2.161 6.034 10.370 1.00 . A A . 10 GLN NE2 1 1 6 1839 1 1 10 GLN O O 4.038 0.809 12.974 1.00 . A A . 10 GLN O 1 1 6 1840 1 1 10 GLN OE1 O 3.169 5.547 12.316 1.00 . A A . 10 GLN OE1 1 1 6 1841 1 1 11 LYS C C 3.441 -1.853 14.415 1.00 . A A . 11 LYS C 1 1 6 1842 1 1 11 LYS CA C 2.577 -0.661 14.814 1.00 . A A . 11 LYS CA 1 1 6 1843 1 1 11 LYS CB C 1.437 -1.126 15.723 1.00 . A A . 11 LYS CB 1 1 6 1844 1 1 11 LYS CD C 2.122 -3.274 16.830 1.00 . A A . 11 LYS CD 1 1 6 1845 1 1 11 LYS CE C 1.005 -4.076 17.479 1.00 . A A . 11 LYS CE 1 1 6 1846 1 1 11 LYS CG C 1.912 -1.780 17.008 1.00 . A A . 11 LYS CG 1 1 6 1847 1 1 11 LYS H H 1.080 -0.044 13.449 1.00 . A A . 11 LYS H 1 1 6 1848 1 1 11 LYS HA H 3.188 0.048 15.351 1.00 . A A . 11 LYS HA 1 1 6 1849 1 1 11 LYS HB2 H 0.828 -0.273 15.981 1.00 . A A . 11 LYS HB2 1 1 6 1850 1 1 11 LYS HB3 H 0.831 -1.840 15.183 1.00 . A A . 11 LYS HB3 1 1 6 1851 1 1 11 LYS HD2 H 2.147 -3.502 15.774 1.00 . A A . 11 LYS HD2 1 1 6 1852 1 1 11 LYS HD3 H 3.064 -3.553 17.282 1.00 . A A . 11 LYS HD3 1 1 6 1853 1 1 11 LYS HE2 H 1.390 -5.043 17.761 1.00 . A A . 11 LYS HE2 1 1 6 1854 1 1 11 LYS HE3 H 0.669 -3.551 18.361 1.00 . A A . 11 LYS HE3 1 1 6 1855 1 1 11 LYS HG2 H 2.847 -1.329 17.307 1.00 . A A . 11 LYS HG2 1 1 6 1856 1 1 11 LYS HG3 H 1.171 -1.619 17.779 1.00 . A A . 11 LYS HG3 1 1 6 1857 1 1 11 LYS HZ1 H -0.259 -3.430 15.946 1.00 . A A . 11 LYS HZ1 1 1 6 1858 1 1 11 LYS HZ2 H -1.025 -4.397 17.105 1.00 . A A . 11 LYS HZ2 1 1 6 1859 1 1 11 LYS HZ3 H 0.002 -5.102 15.961 1.00 . A A . 11 LYS HZ3 1 1 6 1860 1 1 11 LYS N N 2.042 0.011 13.636 1.00 . A A . 11 LYS N 1 1 6 1861 1 1 11 LYS NZ N -0.150 -4.264 16.558 1.00 . A A . 11 LYS NZ 1 1 6 1862 1 1 11 LYS O O 4.563 -2.008 14.899 1.00 . A A . 11 LYS O 1 1 6 1863 1 1 12 VAL C C 4.919 -3.471 12.336 1.00 . A A . 12 VAL C 1 1 6 1864 1 1 12 VAL CA C 3.638 -3.867 13.062 1.00 . A A . 12 VAL CA 1 1 6 1865 1 1 12 VAL CB C 2.771 -4.724 12.121 1.00 . A A . 12 VAL CB 1 1 6 1866 1 1 12 VAL CG1 C 3.589 -5.862 11.530 1.00 . A A . 12 VAL CG1 1 1 6 1867 1 1 12 VAL CG2 C 1.553 -5.259 12.859 1.00 . A A . 12 VAL CG2 1 1 6 1868 1 1 12 VAL H H 2.015 -2.513 13.179 1.00 . A A . 12 VAL H 1 1 6 1869 1 1 12 VAL HA H 3.895 -4.464 13.925 1.00 . A A . 12 VAL HA 1 1 6 1870 1 1 12 VAL HB H 2.428 -4.098 11.310 1.00 . A A . 12 VAL HB 1 1 6 1871 1 1 12 VAL HG11 H 4.012 -6.454 12.329 1.00 . A A . 12 VAL HG11 1 1 6 1872 1 1 12 VAL HG12 H 2.952 -6.484 10.919 1.00 . A A . 12 VAL HG12 1 1 6 1873 1 1 12 VAL HG13 H 4.385 -5.456 10.924 1.00 . A A . 12 VAL HG13 1 1 6 1874 1 1 12 VAL HG21 H 0.667 -4.751 12.509 1.00 . A A . 12 VAL HG21 1 1 6 1875 1 1 12 VAL HG22 H 1.458 -6.319 12.675 1.00 . A A . 12 VAL HG22 1 1 6 1876 1 1 12 VAL HG23 H 1.670 -5.087 13.920 1.00 . A A . 12 VAL HG23 1 1 6 1877 1 1 12 VAL N N 2.914 -2.691 13.528 1.00 . A A . 12 VAL N 1 1 6 1878 1 1 12 VAL O O 6.003 -3.960 12.656 1.00 . A A . 12 VAL O 1 1 6 1879 1 1 13 ILE C C 6.924 -1.371 11.469 1.00 . A A . 13 ILE C 1 1 6 1880 1 1 13 ILE CA C 5.933 -2.120 10.585 1.00 . A A . 13 ILE CA 1 1 6 1881 1 1 13 ILE CB C 5.500 -1.202 9.427 1.00 . A A . 13 ILE CB 1 1 6 1882 1 1 13 ILE CD1 C 6.278 -0.700 7.056 1.00 . A A . 13 ILE CD1 1 1 6 1883 1 1 13 ILE CG1 C 6.682 -0.926 8.496 1.00 . A A . 13 ILE CG1 1 1 6 1884 1 1 13 ILE CG2 C 4.930 0.101 9.969 1.00 . A A . 13 ILE CG2 1 1 6 1885 1 1 13 ILE H H 3.897 -2.230 11.148 1.00 . A A . 13 ILE H 1 1 6 1886 1 1 13 ILE HA H 6.425 -2.987 10.166 1.00 . A A . 13 ILE HA 1 1 6 1887 1 1 13 ILE HB H 4.722 -1.703 8.871 1.00 . A A . 13 ILE HB 1 1 6 1888 1 1 13 ILE HD11 H 6.610 -1.533 6.454 1.00 . A A . 13 ILE HD11 1 1 6 1889 1 1 13 ILE HD12 H 5.203 -0.617 6.993 1.00 . A A . 13 ILE HD12 1 1 6 1890 1 1 13 ILE HD13 H 6.731 0.210 6.693 1.00 . A A . 13 ILE HD13 1 1 6 1891 1 1 13 ILE HG12 H 7.202 -0.044 8.836 1.00 . A A . 13 ILE HG12 1 1 6 1892 1 1 13 ILE HG13 H 7.357 -1.770 8.523 1.00 . A A . 13 ILE HG13 1 1 6 1893 1 1 13 ILE HG21 H 4.274 0.540 9.232 1.00 . A A . 13 ILE HG21 1 1 6 1894 1 1 13 ILE HG22 H 4.373 -0.099 10.872 1.00 . A A . 13 ILE HG22 1 1 6 1895 1 1 13 ILE HG23 H 5.737 0.784 10.186 1.00 . A A . 13 ILE HG23 1 1 6 1896 1 1 13 ILE N N 4.786 -2.583 11.356 1.00 . A A . 13 ILE N 1 1 6 1897 1 1 13 ILE O O 8.133 -1.414 11.239 1.00 . A A . 13 ILE O 1 1 6 1898 1 1 14 ASP C C 8.377 -0.798 13.944 1.00 . A A . 14 ASP C 1 1 6 1899 1 1 14 ASP CA C 7.244 0.069 13.405 1.00 . A A . 14 ASP CA 1 1 6 1900 1 1 14 ASP CB C 6.405 0.612 14.563 1.00 . A A . 14 ASP CB 1 1 6 1901 1 1 14 ASP CG C 6.098 2.089 14.412 1.00 . A A . 14 ASP CG 1 1 6 1902 1 1 14 ASP H H 5.433 -0.692 12.614 1.00 . A A . 14 ASP H 1 1 6 1903 1 1 14 ASP HA H 7.670 0.899 12.861 1.00 . A A . 14 ASP HA 1 1 6 1904 1 1 14 ASP HB2 H 5.471 0.072 14.606 1.00 . A A . 14 ASP HB2 1 1 6 1905 1 1 14 ASP HB3 H 6.944 0.467 15.487 1.00 . A A . 14 ASP HB3 1 1 6 1906 1 1 14 ASP N N 6.405 -0.687 12.483 1.00 . A A . 14 ASP N 1 1 6 1907 1 1 14 ASP O O 9.443 -0.293 14.296 1.00 . A A . 14 ASP O 1 1 6 1908 1 1 14 ASP OD1 O 5.831 2.748 15.439 1.00 . A A . 14 ASP OD1 1 1 6 1909 1 1 14 ASP OD2 O 6.124 2.586 13.267 1.00 . A A . 14 ASP OD2 1 1 6 1910 1 1 15 GLN C C 9.691 -3.901 13.373 1.00 . A A . 15 GLN C 1 1 6 1911 1 1 15 GLN CA C 9.139 -3.040 14.505 1.00 . A A . 15 GLN CA 1 1 6 1912 1 1 15 GLN CB C 8.537 -3.931 15.592 1.00 . A A . 15 GLN CB 1 1 6 1913 1 1 15 GLN CD C 7.832 -4.097 18.013 1.00 . A A . 15 GLN CD 1 1 6 1914 1 1 15 GLN CG C 8.680 -3.361 16.994 1.00 . A A . 15 GLN CG 1 1 6 1915 1 1 15 GLN H H 7.269 -2.445 13.711 1.00 . A A . 15 GLN H 1 1 6 1916 1 1 15 GLN HA H 9.948 -2.465 14.930 1.00 . A A . 15 GLN HA 1 1 6 1917 1 1 15 GLN HB2 H 7.486 -4.068 15.388 1.00 . A A . 15 GLN HB2 1 1 6 1918 1 1 15 GLN HB3 H 9.029 -4.892 15.567 1.00 . A A . 15 GLN HB3 1 1 6 1919 1 1 15 GLN HE21 H 7.945 -5.436 19.477 1.00 . A A . 15 GLN HE21 1 1 6 1920 1 1 15 GLN HE22 H 9.437 -5.051 18.696 1.00 . A A . 15 GLN HE22 1 1 6 1921 1 1 15 GLN HG2 H 9.716 -3.430 17.294 1.00 . A A . 15 GLN HG2 1 1 6 1922 1 1 15 GLN HG3 H 8.380 -2.324 16.979 1.00 . A A . 15 GLN HG3 1 1 6 1923 1 1 15 GLN N N 8.138 -2.104 14.006 1.00 . A A . 15 GLN N 1 1 6 1924 1 1 15 GLN NE2 N 8.469 -4.948 18.809 1.00 . A A . 15 GLN NE2 1 1 6 1925 1 1 15 GLN O O 10.718 -4.562 13.526 1.00 . A A . 15 GLN O 1 1 6 1926 1 1 15 GLN OE1 O 6.618 -3.902 18.084 1.00 . A A . 15 GLN OE1 1 1 6 1927 1 1 16 PHE C C 9.581 -3.777 9.851 1.00 . A A . 16 PHE C 1 1 6 1928 1 1 16 PHE CA C 9.422 -4.669 11.079 1.00 . A A . 16 PHE CA 1 1 6 1929 1 1 16 PHE CB C 8.408 -5.778 10.790 1.00 . A A . 16 PHE CB 1 1 6 1930 1 1 16 PHE CD1 C 7.973 -7.359 12.690 1.00 . A A . 16 PHE CD1 1 1 6 1931 1 1 16 PHE CD2 C 9.649 -7.937 11.096 1.00 . A A . 16 PHE CD2 1 1 6 1932 1 1 16 PHE CE1 C 8.222 -8.529 13.382 1.00 . A A . 16 PHE CE1 1 1 6 1933 1 1 16 PHE CE2 C 9.903 -9.109 11.783 1.00 . A A . 16 PHE CE2 1 1 6 1934 1 1 16 PHE CG C 8.682 -7.050 11.540 1.00 . A A . 16 PHE CG 1 1 6 1935 1 1 16 PHE CZ C 9.189 -9.405 12.929 1.00 . A A . 16 PHE CZ 1 1 6 1936 1 1 16 PHE H H 8.191 -3.340 12.176 1.00 . A A . 16 PHE H 1 1 6 1937 1 1 16 PHE HA H 10.376 -5.116 11.310 1.00 . A A . 16 PHE HA 1 1 6 1938 1 1 16 PHE HB2 H 7.422 -5.436 11.067 1.00 . A A . 16 PHE HB2 1 1 6 1939 1 1 16 PHE HB3 H 8.423 -6.003 9.735 1.00 . A A . 16 PHE HB3 1 1 6 1940 1 1 16 PHE HD1 H 7.216 -6.674 13.045 1.00 . A A . 16 PHE HD1 1 1 6 1941 1 1 16 PHE HD2 H 10.209 -7.707 10.201 1.00 . A A . 16 PHE HD2 1 1 6 1942 1 1 16 PHE HE1 H 7.662 -8.757 14.277 1.00 . A A . 16 PHE HE1 1 1 6 1943 1 1 16 PHE HE2 H 10.660 -9.792 11.427 1.00 . A A . 16 PHE HE2 1 1 6 1944 1 1 16 PHE HZ H 9.385 -10.319 13.467 1.00 . A A . 16 PHE HZ 1 1 6 1945 1 1 16 PHE N N 9.002 -3.888 12.237 1.00 . A A . 16 PHE N 1 1 6 1946 1 1 16 PHE O O 8.755 -3.804 8.940 1.00 . A A . 16 PHE O 1 1 6 1947 1 1 17 GLY C C 11.634 -2.786 7.581 1.00 . A A . 17 GLY C 1 1 6 1948 1 1 17 GLY CA C 10.899 -2.099 8.714 1.00 . A A . 17 GLY CA 1 1 6 1949 1 1 17 GLY H H 11.276 -3.009 10.589 1.00 . A A . 17 GLY H 1 1 6 1950 1 1 17 GLY HA2 H 9.954 -1.729 8.345 1.00 . A A . 17 GLY HA2 1 1 6 1951 1 1 17 GLY HA3 H 11.492 -1.263 9.058 1.00 . A A . 17 GLY HA3 1 1 6 1952 1 1 17 GLY N N 10.651 -2.988 9.834 1.00 . A A . 17 GLY N 1 1 6 1953 1 1 17 GLY O O 11.012 -3.337 6.674 1.00 . A A . 17 GLY O 1 1 6 1954 1 1 18 GLU C C 15.228 -3.518 7.064 1.00 . A A . 18 GLU C 1 1 6 1955 1 1 18 GLU CA C 13.782 -3.374 6.598 1.00 . A A . 18 GLU CA 1 1 6 1956 1 1 18 GLU CB C 13.729 -2.551 5.309 1.00 . A A . 18 GLU CB 1 1 6 1957 1 1 18 GLU CD C 11.782 -2.747 3.711 1.00 . A A . 18 GLU CD 1 1 6 1958 1 1 18 GLU CG C 13.130 -3.302 4.132 1.00 . A A . 18 GLU CG 1 1 6 1959 1 1 18 GLU H H 13.401 -2.297 8.380 1.00 . A A . 18 GLU H 1 1 6 1960 1 1 18 GLU HA H 13.380 -4.357 6.403 1.00 . A A . 18 GLU HA 1 1 6 1961 1 1 18 GLU HB2 H 13.136 -1.666 5.485 1.00 . A A . 18 GLU HB2 1 1 6 1962 1 1 18 GLU HB3 H 14.733 -2.254 5.045 1.00 . A A . 18 GLU HB3 1 1 6 1963 1 1 18 GLU HG2 H 13.807 -3.233 3.294 1.00 . A A . 18 GLU HG2 1 1 6 1964 1 1 18 GLU HG3 H 13.005 -4.339 4.408 1.00 . A A . 18 GLU HG3 1 1 6 1965 1 1 18 GLU N N 12.962 -2.752 7.631 1.00 . A A . 18 GLU N 1 1 6 1966 1 1 18 GLU O O 15.578 -4.482 7.744 1.00 . A A . 18 GLU O 1 1 6 1967 1 1 18 GLU OE1 O 10.754 -3.372 4.046 1.00 . A A . 18 GLU OE1 1 1 6 1968 1 1 18 GLU OE2 O 11.756 -1.690 3.048 1.00 . A A . 18 GLU OE2 1 1 7 1969 1 1 1 HIS C C -3.184 0.119 -4.938 1.00 . A A . 1 HIS C 1 1 7 1970 1 1 1 HIS CA C -2.191 0.224 -6.091 1.00 . A A . 1 HIS CA 1 1 7 1971 1 1 1 HIS CB C -1.223 -0.960 -6.055 1.00 . A A . 1 HIS CB 1 1 7 1972 1 1 1 HIS CD2 C -0.063 -1.463 -3.791 1.00 . A A . 1 HIS CD2 1 1 7 1973 1 1 1 HIS CE1 C 1.661 -0.126 -4.010 1.00 . A A . 1 HIS CE1 1 1 7 1974 1 1 1 HIS CG C -0.177 -0.846 -4.990 1.00 . A A . 1 HIS CG 1 1 7 1975 1 1 1 HIS H1 H -0.758 1.661 -6.696 1.00 . A A . 1 HIS H1 1 1 7 1976 1 1 1 HIS HA H -2.736 0.204 -7.023 1.00 . A A . 1 HIS HA 1 1 7 1977 1 1 1 HIS HB2 H -1.782 -1.867 -5.876 1.00 . A A . 1 HIS HB2 1 1 7 1978 1 1 1 HIS HB3 H -0.721 -1.035 -7.009 1.00 . A A . 1 HIS HB3 1 1 7 1979 1 1 1 HIS HD1 H 1.121 0.570 -5.857 1.00 . A A . 1 HIS HD1 1 1 7 1980 1 1 1 HIS HD2 H -0.749 -2.188 -3.374 1.00 . A A . 1 HIS HD2 1 1 7 1981 1 1 1 HIS HE1 H 2.580 0.405 -3.815 1.00 . A A . 1 HIS HE1 1 1 7 1982 1 1 1 HIS N N -1.454 1.482 -6.030 1.00 . A A . 1 HIS N 1 1 7 1983 1 1 1 HIS ND1 N 0.918 -0.014 -5.097 1.00 . A A . 1 HIS ND1 1 1 7 1984 1 1 1 HIS NE2 N 1.087 -0.999 -3.202 1.00 . A A . 1 HIS NE2 1 1 7 1985 1 1 1 HIS O O -4.355 -0.202 -5.142 1.00 . A A . 1 HIS O 1 1 7 1986 1 1 2 VAL C C -4.284 -1.007 -2.457 1.00 . A A . 2 VAL C 1 1 7 1987 1 1 2 VAL CA C -3.556 0.329 -2.542 1.00 . A A . 2 VAL CA 1 1 7 1988 1 1 2 VAL CB C -4.592 1.468 -2.531 1.00 . A A . 2 VAL CB 1 1 7 1989 1 1 2 VAL CG1 C -5.249 1.580 -1.164 1.00 . A A . 2 VAL CG1 1 1 7 1990 1 1 2 VAL CG2 C -3.941 2.784 -2.929 1.00 . A A . 2 VAL CG2 1 1 7 1991 1 1 2 VAL H H -1.767 0.643 -3.629 1.00 . A A . 2 VAL H 1 1 7 1992 1 1 2 VAL HA H -2.923 0.439 -1.673 1.00 . A A . 2 VAL HA 1 1 7 1993 1 1 2 VAL HB H -5.359 1.237 -3.256 1.00 . A A . 2 VAL HB 1 1 7 1994 1 1 2 VAL HG11 H -4.884 0.790 -0.524 1.00 . A A . 2 VAL HG11 1 1 7 1995 1 1 2 VAL HG12 H -5.009 2.538 -0.726 1.00 . A A . 2 VAL HG12 1 1 7 1996 1 1 2 VAL HG13 H -6.320 1.491 -1.270 1.00 . A A . 2 VAL HG13 1 1 7 1997 1 1 2 VAL HG21 H -2.938 2.825 -2.531 1.00 . A A . 2 VAL HG21 1 1 7 1998 1 1 2 VAL HG22 H -3.905 2.857 -4.006 1.00 . A A . 2 VAL HG22 1 1 7 1999 1 1 2 VAL HG23 H -4.519 3.607 -2.532 1.00 . A A . 2 VAL HG23 1 1 7 2000 1 1 2 VAL N N -2.709 0.392 -3.727 1.00 . A A . 2 VAL N 1 1 7 2001 1 1 2 VAL O O -5.506 -1.052 -2.309 1.00 . A A . 2 VAL O 1 1 7 2002 1 1 3 PHE C C -4.358 -3.846 -1.040 1.00 . A A . 3 PHE C 1 1 7 2003 1 1 3 PHE CA C -4.100 -3.434 -2.486 1.00 . A A . 3 PHE CA 1 1 7 2004 1 1 3 PHE CB C -3.168 -4.445 -3.158 1.00 . A A . 3 PHE CB 1 1 7 2005 1 1 3 PHE CD1 C -4.982 -6.088 -3.707 1.00 . A A . 3 PHE CD1 1 1 7 2006 1 1 3 PHE CD2 C -3.419 -5.513 -5.414 1.00 . A A . 3 PHE CD2 1 1 7 2007 1 1 3 PHE CE1 C -5.632 -6.938 -4.583 1.00 . A A . 3 PHE CE1 1 1 7 2008 1 1 3 PHE CE2 C -4.065 -6.360 -6.295 1.00 . A A . 3 PHE CE2 1 1 7 2009 1 1 3 PHE CG C -3.871 -5.367 -4.112 1.00 . A A . 3 PHE CG 1 1 7 2010 1 1 3 PHE CZ C -5.172 -7.075 -5.878 1.00 . A A . 3 PHE CZ 1 1 7 2011 1 1 3 PHE H H -2.558 -1.995 -2.669 1.00 . A A . 3 PHE H 1 1 7 2012 1 1 3 PHE HA H -5.040 -3.417 -3.016 1.00 . A A . 3 PHE HA 1 1 7 2013 1 1 3 PHE HB2 H -2.409 -3.912 -3.710 1.00 . A A . 3 PHE HB2 1 1 7 2014 1 1 3 PHE HB3 H -2.696 -5.048 -2.397 1.00 . A A . 3 PHE HB3 1 1 7 2015 1 1 3 PHE HD1 H -5.343 -5.982 -2.694 1.00 . A A . 3 PHE HD1 1 1 7 2016 1 1 3 PHE HD2 H -2.554 -4.956 -5.741 1.00 . A A . 3 PHE HD2 1 1 7 2017 1 1 3 PHE HE1 H -6.496 -7.495 -4.255 1.00 . A A . 3 PHE HE1 1 1 7 2018 1 1 3 PHE HE2 H -3.703 -6.466 -7.307 1.00 . A A . 3 PHE HE2 1 1 7 2019 1 1 3 PHE HZ H -5.678 -7.737 -6.565 1.00 . A A . 3 PHE HZ 1 1 7 2020 1 1 3 PHE N N -3.527 -2.095 -2.552 1.00 . A A . 3 PHE N 1 1 7 2021 1 1 3 PHE O O -5.336 -4.531 -0.743 1.00 . A A . 3 PHE O 1 1 7 2022 1 1 4 ARG C C -2.975 -2.660 2.139 1.00 . A A . 4 ARG C 1 1 7 2023 1 1 4 ARG CA C -3.602 -3.748 1.271 1.00 . A A . 4 ARG CA 1 1 7 2024 1 1 4 ARG CB C -2.942 -5.095 1.569 1.00 . A A . 4 ARG CB 1 1 7 2025 1 1 4 ARG CD C -0.602 -5.560 2.359 1.00 . A A . 4 ARG CD 1 1 7 2026 1 1 4 ARG CG C -1.474 -5.154 1.181 1.00 . A A . 4 ARG CG 1 1 7 2027 1 1 4 ARG CZ C 0.242 -7.755 1.642 1.00 . A A . 4 ARG CZ 1 1 7 2028 1 1 4 ARG H H -2.713 -2.879 -0.442 1.00 . A A . 4 ARG H 1 1 7 2029 1 1 4 ARG HA H -4.654 -3.813 1.502 1.00 . A A . 4 ARG HA 1 1 7 2030 1 1 4 ARG HB2 H -3.020 -5.295 2.628 1.00 . A A . 4 ARG HB2 1 1 7 2031 1 1 4 ARG HB3 H -3.467 -5.867 1.026 1.00 . A A . 4 ARG HB3 1 1 7 2032 1 1 4 ARG HD2 H 0.381 -5.133 2.225 1.00 . A A . 4 ARG HD2 1 1 7 2033 1 1 4 ARG HD3 H -1.042 -5.172 3.265 1.00 . A A . 4 ARG HD3 1 1 7 2034 1 1 4 ARG HE H -0.955 -7.449 3.209 1.00 . A A . 4 ARG HE 1 1 7 2035 1 1 4 ARG HG2 H -1.349 -5.878 0.389 1.00 . A A . 4 ARG HG2 1 1 7 2036 1 1 4 ARG HG3 H -1.164 -4.180 0.832 1.00 . A A . 4 ARG HG3 1 1 7 2037 1 1 4 ARG HH11 H 0.853 -6.198 0.509 1.00 . A A . 4 ARG HH11 1 1 7 2038 1 1 4 ARG HH12 H 1.440 -7.751 0.015 1.00 . A A . 4 ARG HH12 1 1 7 2039 1 1 4 ARG HH21 H 0.848 -9.628 1.186 1.00 . A A . 4 ARG HH21 1 1 7 2040 1 1 4 ARG HH22 H -0.187 -9.500 2.568 1.00 . A A . 4 ARG HH22 1 1 7 2041 1 1 4 ARG N N -3.472 -3.422 -0.144 1.00 . A A . 4 ARG N 1 1 7 2042 1 1 4 ARG NE N -0.478 -7.010 2.474 1.00 . A A . 4 ARG NE 1 1 7 2043 1 1 4 ARG NH1 N 0.898 -7.188 0.639 1.00 . A A . 4 ARG NH1 1 1 7 2044 1 1 4 ARG NH2 N 0.306 -9.069 1.813 1.00 . A A . 4 ARG NH2 1 1 7 2045 1 1 4 ARG O O -2.335 -2.950 3.151 1.00 . A A . 4 ARG O 1 1 7 2046 1 1 5 LEU C C -1.090 -0.285 2.436 1.00 . A A . 5 LEU C 1 1 7 2047 1 1 5 LEU CA C -2.615 -0.276 2.476 1.00 . A A . 5 LEU CA 1 1 7 2048 1 1 5 LEU CB C -3.098 -0.308 3.927 1.00 . A A . 5 LEU CB 1 1 7 2049 1 1 5 LEU CD1 C -5.416 0.358 4.608 1.00 . A A . 5 LEU CD1 1 1 7 2050 1 1 5 LEU CD2 C -3.440 1.522 5.605 1.00 . A A . 5 LEU CD2 1 1 7 2051 1 1 5 LEU CG C -3.999 0.849 4.360 1.00 . A A . 5 LEU CG 1 1 7 2052 1 1 5 LEU H H -3.681 -1.240 0.922 1.00 . A A . 5 LEU H 1 1 7 2053 1 1 5 LEU HA H -2.970 0.629 2.007 1.00 . A A . 5 LEU HA 1 1 7 2054 1 1 5 LEU HB2 H -3.646 -1.226 4.072 1.00 . A A . 5 LEU HB2 1 1 7 2055 1 1 5 LEU HB3 H -2.226 -0.307 4.565 1.00 . A A . 5 LEU HB3 1 1 7 2056 1 1 5 LEU HD11 H -5.520 0.066 5.642 1.00 . A A . 5 LEU HD11 1 1 7 2057 1 1 5 LEU HD12 H -5.620 -0.491 3.972 1.00 . A A . 5 LEU HD12 1 1 7 2058 1 1 5 LEU HD13 H -6.116 1.150 4.385 1.00 . A A . 5 LEU HD13 1 1 7 2059 1 1 5 LEU HD21 H -2.361 1.528 5.558 1.00 . A A . 5 LEU HD21 1 1 7 2060 1 1 5 LEU HD22 H -3.760 0.978 6.482 1.00 . A A . 5 LEU HD22 1 1 7 2061 1 1 5 LEU HD23 H -3.804 2.538 5.659 1.00 . A A . 5 LEU HD23 1 1 7 2062 1 1 5 LEU HG H -4.035 1.585 3.569 1.00 . A A . 5 LEU HG 1 1 7 2063 1 1 5 LEU N N -3.162 -1.408 1.736 1.00 . A A . 5 LEU N 1 1 7 2064 1 1 5 LEU O O -0.465 -1.346 2.414 1.00 . A A . 5 LEU O 1 1 7 2065 1 1 6 LYS C C 1.597 0.283 3.556 1.00 . A A . 6 LYS C 1 1 7 2066 1 1 6 LYS CA C 0.955 1.034 2.393 1.00 . A A . 6 LYS CA 1 1 7 2067 1 1 6 LYS CB C 1.357 2.510 2.443 1.00 . A A . 6 LYS CB 1 1 7 2068 1 1 6 LYS CD C 1.535 3.369 4.797 1.00 . A A . 6 LYS CD 1 1 7 2069 1 1 6 LYS CE C 0.958 4.339 5.816 1.00 . A A . 6 LYS CE 1 1 7 2070 1 1 6 LYS CG C 0.670 3.290 3.551 1.00 . A A . 6 LYS CG 1 1 7 2071 1 1 6 LYS H H -1.049 1.713 2.446 1.00 . A A . 6 LYS H 1 1 7 2072 1 1 6 LYS HA H 1.305 0.606 1.467 1.00 . A A . 6 LYS HA 1 1 7 2073 1 1 6 LYS HB2 H 2.424 2.576 2.594 1.00 . A A . 6 LYS HB2 1 1 7 2074 1 1 6 LYS HB3 H 1.106 2.971 1.498 1.00 . A A . 6 LYS HB3 1 1 7 2075 1 1 6 LYS HD2 H 1.597 2.388 5.245 1.00 . A A . 6 LYS HD2 1 1 7 2076 1 1 6 LYS HD3 H 2.525 3.702 4.517 1.00 . A A . 6 LYS HD3 1 1 7 2077 1 1 6 LYS HE2 H -0.074 4.533 5.565 1.00 . A A . 6 LYS HE2 1 1 7 2078 1 1 6 LYS HE3 H 1.011 3.885 6.795 1.00 . A A . 6 LYS HE3 1 1 7 2079 1 1 6 LYS HG2 H 0.468 4.292 3.202 1.00 . A A . 6 LYS HG2 1 1 7 2080 1 1 6 LYS HG3 H -0.261 2.800 3.800 1.00 . A A . 6 LYS HG3 1 1 7 2081 1 1 6 LYS HZ1 H 1.331 6.268 5.108 1.00 . A A . 6 LYS HZ1 1 1 7 2082 1 1 6 LYS HZ2 H 2.713 5.461 5.657 1.00 . A A . 6 LYS HZ2 1 1 7 2083 1 1 6 LYS HZ3 H 1.600 6.084 6.768 1.00 . A A . 6 LYS HZ3 1 1 7 2084 1 1 6 LYS N N -0.496 0.903 2.427 1.00 . A A . 6 LYS N 1 1 7 2085 1 1 6 LYS NZ N 1.702 5.628 5.839 1.00 . A A . 6 LYS NZ 1 1 7 2086 1 1 6 LYS O O 2.773 -0.077 3.503 1.00 . A A . 6 LYS O 1 1 7 2087 1 1 7 LYS C C 0.163 -1.366 6.506 1.00 . A A . 7 LYS C 1 1 7 2088 1 1 7 LYS CA C 1.306 -0.664 5.779 1.00 . A A . 7 LYS CA 1 1 7 2089 1 1 7 LYS CB C 2.010 0.305 6.731 1.00 . A A . 7 LYS CB 1 1 7 2090 1 1 7 LYS CD C 4.316 -0.397 6.023 1.00 . A A . 7 LYS CD 1 1 7 2091 1 1 7 LYS CE C 4.458 -1.231 7.288 1.00 . A A . 7 LYS CE 1 1 7 2092 1 1 7 LYS CG C 3.367 0.771 6.231 1.00 . A A . 7 LYS CG 1 1 7 2093 1 1 7 LYS H H -0.114 0.359 4.588 1.00 . A A . 7 LYS H 1 1 7 2094 1 1 7 LYS HA H 2.015 -1.407 5.446 1.00 . A A . 7 LYS HA 1 1 7 2095 1 1 7 LYS HB2 H 1.384 1.174 6.870 1.00 . A A . 7 LYS HB2 1 1 7 2096 1 1 7 LYS HB3 H 2.150 -0.183 7.685 1.00 . A A . 7 LYS HB3 1 1 7 2097 1 1 7 LYS HD2 H 3.932 -1.026 5.233 1.00 . A A . 7 LYS HD2 1 1 7 2098 1 1 7 LYS HD3 H 5.287 -0.015 5.743 1.00 . A A . 7 LYS HD3 1 1 7 2099 1 1 7 LYS HE2 H 4.773 -0.587 8.094 1.00 . A A . 7 LYS HE2 1 1 7 2100 1 1 7 LYS HE3 H 3.498 -1.664 7.527 1.00 . A A . 7 LYS HE3 1 1 7 2101 1 1 7 LYS HG2 H 3.236 1.286 5.290 1.00 . A A . 7 LYS HG2 1 1 7 2102 1 1 7 LYS HG3 H 3.796 1.447 6.957 1.00 . A A . 7 LYS HG3 1 1 7 2103 1 1 7 LYS HZ1 H 6.418 -1.930 7.105 1.00 . A A . 7 LYS HZ1 1 1 7 2104 1 1 7 LYS HZ2 H 5.284 -2.832 6.231 1.00 . A A . 7 LYS HZ2 1 1 7 2105 1 1 7 LYS HZ3 H 5.383 -2.997 7.911 1.00 . A A . 7 LYS HZ3 1 1 7 2106 1 1 7 LYS N N 0.816 0.047 4.605 1.00 . A A . 7 LYS N 1 1 7 2107 1 1 7 LYS NZ N 5.456 -2.324 7.122 1.00 . A A . 7 LYS NZ 1 1 7 2108 1 1 7 LYS O O 0.101 -2.595 6.543 1.00 . A A . 7 LYS O 1 1 7 2109 1 1 8 TRP C C -1.433 -1.786 9.106 1.00 . A A . 8 TRP C 1 1 7 2110 1 1 8 TRP CA C -1.880 -1.126 7.806 1.00 . A A . 8 TRP CA 1 1 7 2111 1 1 8 TRP CB C -2.625 -2.138 6.935 1.00 . A A . 8 TRP CB 1 1 7 2112 1 1 8 TRP CD1 C -4.737 -1.787 8.345 1.00 . A A . 8 TRP CD1 1 1 7 2113 1 1 8 TRP CD2 C -5.120 -2.640 6.310 1.00 . A A . 8 TRP CD2 1 1 7 2114 1 1 8 TRP CE2 C -6.352 -2.498 6.977 1.00 . A A . 8 TRP CE2 1 1 7 2115 1 1 8 TRP CE3 C -5.112 -3.157 5.011 1.00 . A A . 8 TRP CE3 1 1 7 2116 1 1 8 TRP CG C -4.099 -2.179 7.202 1.00 . A A . 8 TRP CG 1 1 7 2117 1 1 8 TRP CH2 C -7.525 -3.359 5.116 1.00 . A A . 8 TRP CH2 1 1 7 2118 1 1 8 TRP CZ2 C -7.562 -2.856 6.388 1.00 . A A . 8 TRP CZ2 1 1 7 2119 1 1 8 TRP CZ3 C -6.314 -3.512 4.429 1.00 . A A . 8 TRP CZ3 1 1 7 2120 1 1 8 TRP H H -0.634 0.394 7.018 1.00 . A A . 8 TRP H 1 1 7 2121 1 1 8 TRP HA H -2.545 -0.308 8.042 1.00 . A A . 8 TRP HA 1 1 7 2122 1 1 8 TRP HB2 H -2.482 -1.883 5.895 1.00 . A A . 8 TRP HB2 1 1 7 2123 1 1 8 TRP HB3 H -2.224 -3.124 7.119 1.00 . A A . 8 TRP HB3 1 1 7 2124 1 1 8 TRP HD1 H -4.236 -1.391 9.215 1.00 . A A . 8 TRP HD1 1 1 7 2125 1 1 8 TRP HE1 H -6.762 -1.770 8.901 1.00 . A A . 8 TRP HE1 1 1 7 2126 1 1 8 TRP HE3 H -4.189 -3.282 4.465 1.00 . A A . 8 TRP HE3 1 1 7 2127 1 1 8 TRP HH2 H -8.440 -3.650 4.623 1.00 . A A . 8 TRP HH2 1 1 7 2128 1 1 8 TRP HZ2 H -8.504 -2.744 6.905 1.00 . A A . 8 TRP HZ2 1 1 7 2129 1 1 8 TRP HZ3 H -6.328 -3.913 3.426 1.00 . A A . 8 TRP HZ3 1 1 7 2130 1 1 8 TRP N N -0.738 -0.579 7.082 1.00 . A A . 8 TRP N 1 1 7 2131 1 1 8 TRP NE1 N -6.091 -1.977 8.216 1.00 . A A . 8 TRP NE1 1 1 7 2132 1 1 8 TRP O O -2.245 -2.365 9.829 1.00 . A A . 8 TRP O 1 1 7 2133 1 1 9 ILE C C 1.783 -1.699 10.931 1.00 . A A . 9 ILE C 1 1 7 2134 1 1 9 ILE CA C 0.412 -2.286 10.610 1.00 . A A . 9 ILE CA 1 1 7 2135 1 1 9 ILE CB C 0.538 -3.816 10.487 1.00 . A A . 9 ILE CB 1 1 7 2136 1 1 9 ILE CD1 C 2.078 -3.604 8.472 1.00 . A A . 9 ILE CD1 1 1 7 2137 1 1 9 ILE CG1 C 0.812 -4.212 9.035 1.00 . A A . 9 ILE CG1 1 1 7 2138 1 1 9 ILE CG2 C -0.726 -4.493 10.997 1.00 . A A . 9 ILE CG2 1 1 7 2139 1 1 9 ILE H H 0.457 -1.223 8.780 1.00 . A A . 9 ILE H 1 1 7 2140 1 1 9 ILE HA H -0.262 -2.064 11.424 1.00 . A A . 9 ILE HA 1 1 7 2141 1 1 9 ILE HB H 1.363 -4.137 11.103 1.00 . A A . 9 ILE HB 1 1 7 2142 1 1 9 ILE HD11 H 2.157 -3.848 7.422 1.00 . A A . 9 ILE HD11 1 1 7 2143 1 1 9 ILE HD12 H 2.046 -2.531 8.589 1.00 . A A . 9 ILE HD12 1 1 7 2144 1 1 9 ILE HD13 H 2.933 -4.000 8.998 1.00 . A A . 9 ILE HD13 1 1 7 2145 1 1 9 ILE HG12 H 0.903 -5.285 8.972 1.00 . A A . 9 ILE HG12 1 1 7 2146 1 1 9 ILE HG13 H -0.015 -3.888 8.419 1.00 . A A . 9 ILE HG13 1 1 7 2147 1 1 9 ILE HG21 H -1.233 -4.975 10.174 1.00 . A A . 9 ILE HG21 1 1 7 2148 1 1 9 ILE HG22 H -0.463 -5.232 11.739 1.00 . A A . 9 ILE HG22 1 1 7 2149 1 1 9 ILE HG23 H -1.377 -3.755 11.439 1.00 . A A . 9 ILE HG23 1 1 7 2150 1 1 9 ILE N N -0.140 -1.697 9.396 1.00 . A A . 9 ILE N 1 1 7 2151 1 1 9 ILE O O 2.632 -2.368 11.519 1.00 . A A . 9 ILE O 1 1 7 2152 1 1 10 GLN C C 3.638 0.150 12.266 1.00 . A A . 10 GLN C 1 1 7 2153 1 1 10 GLN CA C 3.256 0.233 10.792 1.00 . A A . 10 GLN CA 1 1 7 2154 1 1 10 GLN CB C 3.169 1.697 10.357 1.00 . A A . 10 GLN CB 1 1 7 2155 1 1 10 GLN CD C 2.400 4.037 10.921 1.00 . A A . 10 GLN CD 1 1 7 2156 1 1 10 GLN CG C 2.535 2.605 11.399 1.00 . A A . 10 GLN CG 1 1 7 2157 1 1 10 GLN H H 1.272 0.036 10.080 1.00 . A A . 10 GLN H 1 1 7 2158 1 1 10 GLN HA H 4.016 -0.262 10.207 1.00 . A A . 10 GLN HA 1 1 7 2159 1 1 10 GLN HB2 H 4.166 2.059 10.154 1.00 . A A . 10 GLN HB2 1 1 7 2160 1 1 10 GLN HB3 H 2.582 1.758 9.453 1.00 . A A . 10 GLN HB3 1 1 7 2161 1 1 10 GLN HE21 H 3.466 5.579 10.259 1.00 . A A . 10 GLN HE21 1 1 7 2162 1 1 10 GLN HE22 H 4.365 4.155 10.642 1.00 . A A . 10 GLN HE22 1 1 7 2163 1 1 10 GLN HG2 H 1.552 2.227 11.636 1.00 . A A . 10 GLN HG2 1 1 7 2164 1 1 10 GLN HG3 H 3.148 2.593 12.288 1.00 . A A . 10 GLN HG3 1 1 7 2165 1 1 10 GLN N N 1.989 -0.444 10.544 1.00 . A A . 10 GLN N 1 1 7 2166 1 1 10 GLN NE2 N 3.524 4.653 10.573 1.00 . A A . 10 GLN NE2 1 1 7 2167 1 1 10 GLN O O 4.808 0.285 12.623 1.00 . A A . 10 GLN O 1 1 7 2168 1 1 10 GLN OE1 O 1.299 4.584 10.865 1.00 . A A . 10 GLN OE1 1 1 7 2169 1 1 11 LYS C C 3.624 -1.460 14.894 1.00 . A A . 11 LYS C 1 1 7 2170 1 1 11 LYS CA C 2.874 -0.176 14.554 1.00 . A A . 11 LYS CA 1 1 7 2171 1 1 11 LYS CB C 1.544 -0.134 15.310 1.00 . A A . 11 LYS CB 1 1 7 2172 1 1 11 LYS CD C 0.403 -2.323 15.775 1.00 . A A . 11 LYS CD 1 1 7 2173 1 1 11 LYS CE C -0.839 -3.150 15.482 1.00 . A A . 11 LYS CE 1 1 7 2174 1 1 11 LYS CG C 0.531 -1.152 14.815 1.00 . A A . 11 LYS CG 1 1 7 2175 1 1 11 LYS H H 1.731 -0.173 12.772 1.00 . A A . 11 LYS H 1 1 7 2176 1 1 11 LYS HA H 3.476 0.668 14.855 1.00 . A A . 11 LYS HA 1 1 7 2177 1 1 11 LYS HB2 H 1.732 -0.323 16.356 1.00 . A A . 11 LYS HB2 1 1 7 2178 1 1 11 LYS HB3 H 1.114 0.851 15.203 1.00 . A A . 11 LYS HB3 1 1 7 2179 1 1 11 LYS HD2 H 1.273 -2.954 15.679 1.00 . A A . 11 LYS HD2 1 1 7 2180 1 1 11 LYS HD3 H 0.341 -1.943 16.786 1.00 . A A . 11 LYS HD3 1 1 7 2181 1 1 11 LYS HE2 H -1.708 -2.516 15.571 1.00 . A A . 11 LYS HE2 1 1 7 2182 1 1 11 LYS HE3 H -0.772 -3.530 14.473 1.00 . A A . 11 LYS HE3 1 1 7 2183 1 1 11 LYS HG2 H -0.431 -0.672 14.719 1.00 . A A . 11 LYS HG2 1 1 7 2184 1 1 11 LYS HG3 H 0.849 -1.523 13.850 1.00 . A A . 11 LYS HG3 1 1 7 2185 1 1 11 LYS HZ1 H -1.738 -4.108 17.106 1.00 . A A . 11 LYS HZ1 1 1 7 2186 1 1 11 LYS HZ2 H -0.087 -4.441 16.942 1.00 . A A . 11 LYS HZ2 1 1 7 2187 1 1 11 LYS HZ3 H -1.203 -5.165 15.898 1.00 . A A . 11 LYS HZ3 1 1 7 2188 1 1 11 LYS N N 2.644 -0.073 13.118 1.00 . A A . 11 LYS N 1 1 7 2189 1 1 11 LYS NZ N -0.977 -4.296 16.423 1.00 . A A . 11 LYS NZ 1 1 7 2190 1 1 11 LYS O O 4.546 -1.455 15.711 1.00 . A A . 11 LYS O 1 1 7 2191 1 1 12 VAL C C 5.311 -3.840 14.029 1.00 . A A . 12 VAL C 1 1 7 2192 1 1 12 VAL CA C 3.860 -3.850 14.496 1.00 . A A . 12 VAL CA 1 1 7 2193 1 1 12 VAL CB C 3.108 -4.985 13.776 1.00 . A A . 12 VAL CB 1 1 7 2194 1 1 12 VAL CG1 C 3.888 -6.287 13.871 1.00 . A A . 12 VAL CG1 1 1 7 2195 1 1 12 VAL CG2 C 1.710 -5.148 14.354 1.00 . A A . 12 VAL CG2 1 1 7 2196 1 1 12 VAL H H 2.484 -2.500 13.622 1.00 . A A . 12 VAL H 1 1 7 2197 1 1 12 VAL HA H 3.835 -4.047 15.558 1.00 . A A . 12 VAL HA 1 1 7 2198 1 1 12 VAL HB H 3.015 -4.722 12.732 1.00 . A A . 12 VAL HB 1 1 7 2199 1 1 12 VAL HG11 H 4.824 -6.185 13.341 1.00 . A A . 12 VAL HG11 1 1 7 2200 1 1 12 VAL HG12 H 4.083 -6.515 14.908 1.00 . A A . 12 VAL HG12 1 1 7 2201 1 1 12 VAL HG13 H 3.311 -7.085 13.428 1.00 . A A . 12 VAL HG13 1 1 7 2202 1 1 12 VAL HG21 H 1.749 -5.035 15.427 1.00 . A A . 12 VAL HG21 1 1 7 2203 1 1 12 VAL HG22 H 1.059 -4.396 13.935 1.00 . A A . 12 VAL HG22 1 1 7 2204 1 1 12 VAL HG23 H 1.331 -6.129 14.109 1.00 . A A . 12 VAL HG23 1 1 7 2205 1 1 12 VAL N N 3.224 -2.559 14.262 1.00 . A A . 12 VAL N 1 1 7 2206 1 1 12 VAL O O 6.217 -4.215 14.775 1.00 . A A . 12 VAL O 1 1 7 2207 1 1 13 ILE C C 7.714 -2.293 12.927 1.00 . A A . 13 ILE C 1 1 7 2208 1 1 13 ILE CA C 6.868 -3.349 12.225 1.00 . A A . 13 ILE CA 1 1 7 2209 1 1 13 ILE CB C 6.829 -3.040 10.716 1.00 . A A . 13 ILE CB 1 1 7 2210 1 1 13 ILE CD1 C 8.369 -3.771 8.826 1.00 . A A . 13 ILE CD1 1 1 7 2211 1 1 13 ILE CG1 C 8.246 -3.030 10.139 1.00 . A A . 13 ILE CG1 1 1 7 2212 1 1 13 ILE CG2 C 6.140 -1.707 10.466 1.00 . A A . 13 ILE CG2 1 1 7 2213 1 1 13 ILE H H 4.764 -3.124 12.245 1.00 . A A . 13 ILE H 1 1 7 2214 1 1 13 ILE HA H 7.330 -4.316 12.362 1.00 . A A . 13 ILE HA 1 1 7 2215 1 1 13 ILE HB H 6.255 -3.812 10.228 1.00 . A A . 13 ILE HB 1 1 7 2216 1 1 13 ILE HD11 H 7.642 -4.570 8.794 1.00 . A A . 13 ILE HD11 1 1 7 2217 1 1 13 ILE HD12 H 8.189 -3.088 8.009 1.00 . A A . 13 ILE HD12 1 1 7 2218 1 1 13 ILE HD13 H 9.362 -4.186 8.738 1.00 . A A . 13 ILE HD13 1 1 7 2219 1 1 13 ILE HG12 H 8.554 -2.010 9.974 1.00 . A A . 13 ILE HG12 1 1 7 2220 1 1 13 ILE HG13 H 8.918 -3.494 10.847 1.00 . A A . 13 ILE HG13 1 1 7 2221 1 1 13 ILE HG21 H 5.522 -1.456 11.316 1.00 . A A . 13 ILE HG21 1 1 7 2222 1 1 13 ILE HG22 H 6.885 -0.938 10.326 1.00 . A A . 13 ILE HG22 1 1 7 2223 1 1 13 ILE HG23 H 5.526 -1.779 9.582 1.00 . A A . 13 ILE HG23 1 1 7 2224 1 1 13 ILE N N 5.526 -3.409 12.791 1.00 . A A . 13 ILE N 1 1 7 2225 1 1 13 ILE O O 8.930 -2.441 13.055 1.00 . A A . 13 ILE O 1 1 7 2226 1 1 14 ASP C C 8.629 -0.696 15.200 1.00 . A A . 14 ASP C 1 1 7 2227 1 1 14 ASP CA C 7.755 -0.148 14.076 1.00 . A A . 14 ASP CA 1 1 7 2228 1 1 14 ASP CB C 6.746 0.853 14.640 1.00 . A A . 14 ASP CB 1 1 7 2229 1 1 14 ASP CG C 6.613 2.091 13.775 1.00 . A A . 14 ASP CG 1 1 7 2230 1 1 14 ASP H H 6.094 -1.168 13.251 1.00 . A A . 14 ASP H 1 1 7 2231 1 1 14 ASP HA H 8.386 0.355 13.359 1.00 . A A . 14 ASP HA 1 1 7 2232 1 1 14 ASP HB2 H 5.777 0.379 14.708 1.00 . A A . 14 ASP HB2 1 1 7 2233 1 1 14 ASP HB3 H 7.063 1.157 15.627 1.00 . A A . 14 ASP HB3 1 1 7 2234 1 1 14 ASP N N 7.063 -1.229 13.383 1.00 . A A . 14 ASP N 1 1 7 2235 1 1 14 ASP O O 9.646 -0.099 15.554 1.00 . A A . 14 ASP O 1 1 7 2236 1 1 14 ASP OD1 O 6.986 2.026 12.585 1.00 . A A . 14 ASP OD1 1 1 7 2237 1 1 14 ASP OD2 O 6.137 3.125 14.288 1.00 . A A . 14 ASP OD2 1 1 7 2238 1 1 15 GLN C C 9.752 -3.670 16.338 1.00 . A A . 15 GLN C 1 1 7 2239 1 1 15 GLN CA C 8.972 -2.459 16.841 1.00 . A A . 15 GLN CA 1 1 7 2240 1 1 15 GLN CB C 8.023 -2.880 17.965 1.00 . A A . 15 GLN CB 1 1 7 2241 1 1 15 GLN CD C 6.877 -2.247 20.125 1.00 . A A . 15 GLN CD 1 1 7 2242 1 1 15 GLN CG C 7.849 -1.822 19.042 1.00 . A A . 15 GLN CG 1 1 7 2243 1 1 15 GLN H H 7.407 -2.261 15.430 1.00 . A A . 15 GLN H 1 1 7 2244 1 1 15 GLN HA H 9.670 -1.732 17.226 1.00 . A A . 15 GLN HA 1 1 7 2245 1 1 15 GLN HB2 H 7.054 -3.094 17.540 1.00 . A A . 15 GLN HB2 1 1 7 2246 1 1 15 GLN HB3 H 8.409 -3.775 18.429 1.00 . A A . 15 GLN HB3 1 1 7 2247 1 1 15 GLN HE21 H 6.343 -1.853 21.999 1.00 . A A . 15 GLN HE21 1 1 7 2248 1 1 15 GLN HE22 H 7.633 -0.893 21.369 1.00 . A A . 15 GLN HE22 1 1 7 2249 1 1 15 GLN HG2 H 8.809 -1.629 19.498 1.00 . A A . 15 GLN HG2 1 1 7 2250 1 1 15 GLN HG3 H 7.481 -0.917 18.583 1.00 . A A . 15 GLN HG3 1 1 7 2251 1 1 15 GLN N N 8.226 -1.833 15.756 1.00 . A A . 15 GLN N 1 1 7 2252 1 1 15 GLN NE2 N 6.959 -1.599 21.282 1.00 . A A . 15 GLN NE2 1 1 7 2253 1 1 15 GLN O O 10.670 -4.150 17.003 1.00 . A A . 15 GLN O 1 1 7 2254 1 1 15 GLN OE1 O 6.060 -3.146 19.925 1.00 . A A . 15 GLN OE1 1 1 7 2255 1 1 16 PHE C C 10.910 -4.896 13.384 1.00 . A A . 16 PHE C 1 1 7 2256 1 1 16 PHE CA C 10.043 -5.314 14.567 1.00 . A A . 16 PHE CA 1 1 7 2257 1 1 16 PHE CB C 9.008 -6.348 14.117 1.00 . A A . 16 PHE CB 1 1 7 2258 1 1 16 PHE CD1 C 10.151 -8.070 12.694 1.00 . A A . 16 PHE CD1 1 1 7 2259 1 1 16 PHE CD2 C 9.554 -8.659 14.926 1.00 . A A . 16 PHE CD2 1 1 7 2260 1 1 16 PHE CE1 C 10.681 -9.332 12.499 1.00 . A A . 16 PHE CE1 1 1 7 2261 1 1 16 PHE CE2 C 10.083 -9.922 14.737 1.00 . A A . 16 PHE CE2 1 1 7 2262 1 1 16 PHE CG C 9.583 -7.720 13.908 1.00 . A A . 16 PHE CG 1 1 7 2263 1 1 16 PHE CZ C 10.646 -10.259 13.522 1.00 . A A . 16 PHE CZ 1 1 7 2264 1 1 16 PHE H H 8.640 -3.733 14.677 1.00 . A A . 16 PHE H 1 1 7 2265 1 1 16 PHE HA H 10.675 -5.756 15.323 1.00 . A A . 16 PHE HA 1 1 7 2266 1 1 16 PHE HB2 H 8.235 -6.423 14.866 1.00 . A A . 16 PHE HB2 1 1 7 2267 1 1 16 PHE HB3 H 8.571 -6.025 13.184 1.00 . A A . 16 PHE HB3 1 1 7 2268 1 1 16 PHE HD1 H 10.179 -7.345 11.893 1.00 . A A . 16 PHE HD1 1 1 7 2269 1 1 16 PHE HD2 H 9.114 -8.398 15.877 1.00 . A A . 16 PHE HD2 1 1 7 2270 1 1 16 PHE HE1 H 11.121 -9.592 11.547 1.00 . A A . 16 PHE HE1 1 1 7 2271 1 1 16 PHE HE2 H 10.054 -10.646 15.538 1.00 . A A . 16 PHE HE2 1 1 7 2272 1 1 16 PHE HZ H 11.060 -11.245 13.372 1.00 . A A . 16 PHE HZ 1 1 7 2273 1 1 16 PHE N N 9.379 -4.159 15.160 1.00 . A A . 16 PHE N 1 1 7 2274 1 1 16 PHE O O 10.477 -4.951 12.233 1.00 . A A . 16 PHE O 1 1 7 2275 1 1 17 GLY C C 13.198 -2.549 12.561 1.00 . A A . 17 GLY C 1 1 7 2276 1 1 17 GLY CA C 13.047 -4.055 12.626 1.00 . A A . 17 GLY CA 1 1 7 2277 1 1 17 GLY H H 12.429 -4.455 14.611 1.00 . A A . 17 GLY H 1 1 7 2278 1 1 17 GLY HA2 H 14.016 -4.497 12.804 1.00 . A A . 17 GLY HA2 1 1 7 2279 1 1 17 GLY HA3 H 12.671 -4.409 11.676 1.00 . A A . 17 GLY HA3 1 1 7 2280 1 1 17 GLY N N 12.138 -4.478 13.675 1.00 . A A . 17 GLY N 1 1 7 2281 1 1 17 GLY O O 12.790 -1.919 11.586 1.00 . A A . 17 GLY O 1 1 7 2282 1 1 18 GLU C C 12.674 0.216 13.423 1.00 . A A . 18 GLU C 1 1 7 2283 1 1 18 GLU CA C 13.985 -0.526 13.662 1.00 . A A . 18 GLU CA 1 1 7 2284 1 1 18 GLU CB C 15.025 -0.092 12.627 1.00 . A A . 18 GLU CB 1 1 7 2285 1 1 18 GLU CD C 15.842 2.299 12.625 1.00 . A A . 18 GLU CD 1 1 7 2286 1 1 18 GLU CG C 16.045 0.897 13.166 1.00 . A A . 18 GLU CG 1 1 7 2287 1 1 18 GLU H H 14.088 -2.525 14.352 1.00 . A A . 18 GLU H 1 1 7 2288 1 1 18 GLU HA H 14.349 -0.281 14.648 1.00 . A A . 18 GLU HA 1 1 7 2289 1 1 18 GLU HB2 H 15.553 -0.966 12.275 1.00 . A A . 18 GLU HB2 1 1 7 2290 1 1 18 GLU HB3 H 14.515 0.369 11.794 1.00 . A A . 18 GLU HB3 1 1 7 2291 1 1 18 GLU HG2 H 15.963 0.928 14.243 1.00 . A A . 18 GLU HG2 1 1 7 2292 1 1 18 GLU HG3 H 17.034 0.560 12.892 1.00 . A A . 18 GLU HG3 1 1 7 2293 1 1 18 GLU N N 13.784 -1.969 13.604 1.00 . A A . 18 GLU N 1 1 7 2294 1 1 18 GLU O O 12.406 1.240 14.051 1.00 . A A . 18 GLU O 1 1 7 2295 1 1 18 GLU OE1 O 16.853 2.987 12.370 1.00 . A A . 18 GLU OE1 1 1 7 2296 1 1 18 GLU OE2 O 14.675 2.707 12.456 1.00 . A A . 18 GLU OE2 1 1 8 2297 1 1 1 HIS C C 1.249 -2.053 -3.728 1.00 . A A . 1 HIS C 1 1 8 2298 1 1 1 HIS CA C 1.936 -2.448 -5.032 1.00 . A A . 1 HIS CA 1 1 8 2299 1 1 1 HIS CB C 2.665 -3.781 -4.854 1.00 . A A . 1 HIS CB 1 1 8 2300 1 1 1 HIS CD2 C 2.109 -5.649 -6.566 1.00 . A A . 1 HIS CD2 1 1 8 2301 1 1 1 HIS CE1 C 3.590 -5.130 -8.098 1.00 . A A . 1 HIS CE1 1 1 8 2302 1 1 1 HIS CG C 2.792 -4.567 -6.123 1.00 . A A . 1 HIS CG 1 1 8 2303 1 1 1 HIS H1 H 3.622 -1.658 -6.038 1.00 . A A . 1 HIS H1 1 1 8 2304 1 1 1 HIS HA H 1.186 -2.558 -5.800 1.00 . A A . 1 HIS HA 1 1 8 2305 1 1 1 HIS HB2 H 3.660 -3.592 -4.480 1.00 . A A . 1 HIS HB2 1 1 8 2306 1 1 1 HIS HB3 H 2.125 -4.387 -4.140 1.00 . A A . 1 HIS HB3 1 1 8 2307 1 1 1 HIS HD1 H 4.359 -3.532 -7.078 1.00 . A A . 1 HIS HD1 1 1 8 2308 1 1 1 HIS HD2 H 1.308 -6.158 -6.050 1.00 . A A . 1 HIS HD2 1 1 8 2309 1 1 1 HIS HE1 H 4.178 -5.140 -9.003 1.00 . A A . 1 HIS HE1 1 1 8 2310 1 1 1 HIS N N 2.870 -1.413 -5.461 1.00 . A A . 1 HIS N 1 1 8 2311 1 1 1 HIS ND1 N 3.713 -4.268 -7.105 1.00 . A A . 1 HIS ND1 1 1 8 2312 1 1 1 HIS NE2 N 2.624 -5.979 -7.796 1.00 . A A . 1 HIS NE2 1 1 8 2313 1 1 1 HIS O O 1.655 -2.479 -2.646 1.00 . A A . 1 HIS O 1 1 8 2314 1 1 2 VAL C C -2.023 -0.642 -2.983 1.00 . A A . 2 VAL C 1 1 8 2315 1 1 2 VAL CA C -0.538 -0.785 -2.668 1.00 . A A . 2 VAL CA 1 1 8 2316 1 1 2 VAL CB C -0.002 0.563 -2.149 1.00 . A A . 2 VAL CB 1 1 8 2317 1 1 2 VAL CG1 C -0.634 0.908 -0.809 1.00 . A A . 2 VAL CG1 1 1 8 2318 1 1 2 VAL CG2 C 1.514 0.527 -2.040 1.00 . A A . 2 VAL CG2 1 1 8 2319 1 1 2 VAL H H -0.070 -0.932 -4.727 1.00 . A A . 2 VAL H 1 1 8 2320 1 1 2 VAL HA H -0.414 -1.522 -1.888 1.00 . A A . 2 VAL HA 1 1 8 2321 1 1 2 VAL HB H -0.273 1.332 -2.858 1.00 . A A . 2 VAL HB 1 1 8 2322 1 1 2 VAL HG11 H 0.061 0.677 -0.014 1.00 . A A . 2 VAL HG11 1 1 8 2323 1 1 2 VAL HG12 H -0.874 1.961 -0.784 1.00 . A A . 2 VAL HG12 1 1 8 2324 1 1 2 VAL HG13 H -1.536 0.329 -0.677 1.00 . A A . 2 VAL HG13 1 1 8 2325 1 1 2 VAL HG21 H 1.942 0.359 -3.017 1.00 . A A . 2 VAL HG21 1 1 8 2326 1 1 2 VAL HG22 H 1.869 1.468 -1.647 1.00 . A A . 2 VAL HG22 1 1 8 2327 1 1 2 VAL HG23 H 1.809 -0.274 -1.376 1.00 . A A . 2 VAL HG23 1 1 8 2328 1 1 2 VAL N N 0.206 -1.237 -3.838 1.00 . A A . 2 VAL N 1 1 8 2329 1 1 2 VAL O O -2.435 0.289 -3.675 1.00 . A A . 2 VAL O 1 1 8 2330 1 1 3 PHE C C -4.998 -1.007 -1.473 1.00 . A A . 3 PHE C 1 1 8 2331 1 1 3 PHE CA C -4.263 -1.549 -2.695 1.00 . A A . 3 PHE CA 1 1 8 2332 1 1 3 PHE CB C -4.770 -2.954 -3.027 1.00 . A A . 3 PHE CB 1 1 8 2333 1 1 3 PHE CD1 C -4.895 -3.934 -5.334 1.00 . A A . 3 PHE CD1 1 1 8 2334 1 1 3 PHE CD2 C -6.498 -2.280 -4.717 1.00 . A A . 3 PHE CD2 1 1 8 2335 1 1 3 PHE CE1 C -5.473 -4.033 -6.586 1.00 . A A . 3 PHE CE1 1 1 8 2336 1 1 3 PHE CE2 C -7.081 -2.375 -5.967 1.00 . A A . 3 PHE CE2 1 1 8 2337 1 1 3 PHE CG C -5.400 -3.058 -4.387 1.00 . A A . 3 PHE CG 1 1 8 2338 1 1 3 PHE CZ C -6.567 -3.251 -6.903 1.00 . A A . 3 PHE CZ 1 1 8 2339 1 1 3 PHE H H -2.435 -2.288 -1.926 1.00 . A A . 3 PHE H 1 1 8 2340 1 1 3 PHE HA H -4.456 -0.898 -3.534 1.00 . A A . 3 PHE HA 1 1 8 2341 1 1 3 PHE HB2 H -3.941 -3.645 -2.993 1.00 . A A . 3 PHE HB2 1 1 8 2342 1 1 3 PHE HB3 H -5.507 -3.245 -2.295 1.00 . A A . 3 PHE HB3 1 1 8 2343 1 1 3 PHE HD1 H -4.039 -4.546 -5.087 1.00 . A A . 3 PHE HD1 1 1 8 2344 1 1 3 PHE HD2 H -6.901 -1.593 -3.987 1.00 . A A . 3 PHE HD2 1 1 8 2345 1 1 3 PHE HE1 H -5.069 -4.719 -7.315 1.00 . A A . 3 PHE HE1 1 1 8 2346 1 1 3 PHE HE2 H -7.936 -1.762 -6.212 1.00 . A A . 3 PHE HE2 1 1 8 2347 1 1 3 PHE HZ H -7.020 -3.327 -7.879 1.00 . A A . 3 PHE HZ 1 1 8 2348 1 1 3 PHE N N -2.823 -1.570 -2.469 1.00 . A A . 3 PHE N 1 1 8 2349 1 1 3 PHE O O -5.657 0.031 -1.541 1.00 . A A . 3 PHE O 1 1 8 2350 1 1 4 ARG C C -4.616 -0.414 1.711 1.00 . A A . 4 ARG C 1 1 8 2351 1 1 4 ARG CA C -5.532 -1.309 0.882 1.00 . A A . 4 ARG CA 1 1 8 2352 1 1 4 ARG CB C -5.938 -2.538 1.699 1.00 . A A . 4 ARG CB 1 1 8 2353 1 1 4 ARG CD C -7.353 -3.909 0.139 1.00 . A A . 4 ARG CD 1 1 8 2354 1 1 4 ARG CG C -7.338 -3.041 1.388 1.00 . A A . 4 ARG CG 1 1 8 2355 1 1 4 ARG CZ C -8.936 -4.570 -1.622 1.00 . A A . 4 ARG CZ 1 1 8 2356 1 1 4 ARG H H -4.339 -2.535 -0.364 1.00 . A A . 4 ARG H 1 1 8 2357 1 1 4 ARG HA H -6.420 -0.752 0.621 1.00 . A A . 4 ARG HA 1 1 8 2358 1 1 4 ARG HB2 H -5.239 -3.336 1.497 1.00 . A A . 4 ARG HB2 1 1 8 2359 1 1 4 ARG HB3 H -5.893 -2.288 2.748 1.00 . A A . 4 ARG HB3 1 1 8 2360 1 1 4 ARG HD2 H -6.678 -3.483 -0.588 1.00 . A A . 4 ARG HD2 1 1 8 2361 1 1 4 ARG HD3 H -7.018 -4.901 0.403 1.00 . A A . 4 ARG HD3 1 1 8 2362 1 1 4 ARG HE H -9.433 -3.613 0.056 1.00 . A A . 4 ARG HE 1 1 8 2363 1 1 4 ARG HG2 H -7.694 -3.625 2.223 1.00 . A A . 4 ARG HG2 1 1 8 2364 1 1 4 ARG HG3 H -7.989 -2.193 1.234 1.00 . A A . 4 ARG HG3 1 1 8 2365 1 1 4 ARG HH11 H -7.011 -5.070 -1.977 1.00 . A A . 4 ARG HH11 1 1 8 2366 1 1 4 ARG HH12 H -8.138 -5.531 -3.211 1.00 . A A . 4 ARG HH12 1 1 8 2367 1 1 4 ARG HH21 H -10.363 -5.042 -2.973 1.00 . A A . 4 ARG HH21 1 1 8 2368 1 1 4 ARG HH22 H -10.925 -4.214 -1.560 1.00 . A A . 4 ARG HH22 1 1 8 2369 1 1 4 ARG N N -4.879 -1.717 -0.356 1.00 . A A . 4 ARG N 1 1 8 2370 1 1 4 ARG NE N -8.687 -3.999 -0.449 1.00 . A A . 4 ARG NE 1 1 8 2371 1 1 4 ARG NH1 N -7.947 -5.100 -2.328 1.00 . A A . 4 ARG NH1 1 1 8 2372 1 1 4 ARG NH2 N -10.177 -4.613 -2.090 1.00 . A A . 4 ARG NH2 1 1 8 2373 1 1 4 ARG O O -5.003 0.683 2.118 1.00 . A A . 4 ARG O 1 1 8 2374 1 1 5 LEU C C -1.005 -0.441 2.287 1.00 . A A . 5 LEU C 1 1 8 2375 1 1 5 LEU CA C -2.428 -0.131 2.740 1.00 . A A . 5 LEU CA 1 1 8 2376 1 1 5 LEU CB C -2.582 -0.449 4.228 1.00 . A A . 5 LEU CB 1 1 8 2377 1 1 5 LEU CD1 C -4.655 -0.009 5.568 1.00 . A A . 5 LEU CD1 1 1 8 2378 1 1 5 LEU CD2 C -2.495 1.072 6.219 1.00 . A A . 5 LEU CD2 1 1 8 2379 1 1 5 LEU CG C -3.349 0.581 5.059 1.00 . A A . 5 LEU CG 1 1 8 2380 1 1 5 LEU H H -3.149 -1.768 1.609 1.00 . A A . 5 LEU H 1 1 8 2381 1 1 5 LEU HA H -2.622 0.919 2.583 1.00 . A A . 5 LEU HA 1 1 8 2382 1 1 5 LEU HB2 H -3.098 -1.393 4.313 1.00 . A A . 5 LEU HB2 1 1 8 2383 1 1 5 LEU HB3 H -1.591 -0.544 4.650 1.00 . A A . 5 LEU HB3 1 1 8 2384 1 1 5 LEU HD11 H -4.464 -0.973 6.016 1.00 . A A . 5 LEU HD11 1 1 8 2385 1 1 5 LEU HD12 H -5.342 -0.125 4.743 1.00 . A A . 5 LEU HD12 1 1 8 2386 1 1 5 LEU HD13 H -5.085 0.652 6.305 1.00 . A A . 5 LEU HD13 1 1 8 2387 1 1 5 LEU HD21 H -1.533 1.392 5.848 1.00 . A A . 5 LEU HD21 1 1 8 2388 1 1 5 LEU HD22 H -2.359 0.270 6.930 1.00 . A A . 5 LEU HD22 1 1 8 2389 1 1 5 LEU HD23 H -2.990 1.902 6.703 1.00 . A A . 5 LEU HD23 1 1 8 2390 1 1 5 LEU HG H -3.588 1.431 4.435 1.00 . A A . 5 LEU HG 1 1 8 2391 1 1 5 LEU N N -3.400 -0.888 1.959 1.00 . A A . 5 LEU N 1 1 8 2392 1 1 5 LEU O O -0.792 -1.255 1.388 1.00 . A A . 5 LEU O 1 1 8 2393 1 1 6 LYS C C 2.090 -0.750 3.694 1.00 . A A . 6 LYS C 1 1 8 2394 1 1 6 LYS CA C 1.370 0.004 2.581 1.00 . A A . 6 LYS CA 1 1 8 2395 1 1 6 LYS CB C 2.060 1.347 2.332 1.00 . A A . 6 LYS CB 1 1 8 2396 1 1 6 LYS CD C 1.992 2.113 4.723 1.00 . A A . 6 LYS CD 1 1 8 2397 1 1 6 LYS CE C 1.667 3.265 5.662 1.00 . A A . 6 LYS CE 1 1 8 2398 1 1 6 LYS CG C 1.621 2.443 3.287 1.00 . A A . 6 LYS CG 1 1 8 2399 1 1 6 LYS H H -0.267 0.848 3.625 1.00 . A A . 6 LYS H 1 1 8 2400 1 1 6 LYS HA H 1.412 -0.586 1.678 1.00 . A A . 6 LYS HA 1 1 8 2401 1 1 6 LYS HB2 H 3.127 1.215 2.435 1.00 . A A . 6 LYS HB2 1 1 8 2402 1 1 6 LYS HB3 H 1.842 1.669 1.323 1.00 . A A . 6 LYS HB3 1 1 8 2403 1 1 6 LYS HD2 H 1.439 1.240 5.037 1.00 . A A . 6 LYS HD2 1 1 8 2404 1 1 6 LYS HD3 H 3.052 1.907 4.773 1.00 . A A . 6 LYS HD3 1 1 8 2405 1 1 6 LYS HE2 H 0.709 3.677 5.386 1.00 . A A . 6 LYS HE2 1 1 8 2406 1 1 6 LYS HE3 H 1.618 2.886 6.672 1.00 . A A . 6 LYS HE3 1 1 8 2407 1 1 6 LYS HG2 H 2.102 3.368 3.006 1.00 . A A . 6 LYS HG2 1 1 8 2408 1 1 6 LYS HG3 H 0.548 2.558 3.219 1.00 . A A . 6 LYS HG3 1 1 8 2409 1 1 6 LYS HZ1 H 2.590 4.882 4.715 1.00 . A A . 6 LYS HZ1 1 1 8 2410 1 1 6 LYS HZ2 H 3.648 3.925 5.625 1.00 . A A . 6 LYS HZ2 1 1 8 2411 1 1 6 LYS HZ3 H 2.586 4.987 6.403 1.00 . A A . 6 LYS HZ3 1 1 8 2412 1 1 6 LYS N N -0.034 0.211 2.916 1.00 . A A . 6 LYS N 1 1 8 2413 1 1 6 LYS NZ N 2.695 4.340 5.597 1.00 . A A . 6 LYS NZ 1 1 8 2414 1 1 6 LYS O O 3.317 -0.844 3.702 1.00 . A A . 6 LYS O 1 1 8 2415 1 1 7 LYS C C 0.806 -2.869 6.444 1.00 . A A . 7 LYS C 1 1 8 2416 1 1 7 LYS CA C 1.881 -2.037 5.750 1.00 . A A . 7 LYS CA 1 1 8 2417 1 1 7 LYS CB C 2.530 -1.083 6.755 1.00 . A A . 7 LYS CB 1 1 8 2418 1 1 7 LYS CD C 4.872 -0.175 6.782 1.00 . A A . 7 LYS CD 1 1 8 2419 1 1 7 LYS CE C 5.603 -0.277 5.452 1.00 . A A . 7 LYS CE 1 1 8 2420 1 1 7 LYS CG C 3.992 -1.389 7.028 1.00 . A A . 7 LYS CG 1 1 8 2421 1 1 7 LYS H H 0.345 -1.179 4.572 1.00 . A A . 7 LYS H 1 1 8 2422 1 1 7 LYS HA H 2.636 -2.701 5.358 1.00 . A A . 7 LYS HA 1 1 8 2423 1 1 7 LYS HB2 H 2.460 -0.075 6.374 1.00 . A A . 7 LYS HB2 1 1 8 2424 1 1 7 LYS HB3 H 1.991 -1.143 7.690 1.00 . A A . 7 LYS HB3 1 1 8 2425 1 1 7 LYS HD2 H 4.254 0.711 6.772 1.00 . A A . 7 LYS HD2 1 1 8 2426 1 1 7 LYS HD3 H 5.599 -0.100 7.578 1.00 . A A . 7 LYS HD3 1 1 8 2427 1 1 7 LYS HE2 H 6.664 -0.332 5.643 1.00 . A A . 7 LYS HE2 1 1 8 2428 1 1 7 LYS HE3 H 5.282 -1.177 4.948 1.00 . A A . 7 LYS HE3 1 1 8 2429 1 1 7 LYS HG2 H 4.101 -1.696 8.058 1.00 . A A . 7 LYS HG2 1 1 8 2430 1 1 7 LYS HG3 H 4.310 -2.191 6.377 1.00 . A A . 7 LYS HG3 1 1 8 2431 1 1 7 LYS HZ1 H 6.113 1.034 3.908 1.00 . A A . 7 LYS HZ1 1 1 8 2432 1 1 7 LYS HZ2 H 5.221 1.754 5.152 1.00 . A A . 7 LYS HZ2 1 1 8 2433 1 1 7 LYS HZ3 H 4.452 0.741 4.038 1.00 . A A . 7 LYS HZ3 1 1 8 2434 1 1 7 LYS N N 1.318 -1.288 4.633 1.00 . A A . 7 LYS N 1 1 8 2435 1 1 7 LYS NZ N 5.328 0.895 4.576 1.00 . A A . 7 LYS NZ 1 1 8 2436 1 1 7 LYS O O 0.952 -4.081 6.601 1.00 . A A . 7 LYS O 1 1 8 2437 1 1 8 TRP C C -0.967 -3.312 8.939 1.00 . A A . 8 TRP C 1 1 8 2438 1 1 8 TRP CA C -1.371 -2.890 7.530 1.00 . A A . 8 TRP CA 1 1 8 2439 1 1 8 TRP CB C -1.812 -4.114 6.725 1.00 . A A . 8 TRP CB 1 1 8 2440 1 1 8 TRP CD1 C -4.225 -3.862 7.551 1.00 . A A . 8 TRP CD1 1 1 8 2441 1 1 8 TRP CD2 C -4.037 -4.823 5.536 1.00 . A A . 8 TRP CD2 1 1 8 2442 1 1 8 TRP CE2 C -5.403 -4.745 5.871 1.00 . A A . 8 TRP CE2 1 1 8 2443 1 1 8 TRP CE3 C -3.675 -5.391 4.312 1.00 . A A . 8 TRP CE3 1 1 8 2444 1 1 8 TRP CG C -3.301 -4.253 6.624 1.00 . A A . 8 TRP CG 1 1 8 2445 1 1 8 TRP CH2 C -6.021 -5.765 3.832 1.00 . A A . 8 TRP CH2 1 1 8 2446 1 1 8 TRP CZ2 C -6.404 -5.214 5.025 1.00 . A A . 8 TRP CZ2 1 1 8 2447 1 1 8 TRP CZ3 C -4.670 -5.856 3.473 1.00 . A A . 8 TRP CZ3 1 1 8 2448 1 1 8 TRP H H -0.329 -1.244 6.701 1.00 . A A . 8 TRP H 1 1 8 2449 1 1 8 TRP HA H -2.197 -2.198 7.597 1.00 . A A . 8 TRP HA 1 1 8 2450 1 1 8 TRP HB2 H -1.416 -4.040 5.724 1.00 . A A . 8 TRP HB2 1 1 8 2451 1 1 8 TRP HB3 H -1.425 -5.005 7.198 1.00 . A A . 8 TRP HB3 1 1 8 2452 1 1 8 TRP HD1 H -3.982 -3.394 8.492 1.00 . A A . 8 TRP HD1 1 1 8 2453 1 1 8 TRP HE1 H -6.323 -3.972 7.590 1.00 . A A . 8 TRP HE1 1 1 8 2454 1 1 8 TRP HE3 H -2.639 -5.470 4.017 1.00 . A A . 8 TRP HE3 1 1 8 2455 1 1 8 TRP HH2 H -6.764 -6.142 3.147 1.00 . A A . 8 TRP HH2 1 1 8 2456 1 1 8 TRP HZ2 H -7.450 -5.151 5.287 1.00 . A A . 8 TRP HZ2 1 1 8 2457 1 1 8 TRP HZ3 H -4.409 -6.298 2.523 1.00 . A A . 8 TRP HZ3 1 1 8 2458 1 1 8 TRP N N -0.271 -2.210 6.855 1.00 . A A . 8 TRP N 1 1 8 2459 1 1 8 TRP NE1 N -5.491 -4.156 7.104 1.00 . A A . 8 TRP NE1 1 1 8 2460 1 1 8 TRP O O -1.760 -3.905 9.670 1.00 . A A . 8 TRP O 1 1 8 2461 1 1 9 ILE C C 1.967 -2.474 11.013 1.00 . A A . 9 ILE C 1 1 8 2462 1 1 9 ILE CA C 0.777 -3.348 10.635 1.00 . A A . 9 ILE CA 1 1 8 2463 1 1 9 ILE CB C 1.197 -4.828 10.707 1.00 . A A . 9 ILE CB 1 1 8 2464 1 1 9 ILE CD1 C 3.026 -4.495 8.968 1.00 . A A . 9 ILE CD1 1 1 8 2465 1 1 9 ILE CG1 C 1.795 -5.276 9.371 1.00 . A A . 9 ILE CG1 1 1 8 2466 1 1 9 ILE CG2 C 0.007 -5.699 11.080 1.00 . A A . 9 ILE CG2 1 1 8 2467 1 1 9 ILE H H 0.854 -2.528 8.685 1.00 . A A . 9 ILE H 1 1 8 2468 1 1 9 ILE HA H -0.017 -3.185 11.349 1.00 . A A . 9 ILE HA 1 1 8 2469 1 1 9 ILE HB H 1.944 -4.930 11.479 1.00 . A A . 9 ILE HB 1 1 8 2470 1 1 9 ILE HD11 H 2.727 -3.556 8.524 1.00 . A A . 9 ILE HD11 1 1 8 2471 1 1 9 ILE HD12 H 3.633 -4.303 9.841 1.00 . A A . 9 ILE HD12 1 1 8 2472 1 1 9 ILE HD13 H 3.596 -5.066 8.251 1.00 . A A . 9 ILE HD13 1 1 8 2473 1 1 9 ILE HG12 H 2.070 -6.317 9.439 1.00 . A A . 9 ILE HG12 1 1 8 2474 1 1 9 ILE HG13 H 1.054 -5.153 8.595 1.00 . A A . 9 ILE HG13 1 1 8 2475 1 1 9 ILE HG21 H -0.301 -6.274 10.219 1.00 . A A . 9 ILE HG21 1 1 8 2476 1 1 9 ILE HG22 H 0.289 -6.370 11.877 1.00 . A A . 9 ILE HG22 1 1 8 2477 1 1 9 ILE HG23 H -0.809 -5.073 11.406 1.00 . A A . 9 ILE HG23 1 1 8 2478 1 1 9 ILE N N 0.270 -3.002 9.313 1.00 . A A . 9 ILE N 1 1 8 2479 1 1 9 ILE O O 2.877 -2.917 11.714 1.00 . A A . 9 ILE O 1 1 8 2480 1 1 10 GLN C C 3.328 -0.250 12.331 1.00 . A A . 10 GLN C 1 1 8 2481 1 1 10 GLN CA C 3.032 -0.293 10.836 1.00 . A A . 10 GLN CA 1 1 8 2482 1 1 10 GLN CB C 2.670 1.106 10.335 1.00 . A A . 10 GLN CB 1 1 8 2483 1 1 10 GLN CD C 1.382 3.241 10.746 1.00 . A A . 10 GLN CD 1 1 8 2484 1 1 10 GLN CG C 1.772 1.880 11.288 1.00 . A A . 10 GLN CG 1 1 8 2485 1 1 10 GLN H H 1.201 -0.936 9.991 1.00 . A A . 10 GLN H 1 1 8 2486 1 1 10 GLN HA H 3.916 -0.633 10.317 1.00 . A A . 10 GLN HA 1 1 8 2487 1 1 10 GLN HB2 H 3.579 1.671 10.192 1.00 . A A . 10 GLN HB2 1 1 8 2488 1 1 10 GLN HB3 H 2.158 1.016 9.388 1.00 . A A . 10 GLN HB3 1 1 8 2489 1 1 10 GLN HE21 H 0.643 5.000 11.303 1.00 . A A . 10 GLN HE21 1 1 8 2490 1 1 10 GLN HE22 H 0.830 3.833 12.562 1.00 . A A . 10 GLN HE22 1 1 8 2491 1 1 10 GLN HG2 H 0.873 1.307 11.460 1.00 . A A . 10 GLN HG2 1 1 8 2492 1 1 10 GLN HG3 H 2.296 2.017 12.223 1.00 . A A . 10 GLN HG3 1 1 8 2493 1 1 10 GLN N N 1.954 -1.230 10.545 1.00 . A A . 10 GLN N 1 1 8 2494 1 1 10 GLN NE2 N 0.902 4.113 11.625 1.00 . A A . 10 GLN NE2 1 1 8 2495 1 1 10 GLN O O 4.436 0.090 12.747 1.00 . A A . 10 GLN O 1 1 8 2496 1 1 10 GLN OE1 O 1.509 3.506 9.550 1.00 . A A . 10 GLN OE1 1 1 8 2497 1 1 11 LYS C C 3.470 -1.672 15.029 1.00 . A A . 11 LYS C 1 1 8 2498 1 1 11 LYS CA C 2.481 -0.598 14.587 1.00 . A A . 11 LYS CA 1 1 8 2499 1 1 11 LYS CB C 1.127 -0.828 15.262 1.00 . A A . 11 LYS CB 1 1 8 2500 1 1 11 LYS CD C 1.440 -2.277 17.290 1.00 . A A . 11 LYS CD 1 1 8 2501 1 1 11 LYS CE C 1.080 -2.405 18.762 1.00 . A A . 11 LYS CE 1 1 8 2502 1 1 11 LYS CG C 1.202 -0.866 16.778 1.00 . A A . 11 LYS CG 1 1 8 2503 1 1 11 LYS H H 1.469 -0.857 12.746 1.00 . A A . 11 LYS H 1 1 8 2504 1 1 11 LYS HA H 2.862 0.368 14.882 1.00 . A A . 11 LYS HA 1 1 8 2505 1 1 11 LYS HB2 H 0.456 -0.032 14.975 1.00 . A A . 11 LYS HB2 1 1 8 2506 1 1 11 LYS HB3 H 0.723 -1.769 14.919 1.00 . A A . 11 LYS HB3 1 1 8 2507 1 1 11 LYS HD2 H 0.831 -2.964 16.721 1.00 . A A . 11 LYS HD2 1 1 8 2508 1 1 11 LYS HD3 H 2.484 -2.526 17.160 1.00 . A A . 11 LYS HD3 1 1 8 2509 1 1 11 LYS HE2 H 1.534 -1.589 19.302 1.00 . A A . 11 LYS HE2 1 1 8 2510 1 1 11 LYS HE3 H 0.006 -2.349 18.862 1.00 . A A . 11 LYS HE3 1 1 8 2511 1 1 11 LYS HG2 H 2.015 -0.235 17.106 1.00 . A A . 11 LYS HG2 1 1 8 2512 1 1 11 LYS HG3 H 0.271 -0.498 17.185 1.00 . A A . 11 LYS HG3 1 1 8 2513 1 1 11 LYS HZ1 H 2.150 -4.195 18.651 1.00 . A A . 11 LYS HZ1 1 1 8 2514 1 1 11 LYS HZ2 H 0.742 -4.295 19.583 1.00 . A A . 11 LYS HZ2 1 1 8 2515 1 1 11 LYS HZ3 H 2.109 -3.515 20.200 1.00 . A A . 11 LYS HZ3 1 1 8 2516 1 1 11 LYS N N 2.330 -0.596 13.137 1.00 . A A . 11 LYS N 1 1 8 2517 1 1 11 LYS NZ N 1.554 -3.693 19.339 1.00 . A A . 11 LYS NZ 1 1 8 2518 1 1 11 LYS O O 4.395 -1.401 15.795 1.00 . A A . 11 LYS O 1 1 8 2519 1 1 12 VAL C C 5.587 -3.719 14.472 1.00 . A A . 12 VAL C 1 1 8 2520 1 1 12 VAL CA C 4.146 -4.006 14.881 1.00 . A A . 12 VAL CA 1 1 8 2521 1 1 12 VAL CB C 3.683 -5.311 14.208 1.00 . A A . 12 VAL CB 1 1 8 2522 1 1 12 VAL CG1 C 4.706 -6.416 14.425 1.00 . A A . 12 VAL CG1 1 1 8 2523 1 1 12 VAL CG2 C 2.318 -5.727 14.734 1.00 . A A . 12 VAL CG2 1 1 8 2524 1 1 12 VAL H H 2.517 -3.045 13.932 1.00 . A A . 12 VAL H 1 1 8 2525 1 1 12 VAL HA H 4.108 -4.144 15.952 1.00 . A A . 12 VAL HA 1 1 8 2526 1 1 12 VAL HB H 3.598 -5.134 13.146 1.00 . A A . 12 VAL HB 1 1 8 2527 1 1 12 VAL HG11 H 4.329 -7.341 14.012 1.00 . A A . 12 VAL HG11 1 1 8 2528 1 1 12 VAL HG12 H 5.631 -6.152 13.935 1.00 . A A . 12 VAL HG12 1 1 8 2529 1 1 12 VAL HG13 H 4.881 -6.541 15.483 1.00 . A A . 12 VAL HG13 1 1 8 2530 1 1 12 VAL HG21 H 1.846 -6.392 14.027 1.00 . A A . 12 VAL HG21 1 1 8 2531 1 1 12 VAL HG22 H 2.436 -6.232 15.681 1.00 . A A . 12 VAL HG22 1 1 8 2532 1 1 12 VAL HG23 H 1.702 -4.849 14.870 1.00 . A A . 12 VAL HG23 1 1 8 2533 1 1 12 VAL N N 3.271 -2.892 14.539 1.00 . A A . 12 VAL N 1 1 8 2534 1 1 12 VAL O O 6.506 -3.826 15.283 1.00 . A A . 12 VAL O 1 1 8 2535 1 1 13 ILE C C 7.693 -1.823 13.380 1.00 . A A . 13 ILE C 1 1 8 2536 1 1 13 ILE CA C 7.103 -3.049 12.692 1.00 . A A . 13 ILE CA 1 1 8 2537 1 1 13 ILE CB C 7.074 -2.805 11.171 1.00 . A A . 13 ILE CB 1 1 8 2538 1 1 13 ILE CD1 C 8.797 -3.561 9.457 1.00 . A A . 13 ILE CD1 1 1 8 2539 1 1 13 ILE CG1 C 8.496 -2.653 10.629 1.00 . A A . 13 ILE CG1 1 1 8 2540 1 1 13 ILE CG2 C 6.243 -1.572 10.848 1.00 . A A . 13 ILE CG2 1 1 8 2541 1 1 13 ILE H H 5.002 -3.286 12.610 1.00 . A A . 13 ILE H 1 1 8 2542 1 1 13 ILE HA H 7.740 -3.900 12.887 1.00 . A A . 13 ILE HA 1 1 8 2543 1 1 13 ILE HB H 6.606 -3.657 10.702 1.00 . A A . 13 ILE HB 1 1 8 2544 1 1 13 ILE HD11 H 8.280 -3.199 8.580 1.00 . A A . 13 ILE HD11 1 1 8 2545 1 1 13 ILE HD12 H 9.861 -3.568 9.270 1.00 . A A . 13 ILE HD12 1 1 8 2546 1 1 13 ILE HD13 H 8.464 -4.563 9.682 1.00 . A A . 13 ILE HD13 1 1 8 2547 1 1 13 ILE HG12 H 8.645 -1.635 10.306 1.00 . A A . 13 ILE HG12 1 1 8 2548 1 1 13 ILE HG13 H 9.200 -2.883 11.417 1.00 . A A . 13 ILE HG13 1 1 8 2549 1 1 13 ILE HG21 H 6.793 -0.685 11.128 1.00 . A A . 13 ILE HG21 1 1 8 2550 1 1 13 ILE HG22 H 6.035 -1.546 9.789 1.00 . A A . 13 ILE HG22 1 1 8 2551 1 1 13 ILE HG23 H 5.315 -1.609 11.397 1.00 . A A . 13 ILE HG23 1 1 8 2552 1 1 13 ILE N N 5.775 -3.353 13.208 1.00 . A A . 13 ILE N 1 1 8 2553 1 1 13 ILE O O 8.904 -1.738 13.588 1.00 . A A . 13 ILE O 1 1 8 2554 1 1 14 ASP C C 8.139 0.021 15.609 1.00 . A A . 14 ASP C 1 1 8 2555 1 1 14 ASP CA C 7.265 0.344 14.401 1.00 . A A . 14 ASP CA 1 1 8 2556 1 1 14 ASP CB C 6.055 1.171 14.837 1.00 . A A . 14 ASP CB 1 1 8 2557 1 1 14 ASP CG C 5.771 2.325 13.895 1.00 . A A . 14 ASP CG 1 1 8 2558 1 1 14 ASP H H 5.878 -1.003 13.539 1.00 . A A . 14 ASP H 1 1 8 2559 1 1 14 ASP HA H 7.847 0.919 13.696 1.00 . A A . 14 ASP HA 1 1 8 2560 1 1 14 ASP HB2 H 5.183 0.534 14.868 1.00 . A A . 14 ASP HB2 1 1 8 2561 1 1 14 ASP HB3 H 6.238 1.572 15.823 1.00 . A A . 14 ASP HB3 1 1 8 2562 1 1 14 ASP N N 6.830 -0.877 13.732 1.00 . A A . 14 ASP N 1 1 8 2563 1 1 14 ASP O O 8.996 0.814 15.997 1.00 . A A . 14 ASP O 1 1 8 2564 1 1 14 ASP OD1 O 6.740 2.941 13.403 1.00 . A A . 14 ASP OD1 1 1 8 2565 1 1 14 ASP OD2 O 4.581 2.610 13.648 1.00 . A A . 14 ASP OD2 1 1 8 2566 1 1 15 GLN C C 9.614 -2.726 17.011 1.00 . A A . 15 GLN C 1 1 8 2567 1 1 15 GLN CA C 8.678 -1.575 17.365 1.00 . A A . 15 GLN CA 1 1 8 2568 1 1 15 GLN CB C 7.736 -1.996 18.494 1.00 . A A . 15 GLN CB 1 1 8 2569 1 1 15 GLN CD C 7.560 -2.583 20.945 1.00 . A A . 15 GLN CD 1 1 8 2570 1 1 15 GLN CG C 8.458 -2.520 19.725 1.00 . A A . 15 GLN CG 1 1 8 2571 1 1 15 GLN H H 7.216 -1.737 15.844 1.00 . A A . 15 GLN H 1 1 8 2572 1 1 15 GLN HA H 9.271 -0.736 17.698 1.00 . A A . 15 GLN HA 1 1 8 2573 1 1 15 GLN HB2 H 7.141 -1.144 18.787 1.00 . A A . 15 GLN HB2 1 1 8 2574 1 1 15 GLN HB3 H 7.082 -2.774 18.129 1.00 . A A . 15 GLN HB3 1 1 8 2575 1 1 15 GLN HE21 H 7.596 -2.470 22.930 1.00 . A A . 15 GLN HE21 1 1 8 2576 1 1 15 GLN HE22 H 9.123 -2.293 22.140 1.00 . A A . 15 GLN HE22 1 1 8 2577 1 1 15 GLN HG2 H 8.825 -3.514 19.516 1.00 . A A . 15 GLN HG2 1 1 8 2578 1 1 15 GLN HG3 H 9.291 -1.868 19.942 1.00 . A A . 15 GLN HG3 1 1 8 2579 1 1 15 GLN N N 7.913 -1.148 16.200 1.00 . A A . 15 GLN N 1 1 8 2580 1 1 15 GLN NE2 N 8.152 -2.434 22.125 1.00 . A A . 15 GLN NE2 1 1 8 2581 1 1 15 GLN O O 10.525 -3.056 17.770 1.00 . A A . 15 GLN O 1 1 8 2582 1 1 15 GLN OE1 O 6.347 -2.763 20.830 1.00 . A A . 15 GLN OE1 1 1 8 2583 1 1 16 PHE C C 11.530 -3.955 14.832 1.00 . A A . 16 PHE C 1 1 8 2584 1 1 16 PHE CA C 10.202 -4.452 15.398 1.00 . A A . 16 PHE CA 1 1 8 2585 1 1 16 PHE CB C 9.455 -5.263 14.338 1.00 . A A . 16 PHE CB 1 1 8 2586 1 1 16 PHE CD1 C 9.691 -7.568 15.302 1.00 . A A . 16 PHE CD1 1 1 8 2587 1 1 16 PHE CD2 C 10.547 -7.162 13.114 1.00 . A A . 16 PHE CD2 1 1 8 2588 1 1 16 PHE CE1 C 10.105 -8.885 15.223 1.00 . A A . 16 PHE CE1 1 1 8 2589 1 1 16 PHE CE2 C 10.963 -8.477 13.029 1.00 . A A . 16 PHE CE2 1 1 8 2590 1 1 16 PHE CG C 9.906 -6.693 14.249 1.00 . A A . 16 PHE CG 1 1 8 2591 1 1 16 PHE CZ C 10.743 -9.339 14.085 1.00 . A A . 16 PHE CZ 1 1 8 2592 1 1 16 PHE H H 8.639 -3.027 15.291 1.00 . A A . 16 PHE H 1 1 8 2593 1 1 16 PHE HA H 10.401 -5.084 16.249 1.00 . A A . 16 PHE HA 1 1 8 2594 1 1 16 PHE HB2 H 8.401 -5.263 14.572 1.00 . A A . 16 PHE HB2 1 1 8 2595 1 1 16 PHE HB3 H 9.605 -4.806 13.372 1.00 . A A . 16 PHE HB3 1 1 8 2596 1 1 16 PHE HD1 H 9.192 -7.213 16.193 1.00 . A A . 16 PHE HD1 1 1 8 2597 1 1 16 PHE HD2 H 10.721 -6.488 12.287 1.00 . A A . 16 PHE HD2 1 1 8 2598 1 1 16 PHE HE1 H 9.931 -9.556 16.051 1.00 . A A . 16 PHE HE1 1 1 8 2599 1 1 16 PHE HE2 H 11.462 -8.830 12.139 1.00 . A A . 16 PHE HE2 1 1 8 2600 1 1 16 PHE HZ H 11.066 -10.367 14.022 1.00 . A A . 16 PHE HZ 1 1 8 2601 1 1 16 PHE N N 9.381 -3.335 15.853 1.00 . A A . 16 PHE N 1 1 8 2602 1 1 16 PHE O O 12.592 -4.482 15.159 1.00 . A A . 16 PHE O 1 1 8 2603 1 1 17 GLY C C 12.368 -1.216 12.464 1.00 . A A . 17 GLY C 1 1 8 2604 1 1 17 GLY CA C 12.661 -2.387 13.381 1.00 . A A . 17 GLY CA 1 1 8 2605 1 1 17 GLY H H 10.584 -2.557 13.756 1.00 . A A . 17 GLY H 1 1 8 2606 1 1 17 GLY HA2 H 13.324 -2.058 14.168 1.00 . A A . 17 GLY HA2 1 1 8 2607 1 1 17 GLY HA3 H 13.152 -3.161 12.810 1.00 . A A . 17 GLY HA3 1 1 8 2608 1 1 17 GLY N N 11.459 -2.937 13.980 1.00 . A A . 17 GLY N 1 1 8 2609 1 1 17 GLY O O 12.611 -1.287 11.260 1.00 . A A . 17 GLY O 1 1 8 2610 1 1 18 GLU C C 10.594 0.706 11.093 1.00 . A A . 18 GLU C 1 1 8 2611 1 1 18 GLU CA C 11.514 1.054 12.259 1.00 . A A . 18 GLU CA 1 1 8 2612 1 1 18 GLU CB C 12.790 1.718 11.737 1.00 . A A . 18 GLU CB 1 1 8 2613 1 1 18 GLU CD C 12.934 4.026 10.721 1.00 . A A . 18 GLU CD 1 1 8 2614 1 1 18 GLU CG C 12.849 3.213 11.998 1.00 . A A . 18 GLU CG 1 1 8 2615 1 1 18 GLU H H 11.672 -0.140 14.000 1.00 . A A . 18 GLU H 1 1 8 2616 1 1 18 GLU HA H 11.002 1.744 12.912 1.00 . A A . 18 GLU HA 1 1 8 2617 1 1 18 GLU HB2 H 13.643 1.256 12.213 1.00 . A A . 18 GLU HB2 1 1 8 2618 1 1 18 GLU HB3 H 12.854 1.557 10.671 1.00 . A A . 18 GLU HB3 1 1 8 2619 1 1 18 GLU HG2 H 11.959 3.508 12.535 1.00 . A A . 18 GLU HG2 1 1 8 2620 1 1 18 GLU HG3 H 13.719 3.426 12.602 1.00 . A A . 18 GLU HG3 1 1 8 2621 1 1 18 GLU N N 11.843 -0.136 13.035 1.00 . A A . 18 GLU N 1 1 8 2622 1 1 18 GLU O O 9.499 1.252 10.969 1.00 . A A . 18 GLU O 1 1 8 2623 1 1 18 GLU OE1 O 12.107 3.793 9.814 1.00 . A A . 18 GLU OE1 1 1 8 2624 1 1 18 GLU OE2 O 13.827 4.894 10.627 1.00 . A A . 18 GLU OE2 1 1 9 2625 1 1 1 HIS C C 1.657 -5.548 -3.642 1.00 . A A . 1 HIS C 1 1 9 2626 1 1 1 HIS CA C 1.343 -5.687 -5.128 1.00 . A A . 1 HIS CA 1 1 9 2627 1 1 1 HIS CB C 1.128 -7.160 -5.480 1.00 . A A . 1 HIS CB 1 1 9 2628 1 1 1 HIS CD2 C -0.406 -7.183 -7.571 1.00 . A A . 1 HIS CD2 1 1 9 2629 1 1 1 HIS CE1 C 1.040 -7.970 -9.020 1.00 . A A . 1 HIS CE1 1 1 9 2630 1 1 1 HIS CG C 0.760 -7.386 -6.914 1.00 . A A . 1 HIS CG 1 1 9 2631 1 1 1 HIS H1 H 2.309 -4.226 -6.317 1.00 . A A . 1 HIS H1 1 1 9 2632 1 1 1 HIS HA H 0.440 -5.139 -5.346 1.00 . A A . 1 HIS HA 1 1 9 2633 1 1 1 HIS HB2 H 2.038 -7.707 -5.281 1.00 . A A . 1 HIS HB2 1 1 9 2634 1 1 1 HIS HB3 H 0.333 -7.557 -4.866 1.00 . A A . 1 HIS HB3 1 1 9 2635 1 1 1 HIS HD1 H 2.578 -8.126 -7.680 1.00 . A A . 1 HIS HD1 1 1 9 2636 1 1 1 HIS HD2 H -1.323 -6.800 -7.147 1.00 . A A . 1 HIS HD2 1 1 9 2637 1 1 1 HIS HE1 H 1.487 -8.325 -9.937 1.00 . A A . 1 HIS HE1 1 1 9 2638 1 1 1 HIS N N 2.416 -5.124 -5.941 1.00 . A A . 1 HIS N 1 1 9 2639 1 1 1 HIS ND1 N 1.645 -7.880 -7.849 1.00 . A A . 1 HIS ND1 1 1 9 2640 1 1 1 HIS NE2 N -0.206 -7.554 -8.878 1.00 . A A . 1 HIS NE2 1 1 9 2641 1 1 1 HIS O O 2.126 -6.491 -3.004 1.00 . A A . 1 HIS O 1 1 9 2642 1 1 2 VAL C C 1.208 -2.694 -1.299 1.00 . A A . 2 VAL C 1 1 9 2643 1 1 2 VAL CA C 1.650 -4.101 -1.684 1.00 . A A . 2 VAL CA 1 1 9 2644 1 1 2 VAL CB C 3.142 -4.271 -1.341 1.00 . A A . 2 VAL CB 1 1 9 2645 1 1 2 VAL CG1 C 3.999 -3.391 -2.237 1.00 . A A . 2 VAL CG1 1 1 9 2646 1 1 2 VAL CG2 C 3.390 -3.956 0.126 1.00 . A A . 2 VAL CG2 1 1 9 2647 1 1 2 VAL H H 1.022 -3.652 -3.655 1.00 . A A . 2 VAL H 1 1 9 2648 1 1 2 VAL HA H 1.085 -4.816 -1.104 1.00 . A A . 2 VAL HA 1 1 9 2649 1 1 2 VAL HB H 3.416 -5.301 -1.518 1.00 . A A . 2 VAL HB 1 1 9 2650 1 1 2 VAL HG11 H 4.539 -2.678 -1.630 1.00 . A A . 2 VAL HG11 1 1 9 2651 1 1 2 VAL HG12 H 4.700 -4.005 -2.782 1.00 . A A . 2 VAL HG12 1 1 9 2652 1 1 2 VAL HG13 H 3.366 -2.861 -2.933 1.00 . A A . 2 VAL HG13 1 1 9 2653 1 1 2 VAL HG21 H 3.633 -2.910 0.234 1.00 . A A . 2 VAL HG21 1 1 9 2654 1 1 2 VAL HG22 H 2.502 -4.181 0.697 1.00 . A A . 2 VAL HG22 1 1 9 2655 1 1 2 VAL HG23 H 4.212 -4.555 0.490 1.00 . A A . 2 VAL HG23 1 1 9 2656 1 1 2 VAL N N 1.396 -4.364 -3.095 1.00 . A A . 2 VAL N 1 1 9 2657 1 1 2 VAL O O 1.669 -1.708 -1.875 1.00 . A A . 2 VAL O 1 1 9 2658 1 1 3 PHE C C -0.197 -1.253 1.666 1.00 . A A . 3 PHE C 1 1 9 2659 1 1 3 PHE CA C -0.191 -1.319 0.141 1.00 . A A . 3 PHE CA 1 1 9 2660 1 1 3 PHE CB C -1.603 -1.078 -0.396 1.00 . A A . 3 PHE CB 1 1 9 2661 1 1 3 PHE CD1 C -2.019 -1.937 -2.717 1.00 . A A . 3 PHE CD1 1 1 9 2662 1 1 3 PHE CD2 C -1.336 0.333 -2.454 1.00 . A A . 3 PHE CD2 1 1 9 2663 1 1 3 PHE CE1 C -2.067 -1.767 -4.088 1.00 . A A . 3 PHE CE1 1 1 9 2664 1 1 3 PHE CE2 C -1.383 0.508 -3.824 1.00 . A A . 3 PHE CE2 1 1 9 2665 1 1 3 PHE CG C -1.654 -0.890 -1.886 1.00 . A A . 3 PHE CG 1 1 9 2666 1 1 3 PHE CZ C -1.747 -0.543 -4.642 1.00 . A A . 3 PHE CZ 1 1 9 2667 1 1 3 PHE H H -0.016 -3.429 0.100 1.00 . A A . 3 PHE H 1 1 9 2668 1 1 3 PHE HA H 0.465 -0.551 -0.238 1.00 . A A . 3 PHE HA 1 1 9 2669 1 1 3 PHE HB2 H -2.225 -1.925 -0.148 1.00 . A A . 3 PHE HB2 1 1 9 2670 1 1 3 PHE HB3 H -2.010 -0.191 0.065 1.00 . A A . 3 PHE HB3 1 1 9 2671 1 1 3 PHE HD1 H -2.269 -2.895 -2.284 1.00 . A A . 3 PHE HD1 1 1 9 2672 1 1 3 PHE HD2 H -1.050 1.156 -1.816 1.00 . A A . 3 PHE HD2 1 1 9 2673 1 1 3 PHE HE1 H -2.352 -2.592 -4.724 1.00 . A A . 3 PHE HE1 1 1 9 2674 1 1 3 PHE HE2 H -1.132 1.466 -4.255 1.00 . A A . 3 PHE HE2 1 1 9 2675 1 1 3 PHE HZ H -1.784 -0.408 -5.713 1.00 . A A . 3 PHE HZ 1 1 9 2676 1 1 3 PHE N N 0.313 -2.607 -0.321 1.00 . A A . 3 PHE N 1 1 9 2677 1 1 3 PHE O O -1.225 -0.971 2.282 1.00 . A A . 3 PHE O 1 1 9 2678 1 1 4 ARG C C 0.031 -2.372 4.376 1.00 . A A . 4 ARG C 1 1 9 2679 1 1 4 ARG CA C 1.087 -1.487 3.720 1.00 . A A . 4 ARG CA 1 1 9 2680 1 1 4 ARG CB C 0.958 -0.053 4.237 1.00 . A A . 4 ARG CB 1 1 9 2681 1 1 4 ARG CD C 2.269 1.415 2.674 1.00 . A A . 4 ARG CD 1 1 9 2682 1 1 4 ARG CG C 2.219 0.776 4.053 1.00 . A A . 4 ARG CG 1 1 9 2683 1 1 4 ARG CZ C 3.460 3.529 3.071 1.00 . A A . 4 ARG CZ 1 1 9 2684 1 1 4 ARG H H 1.743 -1.733 1.723 1.00 . A A . 4 ARG H 1 1 9 2685 1 1 4 ARG HA H 2.066 -1.865 3.974 1.00 . A A . 4 ARG HA 1 1 9 2686 1 1 4 ARG HB2 H 0.152 0.437 3.711 1.00 . A A . 4 ARG HB2 1 1 9 2687 1 1 4 ARG HB3 H 0.724 -0.083 5.290 1.00 . A A . 4 ARG HB3 1 1 9 2688 1 1 4 ARG HD2 H 3.135 1.041 2.149 1.00 . A A . 4 ARG HD2 1 1 9 2689 1 1 4 ARG HD3 H 1.375 1.142 2.133 1.00 . A A . 4 ARG HD3 1 1 9 2690 1 1 4 ARG HE H 1.541 3.383 2.547 1.00 . A A . 4 ARG HE 1 1 9 2691 1 1 4 ARG HG2 H 2.238 1.557 4.799 1.00 . A A . 4 ARG HG2 1 1 9 2692 1 1 4 ARG HG3 H 3.080 0.137 4.175 1.00 . A A . 4 ARG HG3 1 1 9 2693 1 1 4 ARG HH11 H 4.578 1.864 3.312 1.00 . A A . 4 ARG HH11 1 1 9 2694 1 1 4 ARG HH12 H 5.407 3.360 3.589 1.00 . A A . 4 ARG HH12 1 1 9 2695 1 1 4 ARG HH21 H 4.292 5.348 3.360 1.00 . A A . 4 ARG HH21 1 1 9 2696 1 1 4 ARG HH22 H 2.620 5.360 2.908 1.00 . A A . 4 ARG HH22 1 1 9 2697 1 1 4 ARG N N 0.958 -1.515 2.268 1.00 . A A . 4 ARG N 1 1 9 2698 1 1 4 ARG NE N 2.352 2.871 2.748 1.00 . A A . 4 ARG NE 1 1 9 2699 1 1 4 ARG NH1 N 4.573 2.863 3.347 1.00 . A A . 4 ARG NH1 1 1 9 2700 1 1 4 ARG NH2 N 3.457 4.855 3.117 1.00 . A A . 4 ARG NH2 1 1 9 2701 1 1 4 ARG O O -0.532 -2.020 5.414 1.00 . A A . 4 ARG O 1 1 9 2702 1 1 5 LEU C C -2.625 -3.870 4.206 1.00 . A A . 5 LEU C 1 1 9 2703 1 1 5 LEU CA C -1.220 -4.458 4.289 1.00 . A A . 5 LEU CA 1 1 9 2704 1 1 5 LEU CB C -0.891 -4.819 5.739 1.00 . A A . 5 LEU CB 1 1 9 2705 1 1 5 LEU CD1 C 0.322 -6.335 7.324 1.00 . A A . 5 LEU CD1 1 1 9 2706 1 1 5 LEU CD2 C -1.517 -7.242 5.892 1.00 . A A . 5 LEU CD2 1 1 9 2707 1 1 5 LEU CG C -0.376 -6.239 5.976 1.00 . A A . 5 LEU CG 1 1 9 2708 1 1 5 LEU H H 0.249 -3.747 2.942 1.00 . A A . 5 LEU H 1 1 9 2709 1 1 5 LEU HA H -1.182 -5.353 3.686 1.00 . A A . 5 LEU HA 1 1 9 2710 1 1 5 LEU HB2 H -0.136 -4.131 6.088 1.00 . A A . 5 LEU HB2 1 1 9 2711 1 1 5 LEU HB3 H -1.791 -4.691 6.323 1.00 . A A . 5 LEU HB3 1 1 9 2712 1 1 5 LEU HD11 H 0.220 -5.398 7.850 1.00 . A A . 5 LEU HD11 1 1 9 2713 1 1 5 LEU HD12 H 1.370 -6.550 7.172 1.00 . A A . 5 LEU HD12 1 1 9 2714 1 1 5 LEU HD13 H -0.127 -7.127 7.906 1.00 . A A . 5 LEU HD13 1 1 9 2715 1 1 5 LEU HD21 H -1.787 -7.394 4.857 1.00 . A A . 5 LEU HD21 1 1 9 2716 1 1 5 LEU HD22 H -2.370 -6.862 6.434 1.00 . A A . 5 LEU HD22 1 1 9 2717 1 1 5 LEU HD23 H -1.204 -8.181 6.325 1.00 . A A . 5 LEU HD23 1 1 9 2718 1 1 5 LEU HG H 0.345 -6.486 5.209 1.00 . A A . 5 LEU HG 1 1 9 2719 1 1 5 LEU N N -0.232 -3.522 3.765 1.00 . A A . 5 LEU N 1 1 9 2720 1 1 5 LEU O O -3.398 -4.204 3.309 1.00 . A A . 5 LEU O 1 1 9 2721 1 1 6 LYS C C -4.153 -0.918 5.693 1.00 . A A . 6 LYS C 1 1 9 2722 1 1 6 LYS CA C -4.259 -2.351 5.181 1.00 . A A . 6 LYS CA 1 1 9 2723 1 1 6 LYS CB C -5.217 -3.151 6.066 1.00 . A A . 6 LYS CB 1 1 9 2724 1 1 6 LYS CD C -3.662 -3.541 8.000 1.00 . A A . 6 LYS CD 1 1 9 2725 1 1 6 LYS CE C -3.699 -3.945 9.466 1.00 . A A . 6 LYS CE 1 1 9 2726 1 1 6 LYS CG C -4.987 -2.945 7.553 1.00 . A A . 6 LYS CG 1 1 9 2727 1 1 6 LYS H H -2.290 -2.763 5.837 1.00 . A A . 6 LYS H 1 1 9 2728 1 1 6 LYS HA H -4.645 -2.333 4.172 1.00 . A A . 6 LYS HA 1 1 9 2729 1 1 6 LYS HB2 H -6.231 -2.857 5.836 1.00 . A A . 6 LYS HB2 1 1 9 2730 1 1 6 LYS HB3 H -5.098 -4.202 5.847 1.00 . A A . 6 LYS HB3 1 1 9 2731 1 1 6 LYS HD2 H -3.451 -4.415 7.402 1.00 . A A . 6 LYS HD2 1 1 9 2732 1 1 6 LYS HD3 H -2.881 -2.808 7.857 1.00 . A A . 6 LYS HD3 1 1 9 2733 1 1 6 LYS HE2 H -3.009 -3.323 10.015 1.00 . A A . 6 LYS HE2 1 1 9 2734 1 1 6 LYS HE3 H -4.700 -3.792 9.843 1.00 . A A . 6 LYS HE3 1 1 9 2735 1 1 6 LYS HG2 H -4.982 -1.885 7.764 1.00 . A A . 6 LYS HG2 1 1 9 2736 1 1 6 LYS HG3 H -5.788 -3.419 8.102 1.00 . A A . 6 LYS HG3 1 1 9 2737 1 1 6 LYS HZ1 H -2.693 -5.683 8.890 1.00 . A A . 6 LYS HZ1 1 1 9 2738 1 1 6 LYS HZ2 H -4.174 -5.970 9.655 1.00 . A A . 6 LYS HZ2 1 1 9 2739 1 1 6 LYS HZ3 H -2.831 -5.494 10.565 1.00 . A A . 6 LYS HZ3 1 1 9 2740 1 1 6 LYS N N -2.949 -2.990 5.148 1.00 . A A . 6 LYS N 1 1 9 2741 1 1 6 LYS NZ N -3.323 -5.373 9.657 1.00 . A A . 6 LYS NZ 1 1 9 2742 1 1 6 LYS O O -5.158 -0.294 6.034 1.00 . A A . 6 LYS O 1 1 9 2743 1 1 7 LYS C C -3.010 1.087 7.696 1.00 . A A . 7 LYS C 1 1 9 2744 1 1 7 LYS CA C -2.693 0.959 6.210 1.00 . A A . 7 LYS CA 1 1 9 2745 1 1 7 LYS CB C -3.540 1.951 5.409 1.00 . A A . 7 LYS CB 1 1 9 2746 1 1 7 LYS CD C -3.594 2.975 3.116 1.00 . A A . 7 LYS CD 1 1 9 2747 1 1 7 LYS CE C -2.234 3.331 2.536 1.00 . A A . 7 LYS CE 1 1 9 2748 1 1 7 LYS CG C -3.539 1.683 3.914 1.00 . A A . 7 LYS CG 1 1 9 2749 1 1 7 LYS H H -2.169 -0.948 5.456 1.00 . A A . 7 LYS H 1 1 9 2750 1 1 7 LYS HA H -1.648 1.185 6.056 1.00 . A A . 7 LYS HA 1 1 9 2751 1 1 7 LYS HB2 H -4.559 1.902 5.762 1.00 . A A . 7 LYS HB2 1 1 9 2752 1 1 7 LYS HB3 H -3.158 2.948 5.575 1.00 . A A . 7 LYS HB3 1 1 9 2753 1 1 7 LYS HD2 H -4.299 2.858 2.306 1.00 . A A . 7 LYS HD2 1 1 9 2754 1 1 7 LYS HD3 H -3.920 3.776 3.766 1.00 . A A . 7 LYS HD3 1 1 9 2755 1 1 7 LYS HE2 H -1.646 2.430 2.454 1.00 . A A . 7 LYS HE2 1 1 9 2756 1 1 7 LYS HE3 H -2.377 3.759 1.555 1.00 . A A . 7 LYS HE3 1 1 9 2757 1 1 7 LYS HG2 H -2.637 1.150 3.653 1.00 . A A . 7 LYS HG2 1 1 9 2758 1 1 7 LYS HG3 H -4.400 1.080 3.665 1.00 . A A . 7 LYS HG3 1 1 9 2759 1 1 7 LYS HZ1 H -1.491 3.981 4.377 1.00 . A A . 7 LYS HZ1 1 1 9 2760 1 1 7 LYS HZ2 H -1.975 5.237 3.351 1.00 . A A . 7 LYS HZ2 1 1 9 2761 1 1 7 LYS HZ3 H -0.526 4.416 3.057 1.00 . A A . 7 LYS HZ3 1 1 9 2762 1 1 7 LYS N N -2.930 -0.401 5.742 1.00 . A A . 7 LYS N 1 1 9 2763 1 1 7 LYS NZ N -1.505 4.309 3.390 1.00 . A A . 7 LYS NZ 1 1 9 2764 1 1 7 LYS O O -3.063 2.192 8.236 1.00 . A A . 7 LYS O 1 1 9 2765 1 1 8 TRP C C -2.502 -0.880 10.550 1.00 . A A . 8 TRP C 1 1 9 2766 1 1 8 TRP CA C -3.531 -0.063 9.776 1.00 . A A . 8 TRP CA 1 1 9 2767 1 1 8 TRP CB C -4.931 -0.633 10.008 1.00 . A A . 8 TRP CB 1 1 9 2768 1 1 8 TRP CD1 C -6.000 1.329 8.752 1.00 . A A . 8 TRP CD1 1 1 9 2769 1 1 8 TRP CD2 C -7.186 -0.569 8.675 1.00 . A A . 8 TRP CD2 1 1 9 2770 1 1 8 TRP CE2 C -7.878 0.423 7.953 1.00 . A A . 8 TRP CE2 1 1 9 2771 1 1 8 TRP CE3 C -7.741 -1.849 8.763 1.00 . A A . 8 TRP CE3 1 1 9 2772 1 1 8 TRP CG C -5.988 0.031 9.178 1.00 . A A . 8 TRP CG 1 1 9 2773 1 1 8 TRP CH2 C -9.616 -1.089 7.427 1.00 . A A . 8 TRP CH2 1 1 9 2774 1 1 8 TRP CZ2 C -9.095 0.173 7.325 1.00 . A A . 8 TRP CZ2 1 1 9 2775 1 1 8 TRP CZ3 C -8.950 -2.095 8.139 1.00 . A A . 8 TRP CZ3 1 1 9 2776 1 1 8 TRP H H -3.164 -0.899 7.865 1.00 . A A . 8 TRP H 1 1 9 2777 1 1 8 TRP HA H -3.504 0.957 10.130 1.00 . A A . 8 TRP HA 1 1 9 2778 1 1 8 TRP HB2 H -4.930 -1.685 9.765 1.00 . A A . 8 TRP HB2 1 1 9 2779 1 1 8 TRP HB3 H -5.195 -0.507 11.048 1.00 . A A . 8 TRP HB3 1 1 9 2780 1 1 8 TRP HD1 H -5.226 2.048 8.972 1.00 . A A . 8 TRP HD1 1 1 9 2781 1 1 8 TRP HE1 H -7.371 2.428 7.601 1.00 . A A . 8 TRP HE1 1 1 9 2782 1 1 8 TRP HE3 H -7.243 -2.637 9.307 1.00 . A A . 8 TRP HE3 1 1 9 2783 1 1 8 TRP HH2 H -10.557 -1.325 6.956 1.00 . A A . 8 TRP HH2 1 1 9 2784 1 1 8 TRP HZ2 H -9.621 0.938 6.771 1.00 . A A . 8 TRP HZ2 1 1 9 2785 1 1 8 TRP HZ3 H -9.394 -3.078 8.197 1.00 . A A . 8 TRP HZ3 1 1 9 2786 1 1 8 TRP N N -3.220 -0.049 8.351 1.00 . A A . 8 TRP N 1 1 9 2787 1 1 8 TRP NE1 N -7.135 1.571 8.016 1.00 . A A . 8 TRP NE1 1 1 9 2788 1 1 8 TRP O O -2.808 -1.447 11.599 1.00 . A A . 8 TRP O 1 1 9 2789 1 1 9 ILE C C 0.968 -0.771 11.009 1.00 . A A . 9 ILE C 1 1 9 2790 1 1 9 ILE CA C -0.208 -1.681 10.670 1.00 . A A . 9 ILE CA 1 1 9 2791 1 1 9 ILE CB C 0.290 -2.833 9.778 1.00 . A A . 9 ILE CB 1 1 9 2792 1 1 9 ILE CD1 C 1.058 -1.207 7.977 1.00 . A A . 9 ILE CD1 1 1 9 2793 1 1 9 ILE CG1 C 0.228 -2.429 8.303 1.00 . A A . 9 ILE CG1 1 1 9 2794 1 1 9 ILE CG2 C -0.535 -4.088 10.023 1.00 . A A . 9 ILE CG2 1 1 9 2795 1 1 9 ILE H H -1.099 -0.461 9.188 1.00 . A A . 9 ILE H 1 1 9 2796 1 1 9 ILE HA H -0.598 -2.103 11.585 1.00 . A A . 9 ILE HA 1 1 9 2797 1 1 9 ILE HB H 1.314 -3.047 10.043 1.00 . A A . 9 ILE HB 1 1 9 2798 1 1 9 ILE HD11 H 1.853 -1.108 8.702 1.00 . A A . 9 ILE HD11 1 1 9 2799 1 1 9 ILE HD12 H 1.484 -1.313 6.990 1.00 . A A . 9 ILE HD12 1 1 9 2800 1 1 9 ILE HD13 H 0.432 -0.327 8.008 1.00 . A A . 9 ILE HD13 1 1 9 2801 1 1 9 ILE HG12 H 0.589 -3.245 7.697 1.00 . A A . 9 ILE HG12 1 1 9 2802 1 1 9 ILE HG13 H -0.797 -2.215 8.039 1.00 . A A . 9 ILE HG13 1 1 9 2803 1 1 9 ILE HG21 H 0.116 -4.891 10.335 1.00 . A A . 9 ILE HG21 1 1 9 2804 1 1 9 ILE HG22 H -1.262 -3.894 10.797 1.00 . A A . 9 ILE HG22 1 1 9 2805 1 1 9 ILE HG23 H -1.043 -4.369 9.113 1.00 . A A . 9 ILE HG23 1 1 9 2806 1 1 9 ILE N N -1.282 -0.934 10.027 1.00 . A A . 9 ILE N 1 1 9 2807 1 1 9 ILE O O 2.104 -1.228 11.127 1.00 . A A . 9 ILE O 1 1 9 2808 1 1 10 GLN C C 2.468 1.087 12.759 1.00 . A A . 10 GLN C 1 1 9 2809 1 1 10 GLN CA C 1.720 1.492 11.494 1.00 . A A . 10 GLN CA 1 1 9 2810 1 1 10 GLN CB C 1.104 2.881 11.673 1.00 . A A . 10 GLN CB 1 1 9 2811 1 1 10 GLN CD C 1.174 5.318 11.009 1.00 . A A . 10 GLN CD 1 1 9 2812 1 1 10 GLN CG C 1.611 3.906 10.672 1.00 . A A . 10 GLN CG 1 1 9 2813 1 1 10 GLN H H -0.240 0.821 11.060 1.00 . A A . 10 GLN H 1 1 9 2814 1 1 10 GLN HA H 2.418 1.522 10.671 1.00 . A A . 10 GLN HA 1 1 9 2815 1 1 10 GLN HB2 H 0.032 2.803 11.565 1.00 . A A . 10 GLN HB2 1 1 9 2816 1 1 10 GLN HB3 H 1.332 3.237 12.667 1.00 . A A . 10 GLN HB3 1 1 9 2817 1 1 10 GLN HE21 H -0.364 6.567 10.847 1.00 . A A . 10 GLN HE21 1 1 9 2818 1 1 10 GLN HE22 H -0.603 4.992 10.179 1.00 . A A . 10 GLN HE22 1 1 9 2819 1 1 10 GLN HG2 H 2.690 3.874 10.659 1.00 . A A . 10 GLN HG2 1 1 9 2820 1 1 10 GLN HG3 H 1.232 3.651 9.693 1.00 . A A . 10 GLN HG3 1 1 9 2821 1 1 10 GLN N N 0.685 0.518 11.167 1.00 . A A . 10 GLN N 1 1 9 2822 1 1 10 GLN NE2 N -0.055 5.661 10.641 1.00 . A A . 10 GLN NE2 1 1 9 2823 1 1 10 GLN O O 3.565 1.578 13.029 1.00 . A A . 10 GLN O 1 1 9 2824 1 1 10 GLN OE1 O 1.932 6.091 11.595 1.00 . A A . 10 GLN OE1 1 1 9 2825 1 1 11 LYS C C 3.655 -1.208 14.479 1.00 . A A . 11 LYS C 1 1 9 2826 1 1 11 LYS CA C 2.477 -0.283 14.771 1.00 . A A . 11 LYS CA 1 1 9 2827 1 1 11 LYS CB C 1.441 -1.015 15.627 1.00 . A A . 11 LYS CB 1 1 9 2828 1 1 11 LYS CD C 1.335 -3.499 15.269 1.00 . A A . 11 LYS CD 1 1 9 2829 1 1 11 LYS CE C 0.814 -3.987 16.612 1.00 . A A . 11 LYS CE 1 1 9 2830 1 1 11 LYS CG C 0.742 -2.149 14.899 1.00 . A A . 11 LYS CG 1 1 9 2831 1 1 11 LYS H H 0.994 -0.165 13.265 1.00 . A A . 11 LYS H 1 1 9 2832 1 1 11 LYS HA H 2.837 0.578 15.314 1.00 . A A . 11 LYS HA 1 1 9 2833 1 1 11 LYS HB2 H 1.934 -1.422 16.497 1.00 . A A . 11 LYS HB2 1 1 9 2834 1 1 11 LYS HB3 H 0.692 -0.305 15.948 1.00 . A A . 11 LYS HB3 1 1 9 2835 1 1 11 LYS HD2 H 1.070 -4.219 14.510 1.00 . A A . 11 LYS HD2 1 1 9 2836 1 1 11 LYS HD3 H 2.411 -3.407 15.321 1.00 . A A . 11 LYS HD3 1 1 9 2837 1 1 11 LYS HE2 H -0.019 -3.367 16.907 1.00 . A A . 11 LYS HE2 1 1 9 2838 1 1 11 LYS HE3 H 0.482 -5.009 16.504 1.00 . A A . 11 LYS HE3 1 1 9 2839 1 1 11 LYS HG2 H -0.305 -2.144 15.163 1.00 . A A . 11 LYS HG2 1 1 9 2840 1 1 11 LYS HG3 H 0.847 -2.000 13.833 1.00 . A A . 11 LYS HG3 1 1 9 2841 1 1 11 LYS HZ1 H 1.643 -3.167 18.346 1.00 . A A . 11 LYS HZ1 1 1 9 2842 1 1 11 LYS HZ2 H 2.790 -3.737 17.240 1.00 . A A . 11 LYS HZ2 1 1 9 2843 1 1 11 LYS HZ3 H 1.907 -4.830 18.180 1.00 . A A . 11 LYS HZ3 1 1 9 2844 1 1 11 LYS N N 1.868 0.189 13.534 1.00 . A A . 11 LYS N 1 1 9 2845 1 1 11 LYS NZ N 1.862 -3.926 17.668 1.00 . A A . 11 LYS NZ 1 1 9 2846 1 1 11 LYS O O 4.713 -1.097 15.100 1.00 . A A . 11 LYS O 1 1 9 2847 1 1 12 VAL C C 5.687 -2.344 12.499 1.00 . A A . 12 VAL C 1 1 9 2848 1 1 12 VAL CA C 4.512 -3.061 13.154 1.00 . A A . 12 VAL CA 1 1 9 2849 1 1 12 VAL CB C 3.980 -4.138 12.190 1.00 . A A . 12 VAL CB 1 1 9 2850 1 1 12 VAL CG1 C 5.121 -4.991 11.658 1.00 . A A . 12 VAL CG1 1 1 9 2851 1 1 12 VAL CG2 C 2.935 -5.001 12.881 1.00 . A A . 12 VAL CG2 1 1 9 2852 1 1 12 VAL H H 2.600 -2.158 13.071 1.00 . A A . 12 VAL H 1 1 9 2853 1 1 12 VAL HA H 4.858 -3.552 14.053 1.00 . A A . 12 VAL HA 1 1 9 2854 1 1 12 VAL HB H 3.510 -3.642 11.353 1.00 . A A . 12 VAL HB 1 1 9 2855 1 1 12 VAL HG11 H 5.673 -5.410 12.487 1.00 . A A . 12 VAL HG11 1 1 9 2856 1 1 12 VAL HG12 H 4.721 -5.788 11.050 1.00 . A A . 12 VAL HG12 1 1 9 2857 1 1 12 VAL HG13 H 5.781 -4.378 11.062 1.00 . A A . 12 VAL HG13 1 1 9 2858 1 1 12 VAL HG21 H 1.953 -4.584 12.711 1.00 . A A . 12 VAL HG21 1 1 9 2859 1 1 12 VAL HG22 H 2.975 -6.003 12.481 1.00 . A A . 12 VAL HG22 1 1 9 2860 1 1 12 VAL HG23 H 3.135 -5.029 13.942 1.00 . A A . 12 VAL HG23 1 1 9 2861 1 1 12 VAL N N 3.465 -2.119 13.530 1.00 . A A . 12 VAL N 1 1 9 2862 1 1 12 VAL O O 6.841 -2.548 12.877 1.00 . A A . 12 VAL O 1 1 9 2863 1 1 13 ILE C C 7.098 0.250 11.731 1.00 . A A . 13 ILE C 1 1 9 2864 1 1 13 ILE CA C 6.417 -0.755 10.808 1.00 . A A . 13 ILE CA 1 1 9 2865 1 1 13 ILE CB C 5.837 -0.007 9.593 1.00 . A A . 13 ILE CB 1 1 9 2866 1 1 13 ILE CD1 C 6.831 0.308 7.271 1.00 . A A . 13 ILE CD1 1 1 9 2867 1 1 13 ILE CG1 C 6.964 0.593 8.750 1.00 . A A . 13 ILE CG1 1 1 9 2868 1 1 13 ILE CG2 C 4.873 1.078 10.049 1.00 . A A . 13 ILE CG2 1 1 9 2869 1 1 13 ILE H H 4.448 -1.384 11.259 1.00 . A A . 13 ILE H 1 1 9 2870 1 1 13 ILE HA H 7.156 -1.459 10.453 1.00 . A A . 13 ILE HA 1 1 9 2871 1 1 13 ILE HB H 5.286 -0.715 8.992 1.00 . A A . 13 ILE HB 1 1 9 2872 1 1 13 ILE HD11 H 6.235 1.081 6.807 1.00 . A A . 13 ILE HD11 1 1 9 2873 1 1 13 ILE HD12 H 7.811 0.289 6.817 1.00 . A A . 13 ILE HD12 1 1 9 2874 1 1 13 ILE HD13 H 6.350 -0.648 7.130 1.00 . A A . 13 ILE HD13 1 1 9 2875 1 1 13 ILE HG12 H 6.972 1.664 8.881 1.00 . A A . 13 ILE HG12 1 1 9 2876 1 1 13 ILE HG13 H 7.908 0.187 9.083 1.00 . A A . 13 ILE HG13 1 1 9 2877 1 1 13 ILE HG21 H 5.429 1.968 10.304 1.00 . A A . 13 ILE HG21 1 1 9 2878 1 1 13 ILE HG22 H 4.182 1.303 9.251 1.00 . A A . 13 ILE HG22 1 1 9 2879 1 1 13 ILE HG23 H 4.327 0.734 10.914 1.00 . A A . 13 ILE HG23 1 1 9 2880 1 1 13 ILE N N 5.386 -1.504 11.515 1.00 . A A . 13 ILE N 1 1 9 2881 1 1 13 ILE O O 8.285 0.541 11.582 1.00 . A A . 13 ILE O 1 1 9 2882 1 1 14 ASP C C 8.150 1.230 14.283 1.00 . A A . 14 ASP C 1 1 9 2883 1 1 14 ASP CA C 6.868 1.746 13.637 1.00 . A A . 14 ASP CA 1 1 9 2884 1 1 14 ASP CB C 5.828 2.057 14.714 1.00 . A A . 14 ASP CB 1 1 9 2885 1 1 14 ASP CG C 5.130 3.383 14.480 1.00 . A A . 14 ASP CG 1 1 9 2886 1 1 14 ASP H H 5.399 0.504 12.754 1.00 . A A . 14 ASP H 1 1 9 2887 1 1 14 ASP HA H 7.093 2.653 13.095 1.00 . A A . 14 ASP HA 1 1 9 2888 1 1 14 ASP HB2 H 5.082 1.276 14.722 1.00 . A A . 14 ASP HB2 1 1 9 2889 1 1 14 ASP HB3 H 6.316 2.093 15.677 1.00 . A A . 14 ASP HB3 1 1 9 2890 1 1 14 ASP N N 6.338 0.776 12.686 1.00 . A A . 14 ASP N 1 1 9 2891 1 1 14 ASP O O 9.004 2.012 14.701 1.00 . A A . 14 ASP O 1 1 9 2892 1 1 14 ASP OD1 O 4.972 3.770 13.303 1.00 . A A . 14 ASP OD1 1 1 9 2893 1 1 14 ASP OD2 O 4.742 4.032 15.473 1.00 . A A . 14 ASP OD2 1 1 9 2894 1 1 15 GLN C C 10.301 -1.403 13.899 1.00 . A A . 15 GLN C 1 1 9 2895 1 1 15 GLN CA C 9.453 -0.711 14.960 1.00 . A A . 15 GLN CA 1 1 9 2896 1 1 15 GLN CB C 9.035 -1.718 16.033 1.00 . A A . 15 GLN CB 1 1 9 2897 1 1 15 GLN CD C 8.256 -2.061 18.412 1.00 . A A . 15 GLN CD 1 1 9 2898 1 1 15 GLN CG C 8.884 -1.106 17.416 1.00 . A A . 15 GLN CG 1 1 9 2899 1 1 15 GLN H H 7.561 -0.661 14.012 1.00 . A A . 15 GLN H 1 1 9 2900 1 1 15 GLN HA H 10.040 0.069 15.421 1.00 . A A . 15 GLN HA 1 1 9 2901 1 1 15 GLN HB2 H 8.089 -2.155 15.751 1.00 . A A . 15 GLN HB2 1 1 9 2902 1 1 15 GLN HB3 H 9.781 -2.497 16.088 1.00 . A A . 15 GLN HB3 1 1 9 2903 1 1 15 GLN HE21 H 8.634 -3.047 20.096 1.00 . A A . 15 GLN HE21 1 1 9 2904 1 1 15 GLN HE22 H 9.925 -2.070 19.493 1.00 . A A . 15 GLN HE22 1 1 9 2905 1 1 15 GLN HG2 H 9.861 -0.823 17.780 1.00 . A A . 15 GLN HG2 1 1 9 2906 1 1 15 GLN HG3 H 8.261 -0.227 17.341 1.00 . A A . 15 GLN HG3 1 1 9 2907 1 1 15 GLN N N 8.276 -0.091 14.363 1.00 . A A . 15 GLN N 1 1 9 2908 1 1 15 GLN NE2 N 9.015 -2.431 19.437 1.00 . A A . 15 GLN NE2 1 1 9 2909 1 1 15 GLN O O 11.470 -1.713 14.129 1.00 . A A . 15 GLN O 1 1 9 2910 1 1 15 GLN OE1 O 7.102 -2.463 18.261 1.00 . A A . 15 GLN OE1 1 1 9 2911 1 1 16 PHE C C 11.064 -3.593 12.111 1.00 . A A . 16 PHE C 1 1 9 2912 1 1 16 PHE CA C 10.406 -2.300 11.639 1.00 . A A . 16 PHE CA 1 1 9 2913 1 1 16 PHE CB C 11.463 -1.364 11.047 1.00 . A A . 16 PHE CB 1 1 9 2914 1 1 16 PHE CD1 C 11.832 -2.611 8.901 1.00 . A A . 16 PHE CD1 1 1 9 2915 1 1 16 PHE CD2 C 13.730 -2.077 10.242 1.00 . A A . 16 PHE CD2 1 1 9 2916 1 1 16 PHE CE1 C 12.654 -3.225 7.975 1.00 . A A . 16 PHE CE1 1 1 9 2917 1 1 16 PHE CE2 C 14.557 -2.689 9.319 1.00 . A A . 16 PHE CE2 1 1 9 2918 1 1 16 PHE CG C 12.359 -2.031 10.043 1.00 . A A . 16 PHE CG 1 1 9 2919 1 1 16 PHE CZ C 14.019 -3.265 8.185 1.00 . A A . 16 PHE CZ 1 1 9 2920 1 1 16 PHE H H 8.771 -1.372 12.612 1.00 . A A . 16 PHE H 1 1 9 2921 1 1 16 PHE HA H 9.680 -2.536 10.877 1.00 . A A . 16 PHE HA 1 1 9 2922 1 1 16 PHE HB2 H 10.968 -0.541 10.554 1.00 . A A . 16 PHE HB2 1 1 9 2923 1 1 16 PHE HB3 H 12.082 -0.982 11.845 1.00 . A A . 16 PHE HB3 1 1 9 2924 1 1 16 PHE HD1 H 10.764 -2.580 8.736 1.00 . A A . 16 PHE HD1 1 1 9 2925 1 1 16 PHE HD2 H 14.152 -1.629 11.129 1.00 . A A . 16 PHE HD2 1 1 9 2926 1 1 16 PHE HE1 H 12.230 -3.674 7.089 1.00 . A A . 16 PHE HE1 1 1 9 2927 1 1 16 PHE HE2 H 15.623 -2.719 9.486 1.00 . A A . 16 PHE HE2 1 1 9 2928 1 1 16 PHE HZ H 14.663 -3.743 7.463 1.00 . A A . 16 PHE HZ 1 1 9 2929 1 1 16 PHE N N 9.705 -1.643 12.736 1.00 . A A . 16 PHE N 1 1 9 2930 1 1 16 PHE O O 12.239 -3.608 12.475 1.00 . A A . 16 PHE O 1 1 9 2931 1 1 17 GLY C C 11.435 -6.748 11.391 1.00 . A A . 17 GLY C 1 1 9 2932 1 1 17 GLY CA C 10.819 -5.962 12.531 1.00 . A A . 17 GLY CA 1 1 9 2933 1 1 17 GLY H H 9.365 -4.607 11.801 1.00 . A A . 17 GLY H 1 1 9 2934 1 1 17 GLY HA2 H 11.571 -5.796 13.288 1.00 . A A . 17 GLY HA2 1 1 9 2935 1 1 17 GLY HA3 H 10.014 -6.541 12.959 1.00 . A A . 17 GLY HA3 1 1 9 2936 1 1 17 GLY N N 10.296 -4.679 12.102 1.00 . A A . 17 GLY N 1 1 9 2937 1 1 17 GLY O O 12.589 -6.526 11.028 1.00 . A A . 17 GLY O 1 1 9 2938 1 1 18 GLU C C 10.030 -8.739 8.704 1.00 . A A . 18 GLU C 1 1 9 2939 1 1 18 GLU CA C 11.141 -8.494 9.721 1.00 . A A . 18 GLU CA 1 1 9 2940 1 1 18 GLU CB C 11.671 -9.831 10.245 1.00 . A A . 18 GLU CB 1 1 9 2941 1 1 18 GLU CD C 11.221 -11.902 11.619 1.00 . A A . 18 GLU CD 1 1 9 2942 1 1 18 GLU CG C 10.701 -10.551 11.166 1.00 . A A . 18 GLU CG 1 1 9 2943 1 1 18 GLU H H 9.750 -7.801 11.159 1.00 . A A . 18 GLU H 1 1 9 2944 1 1 18 GLU HA H 11.946 -7.963 9.236 1.00 . A A . 18 GLU HA 1 1 9 2945 1 1 18 GLU HB2 H 11.883 -10.474 9.404 1.00 . A A . 18 GLU HB2 1 1 9 2946 1 1 18 GLU HB3 H 12.586 -9.652 10.789 1.00 . A A . 18 GLU HB3 1 1 9 2947 1 1 18 GLU HG2 H 10.529 -9.938 12.038 1.00 . A A . 18 GLU HG2 1 1 9 2948 1 1 18 GLU HG3 H 9.768 -10.699 10.642 1.00 . A A . 18 GLU HG3 1 1 9 2949 1 1 18 GLU N N 10.662 -7.671 10.825 1.00 . A A . 18 GLU N 1 1 9 2950 1 1 18 GLU O O 9.183 -7.875 8.475 1.00 . A A . 18 GLU O 1 1 9 2951 1 1 18 GLU OE1 O 12.437 -12.009 11.886 1.00 . A A . 18 GLU OE1 1 1 9 2952 1 1 18 GLU OE2 O 10.414 -12.850 11.707 1.00 . A A . 18 GLU OE2 1 1 10 2953 1 1 1 HIS C C -9.456 -2.647 -0.603 1.00 . A A . 1 HIS C 1 1 10 2954 1 1 1 HIS CA C -10.335 -3.163 -1.738 1.00 . A A . 1 HIS CA 1 1 10 2955 1 1 1 HIS CB C -11.000 -1.989 -2.458 1.00 . A A . 1 HIS CB 1 1 10 2956 1 1 1 HIS CD2 C -11.336 -2.031 -5.029 1.00 . A A . 1 HIS CD2 1 1 10 2957 1 1 1 HIS CE1 C -9.289 -1.524 -5.629 1.00 . A A . 1 HIS CE1 1 1 10 2958 1 1 1 HIS CG C -10.609 -1.871 -3.899 1.00 . A A . 1 HIS CG 1 1 10 2959 1 1 1 HIS H1 H -11.197 -5.051 -1.320 1.00 . A A . 1 HIS H1 1 1 10 2960 1 1 1 HIS HA H -9.715 -3.700 -2.440 1.00 . A A . 1 HIS HA 1 1 10 2961 1 1 1 HIS HB2 H -12.072 -2.110 -2.414 1.00 . A A . 1 HIS HB2 1 1 10 2962 1 1 1 HIS HB3 H -10.725 -1.069 -1.962 1.00 . A A . 1 HIS HB3 1 1 10 2963 1 1 1 HIS HD1 H -8.568 -1.379 -3.720 1.00 . A A . 1 HIS HD1 1 1 10 2964 1 1 1 HIS HD2 H -12.385 -2.285 -5.087 1.00 . A A . 1 HIS HD2 1 1 10 2965 1 1 1 HIS HE1 H -8.419 -1.303 -6.229 1.00 . A A . 1 HIS HE1 1 1 10 2966 1 1 1 HIS N N -11.345 -4.087 -1.235 1.00 . A A . 1 HIS N 1 1 10 2967 1 1 1 HIS ND1 N -9.331 -1.555 -4.309 1.00 . A A . 1 HIS ND1 1 1 10 2968 1 1 1 HIS NE2 N -10.493 -1.809 -6.090 1.00 . A A . 1 HIS NE2 1 1 10 2969 1 1 1 HIS O O -9.955 -2.244 0.448 1.00 . A A . 1 HIS O 1 1 10 2970 1 1 2 VAL C C -5.766 -2.265 -0.339 1.00 . A A . 2 VAL C 1 1 10 2971 1 1 2 VAL CA C -7.196 -2.197 0.183 1.00 . A A . 2 VAL CA 1 1 10 2972 1 1 2 VAL CB C -7.299 -3.024 1.478 1.00 . A A . 2 VAL CB 1 1 10 2973 1 1 2 VAL CG1 C -7.116 -4.505 1.183 1.00 . A A . 2 VAL CG1 1 1 10 2974 1 1 2 VAL CG2 C -6.276 -2.546 2.498 1.00 . A A . 2 VAL CG2 1 1 10 2975 1 1 2 VAL H H -7.807 -2.996 -1.679 1.00 . A A . 2 VAL H 1 1 10 2976 1 1 2 VAL HA H -7.436 -1.170 0.417 1.00 . A A . 2 VAL HA 1 1 10 2977 1 1 2 VAL HB H -8.285 -2.882 1.895 1.00 . A A . 2 VAL HB 1 1 10 2978 1 1 2 VAL HG11 H -6.220 -4.861 1.670 1.00 . A A . 2 VAL HG11 1 1 10 2979 1 1 2 VAL HG12 H -7.970 -5.054 1.550 1.00 . A A . 2 VAL HG12 1 1 10 2980 1 1 2 VAL HG13 H -7.026 -4.650 0.116 1.00 . A A . 2 VAL HG13 1 1 10 2981 1 1 2 VAL HG21 H -6.396 -3.101 3.416 1.00 . A A . 2 VAL HG21 1 1 10 2982 1 1 2 VAL HG22 H -5.281 -2.701 2.109 1.00 . A A . 2 VAL HG22 1 1 10 2983 1 1 2 VAL HG23 H -6.426 -1.493 2.692 1.00 . A A . 2 VAL HG23 1 1 10 2984 1 1 2 VAL N N -8.145 -2.664 -0.821 1.00 . A A . 2 VAL N 1 1 10 2985 1 1 2 VAL O O -5.287 -3.329 -0.732 1.00 . A A . 2 VAL O 1 1 10 2986 1 1 3 PHE C C -3.105 0.319 -0.525 1.00 . A A . 3 PHE C 1 1 10 2987 1 1 3 PHE CA C -3.709 -1.052 -0.813 1.00 . A A . 3 PHE CA 1 1 10 2988 1 1 3 PHE CB C -3.649 -1.343 -2.314 1.00 . A A . 3 PHE CB 1 1 10 2989 1 1 3 PHE CD1 C -1.343 -1.248 -3.299 1.00 . A A . 3 PHE CD1 1 1 10 2990 1 1 3 PHE CD2 C -2.189 -3.364 -2.600 1.00 . A A . 3 PHE CD2 1 1 10 2991 1 1 3 PHE CE1 C -0.163 -1.847 -3.697 1.00 . A A . 3 PHE CE1 1 1 10 2992 1 1 3 PHE CE2 C -1.011 -3.969 -2.996 1.00 . A A . 3 PHE CE2 1 1 10 2993 1 1 3 PHE CG C -2.368 -1.998 -2.746 1.00 . A A . 3 PHE CG 1 1 10 2994 1 1 3 PHE CZ C 0.003 -3.210 -3.546 1.00 . A A . 3 PHE CZ 1 1 10 2995 1 1 3 PHE H H -5.523 -0.308 -0.013 1.00 . A A . 3 PHE H 1 1 10 2996 1 1 3 PHE HA H -3.140 -1.802 -0.286 1.00 . A A . 3 PHE HA 1 1 10 2997 1 1 3 PHE HB2 H -4.463 -2.001 -2.579 1.00 . A A . 3 PHE HB2 1 1 10 2998 1 1 3 PHE HB3 H -3.749 -0.416 -2.857 1.00 . A A . 3 PHE HB3 1 1 10 2999 1 1 3 PHE HD1 H -1.471 -0.181 -3.418 1.00 . A A . 3 PHE HD1 1 1 10 3000 1 1 3 PHE HD2 H -2.982 -3.960 -2.170 1.00 . A A . 3 PHE HD2 1 1 10 3001 1 1 3 PHE HE1 H 0.628 -1.250 -4.127 1.00 . A A . 3 PHE HE1 1 1 10 3002 1 1 3 PHE HE2 H -0.885 -5.035 -2.877 1.00 . A A . 3 PHE HE2 1 1 10 3003 1 1 3 PHE HZ H 0.924 -3.680 -3.856 1.00 . A A . 3 PHE HZ 1 1 10 3004 1 1 3 PHE N N -5.087 -1.123 -0.339 1.00 . A A . 3 PHE N 1 1 10 3005 1 1 3 PHE O O -2.275 0.816 -1.286 1.00 . A A . 3 PHE O 1 1 10 3006 1 1 4 ARG C C -2.088 2.131 2.165 1.00 . A A . 4 ARG C 1 1 10 3007 1 1 4 ARG CA C -3.030 2.239 0.969 1.00 . A A . 4 ARG CA 1 1 10 3008 1 1 4 ARG CB C -4.195 3.170 1.306 1.00 . A A . 4 ARG CB 1 1 10 3009 1 1 4 ARG CD C -4.970 3.851 3.598 1.00 . A A . 4 ARG CD 1 1 10 3010 1 1 4 ARG CG C -4.969 2.753 2.546 1.00 . A A . 4 ARG CG 1 1 10 3011 1 1 4 ARG CZ C -7.341 4.460 3.825 1.00 . A A . 4 ARG CZ 1 1 10 3012 1 1 4 ARG H H -4.190 0.478 1.147 1.00 . A A . 4 ARG H 1 1 10 3013 1 1 4 ARG HA H -2.484 2.648 0.132 1.00 . A A . 4 ARG HA 1 1 10 3014 1 1 4 ARG HB2 H -3.810 4.166 1.468 1.00 . A A . 4 ARG HB2 1 1 10 3015 1 1 4 ARG HB3 H -4.879 3.188 0.471 1.00 . A A . 4 ARG HB3 1 1 10 3016 1 1 4 ARG HD2 H -4.173 3.658 4.301 1.00 . A A . 4 ARG HD2 1 1 10 3017 1 1 4 ARG HD3 H -4.797 4.798 3.110 1.00 . A A . 4 ARG HD3 1 1 10 3018 1 1 4 ARG HE H -6.263 3.531 5.224 1.00 . A A . 4 ARG HE 1 1 10 3019 1 1 4 ARG HG2 H -5.990 2.537 2.267 1.00 . A A . 4 ARG HG2 1 1 10 3020 1 1 4 ARG HG3 H -4.513 1.867 2.963 1.00 . A A . 4 ARG HG3 1 1 10 3021 1 1 4 ARG HH11 H -6.497 4.971 2.063 1.00 . A A . 4 ARG HH11 1 1 10 3022 1 1 4 ARG HH12 H -8.168 5.395 2.236 1.00 . A A . 4 ARG HH12 1 1 10 3023 1 1 4 ARG HH21 H -9.285 4.890 4.171 1.00 . A A . 4 ARG HH21 1 1 10 3024 1 1 4 ARG HH22 H -8.464 4.083 5.464 1.00 . A A . 4 ARG HH22 1 1 10 3025 1 1 4 ARG N N -3.527 0.925 0.580 1.00 . A A . 4 ARG N 1 1 10 3026 1 1 4 ARG NE N -6.236 3.914 4.323 1.00 . A A . 4 ARG NE 1 1 10 3027 1 1 4 ARG NH1 N -7.335 4.986 2.608 1.00 . A A . 4 ARG NH1 1 1 10 3028 1 1 4 ARG NH2 N -8.455 4.479 4.546 1.00 . A A . 4 ARG NH2 1 1 10 3029 1 1 4 ARG O O -2.033 3.028 3.008 1.00 . A A . 4 ARG O 1 1 10 3030 1 1 5 LEU C C 0.966 0.421 2.791 1.00 . A A . 5 LEU C 1 1 10 3031 1 1 5 LEU CA C -0.410 0.804 3.326 1.00 . A A . 5 LEU CA 1 1 10 3032 1 1 5 LEU CB C -0.932 -0.294 4.255 1.00 . A A . 5 LEU CB 1 1 10 3033 1 1 5 LEU CD1 C -1.492 -2.737 4.274 1.00 . A A . 5 LEU CD1 1 1 10 3034 1 1 5 LEU CD2 C -3.232 -1.063 3.620 1.00 . A A . 5 LEU CD2 1 1 10 3035 1 1 5 LEU CG C -1.749 -1.403 3.591 1.00 . A A . 5 LEU CG 1 1 10 3036 1 1 5 LEU H H -1.437 0.351 1.532 1.00 . A A . 5 LEU H 1 1 10 3037 1 1 5 LEU HA H -0.323 1.725 3.883 1.00 . A A . 5 LEU HA 1 1 10 3038 1 1 5 LEU HB2 H -0.081 -0.752 4.735 1.00 . A A . 5 LEU HB2 1 1 10 3039 1 1 5 LEU HB3 H -1.556 0.176 5.003 1.00 . A A . 5 LEU HB3 1 1 10 3040 1 1 5 LEU HD11 H -1.402 -2.585 5.339 1.00 . A A . 5 LEU HD11 1 1 10 3041 1 1 5 LEU HD12 H -0.577 -3.166 3.893 1.00 . A A . 5 LEU HD12 1 1 10 3042 1 1 5 LEU HD13 H -2.314 -3.408 4.074 1.00 . A A . 5 LEU HD13 1 1 10 3043 1 1 5 LEU HD21 H -3.356 -0.009 3.815 1.00 . A A . 5 LEU HD21 1 1 10 3044 1 1 5 LEU HD22 H -3.716 -1.633 4.400 1.00 . A A . 5 LEU HD22 1 1 10 3045 1 1 5 LEU HD23 H -3.676 -1.310 2.667 1.00 . A A . 5 LEU HD23 1 1 10 3046 1 1 5 LEU HG H -1.446 -1.494 2.557 1.00 . A A . 5 LEU HG 1 1 10 3047 1 1 5 LEU N N -1.349 1.029 2.233 1.00 . A A . 5 LEU N 1 1 10 3048 1 1 5 LEU O O 1.097 -0.499 1.984 1.00 . A A . 5 LEU O 1 1 10 3049 1 1 6 LYS C C 3.733 -0.591 3.066 1.00 . A A . 6 LYS C 1 1 10 3050 1 1 6 LYS CA C 3.359 0.867 2.819 1.00 . A A . 6 LYS CA 1 1 10 3051 1 1 6 LYS CB C 4.335 1.786 3.557 1.00 . A A . 6 LYS CB 1 1 10 3052 1 1 6 LYS CD C 5.209 2.081 5.893 1.00 . A A . 6 LYS CD 1 1 10 3053 1 1 6 LYS CE C 5.946 0.751 5.921 1.00 . A A . 6 LYS CE 1 1 10 3054 1 1 6 LYS CG C 3.972 2.015 5.014 1.00 . A A . 6 LYS CG 1 1 10 3055 1 1 6 LYS H H 1.824 1.854 3.890 1.00 . A A . 6 LYS H 1 1 10 3056 1 1 6 LYS HA H 3.420 1.067 1.760 1.00 . A A . 6 LYS HA 1 1 10 3057 1 1 6 LYS HB2 H 5.322 1.350 3.518 1.00 . A A . 6 LYS HB2 1 1 10 3058 1 1 6 LYS HB3 H 4.354 2.745 3.058 1.00 . A A . 6 LYS HB3 1 1 10 3059 1 1 6 LYS HD2 H 5.874 2.840 5.507 1.00 . A A . 6 LYS HD2 1 1 10 3060 1 1 6 LYS HD3 H 4.912 2.340 6.900 1.00 . A A . 6 LYS HD3 1 1 10 3061 1 1 6 LYS HE2 H 5.780 0.283 6.879 1.00 . A A . 6 LYS HE2 1 1 10 3062 1 1 6 LYS HE3 H 5.551 0.120 5.139 1.00 . A A . 6 LYS HE3 1 1 10 3063 1 1 6 LYS HG2 H 3.432 2.946 5.099 1.00 . A A . 6 LYS HG2 1 1 10 3064 1 1 6 LYS HG3 H 3.345 1.201 5.351 1.00 . A A . 6 LYS HG3 1 1 10 3065 1 1 6 LYS HZ1 H 7.652 0.749 4.716 1.00 . A A . 6 LYS HZ1 1 1 10 3066 1 1 6 LYS HZ2 H 7.936 0.252 6.308 1.00 . A A . 6 LYS HZ2 1 1 10 3067 1 1 6 LYS HZ3 H 7.696 1.890 5.964 1.00 . A A . 6 LYS HZ3 1 1 10 3068 1 1 6 LYS N N 1.991 1.133 3.248 1.00 . A A . 6 LYS N 1 1 10 3069 1 1 6 LYS NZ N 7.410 0.923 5.713 1.00 . A A . 6 LYS NZ 1 1 10 3070 1 1 6 LYS O O 4.602 -1.143 2.391 1.00 . A A . 6 LYS O 1 1 10 3071 1 1 7 LYS C C 2.079 -3.273 4.932 1.00 . A A . 7 LYS C 1 1 10 3072 1 1 7 LYS CA C 3.331 -2.606 4.372 1.00 . A A . 7 LYS CA 1 1 10 3073 1 1 7 LYS CB C 4.472 -2.704 5.387 1.00 . A A . 7 LYS CB 1 1 10 3074 1 1 7 LYS CD C 6.601 -3.849 6.068 1.00 . A A . 7 LYS CD 1 1 10 3075 1 1 7 LYS CE C 7.605 -2.818 5.574 1.00 . A A . 7 LYS CE 1 1 10 3076 1 1 7 LYS CG C 5.375 -3.906 5.172 1.00 . A A . 7 LYS CG 1 1 10 3077 1 1 7 LYS H H 2.389 -0.718 4.540 1.00 . A A . 7 LYS H 1 1 10 3078 1 1 7 LYS HA H 3.621 -3.116 3.466 1.00 . A A . 7 LYS HA 1 1 10 3079 1 1 7 LYS HB2 H 5.074 -1.810 5.321 1.00 . A A . 7 LYS HB2 1 1 10 3080 1 1 7 LYS HB3 H 4.050 -2.771 6.379 1.00 . A A . 7 LYS HB3 1 1 10 3081 1 1 7 LYS HD2 H 6.294 -3.585 7.068 1.00 . A A . 7 LYS HD2 1 1 10 3082 1 1 7 LYS HD3 H 7.073 -4.821 6.079 1.00 . A A . 7 LYS HD3 1 1 10 3083 1 1 7 LYS HE2 H 7.099 -1.873 5.449 1.00 . A A . 7 LYS HE2 1 1 10 3084 1 1 7 LYS HE3 H 8.386 -2.713 6.313 1.00 . A A . 7 LYS HE3 1 1 10 3085 1 1 7 LYS HG2 H 4.822 -4.806 5.395 1.00 . A A . 7 LYS HG2 1 1 10 3086 1 1 7 LYS HG3 H 5.695 -3.924 4.140 1.00 . A A . 7 LYS HG3 1 1 10 3087 1 1 7 LYS HZ1 H 8.727 -4.116 4.382 1.00 . A A . 7 LYS HZ1 1 1 10 3088 1 1 7 LYS HZ2 H 8.885 -2.486 3.957 1.00 . A A . 7 LYS HZ2 1 1 10 3089 1 1 7 LYS HZ3 H 7.477 -3.333 3.554 1.00 . A A . 7 LYS HZ3 1 1 10 3090 1 1 7 LYS N N 3.071 -1.211 4.037 1.00 . A A . 7 LYS N 1 1 10 3091 1 1 7 LYS NZ N 8.216 -3.216 4.276 1.00 . A A . 7 LYS NZ 1 1 10 3092 1 1 7 LYS O O 1.208 -2.608 5.494 1.00 . A A . 7 LYS O 1 1 10 3093 1 1 8 TRP C C 0.818 -5.353 6.794 1.00 . A A . 8 TRP C 1 1 10 3094 1 1 8 TRP CA C 0.851 -5.347 5.270 1.00 . A A . 8 TRP CA 1 1 10 3095 1 1 8 TRP CB C 0.897 -6.782 4.742 1.00 . A A . 8 TRP CB 1 1 10 3096 1 1 8 TRP CD1 C -1.627 -7.167 4.526 1.00 . A A . 8 TRP CD1 1 1 10 3097 1 1 8 TRP CD2 C -0.455 -7.693 2.691 1.00 . A A . 8 TRP CD2 1 1 10 3098 1 1 8 TRP CE2 C -1.818 -7.949 2.443 1.00 . A A . 8 TRP CE2 1 1 10 3099 1 1 8 TRP CE3 C 0.474 -7.947 1.678 1.00 . A A . 8 TRP CE3 1 1 10 3100 1 1 8 TRP CG C -0.355 -7.193 4.029 1.00 . A A . 8 TRP CG 1 1 10 3101 1 1 8 TRP CH2 C -1.340 -8.687 0.251 1.00 . A A . 8 TRP CH2 1 1 10 3102 1 1 8 TRP CZ2 C -2.271 -8.448 1.224 1.00 . A A . 8 TRP CZ2 1 1 10 3103 1 1 8 TRP CZ3 C 0.022 -8.442 0.470 1.00 . A A . 8 TRP CZ3 1 1 10 3104 1 1 8 TRP H H 2.723 -5.064 4.321 1.00 . A A . 8 TRP H 1 1 10 3105 1 1 8 TRP HA H -0.045 -4.867 4.904 1.00 . A A . 8 TRP HA 1 1 10 3106 1 1 8 TRP HB2 H 1.721 -6.878 4.051 1.00 . A A . 8 TRP HB2 1 1 10 3107 1 1 8 TRP HB3 H 1.047 -7.458 5.572 1.00 . A A . 8 TRP HB3 1 1 10 3108 1 1 8 TRP HD1 H -1.885 -6.838 5.521 1.00 . A A . 8 TRP HD1 1 1 10 3109 1 1 8 TRP HE1 H -3.482 -7.696 3.694 1.00 . A A . 8 TRP HE1 1 1 10 3110 1 1 8 TRP HE3 H 1.528 -7.764 1.828 1.00 . A A . 8 TRP HE3 1 1 10 3111 1 1 8 TRP HH2 H -1.647 -9.074 -0.709 1.00 . A A . 8 TRP HH2 1 1 10 3112 1 1 8 TRP HZ2 H -3.317 -8.641 1.040 1.00 . A A . 8 TRP HZ2 1 1 10 3113 1 1 8 TRP HZ3 H 0.726 -8.645 -0.325 1.00 . A A . 8 TRP HZ3 1 1 10 3114 1 1 8 TRP N N 1.996 -4.590 4.777 1.00 . A A . 8 TRP N 1 1 10 3115 1 1 8 TRP NE1 N -2.512 -7.621 3.577 1.00 . A A . 8 TRP NE1 1 1 10 3116 1 1 8 TRP O O -0.133 -5.848 7.401 1.00 . A A . 8 TRP O 1 1 10 3117 1 1 9 ILE C C 2.857 -3.606 9.312 1.00 . A A . 9 ILE C 1 1 10 3118 1 1 9 ILE CA C 1.947 -4.743 8.861 1.00 . A A . 9 ILE CA 1 1 10 3119 1 1 9 ILE CB C 2.471 -6.068 9.447 1.00 . A A . 9 ILE CB 1 1 10 3120 1 1 9 ILE CD1 C 4.801 -5.795 8.458 1.00 . A A . 9 ILE CD1 1 1 10 3121 1 1 9 ILE CG1 C 3.559 -6.655 8.545 1.00 . A A . 9 ILE CG1 1 1 10 3122 1 1 9 ILE CG2 C 1.329 -7.058 9.622 1.00 . A A . 9 ILE CG2 1 1 10 3123 1 1 9 ILE H H 2.586 -4.424 6.869 1.00 . A A . 9 ILE H 1 1 10 3124 1 1 9 ILE HA H 0.953 -4.570 9.248 1.00 . A A . 9 ILE HA 1 1 10 3125 1 1 9 ILE HB H 2.891 -5.864 10.420 1.00 . A A . 9 ILE HB 1 1 10 3126 1 1 9 ILE HD11 H 4.593 -4.924 7.854 1.00 . A A . 9 ILE HD11 1 1 10 3127 1 1 9 ILE HD12 H 5.093 -5.482 9.450 1.00 . A A . 9 ILE HD12 1 1 10 3128 1 1 9 ILE HD13 H 5.601 -6.362 8.008 1.00 . A A . 9 ILE HD13 1 1 10 3129 1 1 9 ILE HG12 H 3.851 -7.621 8.925 1.00 . A A . 9 ILE HG12 1 1 10 3130 1 1 9 ILE HG13 H 3.164 -6.770 7.546 1.00 . A A . 9 ILE HG13 1 1 10 3131 1 1 9 ILE HG21 H 0.386 -6.540 9.531 1.00 . A A . 9 ILE HG21 1 1 10 3132 1 1 9 ILE HG22 H 1.395 -7.820 8.860 1.00 . A A . 9 ILE HG22 1 1 10 3133 1 1 9 ILE HG23 H 1.396 -7.516 10.597 1.00 . A A . 9 ILE HG23 1 1 10 3134 1 1 9 ILE N N 1.859 -4.802 7.407 1.00 . A A . 9 ILE N 1 1 10 3135 1 1 9 ILE O O 3.569 -3.726 10.308 1.00 . A A . 9 ILE O 1 1 10 3136 1 1 10 GLN C C 3.486 -0.954 10.362 1.00 . A A . 10 GLN C 1 1 10 3137 1 1 10 GLN CA C 3.649 -1.343 8.896 1.00 . A A . 10 GLN CA 1 1 10 3138 1 1 10 GLN CB C 3.278 -0.161 7.998 1.00 . A A . 10 GLN CB 1 1 10 3139 1 1 10 GLN CD C 1.678 1.741 7.546 1.00 . A A . 10 GLN CD 1 1 10 3140 1 1 10 GLN CG C 2.061 0.612 8.482 1.00 . A A . 10 GLN CG 1 1 10 3141 1 1 10 GLN H H 2.239 -2.468 7.789 1.00 . A A . 10 GLN H 1 1 10 3142 1 1 10 GLN HA H 4.680 -1.607 8.719 1.00 . A A . 10 GLN HA 1 1 10 3143 1 1 10 GLN HB2 H 4.115 0.519 7.954 1.00 . A A . 10 GLN HB2 1 1 10 3144 1 1 10 GLN HB3 H 3.071 -0.530 7.005 1.00 . A A . 10 GLN HB3 1 1 10 3145 1 1 10 GLN HE21 H 0.700 2.119 5.857 1.00 . A A . 10 GLN HE21 1 1 10 3146 1 1 10 GLN HE22 H 0.724 0.465 6.357 1.00 . A A . 10 GLN HE22 1 1 10 3147 1 1 10 GLN HG2 H 1.226 -0.068 8.560 1.00 . A A . 10 GLN HG2 1 1 10 3148 1 1 10 GLN HG3 H 2.278 1.028 9.455 1.00 . A A . 10 GLN HG3 1 1 10 3149 1 1 10 GLN N N 2.827 -2.502 8.571 1.00 . A A . 10 GLN N 1 1 10 3150 1 1 10 GLN NE2 N 0.962 1.409 6.478 1.00 . A A . 10 GLN NE2 1 1 10 3151 1 1 10 GLN O O 4.380 -0.354 10.959 1.00 . A A . 10 GLN O 1 1 10 3152 1 1 10 GLN OE1 O 2.021 2.901 7.780 1.00 . A A . 10 GLN OE1 1 1 10 3153 1 1 11 LYS C C 2.965 -1.787 13.262 1.00 . A A . 11 LYS C 1 1 10 3154 1 1 11 LYS CA C 2.058 -0.987 12.333 1.00 . A A . 11 LYS CA 1 1 10 3155 1 1 11 LYS CB C 0.592 -1.280 12.658 1.00 . A A . 11 LYS CB 1 1 10 3156 1 1 11 LYS CD C 0.137 -3.594 13.523 1.00 . A A . 11 LYS CD 1 1 10 3157 1 1 11 LYS CE C -1.141 -3.410 14.327 1.00 . A A . 11 LYS CE 1 1 10 3158 1 1 11 LYS CG C 0.160 -2.691 12.300 1.00 . A A . 11 LYS CG 1 1 10 3159 1 1 11 LYS H H 1.664 -1.776 10.409 1.00 . A A . 11 LYS H 1 1 10 3160 1 1 11 LYS HA H 2.248 0.065 12.483 1.00 . A A . 11 LYS HA 1 1 10 3161 1 1 11 LYS HB2 H 0.434 -1.134 13.716 1.00 . A A . 11 LYS HB2 1 1 10 3162 1 1 11 LYS HB3 H -0.031 -0.586 12.111 1.00 . A A . 11 LYS HB3 1 1 10 3163 1 1 11 LYS HD2 H 0.201 -4.623 13.201 1.00 . A A . 11 LYS HD2 1 1 10 3164 1 1 11 LYS HD3 H 0.984 -3.357 14.150 1.00 . A A . 11 LYS HD3 1 1 10 3165 1 1 11 LYS HE2 H -0.945 -2.725 15.138 1.00 . A A . 11 LYS HE2 1 1 10 3166 1 1 11 LYS HE3 H -1.901 -2.995 13.681 1.00 . A A . 11 LYS HE3 1 1 10 3167 1 1 11 LYS HG2 H -0.831 -2.658 11.872 1.00 . A A . 11 LYS HG2 1 1 10 3168 1 1 11 LYS HG3 H 0.853 -3.098 11.577 1.00 . A A . 11 LYS HG3 1 1 10 3169 1 1 11 LYS HZ1 H -0.830 -5.302 15.155 1.00 . A A . 11 LYS HZ1 1 1 10 3170 1 1 11 LYS HZ2 H -2.211 -5.198 14.183 1.00 . A A . 11 LYS HZ2 1 1 10 3171 1 1 11 LYS HZ3 H -2.214 -4.521 15.733 1.00 . A A . 11 LYS HZ3 1 1 10 3172 1 1 11 LYS N N 2.339 -1.298 10.937 1.00 . A A . 11 LYS N 1 1 10 3173 1 1 11 LYS NZ N -1.633 -4.698 14.889 1.00 . A A . 11 LYS NZ 1 1 10 3174 1 1 11 LYS O O 3.523 -1.248 14.218 1.00 . A A . 11 LYS O 1 1 10 3175 1 1 12 VAL C C 5.416 -3.535 13.700 1.00 . A A . 12 VAL C 1 1 10 3176 1 1 12 VAL CA C 3.951 -3.951 13.783 1.00 . A A . 12 VAL CA 1 1 10 3177 1 1 12 VAL CB C 3.821 -5.421 13.341 1.00 . A A . 12 VAL CB 1 1 10 3178 1 1 12 VAL CG1 C 4.845 -6.287 14.059 1.00 . A A . 12 VAL CG1 1 1 10 3179 1 1 12 VAL CG2 C 2.410 -5.930 13.592 1.00 . A A . 12 VAL CG2 1 1 10 3180 1 1 12 VAL H H 2.640 -3.449 12.199 1.00 . A A . 12 VAL H 1 1 10 3181 1 1 12 VAL HA H 3.623 -3.875 14.809 1.00 . A A . 12 VAL HA 1 1 10 3182 1 1 12 VAL HB H 4.017 -5.475 12.280 1.00 . A A . 12 VAL HB 1 1 10 3183 1 1 12 VAL HG11 H 4.737 -6.161 15.126 1.00 . A A . 12 VAL HG11 1 1 10 3184 1 1 12 VAL HG12 H 4.686 -7.323 13.799 1.00 . A A . 12 VAL HG12 1 1 10 3185 1 1 12 VAL HG13 H 5.840 -5.990 13.761 1.00 . A A . 12 VAL HG13 1 1 10 3186 1 1 12 VAL HG21 H 2.446 -6.974 13.864 1.00 . A A . 12 VAL HG21 1 1 10 3187 1 1 12 VAL HG22 H 1.962 -5.363 14.395 1.00 . A A . 12 VAL HG22 1 1 10 3188 1 1 12 VAL HG23 H 1.819 -5.811 12.695 1.00 . A A . 12 VAL HG23 1 1 10 3189 1 1 12 VAL N N 3.110 -3.077 12.974 1.00 . A A . 12 VAL N 1 1 10 3190 1 1 12 VAL O O 6.084 -3.375 14.721 1.00 . A A . 12 VAL O 1 1 10 3191 1 1 13 ILE C C 7.539 -1.541 12.763 1.00 . A A . 13 ILE C 1 1 10 3192 1 1 13 ILE CA C 7.292 -2.960 12.262 1.00 . A A . 13 ILE CA 1 1 10 3193 1 1 13 ILE CB C 7.676 -3.041 10.773 1.00 . A A . 13 ILE CB 1 1 10 3194 1 1 13 ILE CD1 C 9.830 -3.826 9.668 1.00 . A A . 13 ILE CD1 1 1 10 3195 1 1 13 ILE CG1 C 9.181 -2.826 10.599 1.00 . A A . 13 ILE CG1 1 1 10 3196 1 1 13 ILE CG2 C 6.892 -2.015 9.967 1.00 . A A . 13 ILE CG2 1 1 10 3197 1 1 13 ILE H H 5.324 -3.502 11.703 1.00 . A A . 13 ILE H 1 1 10 3198 1 1 13 ILE HA H 7.925 -3.640 12.814 1.00 . A A . 13 ILE HA 1 1 10 3199 1 1 13 ILE HB H 7.415 -4.023 10.410 1.00 . A A . 13 ILE HB 1 1 10 3200 1 1 13 ILE HD11 H 10.810 -4.084 10.044 1.00 . A A . 13 ILE HD11 1 1 10 3201 1 1 13 ILE HD12 H 9.221 -4.716 9.613 1.00 . A A . 13 ILE HD12 1 1 10 3202 1 1 13 ILE HD13 H 9.926 -3.393 8.684 1.00 . A A . 13 ILE HD13 1 1 10 3203 1 1 13 ILE HG12 H 9.353 -1.840 10.198 1.00 . A A . 13 ILE HG12 1 1 10 3204 1 1 13 ILE HG13 H 9.662 -2.908 11.563 1.00 . A A . 13 ILE HG13 1 1 10 3205 1 1 13 ILE HG21 H 7.327 -1.037 10.111 1.00 . A A . 13 ILE HG21 1 1 10 3206 1 1 13 ILE HG22 H 6.931 -2.274 8.920 1.00 . A A . 13 ILE HG22 1 1 10 3207 1 1 13 ILE HG23 H 5.865 -2.005 10.298 1.00 . A A . 13 ILE HG23 1 1 10 3208 1 1 13 ILE N N 5.907 -3.360 12.478 1.00 . A A . 13 ILE N 1 1 10 3209 1 1 13 ILE O O 8.636 -1.214 13.216 1.00 . A A . 13 ILE O 1 1 10 3210 1 1 14 ASP C C 7.174 0.754 14.544 1.00 . A A . 14 ASP C 1 1 10 3211 1 1 14 ASP CA C 6.615 0.681 13.126 1.00 . A A . 14 ASP CA 1 1 10 3212 1 1 14 ASP CB C 5.247 1.362 13.068 1.00 . A A . 14 ASP CB 1 1 10 3213 1 1 14 ASP CG C 5.212 2.658 13.854 1.00 . A A . 14 ASP CG 1 1 10 3214 1 1 14 ASP H H 5.663 -1.023 12.308 1.00 . A A . 14 ASP H 1 1 10 3215 1 1 14 ASP HA H 7.292 1.195 12.460 1.00 . A A . 14 ASP HA 1 1 10 3216 1 1 14 ASP HB2 H 5.005 1.581 12.038 1.00 . A A . 14 ASP HB2 1 1 10 3217 1 1 14 ASP HB3 H 4.502 0.695 13.475 1.00 . A A . 14 ASP HB3 1 1 10 3218 1 1 14 ASP N N 6.512 -0.703 12.679 1.00 . A A . 14 ASP N 1 1 10 3219 1 1 14 ASP O O 7.798 1.744 14.925 1.00 . A A . 14 ASP O 1 1 10 3220 1 1 14 ASP OD1 O 5.301 3.735 13.227 1.00 . A A . 14 ASP OD1 1 1 10 3221 1 1 14 ASP OD2 O 5.094 2.596 15.095 1.00 . A A . 14 ASP OD2 1 1 10 3222 1 1 15 GLN C C 8.593 -1.323 16.827 1.00 . A A . 15 GLN C 1 1 10 3223 1 1 15 GLN CA C 7.422 -0.355 16.696 1.00 . A A . 15 GLN CA 1 1 10 3224 1 1 15 GLN CB C 6.291 -0.774 17.636 1.00 . A A . 15 GLN CB 1 1 10 3225 1 1 15 GLN CD C 4.056 0.063 18.466 1.00 . A A . 15 GLN CD 1 1 10 3226 1 1 15 GLN CG C 5.512 0.398 18.212 1.00 . A A . 15 GLN CG 1 1 10 3227 1 1 15 GLN H H 6.440 -1.059 14.959 1.00 . A A . 15 GLN H 1 1 10 3228 1 1 15 GLN HA H 7.757 0.634 16.969 1.00 . A A . 15 GLN HA 1 1 10 3229 1 1 15 GLN HB2 H 5.602 -1.404 17.092 1.00 . A A . 15 GLN HB2 1 1 10 3230 1 1 15 GLN HB3 H 6.710 -1.337 18.456 1.00 . A A . 15 GLN HB3 1 1 10 3231 1 1 15 GLN HE21 H 2.211 0.553 17.910 1.00 . A A . 15 GLN HE21 1 1 10 3232 1 1 15 GLN HE22 H 3.485 1.424 17.134 1.00 . A A . 15 GLN HE22 1 1 10 3233 1 1 15 GLN HG2 H 5.967 0.690 19.147 1.00 . A A . 15 GLN HG2 1 1 10 3234 1 1 15 GLN HG3 H 5.561 1.222 17.516 1.00 . A A . 15 GLN HG3 1 1 10 3235 1 1 15 GLN N N 6.943 -0.300 15.320 1.00 . A A . 15 GLN N 1 1 10 3236 1 1 15 GLN NE2 N 3.160 0.749 17.767 1.00 . A A . 15 GLN NE2 1 1 10 3237 1 1 15 GLN O O 9.319 -1.304 17.821 1.00 . A A . 15 GLN O 1 1 10 3238 1 1 15 GLN OE1 O 3.739 -0.803 19.282 1.00 . A A . 15 GLN OE1 1 1 10 3239 1 1 16 PHE C C 10.664 -3.064 14.531 1.00 . A A . 16 PHE C 1 1 10 3240 1 1 16 PHE CA C 9.854 -3.146 15.821 1.00 . A A . 16 PHE CA 1 1 10 3241 1 1 16 PHE CB C 9.293 -4.559 15.995 1.00 . A A . 16 PHE CB 1 1 10 3242 1 1 16 PHE CD1 C 9.794 -5.648 18.200 1.00 . A A . 16 PHE CD1 1 1 10 3243 1 1 16 PHE CD2 C 7.747 -4.448 17.968 1.00 . A A . 16 PHE CD2 1 1 10 3244 1 1 16 PHE CE1 C 9.470 -5.955 19.508 1.00 . A A . 16 PHE CE1 1 1 10 3245 1 1 16 PHE CE2 C 7.418 -4.752 19.276 1.00 . A A . 16 PHE CE2 1 1 10 3246 1 1 16 PHE CG C 8.938 -4.891 17.416 1.00 . A A . 16 PHE CG 1 1 10 3247 1 1 16 PHE CZ C 8.280 -5.507 20.046 1.00 . A A . 16 PHE CZ 1 1 10 3248 1 1 16 PHE H H 8.159 -2.135 15.052 1.00 . A A . 16 PHE H 1 1 10 3249 1 1 16 PHE HA H 10.501 -2.919 16.654 1.00 . A A . 16 PHE HA 1 1 10 3250 1 1 16 PHE HB2 H 8.400 -4.660 15.398 1.00 . A A . 16 PHE HB2 1 1 10 3251 1 1 16 PHE HB3 H 10.029 -5.274 15.660 1.00 . A A . 16 PHE HB3 1 1 10 3252 1 1 16 PHE HD1 H 10.726 -5.999 17.779 1.00 . A A . 16 PHE HD1 1 1 10 3253 1 1 16 PHE HD2 H 7.071 -3.858 17.367 1.00 . A A . 16 PHE HD2 1 1 10 3254 1 1 16 PHE HE1 H 10.147 -6.546 20.107 1.00 . A A . 16 PHE HE1 1 1 10 3255 1 1 16 PHE HE2 H 6.486 -4.401 19.694 1.00 . A A . 16 PHE HE2 1 1 10 3256 1 1 16 PHE HZ H 8.025 -5.746 21.068 1.00 . A A . 16 PHE HZ 1 1 10 3257 1 1 16 PHE N N 8.771 -2.169 15.818 1.00 . A A . 16 PHE N 1 1 10 3258 1 1 16 PHE O O 10.527 -3.906 13.644 1.00 . A A . 16 PHE O 1 1 10 3259 1 1 17 GLY C C 13.747 -1.447 13.581 1.00 . A A . 17 GLY C 1 1 10 3260 1 1 17 GLY CA C 12.329 -1.868 13.249 1.00 . A A . 17 GLY CA 1 1 10 3261 1 1 17 GLY H H 11.577 -1.401 15.172 1.00 . A A . 17 GLY H 1 1 10 3262 1 1 17 GLY HA2 H 12.359 -2.800 12.705 1.00 . A A . 17 GLY HA2 1 1 10 3263 1 1 17 GLY HA3 H 11.880 -1.111 12.622 1.00 . A A . 17 GLY HA3 1 1 10 3264 1 1 17 GLY N N 11.510 -2.042 14.433 1.00 . A A . 17 GLY N 1 1 10 3265 1 1 17 GLY O O 14.695 -2.195 13.343 1.00 . A A . 17 GLY O 1 1 10 3266 1 1 18 GLU C C 15.377 0.308 16.012 1.00 . A A . 18 GLU C 1 1 10 3267 1 1 18 GLU CA C 15.206 0.273 14.496 1.00 . A A . 18 GLU CA 1 1 10 3268 1 1 18 GLU CB C 15.403 1.676 13.917 1.00 . A A . 18 GLU CB 1 1 10 3269 1 1 18 GLU CD C 16.990 3.603 13.536 1.00 . A A . 18 GLU CD 1 1 10 3270 1 1 18 GLU CG C 16.749 2.292 14.258 1.00 . A A . 18 GLU CG 1 1 10 3271 1 1 18 GLU H H 13.099 0.304 14.298 1.00 . A A . 18 GLU H 1 1 10 3272 1 1 18 GLU HA H 15.951 -0.387 14.077 1.00 . A A . 18 GLU HA 1 1 10 3273 1 1 18 GLU HB2 H 15.315 1.624 12.842 1.00 . A A . 18 GLU HB2 1 1 10 3274 1 1 18 GLU HB3 H 14.627 2.322 14.301 1.00 . A A . 18 GLU HB3 1 1 10 3275 1 1 18 GLU HG2 H 16.789 2.472 15.322 1.00 . A A . 18 GLU HG2 1 1 10 3276 1 1 18 GLU HG3 H 17.529 1.597 13.982 1.00 . A A . 18 GLU HG3 1 1 10 3277 1 1 18 GLU N N 13.893 -0.246 14.133 1.00 . A A . 18 GLU N 1 1 10 3278 1 1 18 GLU O O 16.453 0.014 16.531 1.00 . A A . 18 GLU O 1 1 10 3279 1 1 18 GLU OE1 O 17.899 3.650 12.680 1.00 . A A . 18 GLU OE1 1 1 10 3280 1 1 18 GLU OE2 O 16.272 4.582 13.827 1.00 . A A . 18 GLU OE2 1 1 stop_ save_
Contact the webmaster for help, if required. Monday, May 6, 2024 2:12:28 AM GMT (wattos1)