NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
633389 | 5z5r | 36158 | cing | 4-filtered-FRED | STAR | entry | full | 132 |
data_FRED_restraints_with_modified_coordinates_PDB_code_5z5r # This FRED archive file contains, for PDB entry <5z5r>: # # - 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_5z5r _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 5z5r _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "free and other bound" _Assembly.Molecular_mass 2941.43 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 $Lantibiotic_nukacin A . 1 1 stop_ save_ save_Lantibiotic_nukacin _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Lantibiotic nukacin" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code KKKSGVIPXVXHDCHMNXFQFVFXCCS _Entity.Number_of_monomers 27 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 LYS . 1 1 2 LYS . 1 1 3 LYS . 1 1 4 SER . 1 1 5 GLY . 1 1 6 VAL . 1 1 7 ILE . 1 1 8 PRO . 1 1 9 . $. 1 1 10 VAL . 1 1 11 DAL $DAL 1 1 12 HIS . 1 1 13 ASP . 1 1 14 CYS . 1 1 15 HIS . 1 1 16 MET . 1 1 17 ASN . 1 1 18 DAL $DAL 1 1 19 PHE . 1 1 20 GLN . 1 1 21 PHE . 1 1 22 VAL . 1 1 23 PHE . 1 1 24 DBU $DBU 1 1 25 CYS . 1 1 26 CYS . 1 1 27 SER . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID LYS 1 1 1 1 LYS 2 2 1 1 LYS 3 3 1 1 SER 4 4 1 1 GLY 5 5 1 1 VAL 6 6 1 1 ILE 7 7 1 1 PRO 8 8 1 1 . 9 9 1 1 VAL 10 10 1 1 DAL 11 11 1 1 HIS 12 12 1 1 ASP 13 13 1 1 CYS 14 14 1 1 HIS 15 15 1 1 MET 16 16 1 1 ASN 17 17 1 1 DAL 18 18 1 1 PHE 19 19 1 1 GLN 20 20 1 1 PHE 21 21 1 1 VAL 22 22 1 1 PHE 23 23 1 1 DBU 24 24 1 1 CYS 25 25 1 1 CYS 26 26 1 1 SER 27 27 1 1 stop_ save_ save_DAL _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID DAL _Chem_comp.Type non-polymer save_ save_. _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID . _Chem_comp.Type non-polymer save_ save_DBU _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID DBU _Chem_comp.Type non-polymer save_ save_DYANA/DIANA_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 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 11 DAL HB1 . 11 DALS HB2 1 1 1 1 2 1 1 25 CYS SG . 25 CYSS SG 1 1 2 1 1 1 1 18 DAL HB1 . 18 DALS HB2 1 1 2 1 2 1 1 26 CYS SG . 26 CYSS SG 1 1 3 1 1 1 1 16 MET HA . 16 MET HA 1 1 3 1 2 1 1 16 MET HG3 . 16 MET HG3 1 1 4 1 1 1 1 16 MET HA . 16 MET HA 1 1 4 1 2 1 1 16 MET HG2 . 16 MET HG2 1 1 5 1 1 1 1 7 ILE HA . 7 ILE HA 1 1 5 1 2 1 1 8 PRO HD2 . 8 PRO HD2 1 1 6 1 1 1 1 11 DAL HB1 . 11 DAL HB3 1 1 6 1 2 1 1 25 CYS HA . 25 CYS HA 1 1 7 1 1 1 1 18 DAL HB1 . 18 DAL HB2 1 1 7 1 2 1 1 26 CYS HA . 26 CYS HA 1 1 8 1 1 1 1 20 GLN HA . 20 GLN HA 1 1 8 1 2 1 1 20 GLN QG . 20 GLN QG 1 1 9 1 1 1 1 4 SER HA . 4 SER HA 1 1 9 1 2 1 1 4 SER QB . 4 SER QB 1 1 10 1 1 1 1 7 ILE HA . 7 ILE HA 1 1 10 1 2 1 1 21 PHE HZ . 21 PHE HZ 1 1 11 1 1 1 1 19 PHE HA . 19 PHE HA 1 1 11 1 2 1 1 19 PHE QD . 19 PHE QD 1 1 12 1 1 1 1 23 PHE HA . 23 PHE HA 1 1 12 1 2 1 1 23 PHE QD . 23 PHE QD 1 1 13 1 1 1 1 6 VAL MG2 . 6 VAL QG2 1 1 13 1 2 1 1 21 PHE QD . 21 PHE QD 1 1 14 1 1 1 1 6 VAL HB . 6 VAL HB 1 1 14 1 2 1 1 21 PHE HZ . 21 PHE HZ 1 1 15 1 1 1 1 6 VAL HB . 6 VAL HB 1 1 15 1 2 1 1 21 PHE QE . 21 PHE QE 1 1 16 1 1 1 1 10 VAL MG2 . 10 VAL QG2 1 1 16 1 2 1 1 21 PHE QE . 21 PHE QE 1 1 17 1 1 1 1 15 HIS HA . 15 HIS HA 1 1 17 1 2 1 1 15 HIS HD2 . 15 HIS HD2 1 1 18 1 1 1 1 20 GLN HA . 20 GLN HA 1 1 18 1 2 1 1 21 PHE QD . 21 PHE QD 1 1 19 1 1 1 1 18 DAL HB1 . 18 DAL HB2 1 1 19 1 2 1 1 21 PHE HZ . 21 PHE HZ 1 1 20 1 1 1 1 18 DAL HB1 . 18 DAL HB3 1 1 20 1 2 1 1 21 PHE QD . 21 PHE QD 1 1 21 1 1 1 1 8 PRO HA . 8 PRO HA 1 1 21 1 2 1 1 21 PHE QE . 21 PHE QE 1 1 22 1 1 1 1 22 VAL HA . 22 VAL HA 1 1 22 1 2 1 1 23 PHE H . 23 PHE H 1 1 23 1 1 1 1 11 DAL H . 11 DAL H 1 1 23 1 2 1 1 11 DAL HB1 . 11 DAL HB3 1 1 24 1 1 1 1 12 HIS QB . 12 HIS QB 1 1 24 1 2 1 1 13 ASP H . 13 ASP H 1 1 25 1 1 1 1 10 VAL MG1 . 10 VAL QG1 1 1 25 1 2 1 1 11 DAL H . 11 DAL H 1 1 26 1 1 1 1 10 VAL MG2 . 10 VAL QG2 1 1 26 1 2 1 1 11 DAL H . 11 DAL H 1 1 27 1 1 1 1 26 CYS H . 26 CYS H 1 1 27 1 2 1 1 26 CYS HB2 . 26 CYS HB2 1 1 28 1 1 1 1 11 DAL HB1 . 11 DAL HB2 1 1 28 1 2 1 1 26 CYS H . 26 CYS H 1 1 29 1 1 1 1 11 DAL HA . 11 DAL HA 1 1 29 1 2 1 1 26 CYS H . 26 CYS H 1 1 30 1 1 1 1 12 HIS H . 12 HIS H 1 1 30 1 2 1 1 13 ASP H . 13 ASP H 1 1 31 1 1 1 1 13 ASP H . 13 ASP H 1 1 31 1 2 1 1 14 CYS H . 14 CYS H 1 1 32 1 1 1 1 22 VAL H . 22 VAL H 1 1 32 1 2 1 1 25 CYS H . 25 CYS H 1 1 33 1 1 1 1 11 DAL HA . 11 DAL HA 1 1 33 1 2 1 1 11 DAL HB1 . 11 DAL HB2 1 1 34 1 1 1 1 7 ILE HA . 7 ILE HA 1 1 34 1 2 1 1 8 PRO HD3 . 8 PRO HD3 1 1 35 1 1 1 1 21 PHE QD . 21 PHE QD 1 1 35 1 2 1 1 26 CYS H . 26 CYS H 1 1 36 1 1 1 1 21 PHE H . 21 PHE H 1 1 36 1 2 1 1 21 PHE QD . 21 PHE QD 1 1 37 1 1 1 1 15 HIS H . 15 HIS H 1 1 37 1 2 1 1 16 MET H . 16 MET H 1 1 38 1 1 1 1 2 LYS H . 2 LYS H 1 1 38 1 2 1 1 2 LYS QG . 2 LYS QG 1 1 39 1 1 1 1 2 LYS H . 2 LYS H 1 1 39 1 2 1 1 2 LYS QB . 2 LYS QB 1 1 40 1 1 1 1 12 HIS H . 12 HIS H 1 1 40 1 2 1 1 25 CYS HB3 . 25 CYS HB3 1 1 41 1 1 1 1 12 HIS H . 12 HIS H 1 1 41 1 2 1 1 25 CYS HB2 . 25 CYS HB2 1 1 42 1 1 1 1 11 DAL HA . 11 DAL HA 1 1 42 1 2 1 1 12 HIS H . 12 HIS H 1 1 43 1 1 1 1 20 GLN HA . 20 GLN HA 1 1 43 1 2 1 1 21 PHE H . 21 PHE H 1 1 44 1 1 1 1 14 CYS HA . 14 CYS HA 1 1 44 1 2 1 1 15 HIS H . 15 HIS H 1 1 45 1 1 1 1 3 LYS H . 3 LYS H 1 1 45 1 2 1 1 3 LYS HA . 3 LYS HA 1 1 46 1 1 1 1 3 LYS H . 3 LYS H 1 1 46 1 2 1 1 3 LYS QB . 3 LYS QB 1 1 47 1 1 1 1 3 LYS H . 3 LYS H 1 1 47 1 2 1 1 3 LYS QG . 3 LYS QG 1 1 48 1 1 1 1 20 GLN QG . 20 GLN QG 1 1 48 1 2 1 1 21 PHE H . 21 PHE H 1 1 49 1 1 1 1 11 DAL HB1 . 11 DAL HB2 1 1 49 1 2 1 1 25 CYS H . 25 CYS H 1 1 50 1 1 1 1 6 VAL HB . 6 VAL HB 1 1 50 1 2 1 1 7 ILE H . 7 ILE H 1 1 51 1 1 1 1 7 ILE H . 7 ILE H 1 1 51 1 2 1 1 7 ILE QG . 7 ILE QG1 1 1 52 1 1 1 1 6 VAL MG1 . 6 VAL QG1 1 1 52 1 2 1 1 7 ILE H . 7 ILE H 1 1 53 1 1 1 1 6 VAL MG2 . 6 VAL QG2 1 1 53 1 2 1 1 7 ILE H . 7 ILE H 1 1 54 1 1 1 1 6 VAL HA . 6 VAL HA 1 1 54 1 2 1 1 7 ILE H . 7 ILE H 1 1 55 1 1 1 1 10 VAL H . 10 VAL H 1 1 55 1 2 1 1 10 VAL HB . 10 VAL HB 1 1 56 1 1 1 1 10 VAL H . 10 VAL H 1 1 56 1 2 1 1 10 VAL MG1 . 10 VAL QG1 1 1 57 1 1 1 1 10 VAL H . 10 VAL H 1 1 57 1 2 1 1 10 VAL MG2 . 10 VAL QG2 1 1 58 1 1 1 1 18 DAL H . 18 DAL H 1 1 58 1 2 1 1 18 DAL HB1 . 18 DAL HB2 1 1 59 1 1 1 1 17 ASN HB2 . 17 ASN HB2 1 1 59 1 2 1 1 18 DAL H . 18 DAL H 1 1 60 1 1 1 1 20 GLN H . 20 GLN H 1 1 60 1 2 1 1 20 GLN QG . 20 GLN QG 1 1 61 1 1 1 1 12 HIS HA . 12 HIS HA 1 1 61 1 2 1 1 12 HIS HD2 . 12 HIS HD2 1 1 62 1 1 1 1 6 VAL MG1 . 6 VAL QG1 1 1 62 1 2 1 1 21 PHE QD . 21 PHE QD 1 1 63 1 1 1 1 6 VAL MG2 . 6 VAL QG2 1 1 63 1 2 1 1 21 PHE QE . 21 PHE QE 1 1 64 1 1 1 1 6 VAL MG1 . 6 VAL QG1 1 1 64 1 2 1 1 21 PHE QE . 21 PHE QE 1 1 65 1 1 1 1 10 VAL MG1 . 10 VAL QG1 1 1 65 1 2 1 1 21 PHE QE . 21 PHE QE 1 1 66 1 1 1 1 21 PHE HB2 . 21 PHE HB2 1 1 66 1 2 1 1 25 CYS H . 25 CYS H 1 1 67 1 1 1 1 19 PHE H . 19 PHE H 1 1 67 1 2 1 1 20 GLN H . 20 GLN H 1 1 68 1 1 1 1 25 CYS H . 25 CYS H 1 1 68 1 2 1 1 26 CYS H . 26 CYS H 1 1 69 1 1 1 1 18 DAL H . 18 DAL H 1 1 69 1 2 1 1 19 PHE H . 19 PHE H 1 1 70 1 1 1 1 17 ASN H . 17 ASN H 1 1 70 1 2 1 1 18 DAL H . 18 DAL H 1 1 71 1 1 1 1 10 VAL HA . 10 VAL HA 1 1 71 1 2 1 1 11 DAL H . 11 DAL H 1 1 72 1 1 1 1 17 ASN HB3 . 17 ASN HB3 1 1 72 1 2 1 1 18 DAL H . 18 DAL H 1 1 73 1 1 1 1 18 DAL HB1 . 18 DAL HB3 1 1 73 1 2 1 1 19 PHE QD . 19 PHE QD 1 1 74 1 1 1 1 11 DAL H . 11 DAL H 1 1 74 1 2 1 1 14 CYS QB . 14 CYS QB 1 1 75 1 1 1 1 10 VAL HB . 10 VAL HB 1 1 75 1 2 1 1 11 DAL H . 11 DAL H 1 1 76 1 1 1 1 6 VAL H . 6 VAL H 1 1 76 1 2 1 1 6 VAL MG1 . 6 VAL QG1 1 1 77 1 1 1 1 6 VAL H . 6 VAL H 1 1 77 1 2 1 1 6 VAL MG2 . 6 VAL QG2 1 1 78 1 1 1 1 6 VAL H . 6 VAL H 1 1 78 1 2 1 1 6 VAL HB . 6 VAL HB 1 1 79 1 1 1 1 4 SER QB . 4 SER QB 1 1 79 1 2 1 1 6 VAL H . 6 VAL H 1 1 80 1 1 1 1 26 CYS H . 26 CYS H 1 1 80 1 2 1 1 26 CYS HB3 . 26 CYS HB3 1 1 81 1 1 1 1 5 GLY H . 5 GLY H 1 1 81 1 2 1 1 6 VAL H . 6 VAL H 1 1 82 1 1 1 1 21 PHE QD . 21 PHE QD 1 1 82 1 2 1 1 26 CYS HA . 26 CYS HA 1 1 83 1 1 1 1 19 PHE HB2 . 19 PHE HB2 1 1 83 1 2 1 1 20 GLN H . 20 GLN H 1 1 84 1 1 1 1 19 PHE HB3 . 19 PHE HB3 1 1 84 1 2 1 1 20 GLN H . 20 GLN H 1 1 85 1 1 1 1 8 PRO HA . 8 PRO HA 1 1 85 1 2 1 1 21 PHE HZ . 21 PHE HZ 1 1 86 1 1 1 1 18 DAL HB1 . 18 DAL HB3 1 1 86 1 2 1 1 21 PHE QE . 21 PHE QE 1 1 87 1 1 1 1 18 DAL HB1 . 18 DAL HB3 1 1 87 1 2 1 1 20 GLN H . 20 GLN H 1 1 88 1 1 1 1 10 VAL H . 10 VAL H 1 1 88 1 2 1 1 26 CYS HB2 . 26 CYS HB2 1 1 89 1 1 1 1 10 VAL H . 10 VAL H 1 1 89 1 2 1 1 26 CYS HB3 . 26 CYS HB3 1 1 90 1 1 1 1 18 DAL HB1 . 18 DAL HB2 1 1 90 1 2 1 1 19 PHE H . 19 PHE H 1 1 91 1 1 1 1 21 PHE HB3 . 21 PHE HB3 1 1 91 1 2 1 1 25 CYS H . 25 CYS H 1 1 92 1 1 1 1 14 CYS H . 14 CYS H 1 1 92 1 2 1 1 14 CYS QB . 14 CYS QB 1 1 93 1 1 1 1 6 VAL H . 6 VAL H 1 1 93 1 2 1 1 6 VAL QG . 6 VAL QQG 1 1 94 1 1 1 1 6 VAL QG . 6 VAL QQG 1 1 94 1 2 1 1 7 ILE H . 7 ILE H 1 1 95 1 1 1 1 6 VAL QG . 6 VAL QQG 1 1 95 1 2 1 1 21 PHE QD . 21 PHE QD 1 1 96 1 1 1 1 6 VAL QG . 6 VAL QQG 1 1 96 1 2 1 1 21 PHE QE . 21 PHE QE 1 1 97 1 1 1 1 7 ILE H . 7 ILE H 1 1 97 1 2 1 1 8 PRO QB . 8 PRO QB 1 1 98 1 1 1 1 7 ILE HA . 7 ILE HA 1 1 98 1 2 1 1 8 PRO QB . 8 PRO QB 1 1 99 1 1 1 1 7 ILE HA . 7 ILE HA 1 1 99 1 2 1 1 8 PRO QD . 8 PRO QD 1 1 100 1 1 1 1 7 ILE HB . 7 ILE HB 1 1 100 1 2 1 1 8 PRO QD . 8 PRO QD 1 1 101 1 1 1 1 7 ILE MG . 7 ILE QG2 1 1 101 1 2 1 1 8 PRO QD . 8 PRO QD 1 1 102 1 1 1 1 8 PRO QB . 8 PRO QB 1 1 102 1 2 1 1 21 PHE QE . 21 PHE QE 1 1 103 1 1 1 1 8 PRO QB . 8 PRO QB 1 1 103 1 2 1 1 21 PHE HZ . 21 PHE HZ 1 1 104 1 1 1 1 8 PRO QD . 8 PRO QD 1 1 104 1 2 1 1 21 PHE QE . 21 PHE QE 1 1 105 1 1 1 1 8 PRO QD . 8 PRO QD 1 1 105 1 2 1 1 21 PHE HZ . 21 PHE HZ 1 1 106 1 1 1 1 10 VAL H . 10 VAL H 1 1 106 1 2 1 1 10 VAL QG . 10 VAL QQG 1 1 107 1 1 1 1 10 VAL QG . 10 VAL QQG 1 1 107 1 2 1 1 11 DAL H . 11 DAL H 1 1 108 1 1 1 1 10 VAL QG . 10 VAL QQG 1 1 108 1 2 1 1 21 PHE QE . 21 PHE QE 1 1 109 1 1 1 1 11 DAL H . 11 DAL H 1 1 109 1 2 1 1 25 CYS QB . 25 CYS QB 1 1 110 1 1 1 1 11 DAL HB1 . 11 DAL HB3 1 1 110 1 2 1 1 25 CYS QB . 25 CYS QB 1 1 111 1 1 1 1 11 DAL HA . 11 DAL HA 1 1 111 1 2 1 1 25 CYS QB . 25 CYS QB 1 1 112 1 1 1 1 12 HIS H . 12 HIS H 1 1 112 1 2 1 1 25 CYS QB . 25 CYS QB 1 1 113 1 1 1 1 16 MET H . 16 MET H 1 1 113 1 2 1 1 17 ASN QB . 17 ASN QB 1 1 114 1 1 1 1 17 ASN QB . 17 ASN QB 1 1 114 1 2 1 1 18 DAL H . 18 DAL H 1 1 115 1 1 1 1 18 DAL HB1 . 18 DAL HB3 1 1 115 1 2 1 1 26 CYS QB . 26 CYS QB 1 1 116 1 1 1 1 21 PHE H . 21 PHE H 1 1 116 1 2 1 1 21 PHE QB . 21 PHE QB 1 1 117 1 1 1 1 21 PHE QD . 21 PHE QD 1 1 117 1 2 1 1 26 CYS QB . 26 CYS QB 1 1 118 1 1 1 1 21 PHE QE . 21 PHE QE 1 1 118 1 2 1 1 26 CYS QB . 26 CYS QB 1 1 119 1 1 1 1 22 VAL HA . 22 VAL HA 1 1 119 1 2 1 1 22 VAL QG . 22 VAL QQG 1 1 120 1 1 1 1 22 VAL QG . 22 VAL QQG 1 1 120 1 2 1 1 23 PHE H . 23 PHE H 1 1 121 1 1 1 1 23 PHE HA . 23 PHE HA 1 1 121 1 2 1 1 23 PHE QB . 23 PHE QB 1 1 122 1 1 1 1 25 CYS H . 25 CYS H 1 1 122 1 2 1 1 25 CYS QB . 25 CYS QB 1 1 123 1 1 1 1 25 CYS QB . 25 CYS QB 1 1 123 1 2 1 1 26 CYS H . 26 CYS H 1 1 124 1 1 1 1 26 CYS H . 26 CYS H 1 1 124 1 2 1 1 26 CYS QB . 26 CYS QB 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . . . 2.4 1 1 2 1 . . . . . . . 2.4 1 1 3 1 . . . . . . . 4.08 1 1 4 1 . . . . . . . 4.08 1 1 5 1 . . . . . . . 3.65 1 1 6 1 . . . . . . . 3.82 1 1 7 1 . . . . . . . 4.11 1 1 8 1 . . . . . . . 2.4 1 1 9 1 . . . . . . . 2.4 1 1 10 1 . . . . . . . 5.5 1 1 11 1 . . . . . . . 3.87 1 1 12 1 . . . . . . . 4.47 1 1 13 1 . . . . . . . 4.62 1 1 14 1 . . . . . . . 3.1 1 1 15 1 . . . . . . . 4.94 1 1 16 1 . . . . . . . 4.18 1 1 17 1 . . . . . . . 4.4 1 1 18 1 . . . . . . . 5.07 1 1 19 1 . . . . . . . 4.83 1 1 20 1 . . . . . . . 5.5 1 1 21 1 . . . . . . . 4.41 1 1 22 1 . . . . . . . 3.37 1 1 23 1 . . . . . . . 3.44 1 1 24 1 . . . . . . . 4.18 1 1 25 1 . . . . . . . 5.11 1 1 26 1 . . . . . . . 5.11 1 1 27 1 . . . . . . . 3.74 1 1 28 1 . . . . . . . 4.55 1 1 29 1 . . . . . . . 4.44 1 1 30 1 . . . . . . . 4.11 1 1 31 1 . . . . . . . 4.76 1 1 32 1 . . . . . . . 4.36 1 1 33 1 . . . . . . . 2.4 1 1 34 1 . . . . . . . 3.65 1 1 35 1 . . . . . . . 5.18 1 1 36 1 . . . . . . . 4.85 1 1 37 1 . . . . . . . 5.03 1 1 38 1 . . . . . . . 4.83 1 1 39 1 . . . . . . . 3.69 1 1 40 1 . . . . . . . 5.01 1 1 41 1 . . . . . . . 5.01 1 1 42 1 . . . . . . . 3.56 1 1 43 1 . . . . . . . 3.41 1 1 44 1 . . . . . . . 3.42 1 1 45 1 . . . . . . . 2.76 1 1 46 1 . . . . . . . 3.09 1 1 47 1 . . . . . . . 3.98 1 1 48 1 . . . . . . . 4.63 1 1 49 1 . . . . . . . 3.86 1 1 50 1 . . . . . . . 4.28 1 1 51 1 . . . . . . . 3.9 1 1 52 1 . . . . . . . 4.52 1 1 53 1 . . . . . . . 4.52 1 1 54 1 . . . . . . . 3.45 1 1 55 1 . . . . . . . 3.69 1 1 56 1 . . . . . . . 4.5 1 1 57 1 . . . . . . . 4.5 1 1 58 1 . . . . . . . 3.52 1 1 59 1 . . . . . . . 4.61 1 1 60 1 . . . . . . . 4.81 1 1 61 1 . . . . . . . 4.36 1 1 62 1 . . . . . . . 4.62 1 1 63 1 . . . . . . . 4.35 1 1 64 1 . . . . . . . 4.35 1 1 65 1 . . . . . . . 4.18 1 1 66 1 . . . . . . . 5.5 1 1 67 1 . . . . . . . 4.16 1 1 68 1 . . . . . . . 4.64 1 1 69 1 . . . . . . . 4.3 1 1 70 1 . . . . . . . 5.5 1 1 71 1 . . . . . . . 3.28 1 1 72 1 . . . . . . . 4.61 1 1 73 1 . . . . . . . 4.12 1 1 74 1 . . . . . . . 4.26 1 1 75 1 . . . . . . . 4.12 1 1 76 1 . . . . . . . 4.16 1 1 77 1 . . . . . . . 4.16 1 1 78 1 . . . . . . . 3.13 1 1 79 1 . . . . . . . 3.89 1 1 80 1 . . . . . . . 3.74 1 1 81 1 . . . . . . . 5.12 1 1 82 1 . . . . . . . 4.69 1 1 83 1 . . . . . . . 5.5 1 1 84 1 . . . . . . . 5.5 1 1 85 1 . . . . . . . 5.5 1 1 86 1 . . . . . . . 4.04 1 1 87 1 . . . . . . . 4.65 1 1 88 1 . . . . . . . 5.5 1 1 89 1 . . . . . . . 5.5 1 1 90 1 . . . . . . . 5.5 1 1 91 1 . . . . . . . 5.5 1 1 92 1 . . . . . . . 3.32 1 1 93 1 . . . . . . . 3.51 1 1 94 1 . . . . . . . 3.96 1 1 95 1 . . . . . . . 4.03 1 1 96 1 . . . . . . . 3.43 1 1 97 1 . . . . . . . 5.34 1 1 98 1 . . . . . . . 4.79 1 1 99 1 . . . . . . . 3.15 1 1 100 1 . . . . . . . 5.35 1 1 101 1 . . . . . . . 3.16 1 1 102 1 . . . . . . . 5.34 1 1 103 1 . . . . . . . 5.11 1 1 104 1 . . . . . . . 5.35 1 1 105 1 . . . . . . . 5.02 1 1 106 1 . . . . . . . 3.71 1 1 107 1 . . . . . . . 3.9 1 1 108 1 . . . . . . . 3.56 1 1 109 1 . . . . . . . 5.31 1 1 110 1 . . . . . . . 5.25 1 1 111 1 . . . . . . . 2.41 1 1 112 1 . . . . . . . 4.19 1 1 113 1 . . . . . . . 5.34 1 1 114 1 . . . . . . . 3.98 1 1 115 1 . . . . . . . 5.34 1 1 116 1 . . . . . . . 2.42 1 1 117 1 . . . . . . . 5.34 1 1 118 1 . . . . . . . 3.51 1 1 119 1 . . . . . . . 2.85 1 1 120 1 . . . . . . . 5.03 1 1 121 1 . . . . . . . 2.32 1 1 122 1 . . . . . . . 3.49 1 1 123 1 . . . . . . . 3.2 1 1 124 1 . . . . . . . 3.28 1 1 stop_ save_ save_DYANA/DIANA_distance_constraints_4_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type 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 2 2 1 . . . 1 2 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 11 DAL CB . 11 DAL CB 1 2 1 1 2 1 1 25 CYS SG . 25 CYS SG 1 2 2 1 1 1 1 18 DAL CB . 18 DAL CB 1 2 2 1 2 1 1 26 CYS SG . 26 CYS SG 1 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . . . 2.0 1 2 2 1 . . . . . . . 2.0 1 2 stop_ save_ save_DYANA/DIANA_dihedral_3 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 PHI 1 1 6 VAL C 1 1 7 ILE N 1 1 7 ILE CA 1 1 7 ILE C -140.0 -100.0 . 7 ILE . . 7 ILE . . 7 ILE . . 7 ILE . 1 1 2 PHI 1 1 11 DAL C 1 1 12 HIS N 1 1 12 HIS CA 1 1 12 HIS C -140.0 -100.0 . 12 HIS . . 12 HIS . . 12 HIS . . 12 HIS . 1 1 3 PHI 1 1 14 CYS C 1 1 15 HIS N 1 1 15 HIS CA 1 1 15 HIS C -140.0 -100.0 . 15 HIS . . 15 HIS . . 15 HIS . . 15 HIS . 1 1 4 PHI 1 1 18 DAL C 1 1 19 PHE N 1 1 19 PHE CA 1 1 19 PHE C -160.0 -80.0 . 19 PHE . . 19 PHE . . 19 PHE . . 19 PHE . 1 1 5 PHI 1 1 20 GLN C 1 1 21 PHE N 1 1 21 PHE CA 1 1 21 PHE C -140.0 -100.0 . 21 PHE . . 21 PHE . . 21 PHE . . 21 PHE . 1 1 6 PHI 1 1 21 PHE C 1 1 22 VAL N 1 1 22 VAL CA 1 1 22 VAL C -160.0 -80.0 . 22 VAL . . 22 VAL . . 22 VAL . . 22 VAL . 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 LYS C C 1.848 -1.283 -2.031 1.00 . A A . 1 LYS C 1 1 1 2 1 1 1 LYS CA C 2.094 -0.002 -1.241 1.00 . A A . 1 LYS CA 1 1 1 3 1 1 1 LYS CB C 3.588 0.147 -0.943 1.00 . A A . 1 LYS CB 1 1 1 4 1 1 1 LYS CD C 5.617 1.628 -0.929 1.00 . A A . 1 LYS CD 1 1 1 5 1 1 1 LYS CE C 6.320 2.561 -1.903 1.00 . A A . 1 LYS CE 1 1 1 6 1 1 1 LYS CG C 4.128 1.540 -1.218 1.00 . A A . 1 LYS CG 1 1 1 7 1 1 1 LYS H1 H 1.806 0.000 0.856 1.00 . A A . 1 LYS H1 1 1 1 8 1 1 1 LYS HA H 1.769 0.840 -1.833 1.00 . A A . 1 LYS HA 1 1 1 9 1 1 1 LYS HB2 H 3.760 -0.084 0.098 1.00 . A A . 1 LYS HB2 1 1 1 10 1 1 1 LYS HB3 H 4.136 -0.556 -1.554 1.00 . A A . 1 LYS HB3 1 1 1 11 1 1 1 LYS HD2 H 5.759 2.001 0.074 1.00 . A A . 1 LYS HD2 1 1 1 12 1 1 1 LYS HD3 H 6.050 0.641 -1.013 1.00 . A A . 1 LYS HD3 1 1 1 13 1 1 1 LYS HE2 H 5.574 3.122 -2.445 1.00 . A A . 1 LYS HE2 1 1 1 14 1 1 1 LYS HE3 H 6.945 3.240 -1.343 1.00 . A A . 1 LYS HE3 1 1 1 15 1 1 1 LYS HG2 H 3.959 1.783 -2.256 1.00 . A A . 1 LYS HG2 1 1 1 16 1 1 1 LYS HG3 H 3.606 2.248 -0.591 1.00 . A A . 1 LYS HG3 1 1 1 17 1 1 1 LYS HZ1 H 7.337 0.848 -2.530 1.00 . A A . 1 LYS HZ1 1 1 1 18 1 1 1 LYS HZ2 H 8.078 2.294 -2.999 1.00 . A A . 1 LYS HZ2 1 1 1 19 1 1 1 LYS HZ3 H 6.686 1.759 -3.798 1.00 . A A . 1 LYS HZ3 1 1 1 20 1 1 1 LYS N N 1.329 0.000 0.000 1.00 . A A . 1 LYS N 1 1 1 21 1 1 1 LYS NZ N 7.164 1.813 -2.876 1.00 . A A . 1 LYS NZ 1 1 1 22 1 1 1 LYS O O 2.524 -2.291 -1.826 1.00 . A A . 1 LYS O 1 1 1 23 1 1 2 LYS C C 1.078 -2.225 -5.176 1.00 . A A . 2 LYS C 1 1 1 24 1 1 2 LYS CA C 0.540 -2.393 -3.759 1.00 . A A . 2 LYS CA 1 1 1 25 1 1 2 LYS CB C -0.976 -2.595 -3.797 1.00 . A A . 2 LYS CB 1 1 1 26 1 1 2 LYS CD C -1.971 -2.897 -1.510 1.00 . A A . 2 LYS CD 1 1 1 27 1 1 2 LYS CE C -3.410 -2.428 -1.654 1.00 . A A . 2 LYS CE 1 1 1 28 1 1 2 LYS CG C -1.483 -3.593 -2.770 1.00 . A A . 2 LYS CG 1 1 1 29 1 1 2 LYS H H 0.370 -0.404 -3.052 1.00 . A A . 2 LYS H 1 1 1 30 1 1 2 LYS HA H 1.000 -3.262 -3.313 1.00 . A A . 2 LYS HA 1 1 1 31 1 1 2 LYS HB2 H -1.459 -1.646 -3.615 1.00 . A A . 2 LYS HB2 1 1 1 32 1 1 2 LYS HB3 H -1.255 -2.949 -4.780 1.00 . A A . 2 LYS HB3 1 1 1 33 1 1 2 LYS HD2 H -1.910 -3.587 -0.682 1.00 . A A . 2 LYS HD2 1 1 1 34 1 1 2 LYS HD3 H -1.340 -2.041 -1.315 1.00 . A A . 2 LYS HD3 1 1 1 35 1 1 2 LYS HE2 H -3.507 -1.459 -1.189 1.00 . A A . 2 LYS HE2 1 1 1 36 1 1 2 LYS HE3 H -3.645 -2.347 -2.706 1.00 . A A . 2 LYS HE3 1 1 1 37 1 1 2 LYS HG2 H -2.301 -4.153 -3.199 1.00 . A A . 2 LYS HG2 1 1 1 38 1 1 2 LYS HG3 H -0.680 -4.267 -2.510 1.00 . A A . 2 LYS HG3 1 1 1 39 1 1 2 LYS HZ1 H -4.559 -4.172 -1.650 1.00 . A A . 2 LYS HZ1 1 1 1 40 1 1 2 LYS HZ2 H -5.264 -2.885 -0.807 1.00 . A A . 2 LYS HZ2 1 1 1 41 1 1 2 LYS HZ3 H -3.970 -3.735 -0.125 1.00 . A A . 2 LYS HZ3 1 1 1 42 1 1 2 LYS N N 0.875 -1.237 -2.935 1.00 . A A . 2 LYS N 1 1 1 43 1 1 2 LYS NZ N -4.368 -3.371 -1.014 1.00 . A A . 2 LYS NZ 1 1 1 44 1 1 2 LYS O O 1.853 -3.050 -5.659 1.00 . A A . 2 LYS O 1 1 1 45 1 1 3 LYS C C 2.625 -0.914 -7.298 1.00 . A A . 3 LYS C 1 1 1 46 1 1 3 LYS CA C 1.103 -0.872 -7.200 1.00 . A A . 3 LYS CA 1 1 1 47 1 1 3 LYS CB C 0.590 0.496 -7.654 1.00 . A A . 3 LYS CB 1 1 1 48 1 1 3 LYS CD C -0.948 1.780 -9.169 1.00 . A A . 3 LYS CD 1 1 1 49 1 1 3 LYS CE C -2.362 2.200 -8.797 1.00 . A A . 3 LYS CE 1 1 1 50 1 1 3 LYS CG C -0.602 0.418 -8.593 1.00 . A A . 3 LYS CG 1 1 1 51 1 1 3 LYS H H 0.043 -0.529 -5.400 1.00 . A A . 3 LYS H 1 1 1 52 1 1 3 LYS HA H 0.691 -1.634 -7.844 1.00 . A A . 3 LYS HA 1 1 1 53 1 1 3 LYS HB2 H 0.299 1.066 -6.784 1.00 . A A . 3 LYS HB2 1 1 1 54 1 1 3 LYS HB3 H 1.389 1.016 -8.163 1.00 . A A . 3 LYS HB3 1 1 1 55 1 1 3 LYS HD2 H -0.255 2.512 -8.783 1.00 . A A . 3 LYS HD2 1 1 1 56 1 1 3 LYS HD3 H -0.867 1.737 -10.246 1.00 . A A . 3 LYS HD3 1 1 1 57 1 1 3 LYS HE2 H -3.035 1.384 -9.013 1.00 . A A . 3 LYS HE2 1 1 1 58 1 1 3 LYS HE3 H -2.391 2.419 -7.739 1.00 . A A . 3 LYS HE3 1 1 1 59 1 1 3 LYS HG2 H -0.366 -0.255 -9.405 1.00 . A A . 3 LYS HG2 1 1 1 60 1 1 3 LYS HG3 H -1.455 0.040 -8.047 1.00 . A A . 3 LYS HG3 1 1 1 61 1 1 3 LYS HZ1 H -1.979 3.995 -9.793 1.00 . A A . 3 LYS HZ1 1 1 1 62 1 1 3 LYS HZ2 H -3.462 3.966 -8.980 1.00 . A A . 3 LYS HZ2 1 1 1 63 1 1 3 LYS HZ3 H -3.277 3.120 -10.434 1.00 . A A . 3 LYS HZ3 1 1 1 64 1 1 3 LYS N N 0.662 -1.150 -5.838 1.00 . A A . 3 LYS N 1 1 1 65 1 1 3 LYS NZ N -2.801 3.404 -9.554 1.00 . A A . 3 LYS NZ 1 1 1 66 1 1 3 LYS O O 3.313 -0.030 -6.790 1.00 . A A . 3 LYS O 1 1 1 67 1 1 4 SER C C 4.942 -2.333 -9.584 1.00 . A A . 4 SER C 1 1 1 68 1 1 4 SER CA C 4.583 -2.104 -8.119 1.00 . A A . 4 SER CA 1 1 1 69 1 1 4 SER CB C 5.088 -3.272 -7.269 1.00 . A A . 4 SER CB 1 1 1 70 1 1 4 SER H H 2.541 -2.619 -8.339 1.00 . A A . 4 SER H 1 1 1 71 1 1 4 SER HA H 5.056 -1.194 -7.782 1.00 . A A . 4 SER HA 1 1 1 72 1 1 4 SER HB2 H 4.854 -3.087 -6.232 1.00 . A A . 4 SER HB2 1 1 1 73 1 1 4 SER HB3 H 4.605 -4.183 -7.591 1.00 . A A . 4 SER HB3 1 1 1 74 1 1 4 SER HG H 6.866 -3.678 -6.553 1.00 . A A . 4 SER HG 1 1 1 75 1 1 4 SER N N 3.142 -1.946 -7.956 1.00 . A A . 4 SER N 1 1 1 76 1 1 4 SER O O 5.789 -1.638 -10.143 1.00 . A A . 4 SER O 1 1 1 77 1 1 4 SER OG O 6.491 -3.428 -7.400 1.00 . A A . 4 SER OG 1 1 1 78 1 1 5 GLY C C 5.605 -4.698 -11.763 1.00 . A A . 5 GLY C 1 1 1 79 1 1 5 GLY CA C 4.554 -3.619 -11.594 1.00 . A A . 5 GLY CA 1 1 1 80 1 1 5 GLY H H 3.625 -3.836 -9.704 1.00 . A A . 5 GLY H 1 1 1 81 1 1 5 GLY HA2 H 3.637 -3.949 -12.059 1.00 . A A . 5 GLY HA2 1 1 1 82 1 1 5 GLY HA3 H 4.894 -2.721 -12.089 1.00 . A A . 5 GLY HA3 1 1 1 83 1 1 5 GLY N N 4.290 -3.315 -10.200 1.00 . A A . 5 GLY N 1 1 1 84 1 1 5 GLY O O 6.650 -4.467 -12.372 1.00 . A A . 5 GLY O 1 1 1 85 1 1 6 VAL C C 6.477 -7.415 -12.765 1.00 . A A . 6 VAL C 1 1 1 86 1 1 6 VAL CA C 6.261 -6.999 -11.315 1.00 . A A . 6 VAL CA 1 1 1 87 1 1 6 VAL CB C 5.759 -8.215 -10.513 1.00 . A A . 6 VAL CB 1 1 1 88 1 1 6 VAL CG1 C 6.710 -9.391 -10.675 1.00 . A A . 6 VAL CG1 1 1 1 89 1 1 6 VAL CG2 C 5.592 -7.852 -9.045 1.00 . A A . 6 VAL CG2 1 1 1 90 1 1 6 VAL H H 4.481 -6.003 -10.748 1.00 . A A . 6 VAL H 1 1 1 91 1 1 6 VAL HA H 7.206 -6.683 -10.896 1.00 . A A . 6 VAL HA 1 1 1 92 1 1 6 VAL HB H 4.794 -8.504 -10.903 1.00 . A A . 6 VAL HB 1 1 1 93 1 1 6 VAL HG11 H 6.892 -9.842 -9.711 1.00 . A A . 6 VAL HG11 1 1 1 94 1 1 6 VAL HG12 H 6.269 -10.121 -11.338 1.00 . A A . 6 VAL HG12 1 1 1 95 1 1 6 VAL HG13 H 7.644 -9.043 -11.092 1.00 . A A . 6 VAL HG13 1 1 1 96 1 1 6 VAL HG21 H 6.558 -7.856 -8.562 1.00 . A A . 6 VAL HG21 1 1 1 97 1 1 6 VAL HG22 H 5.153 -6.869 -8.964 1.00 . A A . 6 VAL HG22 1 1 1 98 1 1 6 VAL HG23 H 4.947 -8.574 -8.567 1.00 . A A . 6 VAL HG23 1 1 1 99 1 1 6 VAL N N 5.330 -5.880 -11.221 1.00 . A A . 6 VAL N 1 1 1 100 1 1 6 VAL O O 7.494 -7.077 -13.373 1.00 . A A . 6 VAL O 1 1 1 101 1 1 7 ILE C C 4.234 -8.569 -15.372 1.00 . A A . 7 ILE C 1 1 1 102 1 1 7 ILE CA C 5.600 -8.608 -14.695 1.00 . A A . 7 ILE CA 1 1 1 103 1 1 7 ILE CB C 6.160 -10.040 -14.777 1.00 . A A . 7 ILE CB 1 1 1 104 1 1 7 ILE CD1 C 8.062 -11.522 -13.960 1.00 . A A . 7 ILE CD1 1 1 1 105 1 1 7 ILE CG1 C 7.538 -10.111 -14.115 1.00 . A A . 7 ILE CG1 1 1 1 106 1 1 7 ILE CG2 C 6.239 -10.496 -16.227 1.00 . A A . 7 ILE CG2 1 1 1 107 1 1 7 ILE H H 4.729 -8.384 -12.779 1.00 . A A . 7 ILE H 1 1 1 108 1 1 7 ILE HA H 6.272 -7.949 -15.225 1.00 . A A . 7 ILE HA 1 1 1 109 1 1 7 ILE HB H 5.483 -10.699 -14.255 1.00 . A A . 7 ILE HB 1 1 1 110 1 1 7 ILE HD11 H 8.836 -11.701 -14.691 1.00 . A A . 7 ILE HD11 1 1 1 111 1 1 7 ILE HD12 H 8.466 -11.649 -12.967 1.00 . A A . 7 ILE HD12 1 1 1 112 1 1 7 ILE HD13 H 7.255 -12.224 -14.113 1.00 . A A . 7 ILE HD13 1 1 1 113 1 1 7 ILE HG12 H 8.246 -9.559 -14.712 1.00 . A A . 7 ILE HG12 1 1 1 114 1 1 7 ILE HG13 H 7.479 -9.668 -13.132 1.00 . A A . 7 ILE HG13 1 1 1 115 1 1 7 ILE HG21 H 5.264 -10.413 -16.684 1.00 . A A . 7 ILE HG21 1 1 1 116 1 1 7 ILE HG22 H 6.940 -9.872 -16.762 1.00 . A A . 7 ILE HG22 1 1 1 117 1 1 7 ILE HG23 H 6.569 -11.523 -16.265 1.00 . A A . 7 ILE HG23 1 1 1 118 1 1 7 ILE N N 5.515 -8.148 -13.314 1.00 . A A . 7 ILE N 1 1 1 119 1 1 7 ILE O O 3.361 -9.398 -15.114 1.00 . A A . 7 ILE O 1 1 1 120 1 1 8 PRO C C 2.562 -8.517 -18.025 1.00 . A A . 8 PRO C 1 1 1 121 1 1 8 PRO CA C 2.786 -7.414 -16.997 1.00 . A A . 8 PRO CA 1 1 1 122 1 1 8 PRO CB C 2.963 -6.062 -17.694 1.00 . A A . 8 PRO CB 1 1 1 123 1 1 8 PRO CD C 5.039 -6.560 -16.619 1.00 . A A . 8 PRO CD 1 1 1 124 1 1 8 PRO CG C 4.437 -5.894 -17.825 1.00 . A A . 8 PRO CG 1 1 1 125 1 1 8 PRO HA H 1.939 -7.368 -16.329 1.00 . A A . 8 PRO HA 1 1 1 126 1 1 8 PRO HB2 H 2.479 -6.087 -18.660 1.00 . A A . 8 PRO HB2 1 1 1 127 1 1 8 PRO HB3 H 2.529 -5.281 -17.088 1.00 . A A . 8 PRO HB3 1 1 1 128 1 1 8 PRO HD2 H 5.985 -7.014 -16.872 1.00 . A A . 8 PRO HD2 1 1 1 129 1 1 8 PRO HD3 H 5.163 -5.847 -15.817 1.00 . A A . 8 PRO HD3 1 1 1 130 1 1 8 PRO HG2 H 4.782 -6.372 -18.729 1.00 . A A . 8 PRO HG2 1 1 1 131 1 1 8 PRO HG3 H 4.686 -4.843 -17.836 1.00 . A A . 8 PRO HG3 1 1 1 132 1 1 8 PRO N N 4.043 -7.584 -16.262 1.00 . A A . 8 PRO N 1 1 1 133 1 1 8 PRO O O 3.227 -8.560 -19.058 1.00 . A A . 8 PRO O 1 1 1 134 1 1 9 . C C 1.588 -11.828 -17.948 1.00 . A A . 9 DBB C 1 1 1 135 1 1 9 . CA C 1.305 -10.521 -18.640 1.00 . A A . 9 DBB CA 1 1 1 136 1 1 9 . CB C -0.173 -10.459 -19.029 1.00 . A A . 9 DBB CB 1 1 1 137 1 1 9 . CG C -0.648 -11.849 -19.459 1.00 . A A . 9 DBB CG 1 1 1 138 1 1 9 . H H 1.122 -9.321 -16.893 1.00 . A A . 9 DBB H 1 1 1 139 1 1 9 . HA H 1.920 -10.443 -19.536 1.00 . A A . 9 DBB HA 1 1 1 140 1 1 9 . HB2 H -0.303 -9.759 -19.853 1.00 . A A . 9 DBB HB2 1 1 1 141 1 1 9 . HG1 H -1.476 -11.749 -20.160 1.00 . A A . 9 DBB HG1 1 1 1 142 1 1 9 . HG2 H 0.173 -12.380 -19.938 1.00 . A A . 9 DBB HG2 1 1 1 143 1 1 9 . HG3 H -0.979 -12.406 -18.582 1.00 . A A . 9 DBB HG3 1 1 1 144 1 1 9 . N N 1.620 -9.408 -17.733 1.00 . A A . 9 DBB N 1 1 1 145 1 1 9 . O O 2.039 -12.789 -18.573 1.00 . A A . 9 DBB O 1 1 1 146 1 1 10 VAL C C 0.249 -13.611 -15.278 1.00 . A A . 10 VAL C 1 1 1 147 1 1 10 VAL CA C 1.553 -13.079 -15.860 1.00 . A A . 10 VAL CA 1 1 1 148 1 1 10 VAL CB C 2.548 -12.821 -14.713 1.00 . A A . 10 VAL CB 1 1 1 149 1 1 10 VAL CG1 C 3.929 -12.505 -15.264 1.00 . A A . 10 VAL CG1 1 1 1 150 1 1 10 VAL CG2 C 2.050 -11.695 -13.820 1.00 . A A . 10 VAL CG2 1 1 1 151 1 1 10 VAL H H 0.966 -11.075 -16.204 1.00 . A A . 10 VAL H 1 1 1 152 1 1 10 VAL HA H 1.977 -13.828 -16.514 1.00 . A A . 10 VAL HA 1 1 1 153 1 1 10 VAL HB H 2.619 -13.720 -14.117 1.00 . A A . 10 VAL HB 1 1 1 154 1 1 10 VAL HG11 H 4.210 -13.259 -15.985 1.00 . A A . 10 VAL HG11 1 1 1 155 1 1 10 VAL HG12 H 3.913 -11.536 -15.742 1.00 . A A . 10 VAL HG12 1 1 1 156 1 1 10 VAL HG13 H 4.646 -12.496 -14.456 1.00 . A A . 10 VAL HG13 1 1 1 157 1 1 10 VAL HG21 H 1.732 -10.865 -14.433 1.00 . A A . 10 VAL HG21 1 1 1 158 1 1 10 VAL HG22 H 1.216 -12.045 -13.228 1.00 . A A . 10 VAL HG22 1 1 1 159 1 1 10 VAL HG23 H 2.846 -11.375 -13.165 1.00 . A A . 10 VAL HG23 1 1 1 160 1 1 10 VAL N N 1.324 -11.873 -16.646 1.00 . A A . 10 VAL N 1 1 1 161 1 1 10 VAL O O 0.160 -14.775 -14.889 1.00 . A A . 10 VAL O 1 1 1 162 1 1 11 DAL C C -2.636 -14.275 -15.496 1.00 . A A . 11 DAL C 1 1 1 163 1 1 11 DAL CA C -2.074 -13.137 -14.682 1.00 . A A . 11 DAL CA 1 1 1 164 1 1 11 DAL CB C -1.915 -13.581 -13.226 1.00 . A A . 11 DAL CB 1 1 1 165 1 1 11 DAL H H -0.630 -11.836 -15.547 1.00 . A A . 11 DAL H 1 1 1 166 1 1 11 DAL HA H -2.752 -12.285 -14.731 1.00 . A A . 11 DAL HA 1 1 1 167 1 1 11 DAL HB1 H -2.729 -14.254 -12.960 1.00 . A A . 11 DAL HB1 1 1 1 168 1 1 11 DAL HB2 H -0.963 -14.098 -13.107 1.00 . A A . 11 DAL HB2 1 1 1 169 1 1 11 DAL N N -0.762 -12.751 -15.221 1.00 . A A . 11 DAL N 1 1 1 170 1 1 11 DAL O O -1.934 -14.876 -16.309 1.00 . A A . 11 DAL O 1 1 1 171 1 1 12 HIS C C -5.360 -15.110 -17.192 1.00 . A A . 12 HIS C 1 1 1 172 1 1 12 HIS CA C -4.576 -15.655 -16.002 1.00 . A A . 12 HIS CA 1 1 1 173 1 1 12 HIS CB C -5.512 -16.423 -15.069 1.00 . A A . 12 HIS CB 1 1 1 174 1 1 12 HIS CD2 C -4.731 -18.840 -15.592 1.00 . A A . 12 HIS CD2 1 1 1 175 1 1 12 HIS CE1 C -4.455 -19.541 -13.533 1.00 . A A . 12 HIS CE1 1 1 1 176 1 1 12 HIS CG C -5.048 -17.815 -14.767 1.00 . A A . 12 HIS CG 1 1 1 177 1 1 12 HIS H H -4.420 -14.061 -14.618 1.00 . A A . 12 HIS H 1 1 1 178 1 1 12 HIS HA H -3.814 -16.328 -16.367 1.00 . A A . 12 HIS HA 1 1 1 179 1 1 12 HIS HB2 H -5.592 -15.891 -14.132 1.00 . A A . 12 HIS HB2 1 1 1 180 1 1 12 HIS HB3 H -6.490 -16.490 -15.524 1.00 . A A . 12 HIS HB3 1 1 1 181 1 1 12 HIS HD1 H -5.015 -17.777 -12.661 1.00 . A A . 12 HIS HD1 1 1 1 182 1 1 12 HIS HD2 H -4.759 -18.827 -16.672 1.00 . A A . 12 HIS HD2 1 1 1 183 1 1 12 HIS HE1 H -4.231 -20.166 -12.681 1.00 . A A . 12 HIS HE1 1 1 1 184 1 1 12 HIS N N -3.912 -14.576 -15.279 1.00 . A A . 12 HIS N 1 1 1 185 1 1 12 HIS ND1 N -4.866 -18.286 -13.484 1.00 . A A . 12 HIS ND1 1 1 1 186 1 1 12 HIS NE2 N -4.365 -19.901 -14.800 1.00 . A A . 12 HIS NE2 1 1 1 187 1 1 12 HIS O O -5.608 -15.824 -18.164 1.00 . A A . 12 HIS O 1 1 1 188 1 1 13 ASP C C -5.919 -11.832 -18.511 1.00 . A A . 13 ASP C 1 1 1 189 1 1 13 ASP CA C -6.503 -13.202 -18.179 1.00 . A A . 13 ASP CA 1 1 1 190 1 1 13 ASP CB C -7.973 -13.061 -17.780 1.00 . A A . 13 ASP CB 1 1 1 191 1 1 13 ASP CG C -8.142 -12.591 -16.349 1.00 . A A . 13 ASP CG 1 1 1 192 1 1 13 ASP H H -5.519 -13.325 -16.308 1.00 . A A . 13 ASP H 1 1 1 193 1 1 13 ASP HA H -6.435 -13.829 -19.054 1.00 . A A . 13 ASP HA 1 1 1 194 1 1 13 ASP HB2 H -8.449 -12.344 -18.434 1.00 . A A . 13 ASP HB2 1 1 1 195 1 1 13 ASP HB3 H -8.461 -14.018 -17.886 1.00 . A A . 13 ASP HB3 1 1 1 196 1 1 13 ASP N N -5.747 -13.843 -17.109 1.00 . A A . 13 ASP N 1 1 1 197 1 1 13 ASP O O -6.500 -11.068 -19.283 1.00 . A A . 13 ASP O 1 1 1 198 1 1 13 ASP OD1 O -8.578 -13.402 -15.505 1.00 . A A . 13 ASP OD1 1 1 1 199 1 1 13 ASP OD2 O -7.838 -11.412 -16.073 1.00 . A A . 13 ASP OD2 1 1 1 200 1 1 14 CYS C C -3.962 -9.972 -19.647 1.00 . A A . 14 CYS C 1 1 1 201 1 1 14 CYS CA C -4.106 -10.248 -18.153 1.00 . A A . 14 CYS CA 1 1 1 202 1 1 14 CYS CB C -2.729 -10.235 -17.487 1.00 . A A . 14 CYS CB 1 1 1 203 1 1 14 CYS H H -4.353 -12.177 -17.316 1.00 . A A . 14 CYS H 1 1 1 204 1 1 14 CYS HA H -4.716 -9.474 -17.714 1.00 . A A . 14 CYS HA 1 1 1 205 1 1 14 CYS HB2 H -2.844 -9.971 -16.445 1.00 . A A . 14 CYS HB2 1 1 1 206 1 1 14 CYS HB3 H -2.294 -11.222 -17.556 1.00 . A A . 14 CYS HB3 1 1 1 207 1 1 14 CYS N N -4.768 -11.526 -17.922 1.00 . A A . 14 CYS N 1 1 1 208 1 1 14 CYS O O -3.593 -10.857 -20.420 1.00 . A A . 14 CYS O 1 1 1 209 1 1 14 CYS SG S -1.554 -9.058 -18.229 1.00 . A A . 14 CYS SG 1 1 1 210 1 1 15 HIS C C -3.587 -6.938 -21.579 1.00 . A A . 15 HIS C 1 1 1 211 1 1 15 HIS CA C -4.159 -8.346 -21.448 1.00 . A A . 15 HIS CA 1 1 1 212 1 1 15 HIS CB C -5.533 -8.414 -22.115 1.00 . A A . 15 HIS CB 1 1 1 213 1 1 15 HIS CD2 C -4.675 -7.930 -24.514 1.00 . A A . 15 HIS CD2 1 1 1 214 1 1 15 HIS CE1 C -6.006 -9.285 -25.610 1.00 . A A . 15 HIS CE1 1 1 1 215 1 1 15 HIS CG C -5.470 -8.543 -23.606 1.00 . A A . 15 HIS CG 1 1 1 216 1 1 15 HIS H H -4.545 -8.078 -19.384 1.00 . A A . 15 HIS H 1 1 1 217 1 1 15 HIS HA H -3.494 -9.038 -21.941 1.00 . A A . 15 HIS HA 1 1 1 218 1 1 15 HIS HB2 H -6.070 -9.269 -21.731 1.00 . A A . 15 HIS HB2 1 1 1 219 1 1 15 HIS HB3 H -6.085 -7.515 -21.882 1.00 . A A . 15 HIS HB3 1 1 1 220 1 1 15 HIS HD1 H -6.983 -9.969 -23.947 1.00 . A A . 15 HIS HD1 1 1 1 221 1 1 15 HIS HD2 H -3.906 -7.201 -24.305 1.00 . A A . 15 HIS HD2 1 1 1 222 1 1 15 HIS HE1 H -6.489 -9.827 -26.409 1.00 . A A . 15 HIS HE1 1 1 1 223 1 1 15 HIS N N -4.256 -8.739 -20.047 1.00 . A A . 15 HIS N 1 1 1 224 1 1 15 HIS ND1 N -6.293 -9.385 -24.324 1.00 . A A . 15 HIS ND1 1 1 1 225 1 1 15 HIS NE2 N -5.029 -8.409 -25.752 1.00 . A A . 15 HIS NE2 1 1 1 226 1 1 15 HIS O O -4.190 -6.068 -22.207 1.00 . A A . 15 HIS O 1 1 1 227 1 1 16 MET C C -2.593 -4.366 -20.296 1.00 . A A . 16 MET C 1 1 1 228 1 1 16 MET CA C -1.767 -5.418 -21.030 1.00 . A A . 16 MET CA 1 1 1 229 1 1 16 MET CB C -1.549 -4.988 -22.482 1.00 . A A . 16 MET CB 1 1 1 230 1 1 16 MET CE C 0.273 -2.791 -25.061 1.00 . A A . 16 MET CE 1 1 1 231 1 1 16 MET CG C -0.442 -3.960 -22.652 1.00 . A A . 16 MET CG 1 1 1 232 1 1 16 MET H H -1.988 -7.453 -20.494 1.00 . A A . 16 MET H 1 1 1 233 1 1 16 MET HA H -0.808 -5.509 -20.543 1.00 . A A . 16 MET HA 1 1 1 234 1 1 16 MET HB2 H -1.295 -5.859 -23.068 1.00 . A A . 16 MET HB2 1 1 1 235 1 1 16 MET HB3 H -2.466 -4.564 -22.862 1.00 . A A . 16 MET HB3 1 1 1 236 1 1 16 MET HE1 H 0.951 -2.012 -24.745 1.00 . A A . 16 MET HE1 1 1 1 237 1 1 16 MET HE2 H 0.428 -3.000 -26.109 1.00 . A A . 16 MET HE2 1 1 1 238 1 1 16 MET HE3 H -0.746 -2.466 -24.905 1.00 . A A . 16 MET HE3 1 1 1 239 1 1 16 MET HG2 H -0.889 -2.982 -22.749 1.00 . A A . 16 MET HG2 1 1 1 240 1 1 16 MET HG3 H 0.187 -3.981 -21.775 1.00 . A A . 16 MET HG3 1 1 1 241 1 1 16 MET N N -2.420 -6.720 -20.980 1.00 . A A . 16 MET N 1 1 1 242 1 1 16 MET O O -3.309 -3.581 -20.917 1.00 . A A . 16 MET O 1 1 1 243 1 1 16 MET SD S 0.580 -4.274 -24.104 1.00 . A A . 16 MET SD 1 1 1 244 1 1 17 ASN C C -2.327 -2.792 -17.084 1.00 . A A . 17 ASN C 1 1 1 245 1 1 17 ASN CA C -3.228 -3.403 -18.152 1.00 . A A . 17 ASN CA 1 1 1 246 1 1 17 ASN CB C -4.428 -4.086 -17.494 1.00 . A A . 17 ASN CB 1 1 1 247 1 1 17 ASN CG C -5.570 -4.311 -18.465 1.00 . A A . 17 ASN CG 1 1 1 248 1 1 17 ASN H H -1.902 -5.009 -18.533 1.00 . A A . 17 ASN H 1 1 1 249 1 1 17 ASN HA H -3.584 -2.617 -18.800 1.00 . A A . 17 ASN HA 1 1 1 250 1 1 17 ASN HB2 H -4.119 -5.045 -17.103 1.00 . A A . 17 ASN HB2 1 1 1 251 1 1 17 ASN HB3 H -4.786 -3.470 -16.683 1.00 . A A . 17 ASN HB3 1 1 1 252 1 1 17 ASN HD21 H -6.201 -2.445 -18.196 1.00 . A A . 17 ASN HD21 1 1 1 253 1 1 17 ASN HD22 H -7.129 -3.399 -19.297 1.00 . A A . 17 ASN HD22 1 1 1 254 1 1 17 ASN N N -2.489 -4.358 -18.971 1.00 . A A . 17 ASN N 1 1 1 255 1 1 17 ASN ND2 N -6.382 -3.281 -18.674 1.00 . A A . 17 ASN ND2 1 1 1 256 1 1 17 ASN O O -1.904 -1.642 -17.198 1.00 . A A . 17 ASN O 1 1 1 257 1 1 17 ASN OD1 O -5.721 -5.399 -19.022 1.00 . A A . 17 ASN OD1 1 1 1 258 1 1 18 DAL C C -1.964 -2.168 -14.060 1.00 . A A . 18 DAL C 1 1 1 259 1 1 18 DAL CA C -1.180 -3.100 -14.948 1.00 . A A . 18 DAL CA 1 1 1 260 1 1 18 DAL CB C -0.700 -4.301 -14.129 1.00 . A A . 18 DAL CB 1 1 1 261 1 1 18 DAL H H -2.406 -4.477 -16.011 1.00 . A A . 18 DAL H 1 1 1 262 1 1 18 DAL HA H -0.320 -2.573 -15.359 1.00 . A A . 18 DAL HA 1 1 1 263 1 1 18 DAL HB1 H -0.123 -3.951 -13.273 1.00 . A A . 18 DAL HB1 1 1 1 264 1 1 18 DAL HB2 H -1.562 -4.869 -13.779 1.00 . A A . 18 DAL HB2 1 1 1 265 1 1 18 DAL N N -2.038 -3.569 -16.045 1.00 . A A . 18 DAL N 1 1 1 266 1 1 18 DAL O O -1.727 -0.960 -14.047 1.00 . A A . 18 DAL O 1 1 1 267 1 1 19 PHE C C -3.422 -2.262 -10.952 1.00 . A A . 19 PHE C 1 1 1 268 1 1 19 PHE CA C -3.737 -1.936 -12.409 1.00 . A A . 19 PHE CA 1 1 1 269 1 1 19 PHE CB C -5.220 -2.190 -12.691 1.00 . A A . 19 PHE CB 1 1 1 270 1 1 19 PHE CD1 C -6.866 -0.577 -13.682 1.00 . A A . 19 PHE CD1 1 1 1 271 1 1 19 PHE CD2 C -5.151 -1.453 -15.088 1.00 . A A . 19 PHE CD2 1 1 1 272 1 1 19 PHE CE1 C -7.362 0.161 -14.741 1.00 . A A . 19 PHE CE1 1 1 1 273 1 1 19 PHE CE2 C -5.642 -0.718 -16.150 1.00 . A A . 19 PHE CE2 1 1 1 274 1 1 19 PHE CG C -5.756 -1.391 -13.843 1.00 . A A . 19 PHE CG 1 1 1 275 1 1 19 PHE CZ C -6.749 0.089 -15.977 1.00 . A A . 19 PHE CZ 1 1 1 276 1 1 19 PHE H H -3.050 -3.696 -13.364 1.00 . A A . 19 PHE H 1 1 1 277 1 1 19 PHE HA H -3.519 -0.895 -12.587 1.00 . A A . 19 PHE HA 1 1 1 278 1 1 19 PHE HB2 H -5.361 -3.236 -12.919 1.00 . A A . 19 PHE HB2 1 1 1 279 1 1 19 PHE HB3 H -5.794 -1.936 -11.813 1.00 . A A . 19 PHE HB3 1 1 1 280 1 1 19 PHE HD1 H -7.346 -0.520 -12.715 1.00 . A A . 19 PHE HD1 1 1 1 281 1 1 19 PHE HD2 H -4.285 -2.085 -15.226 1.00 . A A . 19 PHE HD2 1 1 1 282 1 1 19 PHE HE1 H -8.228 0.790 -14.602 1.00 . A A . 19 PHE HE1 1 1 1 283 1 1 19 PHE HE2 H -5.162 -0.776 -17.116 1.00 . A A . 19 PHE HE2 1 1 1 284 1 1 19 PHE HZ H -7.135 0.665 -16.805 1.00 . A A . 19 PHE HZ 1 1 1 285 1 1 19 PHE N N -2.908 -2.728 -13.310 1.00 . A A . 19 PHE N 1 1 1 286 1 1 19 PHE O O -3.415 -1.379 -10.095 1.00 . A A . 19 PHE O 1 1 1 287 1 1 20 GLN C C -2.583 -5.482 -9.293 1.00 . A A . 20 GLN C 1 1 1 288 1 1 20 GLN CA C -2.848 -3.980 -9.327 1.00 . A A . 20 GLN CA 1 1 1 289 1 1 20 GLN CB C -3.993 -3.632 -8.374 1.00 . A A . 20 GLN CB 1 1 1 290 1 1 20 GLN CD C -4.700 -2.207 -6.411 1.00 . A A . 20 GLN CD 1 1 1 291 1 1 20 GLN CG C -3.546 -2.866 -7.139 1.00 . A A . 20 GLN CG 1 1 1 292 1 1 20 GLN H H -3.184 -4.195 -11.405 1.00 . A A . 20 GLN H 1 1 1 293 1 1 20 GLN HA H -1.956 -3.463 -9.007 1.00 . A A . 20 GLN HA 1 1 1 294 1 1 20 GLN HB2 H -4.715 -3.028 -8.904 1.00 . A A . 20 GLN HB2 1 1 1 295 1 1 20 GLN HB3 H -4.468 -4.546 -8.051 1.00 . A A . 20 GLN HB3 1 1 1 296 1 1 20 GLN HE21 H -5.507 -3.984 -6.030 1.00 . A A . 20 GLN HE21 1 1 1 297 1 1 20 GLN HE22 H -6.379 -2.619 -5.430 1.00 . A A . 20 GLN HE22 1 1 1 298 1 1 20 GLN HG2 H -3.059 -3.553 -6.462 1.00 . A A . 20 GLN HG2 1 1 1 299 1 1 20 GLN HG3 H -2.845 -2.102 -7.440 1.00 . A A . 20 GLN HG3 1 1 1 300 1 1 20 GLN N N -3.163 -3.537 -10.680 1.00 . A A . 20 GLN N 1 1 1 301 1 1 20 GLN NE2 N -5.623 -3.018 -5.906 1.00 . A A . 20 GLN NE2 1 1 1 302 1 1 20 GLN O O -3.135 -6.238 -10.092 1.00 . A A . 20 GLN O 1 1 1 303 1 1 20 GLN OE1 O -4.763 -0.982 -6.303 1.00 . A A . 20 GLN OE1 1 1 1 304 1 1 21 PHE C C -2.072 -7.926 -7.003 1.00 . A A . 21 PHE C 1 1 1 305 1 1 21 PHE CA C -1.393 -7.319 -8.228 1.00 . A A . 21 PHE CA 1 1 1 306 1 1 21 PHE CB C 0.123 -7.492 -8.123 1.00 . A A . 21 PHE CB 1 1 1 307 1 1 21 PHE CD1 C 0.749 -6.195 -10.178 1.00 . A A . 21 PHE CD1 1 1 1 308 1 1 21 PHE CD2 C 1.586 -8.416 -9.940 1.00 . A A . 21 PHE CD2 1 1 1 309 1 1 21 PHE CE1 C 1.402 -6.075 -11.390 1.00 . A A . 21 PHE CE1 1 1 1 310 1 1 21 PHE CE2 C 2.241 -8.301 -11.152 1.00 . A A . 21 PHE CE2 1 1 1 311 1 1 21 PHE CG C 0.834 -7.365 -9.440 1.00 . A A . 21 PHE CG 1 1 1 312 1 1 21 PHE CZ C 2.148 -7.130 -11.878 1.00 . A A . 21 PHE CZ 1 1 1 313 1 1 21 PHE H H -1.325 -5.256 -7.756 1.00 . A A . 21 PHE H 1 1 1 314 1 1 21 PHE HA H -1.745 -7.830 -9.110 1.00 . A A . 21 PHE HA 1 1 1 315 1 1 21 PHE HB2 H 0.519 -6.738 -7.459 1.00 . A A . 21 PHE HB2 1 1 1 316 1 1 21 PHE HB3 H 0.339 -8.470 -7.720 1.00 . A A . 21 PHE HB3 1 1 1 317 1 1 21 PHE HD1 H 0.165 -5.369 -9.797 1.00 . A A . 21 PHE HD1 1 1 1 318 1 1 21 PHE HD2 H 1.659 -9.332 -9.374 1.00 . A A . 21 PHE HD2 1 1 1 319 1 1 21 PHE HE1 H 1.327 -5.158 -11.956 1.00 . A A . 21 PHE HE1 1 1 1 320 1 1 21 PHE HE2 H 2.824 -9.127 -11.531 1.00 . A A . 21 PHE HE2 1 1 1 321 1 1 21 PHE HZ H 2.660 -7.038 -12.825 1.00 . A A . 21 PHE HZ 1 1 1 322 1 1 21 PHE N N -1.733 -5.907 -8.364 1.00 . A A . 21 PHE N 1 1 1 323 1 1 21 PHE O O -1.560 -7.835 -5.887 1.00 . A A . 21 PHE O 1 1 1 324 1 1 22 VAL C C -3.390 -10.525 -5.771 1.00 . A A . 22 VAL C 1 1 1 325 1 1 22 VAL CA C -3.978 -9.167 -6.136 1.00 . A A . 22 VAL CA 1 1 1 326 1 1 22 VAL CB C -5.461 -9.345 -6.509 1.00 . A A . 22 VAL CB 1 1 1 327 1 1 22 VAL CG1 C -6.262 -9.817 -5.305 1.00 . A A . 22 VAL CG1 1 1 1 328 1 1 22 VAL CG2 C -6.031 -8.048 -7.063 1.00 . A A . 22 VAL CG2 1 1 1 329 1 1 22 VAL H H -3.585 -8.583 -8.132 1.00 . A A . 22 VAL H 1 1 1 330 1 1 22 VAL HA H -3.921 -8.517 -5.275 1.00 . A A . 22 VAL HA 1 1 1 331 1 1 22 VAL HB H -5.530 -10.101 -7.278 1.00 . A A . 22 VAL HB 1 1 1 332 1 1 22 VAL HG11 H -7.282 -9.472 -5.394 1.00 . A A . 22 VAL HG11 1 1 1 333 1 1 22 VAL HG12 H -6.248 -10.896 -5.264 1.00 . A A . 22 VAL HG12 1 1 1 334 1 1 22 VAL HG13 H -5.825 -9.416 -4.403 1.00 . A A . 22 VAL HG13 1 1 1 335 1 1 22 VAL HG21 H -5.689 -7.219 -6.461 1.00 . A A . 22 VAL HG21 1 1 1 336 1 1 22 VAL HG22 H -5.697 -7.914 -8.082 1.00 . A A . 22 VAL HG22 1 1 1 337 1 1 22 VAL HG23 H -7.109 -8.089 -7.041 1.00 . A A . 22 VAL HG23 1 1 1 338 1 1 22 VAL N N -3.228 -8.544 -7.220 1.00 . A A . 22 VAL N 1 1 1 339 1 1 22 VAL O O -3.726 -11.101 -4.736 1.00 . A A . 22 VAL O 1 1 1 340 1 1 23 PHE C C -0.813 -12.606 -7.455 1.00 . A A . 23 PHE C 1 1 1 341 1 1 23 PHE CA C -1.874 -12.324 -6.396 1.00 . A A . 23 PHE CA 1 1 1 342 1 1 23 PHE CB C -2.922 -13.439 -6.398 1.00 . A A . 23 PHE CB 1 1 1 343 1 1 23 PHE CD1 C -2.282 -15.854 -6.630 1.00 . A A . 23 PHE CD1 1 1 1 344 1 1 23 PHE CD2 C -2.089 -14.832 -4.484 1.00 . A A . 23 PHE CD2 1 1 1 345 1 1 23 PHE CE1 C -1.820 -17.048 -6.107 1.00 . A A . 23 PHE CE1 1 1 1 346 1 1 23 PHE CE2 C -1.626 -16.022 -3.956 1.00 . A A . 23 PHE CE2 1 1 1 347 1 1 23 PHE CG C -2.421 -14.734 -5.826 1.00 . A A . 23 PHE CG 1 1 1 348 1 1 23 PHE CZ C -1.493 -17.132 -4.768 1.00 . A A . 23 PHE CZ 1 1 1 349 1 1 23 PHE H H -2.282 -10.526 -7.435 1.00 . A A . 23 PHE H 1 1 1 350 1 1 23 PHE HA H -1.399 -12.290 -5.428 1.00 . A A . 23 PHE HA 1 1 1 351 1 1 23 PHE HB2 H -3.773 -13.126 -5.811 1.00 . A A . 23 PHE HB2 1 1 1 352 1 1 23 PHE HB3 H -3.239 -13.624 -7.413 1.00 . A A . 23 PHE HB3 1 1 1 353 1 1 23 PHE HD1 H -2.538 -15.790 -7.678 1.00 . A A . 23 PHE HD1 1 1 1 354 1 1 23 PHE HD2 H -2.193 -13.966 -3.848 1.00 . A A . 23 PHE HD2 1 1 1 355 1 1 23 PHE HE1 H -1.717 -17.913 -6.744 1.00 . A A . 23 PHE HE1 1 1 1 356 1 1 23 PHE HE2 H -1.371 -16.086 -2.908 1.00 . A A . 23 PHE HE2 1 1 1 357 1 1 23 PHE HZ H -1.131 -18.063 -4.357 1.00 . A A . 23 PHE HZ 1 1 1 358 1 1 23 PHE N N -2.510 -11.032 -6.627 1.00 . A A . 23 PHE N 1 1 1 359 1 1 23 PHE O O -0.580 -13.756 -7.824 1.00 . A A . 23 PHE O 1 1 1 360 1 1 24 DBU C C 0.440 -11.284 -10.291 1.00 . A A . 24 DBU C 1 1 1 361 1 1 24 DBU CA C 0.795 -11.671 -8.893 1.00 . A A . 24 DBU CA 1 1 1 362 1 1 24 DBU CB C 2.054 -12.110 -8.710 1.00 . A A . 24 DBU CB 1 1 1 363 1 1 24 DBU CG C 2.656 -12.556 -7.414 1.00 . A A . 24 DBU CG 1 1 1 364 1 1 24 DBU HG1 H 1.953 -12.532 -6.578 1.00 . A A . 24 DBU HG1 1 1 1 365 1 1 24 DBU HG2 H 3.502 -11.910 -7.160 1.00 . A A . 24 DBU HG2 1 1 1 366 1 1 24 DBU HG3 H 3.025 -13.581 -7.514 1.00 . A A . 24 DBU HG3 1 1 1 367 1 1 24 DBU N N -0.174 -11.547 -7.941 1.00 . A A . 24 DBU N 1 1 1 368 1 1 24 DBU O O 1.317 -11.029 -11.118 1.00 . A A . 24 DBU O 1 1 1 369 1 1 25 CYS C C -1.214 -9.365 -12.131 1.00 . A A . 25 CYS C 1 1 1 370 1 1 25 CYS CA C -1.337 -10.869 -11.902 1.00 . A A . 25 CYS CA 1 1 1 371 1 1 25 CYS CB C -2.792 -11.306 -12.079 1.00 . A A . 25 CYS CB 1 1 1 372 1 1 25 CYS H H -1.508 -11.447 -9.873 1.00 . A A . 25 CYS H 1 1 1 373 1 1 25 CYS HA H -0.725 -11.382 -12.628 1.00 . A A . 25 CYS HA 1 1 1 374 1 1 25 CYS HB2 H -3.431 -10.639 -11.518 1.00 . A A . 25 CYS HB2 1 1 1 375 1 1 25 CYS HB3 H -3.053 -11.249 -13.125 1.00 . A A . 25 CYS HB3 1 1 1 376 1 1 25 CYS N N -0.857 -11.233 -10.574 1.00 . A A . 25 CYS N 1 1 1 377 1 1 25 CYS O O -1.037 -8.595 -11.187 1.00 . A A . 25 CYS O 1 1 1 378 1 1 25 CYS SG S -3.133 -13.003 -11.513 1.00 . A A . 25 CYS SG 1 1 1 379 1 1 26 CYS C C -2.453 -7.082 -14.498 1.00 . A A . 26 CYS C 1 1 1 380 1 1 26 CYS CA C -1.208 -7.544 -13.746 1.00 . A A . 26 CYS CA 1 1 1 381 1 1 26 CYS CB C 0.037 -7.299 -14.600 1.00 . A A . 26 CYS CB 1 1 1 382 1 1 26 CYS H H -1.449 -9.617 -14.101 1.00 . A A . 26 CYS H 1 1 1 383 1 1 26 CYS HA H -1.124 -6.977 -12.832 1.00 . A A . 26 CYS HA 1 1 1 384 1 1 26 CYS HB2 H 0.901 -7.693 -14.085 1.00 . A A . 26 CYS HB2 1 1 1 385 1 1 26 CYS HB3 H -0.077 -7.811 -15.544 1.00 . A A . 26 CYS HB3 1 1 1 386 1 1 26 CYS N N -1.309 -8.955 -13.391 1.00 . A A . 26 CYS N 1 1 1 387 1 1 26 CYS O O -2.391 -6.764 -15.685 1.00 . A A . 26 CYS O 1 1 1 388 1 1 26 CYS SG S 0.360 -5.542 -14.957 1.00 . A A . 26 CYS SG 1 1 1 389 1 1 27 SER C C -5.585 -5.660 -13.484 1.00 . A A . 27 SER C 1 1 1 390 1 1 27 SER CA C -4.843 -6.630 -14.399 1.00 . A A . 27 SER CA 1 1 1 391 1 1 27 SER CB C -5.722 -7.847 -14.692 1.00 . A A . 27 SER CB 1 1 1 392 1 1 27 SER H H -3.567 -7.315 -12.854 1.00 . A A . 27 SER H 1 1 1 393 1 1 27 SER HA H -4.616 -6.128 -15.328 1.00 . A A . 27 SER HA 1 1 1 394 1 1 27 SER HB2 H -6.521 -7.559 -15.357 1.00 . A A . 27 SER HB2 1 1 1 395 1 1 27 SER HB3 H -5.124 -8.616 -15.159 1.00 . A A . 27 SER HB3 1 1 1 396 1 1 27 SER HG H -7.001 -7.797 -13.208 1.00 . A A . 27 SER HG 1 1 1 397 1 1 27 SER N N -3.582 -7.049 -13.797 1.00 . A A . 27 SER N 1 1 1 398 1 1 27 SER O O -6.764 -5.375 -13.691 1.00 . A A . 27 SER O 1 1 1 399 1 1 27 SER OG O -6.286 -8.367 -13.500 1.00 . A A . 27 SER OG 1 1 2 400 1 1 1 LYS C C 4.576 1.277 -5.804 1.00 . A A . 1 LYS C 1 1 2 401 1 1 1 LYS CA C 4.576 1.832 -7.224 1.00 . A A . 1 LYS CA 1 1 2 402 1 1 1 LYS CB C 5.299 0.863 -8.162 1.00 . A A . 1 LYS CB 1 1 2 403 1 1 1 LYS CD C 7.056 1.717 -9.741 1.00 . A A . 1 LYS CD 1 1 2 404 1 1 1 LYS CE C 7.285 2.781 -10.804 1.00 . A A . 1 LYS CE 1 1 2 405 1 1 1 LYS CG C 5.576 1.441 -9.539 1.00 . A A . 1 LYS CG 1 1 2 406 1 1 1 LYS H1 H 4.813 3.848 -7.828 1.00 . A A . 1 LYS H1 1 1 2 407 1 1 1 LYS HA H 3.555 1.945 -7.555 1.00 . A A . 1 LYS HA 1 1 2 408 1 1 1 LYS HB2 H 6.243 0.585 -7.715 1.00 . A A . 1 LYS HB2 1 1 2 409 1 1 1 LYS HB3 H 4.693 -0.023 -8.282 1.00 . A A . 1 LYS HB3 1 1 2 410 1 1 1 LYS HD2 H 7.480 2.059 -8.809 1.00 . A A . 1 LYS HD2 1 1 2 411 1 1 1 LYS HD3 H 7.546 0.804 -10.048 1.00 . A A . 1 LYS HD3 1 1 2 412 1 1 1 LYS HE2 H 6.449 3.464 -10.796 1.00 . A A . 1 LYS HE2 1 1 2 413 1 1 1 LYS HE3 H 8.191 3.319 -10.567 1.00 . A A . 1 LYS HE3 1 1 2 414 1 1 1 LYS HG2 H 5.247 0.736 -10.288 1.00 . A A . 1 LYS HG2 1 1 2 415 1 1 1 LYS HG3 H 5.028 2.366 -9.648 1.00 . A A . 1 LYS HG3 1 1 2 416 1 1 1 LYS HZ1 H 8.385 2.310 -12.515 1.00 . A A . 1 LYS HZ1 1 1 2 417 1 1 1 LYS HZ2 H 6.758 2.656 -12.821 1.00 . A A . 1 LYS HZ2 1 1 2 418 1 1 1 LYS HZ3 H 7.192 1.173 -12.133 1.00 . A A . 1 LYS HZ3 1 1 2 419 1 1 1 LYS N N 5.209 3.145 -7.269 1.00 . A A . 1 LYS N 1 1 2 420 1 1 1 LYS NZ N 7.414 2.188 -12.164 1.00 . A A . 1 LYS NZ 1 1 2 421 1 1 1 LYS O O 5.604 0.819 -5.305 1.00 . A A . 1 LYS O 1 1 2 422 1 1 2 LYS C C 2.132 -0.180 -3.694 1.00 . A A . 2 LYS C 1 1 2 423 1 1 2 LYS CA C 3.280 0.819 -3.795 1.00 . A A . 2 LYS CA 1 1 2 424 1 1 2 LYS CB C 3.047 1.978 -2.824 1.00 . A A . 2 LYS CB 1 1 2 425 1 1 2 LYS CD C 2.609 2.704 -0.459 1.00 . A A . 2 LYS CD 1 1 2 426 1 1 2 LYS CE C 2.718 2.321 1.009 1.00 . A A . 2 LYS CE 1 1 2 427 1 1 2 LYS CG C 3.015 1.554 -1.366 1.00 . A A . 2 LYS CG 1 1 2 428 1 1 2 LYS H H 2.631 1.697 -5.608 1.00 . A A . 2 LYS H 1 1 2 429 1 1 2 LYS HA H 4.200 0.319 -3.531 1.00 . A A . 2 LYS HA 1 1 2 430 1 1 2 LYS HB2 H 3.839 2.702 -2.949 1.00 . A A . 2 LYS HB2 1 1 2 431 1 1 2 LYS HB3 H 2.103 2.447 -3.061 1.00 . A A . 2 LYS HB3 1 1 2 432 1 1 2 LYS HD2 H 3.257 3.546 -0.648 1.00 . A A . 2 LYS HD2 1 1 2 433 1 1 2 LYS HD3 H 1.586 2.978 -0.676 1.00 . A A . 2 LYS HD3 1 1 2 434 1 1 2 LYS HE2 H 1.724 2.218 1.416 1.00 . A A . 2 LYS HE2 1 1 2 435 1 1 2 LYS HE3 H 3.237 1.376 1.084 1.00 . A A . 2 LYS HE3 1 1 2 436 1 1 2 LYS HG2 H 2.304 0.750 -1.249 1.00 . A A . 2 LYS HG2 1 1 2 437 1 1 2 LYS HG3 H 3.999 1.211 -1.079 1.00 . A A . 2 LYS HG3 1 1 2 438 1 1 2 LYS HZ1 H 4.167 2.885 2.404 1.00 . A A . 2 LYS HZ1 1 1 2 439 1 1 2 LYS HZ2 H 2.800 3.881 2.395 1.00 . A A . 2 LYS HZ2 1 1 2 440 1 1 2 LYS HZ3 H 3.945 4.005 1.156 1.00 . A A . 2 LYS HZ3 1 1 2 441 1 1 2 LYS N N 3.416 1.320 -5.157 1.00 . A A . 2 LYS N 1 1 2 442 1 1 2 LYS NZ N 3.460 3.345 1.796 1.00 . A A . 2 LYS NZ 1 1 2 443 1 1 2 LYS O O 2.306 -1.294 -3.199 1.00 . A A . 2 LYS O 1 1 2 444 1 1 3 LYS C C 0.085 -1.998 -4.753 1.00 . A A . 3 LYS C 1 1 2 445 1 1 3 LYS CA C -0.218 -0.636 -4.136 1.00 . A A . 3 LYS CA 1 1 2 446 1 1 3 LYS CB C -1.380 0.025 -4.880 1.00 . A A . 3 LYS CB 1 1 2 447 1 1 3 LYS CD C -2.891 2.026 -4.719 1.00 . A A . 3 LYS CD 1 1 2 448 1 1 3 LYS CE C -4.239 1.679 -5.333 1.00 . A A . 3 LYS CE 1 1 2 449 1 1 3 LYS CG C -2.294 0.840 -3.981 1.00 . A A . 3 LYS CG 1 1 2 450 1 1 3 LYS H H 0.882 1.123 -4.552 1.00 . A A . 3 LYS H 1 1 2 451 1 1 3 LYS HA H -0.497 -0.777 -3.103 1.00 . A A . 3 LYS HA 1 1 2 452 1 1 3 LYS HB2 H -0.979 0.681 -5.639 1.00 . A A . 3 LYS HB2 1 1 2 453 1 1 3 LYS HB3 H -1.971 -0.744 -5.356 1.00 . A A . 3 LYS HB3 1 1 2 454 1 1 3 LYS HD2 H -3.025 2.842 -4.025 1.00 . A A . 3 LYS HD2 1 1 2 455 1 1 3 LYS HD3 H -2.214 2.327 -5.506 1.00 . A A . 3 LYS HD3 1 1 2 456 1 1 3 LYS HE2 H -4.076 1.039 -6.187 1.00 . A A . 3 LYS HE2 1 1 2 457 1 1 3 LYS HE3 H -4.830 1.154 -4.598 1.00 . A A . 3 LYS HE3 1 1 2 458 1 1 3 LYS HG2 H -3.095 0.208 -3.629 1.00 . A A . 3 LYS HG2 1 1 2 459 1 1 3 LYS HG3 H -1.723 1.203 -3.137 1.00 . A A . 3 LYS HG3 1 1 2 460 1 1 3 LYS HZ1 H -5.754 3.099 -5.110 1.00 . A A . 3 LYS HZ1 1 1 2 461 1 1 3 LYS HZ2 H -5.377 2.747 -6.721 1.00 . A A . 3 LYS HZ2 1 1 2 462 1 1 3 LYS HZ3 H -4.336 3.712 -5.801 1.00 . A A . 3 LYS HZ3 1 1 2 463 1 1 3 LYS N N 0.959 0.224 -4.169 1.00 . A A . 3 LYS N 1 1 2 464 1 1 3 LYS NZ N -4.978 2.894 -5.772 1.00 . A A . 3 LYS NZ 1 1 2 465 1 1 3 LYS O O -0.235 -3.037 -4.177 1.00 . A A . 3 LYS O 1 1 2 466 1 1 4 SER C C 2.081 -2.954 -7.720 1.00 . A A . 4 SER C 1 1 2 467 1 1 4 SER CA C 1.051 -3.218 -6.625 1.00 . A A . 4 SER CA 1 1 2 468 1 1 4 SER CB C -0.202 -3.854 -7.230 1.00 . A A . 4 SER CB 1 1 2 469 1 1 4 SER H H 0.935 -1.123 -6.338 1.00 . A A . 4 SER H 1 1 2 470 1 1 4 SER HA H 1.477 -3.898 -5.903 1.00 . A A . 4 SER HA 1 1 2 471 1 1 4 SER HB2 H 0.046 -4.293 -8.185 1.00 . A A . 4 SER HB2 1 1 2 472 1 1 4 SER HB3 H -0.570 -4.622 -6.565 1.00 . A A . 4 SER HB3 1 1 2 473 1 1 4 SER HG H -1.141 -2.508 -8.300 1.00 . A A . 4 SER HG 1 1 2 474 1 1 4 SER N N 0.706 -1.984 -5.929 1.00 . A A . 4 SER N 1 1 2 475 1 1 4 SER O O 2.417 -1.807 -8.008 1.00 . A A . 4 SER O 1 1 2 476 1 1 4 SER OG O -1.222 -2.889 -7.422 1.00 . A A . 4 SER OG 1 1 2 477 1 1 5 GLY C C 4.619 -4.980 -9.333 1.00 . A A . 5 GLY C 1 1 2 478 1 1 5 GLY CA C 3.564 -3.893 -9.383 1.00 . A A . 5 GLY CA 1 1 2 479 1 1 5 GLY H H 2.272 -4.919 -8.056 1.00 . A A . 5 GLY H 1 1 2 480 1 1 5 GLY HA2 H 3.061 -3.936 -10.338 1.00 . A A . 5 GLY HA2 1 1 2 481 1 1 5 GLY HA3 H 4.049 -2.932 -9.286 1.00 . A A . 5 GLY HA3 1 1 2 482 1 1 5 GLY N N 2.578 -4.028 -8.327 1.00 . A A . 5 GLY N 1 1 2 483 1 1 5 GLY O O 5.812 -4.693 -9.226 1.00 . A A . 5 GLY O 1 1 2 484 1 1 6 VAL C C 5.733 -7.604 -10.738 1.00 . A A . 6 VAL C 1 1 2 485 1 1 6 VAL CA C 5.096 -7.366 -9.373 1.00 . A A . 6 VAL CA 1 1 2 486 1 1 6 VAL CB C 4.377 -8.653 -8.924 1.00 . A A . 6 VAL CB 1 1 2 487 1 1 6 VAL CG1 C 5.311 -9.849 -9.026 1.00 . A A . 6 VAL CG1 1 1 2 488 1 1 6 VAL CG2 C 3.848 -8.499 -7.506 1.00 . A A . 6 VAL CG2 1 1 2 489 1 1 6 VAL H H 3.218 -6.397 -9.495 1.00 . A A . 6 VAL H 1 1 2 490 1 1 6 VAL HA H 5.874 -7.145 -8.657 1.00 . A A . 6 VAL HA 1 1 2 491 1 1 6 VAL HB H 3.538 -8.821 -9.582 1.00 . A A . 6 VAL HB 1 1 2 492 1 1 6 VAL HG11 H 6.332 -9.504 -9.089 1.00 . A A . 6 VAL HG11 1 1 2 493 1 1 6 VAL HG12 H 5.193 -10.474 -8.152 1.00 . A A . 6 VAL HG12 1 1 2 494 1 1 6 VAL HG13 H 5.069 -10.419 -9.911 1.00 . A A . 6 VAL HG13 1 1 2 495 1 1 6 VAL HG21 H 3.184 -9.320 -7.279 1.00 . A A . 6 VAL HG21 1 1 2 496 1 1 6 VAL HG22 H 4.674 -8.501 -6.810 1.00 . A A . 6 VAL HG22 1 1 2 497 1 1 6 VAL HG23 H 3.309 -7.567 -7.421 1.00 . A A . 6 VAL HG23 1 1 2 498 1 1 6 VAL N N 4.180 -6.232 -9.410 1.00 . A A . 6 VAL N 1 1 2 499 1 1 6 VAL O O 6.868 -7.196 -10.983 1.00 . A A . 6 VAL O 1 1 2 500 1 1 7 ILE C C 4.367 -8.454 -13.994 1.00 . A A . 7 ILE C 1 1 2 501 1 1 7 ILE CA C 5.487 -8.555 -12.963 1.00 . A A . 7 ILE CA 1 1 2 502 1 1 7 ILE CB C 6.115 -9.959 -13.041 1.00 . A A . 7 ILE CB 1 1 2 503 1 1 7 ILE CD1 C 7.941 -11.432 -12.055 1.00 . A A . 7 ILE CD1 1 1 2 504 1 1 7 ILE CG1 C 7.324 -10.052 -12.108 1.00 . A A . 7 ILE CG1 1 1 2 505 1 1 7 ILE CG2 C 6.518 -10.281 -14.472 1.00 . A A . 7 ILE CG2 1 1 2 506 1 1 7 ILE H H 4.097 -8.565 -11.367 1.00 . A A . 7 ILE H 1 1 2 507 1 1 7 ILE HA H 6.249 -7.828 -13.203 1.00 . A A . 7 ILE HA 1 1 2 508 1 1 7 ILE HB H 5.374 -10.679 -12.730 1.00 . A A . 7 ILE HB 1 1 2 509 1 1 7 ILE HD11 H 8.418 -11.651 -12.999 1.00 . A A . 7 ILE HD11 1 1 2 510 1 1 7 ILE HD12 H 8.674 -11.470 -11.263 1.00 . A A . 7 ILE HD12 1 1 2 511 1 1 7 ILE HD13 H 7.170 -12.165 -11.865 1.00 . A A . 7 ILE HD13 1 1 2 512 1 1 7 ILE HG12 H 8.083 -9.363 -12.442 1.00 . A A . 7 ILE HG12 1 1 2 513 1 1 7 ILE HG13 H 7.018 -9.786 -11.106 1.00 . A A . 7 ILE HG13 1 1 2 514 1 1 7 ILE HG21 H 5.638 -10.292 -15.099 1.00 . A A . 7 ILE HG21 1 1 2 515 1 1 7 ILE HG22 H 7.205 -9.529 -14.830 1.00 . A A . 7 ILE HG22 1 1 2 516 1 1 7 ILE HG23 H 6.994 -11.249 -14.503 1.00 . A A . 7 ILE HG23 1 1 2 517 1 1 7 ILE N N 4.994 -8.265 -11.622 1.00 . A A . 7 ILE N 1 1 2 518 1 1 7 ILE O O 3.454 -9.279 -14.038 1.00 . A A . 7 ILE O 1 1 2 519 1 1 8 PRO C C 3.510 -8.232 -17.002 1.00 . A A . 8 PRO C 1 1 2 520 1 1 8 PRO CA C 3.440 -7.188 -15.893 1.00 . A A . 8 PRO CA 1 1 2 521 1 1 8 PRO CB C 3.811 -5.806 -16.436 1.00 . A A . 8 PRO CB 1 1 2 522 1 1 8 PRO CD C 5.499 -6.399 -14.850 1.00 . A A . 8 PRO CD 1 1 2 523 1 1 8 PRO CG C 5.263 -5.659 -16.138 1.00 . A A . 8 PRO CG 1 1 2 524 1 1 8 PRO HA H 2.439 -7.161 -15.489 1.00 . A A . 8 PRO HA 1 1 2 525 1 1 8 PRO HB2 H 3.619 -5.771 -17.500 1.00 . A A . 8 PRO HB2 1 1 2 526 1 1 8 PRO HB3 H 3.227 -5.049 -15.935 1.00 . A A . 8 PRO HB3 1 1 2 527 1 1 8 PRO HD2 H 6.476 -6.858 -14.852 1.00 . A A . 8 PRO HD2 1 1 2 528 1 1 8 PRO HD3 H 5.394 -5.731 -14.008 1.00 . A A . 8 PRO HD3 1 1 2 529 1 1 8 PRO HG2 H 5.847 -6.096 -16.934 1.00 . A A . 8 PRO HG2 1 1 2 530 1 1 8 PRO HG3 H 5.510 -4.614 -16.021 1.00 . A A . 8 PRO HG3 1 1 2 531 1 1 8 PRO N N 4.438 -7.420 -14.845 1.00 . A A . 8 PRO N 1 1 2 532 1 1 8 PRO O O 4.335 -8.134 -17.908 1.00 . A A . 8 PRO O 1 1 2 533 1 1 9 . C C 2.776 -11.635 -17.250 1.00 . A A . 9 DBB C 1 1 2 534 1 1 9 . CA C 2.600 -10.303 -17.929 1.00 . A A . 9 DBB CA 1 1 2 535 1 1 9 . CB C 1.253 -10.273 -18.655 1.00 . A A . 9 DBB CB 1 1 2 536 1 1 9 . CG C 0.723 -8.838 -18.687 1.00 . A A . 9 DBB CG 1 1 2 537 1 1 9 . H H 2.003 -9.255 -16.176 1.00 . A A . 9 DBB H 1 1 2 538 1 1 9 . HA H 3.404 -10.151 -18.648 1.00 . A A . 9 DBB HA 1 1 2 539 1 1 9 . HB2 H 0.543 -10.910 -18.131 1.00 . A A . 9 DBB HB2 1 1 2 540 1 1 9 . HG1 H -0.150 -8.788 -19.339 1.00 . A A . 9 DBB HG1 1 1 2 541 1 1 9 . HG2 H 0.444 -8.531 -17.680 1.00 . A A . 9 DBB HG2 1 1 2 542 1 1 9 . HG3 H 1.499 -8.173 -19.068 1.00 . A A . 9 DBB HG3 1 1 2 543 1 1 9 . N N 2.637 -9.232 -16.923 1.00 . A A . 9 DBB N 1 1 2 544 1 1 9 . O O 3.589 -12.457 -17.674 1.00 . A A . 9 DBB O 1 1 2 545 1 1 10 VAL C C 0.715 -13.775 -15.351 1.00 . A A . 10 VAL C 1 1 2 546 1 1 10 VAL CA C 2.083 -13.109 -15.441 1.00 . A A . 10 VAL CA 1 1 2 547 1 1 10 VAL CB C 2.626 -12.883 -14.017 1.00 . A A . 10 VAL CB 1 1 2 548 1 1 10 VAL CG1 C 2.487 -14.148 -13.185 1.00 . A A . 10 VAL CG1 1 1 2 549 1 1 10 VAL CG2 C 4.076 -12.425 -14.067 1.00 . A A . 10 VAL CG2 1 1 2 550 1 1 10 VAL H H 1.381 -11.165 -15.897 1.00 . A A . 10 VAL H 1 1 2 551 1 1 10 VAL HA H 2.761 -13.769 -15.962 1.00 . A A . 10 VAL HA 1 1 2 552 1 1 10 VAL HB H 2.041 -12.105 -13.550 1.00 . A A . 10 VAL HB 1 1 2 553 1 1 10 VAL HG11 H 2.962 -14.971 -13.700 1.00 . A A . 10 VAL HG11 1 1 2 554 1 1 10 VAL HG12 H 2.959 -14.002 -12.225 1.00 . A A . 10 VAL HG12 1 1 2 555 1 1 10 VAL HG13 H 1.440 -14.371 -13.042 1.00 . A A . 10 VAL HG13 1 1 2 556 1 1 10 VAL HG21 H 4.122 -11.423 -14.469 1.00 . A A . 10 VAL HG21 1 1 2 557 1 1 10 VAL HG22 H 4.491 -12.431 -13.070 1.00 . A A . 10 VAL HG22 1 1 2 558 1 1 10 VAL HG23 H 4.644 -13.093 -14.697 1.00 . A A . 10 VAL HG23 1 1 2 559 1 1 10 VAL N N 2.010 -11.858 -16.187 1.00 . A A . 10 VAL N 1 1 2 560 1 1 10 VAL O O 0.614 -14.980 -15.127 1.00 . A A . 10 VAL O 1 1 2 561 1 1 11 DAL C C -1.908 -14.530 -16.549 1.00 . A A . 11 DAL C 1 1 2 562 1 1 11 DAL CA C -1.711 -13.499 -15.467 1.00 . A A . 11 DAL CA 1 1 2 563 1 1 11 DAL CB C -1.953 -14.141 -14.099 1.00 . A A . 11 DAL CB 1 1 2 564 1 1 11 DAL H H -0.192 -12.028 -15.704 1.00 . A A . 11 DAL H 1 1 2 565 1 1 11 DAL HA H -2.414 -12.679 -15.614 1.00 . A A . 11 DAL HA 1 1 2 566 1 1 11 DAL HB1 H -2.827 -14.789 -14.151 1.00 . A A . 11 DAL HB1 1 1 2 567 1 1 11 DAL HB2 H -1.081 -14.730 -13.816 1.00 . A A . 11 DAL HB2 1 1 2 568 1 1 11 DAL N N -0.337 -12.982 -15.528 1.00 . A A . 11 DAL N 1 1 2 569 1 1 11 DAL O O -0.944 -15.103 -17.057 1.00 . A A . 11 DAL O 1 1 2 570 1 1 12 HIS C C -3.725 -15.058 -19.282 1.00 . A A . 12 HIS C 1 1 2 571 1 1 12 HIS CA C -3.491 -15.747 -17.941 1.00 . A A . 12 HIS CA 1 1 2 572 1 1 12 HIS CB C -4.730 -16.550 -17.544 1.00 . A A . 12 HIS CB 1 1 2 573 1 1 12 HIS CD2 C -4.649 -18.452 -15.783 1.00 . A A . 12 HIS CD2 1 1 2 574 1 1 12 HIS CE1 C -3.638 -19.971 -16.998 1.00 . A A . 12 HIS CE1 1 1 2 575 1 1 12 HIS CG C -4.414 -17.909 -17.000 1.00 . A A . 12 HIS CG 1 1 2 576 1 1 12 HIS H H -3.890 -14.284 -16.464 1.00 . A A . 12 HIS H 1 1 2 577 1 1 12 HIS HA H -2.653 -16.420 -18.039 1.00 . A A . 12 HIS HA 1 1 2 578 1 1 12 HIS HB2 H -5.274 -16.007 -16.784 1.00 . A A . 12 HIS HB2 1 1 2 579 1 1 12 HIS HB3 H -5.362 -16.677 -18.411 1.00 . A A . 12 HIS HB3 1 1 2 580 1 1 12 HIS HD1 H -3.478 -18.797 -18.666 1.00 . A A . 12 HIS HD1 1 1 2 581 1 1 12 HIS HD2 H -5.133 -17.968 -14.946 1.00 . A A . 12 HIS HD2 1 1 2 582 1 1 12 HIS HE1 H -3.176 -20.895 -17.313 1.00 . A A . 12 HIS HE1 1 1 2 583 1 1 12 HIS N N -3.165 -14.773 -16.906 1.00 . A A . 12 HIS N 1 1 2 584 1 1 12 HIS ND1 N -3.779 -18.886 -17.738 1.00 . A A . 12 HIS ND1 1 1 2 585 1 1 12 HIS NE2 N -4.157 -19.734 -15.807 1.00 . A A . 12 HIS NE2 1 1 2 586 1 1 12 HIS O O -3.370 -15.589 -20.335 1.00 . A A . 12 HIS O 1 1 2 587 1 1 13 ASP C C -3.418 -12.236 -20.827 1.00 . A A . 13 ASP C 1 1 2 588 1 1 13 ASP CA C -4.607 -13.112 -20.448 1.00 . A A . 13 ASP CA 1 1 2 589 1 1 13 ASP CB C -5.853 -12.246 -20.253 1.00 . A A . 13 ASP CB 1 1 2 590 1 1 13 ASP CG C -7.104 -12.899 -20.807 1.00 . A A . 13 ASP CG 1 1 2 591 1 1 13 ASP H H -4.585 -13.503 -18.367 1.00 . A A . 13 ASP H 1 1 2 592 1 1 13 ASP HA H -4.790 -13.815 -21.247 1.00 . A A . 13 ASP HA 1 1 2 593 1 1 13 ASP HB2 H -5.999 -12.069 -19.197 1.00 . A A . 13 ASP HB2 1 1 2 594 1 1 13 ASP HB3 H -5.709 -11.301 -20.756 1.00 . A A . 13 ASP HB3 1 1 2 595 1 1 13 ASP N N -4.326 -13.874 -19.236 1.00 . A A . 13 ASP N 1 1 2 596 1 1 13 ASP O O -3.142 -12.022 -22.008 1.00 . A A . 13 ASP O 1 1 2 597 1 1 13 ASP OD1 O -7.235 -14.135 -20.679 1.00 . A A . 13 ASP OD1 1 1 2 598 1 1 13 ASP OD2 O -7.953 -12.175 -21.367 1.00 . A A . 13 ASP OD2 1 1 2 599 1 1 14 CYS C C -1.901 -9.734 -20.998 1.00 . A A . 14 CYS C 1 1 2 600 1 1 14 CYS CA C -1.557 -10.875 -20.045 1.00 . A A . 14 CYS CA 1 1 2 601 1 1 14 CYS CB C -0.396 -11.695 -20.611 1.00 . A A . 14 CYS CB 1 1 2 602 1 1 14 CYS H H -2.985 -11.936 -18.898 1.00 . A A . 14 CYS H 1 1 2 603 1 1 14 CYS HA H -1.262 -10.457 -19.094 1.00 . A A . 14 CYS HA 1 1 2 604 1 1 14 CYS HB2 H -0.362 -12.650 -20.108 1.00 . A A . 14 CYS HB2 1 1 2 605 1 1 14 CYS HB3 H -0.559 -11.855 -21.666 1.00 . A A . 14 CYS HB3 1 1 2 606 1 1 14 CYS N N -2.716 -11.730 -19.818 1.00 . A A . 14 CYS N 1 1 2 607 1 1 14 CYS O O -1.292 -9.591 -22.058 1.00 . A A . 14 CYS O 1 1 2 608 1 1 14 CYS SG S 1.235 -10.908 -20.414 1.00 . A A . 14 CYS SG 1 1 2 609 1 1 15 HIS C C -3.626 -6.581 -20.561 1.00 . A A . 15 HIS C 1 1 2 610 1 1 15 HIS CA C -3.306 -7.793 -21.431 1.00 . A A . 15 HIS CA 1 1 2 611 1 1 15 HIS CB C -4.529 -8.173 -22.267 1.00 . A A . 15 HIS CB 1 1 2 612 1 1 15 HIS CD2 C -6.099 -6.525 -23.509 1.00 . A A . 15 HIS CD2 1 1 2 613 1 1 15 HIS CE1 C -4.647 -5.714 -24.938 1.00 . A A . 15 HIS CE1 1 1 2 614 1 1 15 HIS CG C -4.913 -7.133 -23.273 1.00 . A A . 15 HIS CG 1 1 2 615 1 1 15 HIS H H -3.329 -9.088 -19.756 1.00 . A A . 15 HIS H 1 1 2 616 1 1 15 HIS HA H -2.492 -7.540 -22.094 1.00 . A A . 15 HIS HA 1 1 2 617 1 1 15 HIS HB2 H -4.322 -9.089 -22.800 1.00 . A A . 15 HIS HB2 1 1 2 618 1 1 15 HIS HB3 H -5.372 -8.328 -21.609 1.00 . A A . 15 HIS HB3 1 1 2 619 1 1 15 HIS HD1 H -3.078 -6.843 -24.267 1.00 . A A . 15 HIS HD1 1 1 2 620 1 1 15 HIS HD2 H -7.025 -6.697 -22.979 1.00 . A A . 15 HIS HD2 1 1 2 621 1 1 15 HIS HE1 H -4.202 -5.139 -25.736 1.00 . A A . 15 HIS HE1 1 1 2 622 1 1 15 HIS N N -2.881 -8.923 -20.612 1.00 . A A . 15 HIS N 1 1 2 623 1 1 15 HIS ND1 N -4.024 -6.603 -24.185 1.00 . A A . 15 HIS ND1 1 1 2 624 1 1 15 HIS NE2 N -5.907 -5.648 -24.548 1.00 . A A . 15 HIS NE2 1 1 2 625 1 1 15 HIS O O -4.785 -6.193 -20.424 1.00 . A A . 15 HIS O 1 1 2 626 1 1 16 MET C C -1.416 -4.176 -18.804 1.00 . A A . 16 MET C 1 1 2 627 1 1 16 MET CA C -2.762 -4.822 -19.119 1.00 . A A . 16 MET CA 1 1 2 628 1 1 16 MET CB C -3.469 -5.214 -17.820 1.00 . A A . 16 MET CB 1 1 2 629 1 1 16 MET CE C -6.730 -2.638 -17.996 1.00 . A A . 16 MET CE 1 1 2 630 1 1 16 MET CG C -4.894 -4.696 -17.724 1.00 . A A . 16 MET CG 1 1 2 631 1 1 16 MET H H -1.689 -6.346 -20.122 1.00 . A A . 16 MET H 1 1 2 632 1 1 16 MET HA H -3.374 -4.109 -19.650 1.00 . A A . 16 MET HA 1 1 2 633 1 1 16 MET HB2 H -3.495 -6.291 -17.750 1.00 . A A . 16 MET HB2 1 1 2 634 1 1 16 MET HB3 H -2.908 -4.820 -16.986 1.00 . A A . 16 MET HB3 1 1 2 635 1 1 16 MET HE1 H -7.152 -2.099 -17.161 1.00 . A A . 16 MET HE1 1 1 2 636 1 1 16 MET HE2 H -6.871 -2.067 -18.902 1.00 . A A . 16 MET HE2 1 1 2 637 1 1 16 MET HE3 H -7.223 -3.595 -18.093 1.00 . A A . 16 MET HE3 1 1 2 638 1 1 16 MET HG2 H -5.456 -5.066 -18.568 1.00 . A A . 16 MET HG2 1 1 2 639 1 1 16 MET HG3 H -5.336 -5.066 -16.811 1.00 . A A . 16 MET HG3 1 1 2 640 1 1 16 MET N N -2.590 -5.990 -19.975 1.00 . A A . 16 MET N 1 1 2 641 1 1 16 MET O O -0.392 -4.540 -19.381 1.00 . A A . 16 MET O 1 1 2 642 1 1 16 MET SD S -4.980 -2.895 -17.719 1.00 . A A . 16 MET SD 1 1 2 643 1 1 17 ASN C C 0.149 -2.817 -16.041 1.00 . A A . 17 ASN C 1 1 2 644 1 1 17 ASN CA C -0.206 -2.519 -17.494 1.00 . A A . 17 ASN CA 1 1 2 645 1 1 17 ASN CB C -0.369 -1.011 -17.692 1.00 . A A . 17 ASN CB 1 1 2 646 1 1 17 ASN CG C 0.767 -0.220 -17.073 1.00 . A A . 17 ASN CG 1 1 2 647 1 1 17 ASN H H -2.274 -2.970 -17.460 1.00 . A A . 17 ASN H 1 1 2 648 1 1 17 ASN HA H 0.594 -2.872 -18.128 1.00 . A A . 17 ASN HA 1 1 2 649 1 1 17 ASN HB2 H -0.399 -0.794 -18.750 1.00 . A A . 17 ASN HB2 1 1 2 650 1 1 17 ASN HB3 H -1.295 -0.692 -17.237 1.00 . A A . 17 ASN HB3 1 1 2 651 1 1 17 ASN HD21 H -0.531 0.959 -16.136 1.00 . A A . 17 ASN HD21 1 1 2 652 1 1 17 ASN HD22 H 1.138 1.314 -15.864 1.00 . A A . 17 ASN HD22 1 1 2 653 1 1 17 ASN N N -1.426 -3.216 -17.885 1.00 . A A . 17 ASN N 1 1 2 654 1 1 17 ASN ND2 N 0.423 0.786 -16.277 1.00 . A A . 17 ASN ND2 1 1 2 655 1 1 17 ASN O O 1.318 -2.782 -15.657 1.00 . A A . 17 ASN O 1 1 2 656 1 1 17 ASN OD1 O 1.940 -0.510 -17.308 1.00 . A A . 17 ASN OD1 1 1 2 657 1 1 18 DAL C C -1.544 -2.531 -12.976 1.00 . A A . 18 DAL C 1 1 2 658 1 1 18 DAL CA C -0.661 -3.419 -13.815 1.00 . A A . 18 DAL CA 1 1 2 659 1 1 18 DAL CB C -1.017 -4.885 -13.555 1.00 . A A . 18 DAL CB 1 1 2 660 1 1 18 DAL H H -1.777 -3.124 -15.602 1.00 . A A . 18 DAL H 1 1 2 661 1 1 18 DAL HA H 0.383 -3.246 -13.554 1.00 . A A . 18 DAL HA 1 1 2 662 1 1 18 DAL HB1 H -1.327 -5.005 -12.517 1.00 . A A . 18 DAL HB1 1 1 2 663 1 1 18 DAL HB2 H -1.832 -5.182 -14.214 1.00 . A A . 18 DAL HB2 1 1 2 664 1 1 18 DAL N N -0.868 -3.112 -15.238 1.00 . A A . 18 DAL N 1 1 2 665 1 1 18 DAL O O -1.066 -1.602 -12.324 1.00 . A A . 18 DAL O 1 1 2 666 1 1 19 PHE C C -4.016 -2.635 -10.837 1.00 . A A . 19 PHE C 1 1 2 667 1 1 19 PHE CA C -3.802 -2.029 -12.221 1.00 . A A . 19 PHE CA 1 1 2 668 1 1 19 PHE CB C -5.137 -1.946 -12.965 1.00 . A A . 19 PHE CB 1 1 2 669 1 1 19 PHE CD1 C -6.640 -3.732 -12.045 1.00 . A A . 19 PHE CD1 1 1 2 670 1 1 19 PHE CD2 C -5.709 -4.044 -14.218 1.00 . A A . 19 PHE CD2 1 1 2 671 1 1 19 PHE CE1 C -7.292 -4.947 -12.146 1.00 . A A . 19 PHE CE1 1 1 2 672 1 1 19 PHE CE2 C -6.358 -5.259 -14.325 1.00 . A A . 19 PHE CE2 1 1 2 673 1 1 19 PHE CG C -5.843 -3.267 -13.078 1.00 . A A . 19 PHE CG 1 1 2 674 1 1 19 PHE CZ C -7.150 -5.712 -13.287 1.00 . A A . 19 PHE CZ 1 1 2 675 1 1 19 PHE H H -3.162 -3.566 -13.528 1.00 . A A . 19 PHE H 1 1 2 676 1 1 19 PHE HA H -3.401 -1.034 -12.107 1.00 . A A . 19 PHE HA 1 1 2 677 1 1 19 PHE HB2 H -5.791 -1.265 -12.442 1.00 . A A . 19 PHE HB2 1 1 2 678 1 1 19 PHE HB3 H -4.961 -1.575 -13.963 1.00 . A A . 19 PHE HB3 1 1 2 679 1 1 19 PHE HD1 H -6.752 -3.134 -11.151 1.00 . A A . 19 PHE HD1 1 1 2 680 1 1 19 PHE HD2 H -5.089 -3.692 -15.029 1.00 . A A . 19 PHE HD2 1 1 2 681 1 1 19 PHE HE1 H -7.910 -5.298 -11.333 1.00 . A A . 19 PHE HE1 1 1 2 682 1 1 19 PHE HE2 H -6.245 -5.855 -15.218 1.00 . A A . 19 PHE HE2 1 1 2 683 1 1 19 PHE HZ H -7.658 -6.661 -13.369 1.00 . A A . 19 PHE HZ 1 1 2 684 1 1 19 PHE N N -2.842 -2.813 -12.989 1.00 . A A . 19 PHE N 1 1 2 685 1 1 19 PHE O O -4.286 -1.922 -9.871 1.00 . A A . 19 PHE O 1 1 2 686 1 1 20 GLN C C -3.770 -6.145 -9.640 1.00 . A A . 20 GLN C 1 1 2 687 1 1 20 GLN CA C -4.073 -4.658 -9.485 1.00 . A A . 20 GLN CA 1 1 2 688 1 1 20 GLN CB C -5.501 -4.468 -8.971 1.00 . A A . 20 GLN CB 1 1 2 689 1 1 20 GLN CD C -6.822 -3.691 -6.962 1.00 . A A . 20 GLN CD 1 1 2 690 1 1 20 GLN CG C -5.605 -4.450 -7.455 1.00 . A A . 20 GLN CG 1 1 2 691 1 1 20 GLN H H -3.676 -4.469 -11.555 1.00 . A A . 20 GLN H 1 1 2 692 1 1 20 GLN HA H -3.384 -4.235 -8.770 1.00 . A A . 20 GLN HA 1 1 2 693 1 1 20 GLN HB2 H -5.885 -3.532 -9.348 1.00 . A A . 20 GLN HB2 1 1 2 694 1 1 20 GLN HB3 H -6.115 -5.275 -9.342 1.00 . A A . 20 GLN HB3 1 1 2 695 1 1 20 GLN HE21 H -5.656 -2.295 -6.159 1.00 . A A . 20 GLN HE21 1 1 2 696 1 1 20 GLN HE22 H -7.356 -2.057 -5.964 1.00 . A A . 20 GLN HE22 1 1 2 697 1 1 20 GLN HG2 H -5.666 -5.467 -7.098 1.00 . A A . 20 GLN HG2 1 1 2 698 1 1 20 GLN HG3 H -4.719 -3.981 -7.052 1.00 . A A . 20 GLN HG3 1 1 2 699 1 1 20 GLN N N -3.893 -3.956 -10.750 1.00 . A A . 20 GLN N 1 1 2 700 1 1 20 GLN NE2 N -6.589 -2.568 -6.293 1.00 . A A . 20 GLN NE2 1 1 2 701 1 1 20 GLN O O -3.875 -6.700 -10.734 1.00 . A A . 20 GLN O 1 1 2 702 1 1 20 GLN OE1 O -7.959 -4.111 -7.179 1.00 . A A . 20 GLN OE1 1 1 2 703 1 1 21 PHE C C -4.007 -8.983 -7.627 1.00 . A A . 21 PHE C 1 1 2 704 1 1 21 PHE CA C -3.073 -8.207 -8.551 1.00 . A A . 21 PHE CA 1 1 2 705 1 1 21 PHE CB C -1.619 -8.428 -8.127 1.00 . A A . 21 PHE CB 1 1 2 706 1 1 21 PHE CD1 C 0.270 -9.130 -9.622 1.00 . A A . 21 PHE CD1 1 1 2 707 1 1 21 PHE CD2 C -0.592 -6.918 -9.848 1.00 . A A . 21 PHE CD2 1 1 2 708 1 1 21 PHE CE1 C 1.184 -8.880 -10.629 1.00 . A A . 21 PHE CE1 1 1 2 709 1 1 21 PHE CE2 C 0.319 -6.663 -10.855 1.00 . A A . 21 PHE CE2 1 1 2 710 1 1 21 PHE CG C -0.627 -8.153 -9.221 1.00 . A A . 21 PHE CG 1 1 2 711 1 1 21 PHE CZ C 1.209 -7.645 -11.246 1.00 . A A . 21 PHE CZ 1 1 2 712 1 1 21 PHE H H -3.328 -6.287 -7.695 1.00 . A A . 21 PHE H 1 1 2 713 1 1 21 PHE HA H -3.203 -8.566 -9.560 1.00 . A A . 21 PHE HA 1 1 2 714 1 1 21 PHE HB2 H -1.389 -7.774 -7.300 1.00 . A A . 21 PHE HB2 1 1 2 715 1 1 21 PHE HB3 H -1.495 -9.454 -7.815 1.00 . A A . 21 PHE HB3 1 1 2 716 1 1 21 PHE HD1 H 0.251 -10.097 -9.140 1.00 . A A . 21 PHE HD1 1 1 2 717 1 1 21 PHE HD2 H -1.287 -6.149 -9.543 1.00 . A A . 21 PHE HD2 1 1 2 718 1 1 21 PHE HE1 H 1.878 -9.650 -10.931 1.00 . A A . 21 PHE HE1 1 1 2 719 1 1 21 PHE HE2 H 0.337 -5.696 -11.336 1.00 . A A . 21 PHE HE2 1 1 2 720 1 1 21 PHE HZ H 1.921 -7.448 -12.033 1.00 . A A . 21 PHE HZ 1 1 2 721 1 1 21 PHE N N -3.393 -6.784 -8.537 1.00 . A A . 21 PHE N 1 1 2 722 1 1 21 PHE O O -3.866 -8.942 -6.405 1.00 . A A . 21 PHE O 1 1 2 723 1 1 22 VAL C C -5.313 -11.803 -7.010 1.00 . A A . 22 VAL C 1 1 2 724 1 1 22 VAL CA C -5.921 -10.477 -7.454 1.00 . A A . 22 VAL CA 1 1 2 725 1 1 22 VAL CB C -7.198 -10.758 -8.269 1.00 . A A . 22 VAL CB 1 1 2 726 1 1 22 VAL CG1 C -8.251 -11.425 -7.398 1.00 . A A . 22 VAL CG1 1 1 2 727 1 1 22 VAL CG2 C -7.734 -9.471 -8.877 1.00 . A A . 22 VAL CG2 1 1 2 728 1 1 22 VAL H H -5.025 -9.684 -9.199 1.00 . A A . 22 VAL H 1 1 2 729 1 1 22 VAL HA H -6.196 -9.907 -6.578 1.00 . A A . 22 VAL HA 1 1 2 730 1 1 22 VAL HB H -6.946 -11.434 -9.073 1.00 . A A . 22 VAL HB 1 1 2 731 1 1 22 VAL HG11 H -8.111 -12.496 -7.422 1.00 . A A . 22 VAL HG11 1 1 2 732 1 1 22 VAL HG12 H -8.156 -11.071 -6.382 1.00 . A A . 22 VAL HG12 1 1 2 733 1 1 22 VAL HG13 H -9.234 -11.183 -7.774 1.00 . A A . 22 VAL HG13 1 1 2 734 1 1 22 VAL HG21 H -7.611 -8.662 -8.172 1.00 . A A . 22 VAL HG21 1 1 2 735 1 1 22 VAL HG22 H -7.189 -9.245 -9.782 1.00 . A A . 22 VAL HG22 1 1 2 736 1 1 22 VAL HG23 H -8.782 -9.591 -9.108 1.00 . A A . 22 VAL HG23 1 1 2 737 1 1 22 VAL N N -4.963 -9.691 -8.222 1.00 . A A . 22 VAL N 1 1 2 738 1 1 22 VAL O O -5.815 -12.453 -6.093 1.00 . A A . 22 VAL O 1 1 2 739 1 1 23 PHE C C -2.269 -13.602 -8.155 1.00 . A A . 23 PHE C 1 1 2 740 1 1 23 PHE CA C -3.551 -13.450 -7.341 1.00 . A A . 23 PHE CA 1 1 2 741 1 1 23 PHE CB C -4.478 -14.639 -7.601 1.00 . A A . 23 PHE CB 1 1 2 742 1 1 23 PHE CD1 C -3.654 -15.981 -5.647 1.00 . A A . 23 PHE CD1 1 1 2 743 1 1 23 PHE CD2 C -3.872 -17.069 -7.757 1.00 . A A . 23 PHE CD2 1 1 2 744 1 1 23 PHE CE1 C -3.206 -17.160 -5.081 1.00 . A A . 23 PHE CE1 1 1 2 745 1 1 23 PHE CE2 C -3.425 -18.251 -7.196 1.00 . A A . 23 PHE CE2 1 1 2 746 1 1 23 PHE CG C -3.991 -15.922 -6.989 1.00 . A A . 23 PHE CG 1 1 2 747 1 1 23 PHE CZ C -3.091 -18.296 -5.857 1.00 . A A . 23 PHE CZ 1 1 2 748 1 1 23 PHE H H -3.875 -11.639 -8.390 1.00 . A A . 23 PHE H 1 1 2 749 1 1 23 PHE HA H -3.297 -13.424 -6.293 1.00 . A A . 23 PHE HA 1 1 2 750 1 1 23 PHE HB2 H -5.452 -14.424 -7.188 1.00 . A A . 23 PHE HB2 1 1 2 751 1 1 23 PHE HB3 H -4.567 -14.791 -8.666 1.00 . A A . 23 PHE HB3 1 1 2 752 1 1 23 PHE HD1 H -3.743 -15.092 -5.038 1.00 . A A . 23 PHE HD1 1 1 2 753 1 1 23 PHE HD2 H -4.132 -17.035 -8.805 1.00 . A A . 23 PHE HD2 1 1 2 754 1 1 23 PHE HE1 H -2.946 -17.191 -4.033 1.00 . A A . 23 PHE HE1 1 1 2 755 1 1 23 PHE HE2 H -3.336 -19.138 -7.806 1.00 . A A . 23 PHE HE2 1 1 2 756 1 1 23 PHE HZ H -2.743 -19.218 -5.417 1.00 . A A . 23 PHE HZ 1 1 2 757 1 1 23 PHE N N -4.228 -12.200 -7.667 1.00 . A A . 23 PHE N 1 1 2 758 1 1 23 PHE O O -1.932 -14.697 -8.601 1.00 . A A . 23 PHE O 1 1 2 759 1 1 24 DBU C C -0.449 -12.022 -10.469 1.00 . A A . 24 DBU C 1 1 2 760 1 1 24 DBU CA C -0.396 -12.503 -9.056 1.00 . A A . 24 DBU CA 1 1 2 761 1 1 24 DBU CB C 0.813 -12.901 -8.620 1.00 . A A . 24 DBU CB 1 1 2 762 1 1 24 DBU CG C 1.133 -13.422 -7.254 1.00 . A A . 24 DBU CG 1 1 2 763 1 1 24 DBU HG1 H 2.169 -13.246 -6.953 1.00 . A A . 24 DBU HG1 1 1 2 764 1 1 24 DBU HG2 H 0.951 -14.501 -7.219 1.00 . A A . 24 DBU HG2 1 1 2 765 1 1 24 DBU HG3 H 0.482 -12.943 -6.516 1.00 . A A . 24 DBU HG3 1 1 2 766 1 1 24 DBU N N -1.560 -12.494 -8.344 1.00 . A A . 24 DBU N 1 1 2 767 1 1 24 DBU O O 0.573 -11.657 -11.051 1.00 . A A . 24 DBU O 1 1 2 768 1 1 25 CYS C C -1.765 -10.048 -12.510 1.00 . A A . 25 CYS C 1 1 2 769 1 1 25 CYS CA C -1.838 -11.569 -12.416 1.00 . A A . 25 CYS CA 1 1 2 770 1 1 25 CYS CB C -3.184 -12.060 -12.953 1.00 . A A . 25 CYS CB 1 1 2 771 1 1 25 CYS H H -2.426 -12.318 -10.526 1.00 . A A . 25 CYS H 1 1 2 772 1 1 25 CYS HA H -1.046 -11.993 -13.015 1.00 . A A . 25 CYS HA 1 1 2 773 1 1 25 CYS HB2 H -3.976 -11.486 -12.495 1.00 . A A . 25 CYS HB2 1 1 2 774 1 1 25 CYS HB3 H -3.212 -11.913 -14.022 1.00 . A A . 25 CYS HB3 1 1 2 775 1 1 25 CYS N N -1.649 -12.015 -11.041 1.00 . A A . 25 CYS N 1 1 2 776 1 1 25 CYS O O -1.912 -9.345 -11.509 1.00 . A A . 25 CYS O 1 1 2 777 1 1 25 CYS SG S -3.517 -13.821 -12.626 1.00 . A A . 25 CYS SG 1 1 2 778 1 1 26 CYS C C -2.428 -7.662 -15.022 1.00 . A A . 26 CYS C 1 1 2 779 1 1 26 CYS CA C -1.444 -8.108 -13.945 1.00 . A A . 26 CYS CA 1 1 2 780 1 1 26 CYS CB C -0.019 -7.726 -14.351 1.00 . A A . 26 CYS CB 1 1 2 781 1 1 26 CYS H H -1.428 -10.157 -14.478 1.00 . A A . 26 CYS H 1 1 2 782 1 1 26 CYS HA H -1.692 -7.610 -13.020 1.00 . A A . 26 CYS HA 1 1 2 783 1 1 26 CYS HB2 H 0.681 -8.278 -13.740 1.00 . A A . 26 CYS HB2 1 1 2 784 1 1 26 CYS HB3 H 0.133 -7.985 -15.388 1.00 . A A . 26 CYS HB3 1 1 2 785 1 1 26 CYS N N -1.537 -9.545 -13.719 1.00 . A A . 26 CYS N 1 1 2 786 1 1 26 CYS O O -2.130 -6.774 -15.821 1.00 . A A . 26 CYS O 1 1 2 787 1 1 26 CYS SG S 0.358 -5.954 -14.159 1.00 . A A . 26 CYS SG 1 1 2 788 1 1 27 SER C C -6.017 -8.317 -15.495 1.00 . A A . 27 SER C 1 1 2 789 1 1 27 SER CA C -4.630 -7.955 -16.018 1.00 . A A . 27 SER CA 1 1 2 790 1 1 27 SER CB C -4.362 -8.687 -17.334 1.00 . A A . 27 SER CB 1 1 2 791 1 1 27 SER H H -3.781 -8.984 -14.374 1.00 . A A . 27 SER H 1 1 2 792 1 1 27 SER HA H -4.591 -6.890 -16.194 1.00 . A A . 27 SER HA 1 1 2 793 1 1 27 SER HB2 H -3.440 -8.326 -17.763 1.00 . A A . 27 SER HB2 1 1 2 794 1 1 27 SER HB3 H -4.279 -9.747 -17.143 1.00 . A A . 27 SER HB3 1 1 2 795 1 1 27 SER HG H -5.570 -9.276 -18.760 1.00 . A A . 27 SER HG 1 1 2 796 1 1 27 SER N N -3.603 -8.285 -15.037 1.00 . A A . 27 SER N 1 1 2 797 1 1 27 SER O O -6.150 -8.973 -14.463 1.00 . A A . 27 SER O 1 1 2 798 1 1 27 SER OG O -5.412 -8.471 -18.261 1.00 . A A . 27 SER OG 1 1 3 799 1 1 1 LYS C C 2.755 1.773 -1.936 1.00 . A A . 1 LYS C 1 1 3 800 1 1 1 LYS CA C 4.028 1.757 -1.097 1.00 . A A . 1 LYS CA 1 1 3 801 1 1 1 LYS CB C 4.294 3.153 -0.527 1.00 . A A . 1 LYS CB 1 1 3 802 1 1 1 LYS CD C 5.089 4.534 1.414 1.00 . A A . 1 LYS CD 1 1 3 803 1 1 1 LYS CE C 5.628 4.504 2.837 1.00 . A A . 1 LYS CE 1 1 3 804 1 1 1 LYS CG C 4.701 3.145 0.936 1.00 . A A . 1 LYS CG 1 1 3 805 1 1 1 LYS H1 H 5.240 0.362 -2.129 1.00 . A A . 1 LYS H1 1 1 3 806 1 1 1 LYS HA H 3.898 1.063 -0.280 1.00 . A A . 1 LYS HA 1 1 3 807 1 1 1 LYS HB2 H 5.085 3.617 -1.097 1.00 . A A . 1 LYS HB2 1 1 3 808 1 1 1 LYS HB3 H 3.395 3.745 -0.626 1.00 . A A . 1 LYS HB3 1 1 3 809 1 1 1 LYS HD2 H 5.853 4.930 0.761 1.00 . A A . 1 LYS HD2 1 1 3 810 1 1 1 LYS HD3 H 4.218 5.173 1.382 1.00 . A A . 1 LYS HD3 1 1 3 811 1 1 1 LYS HE2 H 5.792 5.518 3.167 1.00 . A A . 1 LYS HE2 1 1 3 812 1 1 1 LYS HE3 H 4.895 4.031 3.475 1.00 . A A . 1 LYS HE3 1 1 3 813 1 1 1 LYS HG2 H 3.871 2.791 1.530 1.00 . A A . 1 LYS HG2 1 1 3 814 1 1 1 LYS HG3 H 5.545 2.482 1.062 1.00 . A A . 1 LYS HG3 1 1 3 815 1 1 1 LYS HZ1 H 7.240 3.492 1.977 1.00 . A A . 1 LYS HZ1 1 1 3 816 1 1 1 LYS HZ2 H 6.773 2.881 3.484 1.00 . A A . 1 LYS HZ2 1 1 3 817 1 1 1 LYS HZ3 H 7.635 4.334 3.390 1.00 . A A . 1 LYS HZ3 1 1 3 818 1 1 1 LYS N N 5.167 1.310 -1.889 1.00 . A A . 1 LYS N 1 1 3 819 1 1 1 LYS NZ N 6.909 3.750 2.929 1.00 . A A . 1 LYS NZ 1 1 3 820 1 1 1 LYS O O 1.653 1.597 -1.415 1.00 . A A . 1 LYS O 1 1 3 821 1 1 2 LYS C C 2.000 1.085 -5.336 1.00 . A A . 2 LYS C 1 1 3 822 1 1 2 LYS CA C 1.776 2.019 -4.151 1.00 . A A . 2 LYS CA 1 1 3 823 1 1 2 LYS CB C 1.542 3.447 -4.651 1.00 . A A . 2 LYS CB 1 1 3 824 1 1 2 LYS CD C -0.816 4.258 -4.345 1.00 . A A . 2 LYS CD 1 1 3 825 1 1 2 LYS CE C -1.549 5.544 -3.996 1.00 . A A . 2 LYS CE 1 1 3 826 1 1 2 LYS CG C 0.593 4.249 -3.777 1.00 . A A . 2 LYS CG 1 1 3 827 1 1 2 LYS H H 3.816 2.117 -3.595 1.00 . A A . 2 LYS H 1 1 3 828 1 1 2 LYS HA H 0.903 1.689 -3.608 1.00 . A A . 2 LYS HA 1 1 3 829 1 1 2 LYS HB2 H 2.490 3.963 -4.686 1.00 . A A . 2 LYS HB2 1 1 3 830 1 1 2 LYS HB3 H 1.128 3.403 -5.648 1.00 . A A . 2 LYS HB3 1 1 3 831 1 1 2 LYS HD2 H -0.762 4.167 -5.420 1.00 . A A . 2 LYS HD2 1 1 3 832 1 1 2 LYS HD3 H -1.364 3.419 -3.938 1.00 . A A . 2 LYS HD3 1 1 3 833 1 1 2 LYS HE2 H -2.586 5.311 -3.807 1.00 . A A . 2 LYS HE2 1 1 3 834 1 1 2 LYS HE3 H -1.106 5.965 -3.106 1.00 . A A . 2 LYS HE3 1 1 3 835 1 1 2 LYS HG2 H 0.570 3.811 -2.790 1.00 . A A . 2 LYS HG2 1 1 3 836 1 1 2 LYS HG3 H 0.952 5.267 -3.713 1.00 . A A . 2 LYS HG3 1 1 3 837 1 1 2 LYS HZ1 H -2.283 6.436 -5.737 1.00 . A A . 2 LYS HZ1 1 1 3 838 1 1 2 LYS HZ2 H -0.595 6.406 -5.642 1.00 . A A . 2 LYS HZ2 1 1 3 839 1 1 2 LYS HZ3 H -1.475 7.507 -4.706 1.00 . A A . 2 LYS HZ3 1 1 3 840 1 1 2 LYS N N 2.912 1.983 -3.238 1.00 . A A . 2 LYS N 1 1 3 841 1 1 2 LYS NZ N -1.470 6.544 -5.097 1.00 . A A . 2 LYS NZ 1 1 3 842 1 1 2 LYS O O 2.962 1.239 -6.089 1.00 . A A . 2 LYS O 1 1 3 843 1 1 3 LYS C C 2.535 -1.585 -6.548 1.00 . A A . 3 LYS C 1 1 3 844 1 1 3 LYS CA C 1.203 -0.843 -6.591 1.00 . A A . 3 LYS CA 1 1 3 845 1 1 3 LYS CB C 1.048 -0.129 -7.936 1.00 . A A . 3 LYS CB 1 1 3 846 1 1 3 LYS CD C -0.974 0.552 -9.261 1.00 . A A . 3 LYS CD 1 1 3 847 1 1 3 LYS CE C -2.229 0.753 -8.425 1.00 . A A . 3 LYS CE 1 1 3 848 1 1 3 LYS CG C -0.143 -0.611 -8.747 1.00 . A A . 3 LYS CG 1 1 3 849 1 1 3 LYS H H 0.360 0.044 -4.863 1.00 . A A . 3 LYS H 1 1 3 850 1 1 3 LYS HA H 0.402 -1.558 -6.478 1.00 . A A . 3 LYS HA 1 1 3 851 1 1 3 LYS HB2 H 0.931 0.929 -7.757 1.00 . A A . 3 LYS HB2 1 1 3 852 1 1 3 LYS HB3 H 1.943 -0.290 -8.520 1.00 . A A . 3 LYS HB3 1 1 3 853 1 1 3 LYS HD2 H -0.381 1.454 -9.222 1.00 . A A . 3 LYS HD2 1 1 3 854 1 1 3 LYS HD3 H -1.262 0.353 -10.284 1.00 . A A . 3 LYS HD3 1 1 3 855 1 1 3 LYS HE2 H -2.819 -0.149 -8.462 1.00 . A A . 3 LYS HE2 1 1 3 856 1 1 3 LYS HE3 H -1.937 0.951 -7.404 1.00 . A A . 3 LYS HE3 1 1 3 857 1 1 3 LYS HG2 H 0.215 -1.184 -9.589 1.00 . A A . 3 LYS HG2 1 1 3 858 1 1 3 LYS HG3 H -0.763 -1.236 -8.121 1.00 . A A . 3 LYS HG3 1 1 3 859 1 1 3 LYS HZ1 H -2.735 2.170 -9.874 1.00 . A A . 3 LYS HZ1 1 1 3 860 1 1 3 LYS HZ2 H -2.956 2.707 -8.286 1.00 . A A . 3 LYS HZ2 1 1 3 861 1 1 3 LYS HZ3 H -4.052 1.615 -8.969 1.00 . A A . 3 LYS HZ3 1 1 3 862 1 1 3 LYS N N 1.105 0.116 -5.496 1.00 . A A . 3 LYS N 1 1 3 863 1 1 3 LYS NZ N -3.051 1.891 -8.923 1.00 . A A . 3 LYS NZ 1 1 3 864 1 1 3 LYS O O 3.358 -1.350 -5.663 1.00 . A A . 3 LYS O 1 1 3 865 1 1 4 SER C C 4.519 -3.282 -9.003 1.00 . A A . 4 SER C 1 1 3 866 1 1 4 SER CA C 3.972 -3.257 -7.579 1.00 . A A . 4 SER CA 1 1 3 867 1 1 4 SER CB C 3.726 -4.686 -7.089 1.00 . A A . 4 SER CB 1 1 3 868 1 1 4 SER H H 2.046 -2.621 -8.186 1.00 . A A . 4 SER H 1 1 3 869 1 1 4 SER HA H 4.699 -2.785 -6.935 1.00 . A A . 4 SER HA 1 1 3 870 1 1 4 SER HB2 H 4.420 -5.354 -7.575 1.00 . A A . 4 SER HB2 1 1 3 871 1 1 4 SER HB3 H 3.875 -4.727 -6.020 1.00 . A A . 4 SER HB3 1 1 3 872 1 1 4 SER HG H 1.897 -5.159 -6.571 1.00 . A A . 4 SER HG 1 1 3 873 1 1 4 SER N N 2.740 -2.479 -7.509 1.00 . A A . 4 SER N 1 1 3 874 1 1 4 SER O O 5.522 -2.638 -9.306 1.00 . A A . 4 SER O 1 1 3 875 1 1 4 SER OG O 2.405 -5.105 -7.384 1.00 . A A . 4 SER OG 1 1 3 876 1 1 5 GLY C C 5.439 -5.093 -11.435 1.00 . A A . 5 GLY C 1 1 3 877 1 1 5 GLY CA C 4.283 -4.129 -11.255 1.00 . A A . 5 GLY CA 1 1 3 878 1 1 5 GLY H H 3.057 -4.525 -9.575 1.00 . A A . 5 GLY H 1 1 3 879 1 1 5 GLY HA2 H 3.453 -4.463 -11.859 1.00 . A A . 5 GLY HA2 1 1 3 880 1 1 5 GLY HA3 H 4.590 -3.150 -11.593 1.00 . A A . 5 GLY HA3 1 1 3 881 1 1 5 GLY N N 3.850 -4.033 -9.874 1.00 . A A . 5 GLY N 1 1 3 882 1 1 5 GLY O O 6.518 -4.703 -11.882 1.00 . A A . 5 GLY O 1 1 3 883 1 1 6 VAL C C 6.459 -7.771 -12.666 1.00 . A A . 6 VAL C 1 1 3 884 1 1 6 VAL CA C 6.247 -7.378 -11.208 1.00 . A A . 6 VAL CA 1 1 3 885 1 1 6 VAL CB C 5.891 -8.636 -10.395 1.00 . A A . 6 VAL CB 1 1 3 886 1 1 6 VAL CG1 C 7.043 -9.630 -10.417 1.00 . A A . 6 VAL CG1 1 1 3 887 1 1 6 VAL CG2 C 5.526 -8.261 -8.966 1.00 . A A . 6 VAL CG2 1 1 3 888 1 1 6 VAL H H 4.335 -6.605 -10.734 1.00 . A A . 6 VAL H 1 1 3 889 1 1 6 VAL HA H 7.169 -6.971 -10.817 1.00 . A A . 6 VAL HA 1 1 3 890 1 1 6 VAL HB H 5.032 -9.104 -10.853 1.00 . A A . 6 VAL HB 1 1 3 891 1 1 6 VAL HG11 H 7.586 -9.570 -9.485 1.00 . A A . 6 VAL HG11 1 1 3 892 1 1 6 VAL HG12 H 6.654 -10.629 -10.545 1.00 . A A . 6 VAL HG12 1 1 3 893 1 1 6 VAL HG13 H 7.706 -9.393 -11.236 1.00 . A A . 6 VAL HG13 1 1 3 894 1 1 6 VAL HG21 H 4.767 -7.494 -8.979 1.00 . A A . 6 VAL HG21 1 1 3 895 1 1 6 VAL HG22 H 5.148 -9.132 -8.451 1.00 . A A . 6 VAL HG22 1 1 3 896 1 1 6 VAL HG23 H 6.403 -7.893 -8.455 1.00 . A A . 6 VAL HG23 1 1 3 897 1 1 6 VAL N N 5.216 -6.355 -11.084 1.00 . A A . 6 VAL N 1 1 3 898 1 1 6 VAL O O 7.478 -7.433 -13.268 1.00 . A A . 6 VAL O 1 1 3 899 1 1 7 ILE C C 4.205 -8.851 -15.293 1.00 . A A . 7 ILE C 1 1 3 900 1 1 7 ILE CA C 5.569 -8.923 -14.615 1.00 . A A . 7 ILE CA 1 1 3 901 1 1 7 ILE CB C 6.108 -10.362 -14.722 1.00 . A A . 7 ILE CB 1 1 3 902 1 1 7 ILE CD1 C 8.542 -9.628 -14.843 1.00 . A A . 7 ILE CD1 1 1 3 903 1 1 7 ILE CG1 C 7.507 -10.452 -14.110 1.00 . A A . 7 ILE CG1 1 1 3 904 1 1 7 ILE CG2 C 6.129 -10.813 -16.174 1.00 . A A . 7 ILE CG2 1 1 3 905 1 1 7 ILE H H 4.702 -8.723 -12.695 1.00 . A A . 7 ILE H 1 1 3 906 1 1 7 ILE HA H 6.252 -8.265 -15.133 1.00 . A A . 7 ILE HA 1 1 3 907 1 1 7 ILE HB H 5.442 -11.013 -14.177 1.00 . A A . 7 ILE HB 1 1 3 908 1 1 7 ILE HD11 H 9.004 -8.935 -14.156 1.00 . A A . 7 ILE HD11 1 1 3 909 1 1 7 ILE HD12 H 9.295 -10.281 -15.258 1.00 . A A . 7 ILE HD12 1 1 3 910 1 1 7 ILE HD13 H 8.064 -9.078 -15.641 1.00 . A A . 7 ILE HD13 1 1 3 911 1 1 7 ILE HG12 H 7.470 -10.105 -13.089 1.00 . A A . 7 ILE HG12 1 1 3 912 1 1 7 ILE HG13 H 7.832 -11.483 -14.123 1.00 . A A . 7 ILE HG13 1 1 3 913 1 1 7 ILE HG21 H 6.654 -10.082 -16.771 1.00 . A A . 7 ILE HG21 1 1 3 914 1 1 7 ILE HG22 H 6.633 -11.765 -16.248 1.00 . A A . 7 ILE HG22 1 1 3 915 1 1 7 ILE HG23 H 5.116 -10.913 -16.535 1.00 . A A . 7 ILE HG23 1 1 3 916 1 1 7 ILE N N 5.489 -8.485 -13.227 1.00 . A A . 7 ILE N 1 1 3 917 1 1 7 ILE O O 3.307 -9.649 -15.023 1.00 . A A . 7 ILE O 1 1 3 918 1 1 8 PRO C C 2.534 -8.786 -17.946 1.00 . A A . 8 PRO C 1 1 3 919 1 1 8 PRO CA C 2.793 -7.675 -16.934 1.00 . A A . 8 PRO CA 1 1 3 920 1 1 8 PRO CB C 3.011 -6.340 -17.650 1.00 . A A . 8 PRO CB 1 1 3 921 1 1 8 PRO CD C 5.071 -6.886 -16.568 1.00 . A A . 8 PRO CD 1 1 3 922 1 1 8 PRO CG C 4.490 -6.219 -17.784 1.00 . A A . 8 PRO CG 1 1 3 923 1 1 8 PRO HA H 1.947 -7.593 -16.267 1.00 . A A . 8 PRO HA 1 1 3 924 1 1 8 PRO HB2 H 2.527 -6.363 -18.617 1.00 . A A . 8 PRO HB2 1 1 3 925 1 1 8 PRO HB3 H 2.601 -5.537 -17.056 1.00 . A A . 8 PRO HB3 1 1 3 926 1 1 8 PRO HD2 H 6.003 -7.373 -16.814 1.00 . A A . 8 PRO HD2 1 1 3 927 1 1 8 PRO HD3 H 5.217 -6.166 -15.776 1.00 . A A . 8 PRO HD3 1 1 3 928 1 1 8 PRO HG2 H 4.820 -6.720 -18.681 1.00 . A A . 8 PRO HG2 1 1 3 929 1 1 8 PRO HG3 H 4.772 -5.176 -17.810 1.00 . A A . 8 PRO HG3 1 1 3 930 1 1 8 PRO N N 4.044 -7.873 -16.197 1.00 . A A . 8 PRO N 1 1 3 931 1 1 8 PRO O O 3.033 -8.743 -19.070 1.00 . A A . 8 PRO O 1 1 3 932 1 1 9 . C C 1.635 -12.203 -17.674 1.00 . A A . 9 DBB C 1 1 3 933 1 1 9 . CA C 1.425 -10.912 -18.418 1.00 . A A . 9 DBB CA 1 1 3 934 1 1 9 . CB C -0.037 -10.808 -18.858 1.00 . A A . 9 DBB CB 1 1 3 935 1 1 9 . CG C -0.391 -9.341 -19.112 1.00 . A A . 9 DBB CG 1 1 3 936 1 1 9 . H H 1.384 -9.758 -16.631 1.00 . A A . 9 DBB H 1 1 3 937 1 1 9 . HA H 2.071 -10.887 -19.295 1.00 . A A . 9 DBB HA 1 1 3 938 1 1 9 . HB2 H -0.682 -11.207 -18.076 1.00 . A A . 9 DBB HB2 1 1 3 939 1 1 9 . HG1 H -1.370 -9.280 -19.588 1.00 . A A . 9 DBB HG1 1 1 3 940 1 1 9 . HG2 H -0.413 -8.804 -18.165 1.00 . A A . 9 DBB HG2 1 1 3 941 1 1 9 . HG3 H 0.359 -8.895 -19.766 1.00 . A A . 9 DBB HG3 1 1 3 942 1 1 9 . N N 1.752 -9.780 -17.539 1.00 . A A . 9 DBB N 1 1 3 943 1 1 9 . O O 2.208 -13.154 -18.208 1.00 . A A . 9 DBB O 1 1 3 944 1 1 10 VAL C C -0.053 -14.011 -15.229 1.00 . A A . 10 VAL C 1 1 3 945 1 1 10 VAL CA C 1.310 -13.438 -15.601 1.00 . A A . 10 VAL CA 1 1 3 946 1 1 10 VAL CB C 2.098 -13.138 -14.312 1.00 . A A . 10 VAL CB 1 1 3 947 1 1 10 VAL CG1 C 2.124 -14.359 -13.406 1.00 . A A . 10 VAL CG1 1 1 3 948 1 1 10 VAL CG2 C 3.510 -12.680 -14.645 1.00 . A A . 10 VAL CG2 1 1 3 949 1 1 10 VAL H H 0.724 -11.457 -16.058 1.00 . A A . 10 VAL H 1 1 3 950 1 1 10 VAL HA H 1.857 -14.177 -16.169 1.00 . A A . 10 VAL HA 1 1 3 951 1 1 10 VAL HB H 1.597 -12.338 -13.787 1.00 . A A . 10 VAL HB 1 1 3 952 1 1 10 VAL HG11 H 1.120 -14.584 -13.076 1.00 . A A . 10 VAL HG11 1 1 3 953 1 1 10 VAL HG12 H 2.524 -15.203 -13.949 1.00 . A A . 10 VAL HG12 1 1 3 954 1 1 10 VAL HG13 H 2.747 -14.156 -12.547 1.00 . A A . 10 VAL HG13 1 1 3 955 1 1 10 VAL HG21 H 3.982 -12.294 -13.754 1.00 . A A . 10 VAL HG21 1 1 3 956 1 1 10 VAL HG22 H 4.081 -13.517 -15.021 1.00 . A A . 10 VAL HG22 1 1 3 957 1 1 10 VAL HG23 H 3.470 -11.906 -15.397 1.00 . A A . 10 VAL HG23 1 1 3 958 1 1 10 VAL N N 1.171 -12.246 -16.429 1.00 . A A . 10 VAL N 1 1 3 959 1 1 10 VAL O O -0.168 -15.182 -14.870 1.00 . A A . 10 VAL O 1 1 3 960 1 1 11 DAL C C -2.873 -14.706 -15.926 1.00 . A A . 11 DAL C 1 1 3 961 1 1 11 DAL CA C -2.451 -13.603 -14.989 1.00 . A A . 11 DAL CA 1 1 3 962 1 1 11 DAL CB C -2.491 -14.115 -13.547 1.00 . A A . 11 DAL CB 1 1 3 963 1 1 11 DAL H H -0.928 -12.254 -15.612 1.00 . A A . 11 DAL H 1 1 3 964 1 1 11 DAL HA H -3.131 -12.758 -15.094 1.00 . A A . 11 DAL HA 1 1 3 965 1 1 11 DAL HB1 H -3.215 -14.925 -13.469 1.00 . A A . 11 DAL HB1 1 1 3 966 1 1 11 DAL HB2 H -1.504 -14.482 -13.266 1.00 . A A . 11 DAL HB2 1 1 3 967 1 1 11 DAL N N -1.084 -13.177 -15.319 1.00 . A A . 11 DAL N 1 1 3 968 1 1 11 DAL O O -2.035 -15.354 -16.556 1.00 . A A . 11 DAL O 1 1 3 969 1 1 12 HIS C C -5.177 -15.373 -18.225 1.00 . A A . 12 HIS C 1 1 3 970 1 1 12 HIS CA C -4.718 -15.964 -16.895 1.00 . A A . 12 HIS CA 1 1 3 971 1 1 12 HIS CB C -5.884 -16.680 -16.212 1.00 . A A . 12 HIS CB 1 1 3 972 1 1 12 HIS CD2 C -5.010 -18.251 -14.342 1.00 . A A . 12 HIS CD2 1 1 3 973 1 1 12 HIS CE1 C -5.493 -16.991 -12.614 1.00 . A A . 12 HIS CE1 1 1 3 974 1 1 12 HIS CG C -5.581 -17.117 -14.812 1.00 . A A . 12 HIS CG 1 1 3 975 1 1 12 HIS H H -4.797 -14.378 -15.496 1.00 . A A . 12 HIS H 1 1 3 976 1 1 12 HIS HA H -3.931 -16.678 -17.086 1.00 . A A . 12 HIS HA 1 1 3 977 1 1 12 HIS HB2 H -6.734 -16.015 -16.175 1.00 . A A . 12 HIS HB2 1 1 3 978 1 1 12 HIS HB3 H -6.144 -17.558 -16.786 1.00 . A A . 12 HIS HB3 1 1 3 979 1 1 12 HIS HD1 H -6.294 -15.465 -13.716 1.00 . A A . 12 HIS HD1 1 1 3 980 1 1 12 HIS HD2 H -4.654 -19.083 -14.934 1.00 . A A . 12 HIS HD2 1 1 3 981 1 1 12 HIS HE1 H -5.596 -16.632 -11.601 1.00 . A A . 12 HIS HE1 1 1 3 982 1 1 12 HIS N N -4.180 -14.926 -16.023 1.00 . A A . 12 HIS N 1 1 3 983 1 1 12 HIS ND1 N -5.873 -16.349 -13.705 1.00 . A A . 12 HIS ND1 1 1 3 984 1 1 12 HIS NE2 N -4.967 -18.148 -12.974 1.00 . A A . 12 HIS NE2 1 1 3 985 1 1 12 HIS O O -5.043 -16.002 -19.274 1.00 . A A . 12 HIS O 1 1 3 986 1 1 13 ASP C C -5.052 -12.777 -20.090 1.00 . A A . 13 ASP C 1 1 3 987 1 1 13 ASP CA C -6.197 -13.484 -19.371 1.00 . A A . 13 ASP CA 1 1 3 988 1 1 13 ASP CB C -7.290 -12.477 -19.013 1.00 . A A . 13 ASP CB 1 1 3 989 1 1 13 ASP CG C -8.504 -12.594 -19.914 1.00 . A A . 13 ASP CG 1 1 3 990 1 1 13 ASP H H -5.797 -13.710 -17.305 1.00 . A A . 13 ASP H 1 1 3 991 1 1 13 ASP HA H -6.611 -14.232 -20.031 1.00 . A A . 13 ASP HA 1 1 3 992 1 1 13 ASP HB2 H -7.605 -12.645 -17.993 1.00 . A A . 13 ASP HB2 1 1 3 993 1 1 13 ASP HB3 H -6.893 -11.477 -19.103 1.00 . A A . 13 ASP HB3 1 1 3 994 1 1 13 ASP N N -5.718 -14.161 -18.172 1.00 . A A . 13 ASP N 1 1 3 995 1 1 13 ASP O O -4.950 -12.825 -21.316 1.00 . A A . 13 ASP O 1 1 3 996 1 1 13 ASP OD1 O -8.863 -13.733 -20.281 1.00 . A A . 13 ASP OD1 1 1 3 997 1 1 13 ASP OD2 O -9.095 -11.548 -20.251 1.00 . A A . 13 ASP OD2 1 1 3 998 1 1 14 CYS C C -3.503 -10.465 -21.000 1.00 . A A . 14 CYS C 1 1 3 999 1 1 14 CYS CA C -3.056 -11.399 -19.880 1.00 . A A . 14 CYS CA 1 1 3 1000 1 1 14 CYS CB C -2.013 -12.385 -20.408 1.00 . A A . 14 CYS CB 1 1 3 1001 1 1 14 CYS H H -4.328 -12.116 -18.347 1.00 . A A . 14 CYS H 1 1 3 1002 1 1 14 CYS HA H -2.614 -10.810 -19.091 1.00 . A A . 14 CYS HA 1 1 3 1003 1 1 14 CYS HB2 H -2.002 -13.260 -19.775 1.00 . A A . 14 CYS HB2 1 1 3 1004 1 1 14 CYS HB3 H -2.282 -12.678 -21.412 1.00 . A A . 14 CYS HB3 1 1 3 1005 1 1 14 CYS N N -4.193 -12.119 -19.318 1.00 . A A . 14 CYS N 1 1 3 1006 1 1 14 CYS O O -3.522 -10.846 -22.171 1.00 . A A . 14 CYS O 1 1 3 1007 1 1 14 CYS SG S -0.318 -11.719 -20.460 1.00 . A A . 14 CYS SG 1 1 3 1008 1 1 15 HIS C C -3.542 -6.941 -21.442 1.00 . A A . 15 HIS C 1 1 3 1009 1 1 15 HIS CA C -4.309 -8.249 -21.607 1.00 . A A . 15 HIS CA 1 1 3 1010 1 1 15 HIS CB C -5.809 -7.997 -21.459 1.00 . A A . 15 HIS CB 1 1 3 1011 1 1 15 HIS CD2 C -6.542 -10.003 -22.930 1.00 . A A . 15 HIS CD2 1 1 3 1012 1 1 15 HIS CE1 C -8.266 -9.069 -23.911 1.00 . A A . 15 HIS CE1 1 1 3 1013 1 1 15 HIS CG C -6.644 -8.739 -22.457 1.00 . A A . 15 HIS CG 1 1 3 1014 1 1 15 HIS H H -3.827 -8.994 -19.685 1.00 . A A . 15 HIS H 1 1 3 1015 1 1 15 HIS HA H -4.115 -8.643 -22.593 1.00 . A A . 15 HIS HA 1 1 3 1016 1 1 15 HIS HB2 H -6.123 -8.303 -20.471 1.00 . A A . 15 HIS HB2 1 1 3 1017 1 1 15 HIS HB3 H -6.004 -6.941 -21.582 1.00 . A A . 15 HIS HB3 1 1 3 1018 1 1 15 HIS HD1 H -8.066 -7.269 -22.960 1.00 . A A . 15 HIS HD1 1 1 3 1019 1 1 15 HIS HD2 H -5.797 -10.735 -22.650 1.00 . A A . 15 HIS HD2 1 1 3 1020 1 1 15 HIS HE1 H -9.130 -8.912 -24.539 1.00 . A A . 15 HIS HE1 1 1 3 1021 1 1 15 HIS N N -3.863 -9.239 -20.633 1.00 . A A . 15 HIS N 1 1 3 1022 1 1 15 HIS ND1 N -7.732 -8.180 -23.092 1.00 . A A . 15 HIS ND1 1 1 3 1023 1 1 15 HIS NE2 N -7.562 -10.184 -23.831 1.00 . A A . 15 HIS NE2 1 1 3 1024 1 1 15 HIS O O -2.619 -6.651 -22.203 1.00 . A A . 15 HIS O 1 1 3 1025 1 1 16 MET C C -3.973 -4.138 -19.039 1.00 . A A . 16 MET C 1 1 3 1026 1 1 16 MET CA C -3.280 -4.876 -20.180 1.00 . A A . 16 MET CA 1 1 3 1027 1 1 16 MET CB C -3.281 -4.008 -21.440 1.00 . A A . 16 MET CB 1 1 3 1028 1 1 16 MET CE C -0.053 -1.556 -22.202 1.00 . A A . 16 MET CE 1 1 3 1029 1 1 16 MET CG C -1.890 -3.610 -21.905 1.00 . A A . 16 MET CG 1 1 3 1030 1 1 16 MET H H -4.674 -6.439 -19.871 1.00 . A A . 16 MET H 1 1 3 1031 1 1 16 MET HA H -2.258 -5.079 -19.894 1.00 . A A . 16 MET HA 1 1 3 1032 1 1 16 MET HB2 H -3.762 -4.554 -22.238 1.00 . A A . 16 MET HB2 1 1 3 1033 1 1 16 MET HB3 H -3.842 -3.107 -21.242 1.00 . A A . 16 MET HB3 1 1 3 1034 1 1 16 MET HE1 H 0.249 -1.872 -21.215 1.00 . A A . 16 MET HE1 1 1 3 1035 1 1 16 MET HE2 H 0.514 -2.100 -22.943 1.00 . A A . 16 MET HE2 1 1 3 1036 1 1 16 MET HE3 H 0.130 -0.497 -22.314 1.00 . A A . 16 MET HE3 1 1 3 1037 1 1 16 MET HG2 H -1.195 -3.761 -21.092 1.00 . A A . 16 MET HG2 1 1 3 1038 1 1 16 MET HG3 H -1.610 -4.240 -22.737 1.00 . A A . 16 MET HG3 1 1 3 1039 1 1 16 MET N N -3.931 -6.154 -20.444 1.00 . A A . 16 MET N 1 1 3 1040 1 1 16 MET O O -5.187 -3.941 -19.062 1.00 . A A . 16 MET O 1 1 3 1041 1 1 16 MET SD S -1.799 -1.887 -22.427 1.00 . A A . 16 MET SD 1 1 3 1042 1 1 17 ASN C C -2.626 -2.659 -15.905 1.00 . A A . 17 ASN C 1 1 3 1043 1 1 17 ASN CA C -3.733 -3.017 -16.892 1.00 . A A . 17 ASN CA 1 1 3 1044 1 1 17 ASN CB C -4.800 -3.863 -16.194 1.00 . A A . 17 ASN CB 1 1 3 1045 1 1 17 ASN CG C -6.207 -3.399 -16.515 1.00 . A A . 17 ASN CG 1 1 3 1046 1 1 17 ASN H H -2.232 -3.920 -18.081 1.00 . A A . 17 ASN H 1 1 3 1047 1 1 17 ASN HA H -4.187 -2.106 -17.252 1.00 . A A . 17 ASN HA 1 1 3 1048 1 1 17 ASN HB2 H -4.699 -4.891 -16.510 1.00 . A A . 17 ASN HB2 1 1 3 1049 1 1 17 ASN HB3 H -4.656 -3.804 -15.125 1.00 . A A . 17 ASN HB3 1 1 3 1050 1 1 17 ASN HD21 H -6.838 -5.284 -16.590 1.00 . A A . 17 ASN HD21 1 1 3 1051 1 1 17 ASN HD22 H -8.038 -4.077 -16.891 1.00 . A A . 17 ASN HD22 1 1 3 1052 1 1 17 ASN N N -3.193 -3.733 -18.042 1.00 . A A . 17 ASN N 1 1 3 1053 1 1 17 ASN ND2 N -7.120 -4.349 -16.682 1.00 . A A . 17 ASN ND2 1 1 3 1054 1 1 17 ASN O O -2.144 -1.527 -15.882 1.00 . A A . 17 ASN O 1 1 3 1055 1 1 17 ASN OD1 O -6.471 -2.200 -16.612 1.00 . A A . 17 ASN OD1 1 1 3 1056 1 1 18 DAL C C -1.719 -2.626 -12.939 1.00 . A A . 18 DAL C 1 1 3 1057 1 1 18 DAL CA C -1.168 -3.418 -14.097 1.00 . A A . 18 DAL CA 1 1 3 1058 1 1 18 DAL CB C -0.661 -4.772 -13.594 1.00 . A A . 18 DAL CB 1 1 3 1059 1 1 18 DAL H H -2.650 -4.514 -15.160 1.00 . A A . 18 DAL H 1 1 3 1060 1 1 18 DAL HA H -0.345 -2.869 -14.554 1.00 . A A . 18 DAL HA 1 1 3 1061 1 1 18 DAL HB1 H -0.057 -4.625 -12.699 1.00 . A A . 18 DAL HB1 1 1 3 1062 1 1 18 DAL HB2 H -1.511 -5.412 -13.356 1.00 . A A . 18 DAL HB2 1 1 3 1063 1 1 18 DAL N N -2.227 -3.632 -15.093 1.00 . A A . 18 DAL N 1 1 3 1064 1 1 18 DAL O O -1.352 -1.470 -12.734 1.00 . A A . 18 DAL O 1 1 3 1065 1 1 19 PHE C C -3.301 -3.546 -9.833 1.00 . A A . 19 PHE C 1 1 3 1066 1 1 19 PHE CA C -3.219 -2.593 -11.022 1.00 . A A . 19 PHE CA 1 1 3 1067 1 1 19 PHE CB C -4.618 -2.086 -11.380 1.00 . A A . 19 PHE CB 1 1 3 1068 1 1 19 PHE CD1 C -4.855 0.344 -11.961 1.00 . A A . 19 PHE CD1 1 1 3 1069 1 1 19 PHE CD2 C -4.360 -1.197 -13.712 1.00 . A A . 19 PHE CD2 1 1 3 1070 1 1 19 PHE CE1 C -4.848 1.385 -12.870 1.00 . A A . 19 PHE CE1 1 1 3 1071 1 1 19 PHE CE2 C -4.352 -0.160 -14.626 1.00 . A A . 19 PHE CE2 1 1 3 1072 1 1 19 PHE CG C -4.611 -0.957 -12.371 1.00 . A A . 19 PHE CG 1 1 3 1073 1 1 19 PHE CZ C -4.598 1.132 -14.204 1.00 . A A . 19 PHE CZ 1 1 3 1074 1 1 19 PHE H H -2.862 -4.172 -12.388 1.00 . A A . 19 PHE H 1 1 3 1075 1 1 19 PHE HA H -2.599 -1.753 -10.753 1.00 . A A . 19 PHE HA 1 1 3 1076 1 1 19 PHE HB2 H -5.189 -2.897 -11.806 1.00 . A A . 19 PHE HB2 1 1 3 1077 1 1 19 PHE HB3 H -5.107 -1.738 -10.482 1.00 . A A . 19 PHE HB3 1 1 3 1078 1 1 19 PHE HD1 H -5.051 0.542 -10.916 1.00 . A A . 19 PHE HD1 1 1 3 1079 1 1 19 PHE HD2 H -4.169 -2.207 -14.044 1.00 . A A . 19 PHE HD2 1 1 3 1080 1 1 19 PHE HE1 H -5.041 2.394 -12.537 1.00 . A A . 19 PHE HE1 1 1 3 1081 1 1 19 PHE HE2 H -4.157 -0.360 -15.669 1.00 . A A . 19 PHE HE2 1 1 3 1082 1 1 19 PHE HZ H -4.592 1.944 -14.916 1.00 . A A . 19 PHE HZ 1 1 3 1083 1 1 19 PHE N N -2.609 -3.249 -12.173 1.00 . A A . 19 PHE N 1 1 3 1084 1 1 19 PHE O O -2.747 -3.274 -8.768 1.00 . A A . 19 PHE O 1 1 3 1085 1 1 20 GLN C C -3.433 -6.953 -9.329 1.00 . A A . 20 GLN C 1 1 3 1086 1 1 20 GLN CA C -4.150 -5.656 -8.968 1.00 . A A . 20 GLN CA 1 1 3 1087 1 1 20 GLN CB C -5.632 -5.933 -8.713 1.00 . A A . 20 GLN CB 1 1 3 1088 1 1 20 GLN CD C -7.564 -5.755 -7.094 1.00 . A A . 20 GLN CD 1 1 3 1089 1 1 20 GLN CG C -6.061 -5.674 -7.277 1.00 . A A . 20 GLN CG 1 1 3 1090 1 1 20 GLN H H -4.412 -4.824 -10.896 1.00 . A A . 20 GLN H 1 1 3 1091 1 1 20 GLN HA H -3.708 -5.254 -8.068 1.00 . A A . 20 GLN HA 1 1 3 1092 1 1 20 GLN HB2 H -6.221 -5.302 -9.361 1.00 . A A . 20 GLN HB2 1 1 3 1093 1 1 20 GLN HB3 H -5.838 -6.968 -8.946 1.00 . A A . 20 GLN HB3 1 1 3 1094 1 1 20 GLN HE21 H -7.553 -7.665 -7.648 1.00 . A A . 20 GLN HE21 1 1 3 1095 1 1 20 GLN HE22 H -9.100 -7.008 -7.245 1.00 . A A . 20 GLN HE22 1 1 3 1096 1 1 20 GLN HG2 H -5.596 -6.410 -6.638 1.00 . A A . 20 GLN HG2 1 1 3 1097 1 1 20 GLN HG3 H -5.730 -4.688 -6.989 1.00 . A A . 20 GLN HG3 1 1 3 1098 1 1 20 GLN N N -3.995 -4.664 -10.024 1.00 . A A . 20 GLN N 1 1 3 1099 1 1 20 GLN NE2 N -8.130 -6.928 -7.356 1.00 . A A . 20 GLN NE2 1 1 3 1100 1 1 20 GLN O O -3.720 -7.567 -10.357 1.00 . A A . 20 GLN O 1 1 3 1101 1 1 20 GLN OE1 O -8.209 -4.775 -6.721 1.00 . A A . 20 GLN OE1 1 1 3 1102 1 1 21 PHE C C -2.305 -9.742 -7.888 1.00 . A A . 21 PHE C 1 1 3 1103 1 1 21 PHE CA C -1.739 -8.587 -8.709 1.00 . A A . 21 PHE CA 1 1 3 1104 1 1 21 PHE CB C -0.265 -8.372 -8.359 1.00 . A A . 21 PHE CB 1 1 3 1105 1 1 21 PHE CD1 C 1.602 -9.130 -9.854 1.00 . A A . 21 PHE CD1 1 1 3 1106 1 1 21 PHE CD2 C 0.464 -7.107 -10.400 1.00 . A A . 21 PHE CD2 1 1 3 1107 1 1 21 PHE CE1 C 2.416 -8.975 -10.960 1.00 . A A . 21 PHE CE1 1 1 3 1108 1 1 21 PHE CE2 C 1.274 -6.947 -11.508 1.00 . A A . 21 PHE CE2 1 1 3 1109 1 1 21 PHE CG C 0.618 -8.200 -9.562 1.00 . A A . 21 PHE CG 1 1 3 1110 1 1 21 PHE CZ C 2.253 -7.881 -11.788 1.00 . A A . 21 PHE CZ 1 1 3 1111 1 1 21 PHE H H -2.315 -6.831 -7.676 1.00 . A A . 21 PHE H 1 1 3 1112 1 1 21 PHE HA H -1.819 -8.833 -9.757 1.00 . A A . 21 PHE HA 1 1 3 1113 1 1 21 PHE HB2 H -0.173 -7.484 -7.751 1.00 . A A . 21 PHE HB2 1 1 3 1114 1 1 21 PHE HB3 H 0.093 -9.224 -7.802 1.00 . A A . 21 PHE HB3 1 1 3 1115 1 1 21 PHE HD1 H 1.731 -9.986 -9.206 1.00 . A A . 21 PHE HD1 1 1 3 1116 1 1 21 PHE HD2 H -0.300 -6.375 -10.182 1.00 . A A . 21 PHE HD2 1 1 3 1117 1 1 21 PHE HE1 H 3.180 -9.707 -11.176 1.00 . A A . 21 PHE HE1 1 1 3 1118 1 1 21 PHE HE2 H 1.145 -6.091 -12.153 1.00 . A A . 21 PHE HE2 1 1 3 1119 1 1 21 PHE HZ H 2.887 -7.758 -12.653 1.00 . A A . 21 PHE HZ 1 1 3 1120 1 1 21 PHE N N -2.498 -7.364 -8.478 1.00 . A A . 21 PHE N 1 1 3 1121 1 1 21 PHE O O -1.801 -10.057 -6.809 1.00 . A A . 21 PHE O 1 1 3 1122 1 1 22 VAL C C -3.199 -12.776 -7.920 1.00 . A A . 22 VAL C 1 1 3 1123 1 1 22 VAL CA C -3.992 -11.489 -7.721 1.00 . A A . 22 VAL CA 1 1 3 1124 1 1 22 VAL CB C -5.433 -11.705 -8.218 1.00 . A A . 22 VAL CB 1 1 3 1125 1 1 22 VAL CG1 C -6.352 -10.618 -7.682 1.00 . A A . 22 VAL CG1 1 1 3 1126 1 1 22 VAL CG2 C -5.472 -11.746 -9.738 1.00 . A A . 22 VAL CG2 1 1 3 1127 1 1 22 VAL H H -3.713 -10.072 -9.268 1.00 . A A . 22 VAL H 1 1 3 1128 1 1 22 VAL HA H -4.027 -11.259 -6.666 1.00 . A A . 22 VAL HA 1 1 3 1129 1 1 22 VAL HB H -5.782 -12.657 -7.844 1.00 . A A . 22 VAL HB 1 1 3 1130 1 1 22 VAL HG11 H -5.782 -9.715 -7.518 1.00 . A A . 22 VAL HG11 1 1 3 1131 1 1 22 VAL HG12 H -7.137 -10.425 -8.398 1.00 . A A . 22 VAL HG12 1 1 3 1132 1 1 22 VAL HG13 H -6.787 -10.943 -6.748 1.00 . A A . 22 VAL HG13 1 1 3 1133 1 1 22 VAL HG21 H -4.466 -11.682 -10.125 1.00 . A A . 22 VAL HG21 1 1 3 1134 1 1 22 VAL HG22 H -5.924 -12.673 -10.063 1.00 . A A . 22 VAL HG22 1 1 3 1135 1 1 22 VAL HG23 H -6.054 -10.914 -10.106 1.00 . A A . 22 VAL HG23 1 1 3 1136 1 1 22 VAL N N -3.356 -10.369 -8.405 1.00 . A A . 22 VAL N 1 1 3 1137 1 1 22 VAL O O -3.396 -13.494 -8.900 1.00 . A A . 22 VAL O 1 1 3 1138 1 1 23 PHE C C -0.317 -14.069 -8.029 1.00 . A A . 23 PHE C 1 1 3 1139 1 1 23 PHE CA C -1.476 -14.262 -7.055 1.00 . A A . 23 PHE CA 1 1 3 1140 1 1 23 PHE CB C -2.323 -15.463 -7.485 1.00 . A A . 23 PHE CB 1 1 3 1141 1 1 23 PHE CD1 C -1.593 -17.000 -5.641 1.00 . A A . 23 PHE CD1 1 1 3 1142 1 1 23 PHE CD2 C -1.485 -17.793 -7.887 1.00 . A A . 23 PHE CD2 1 1 3 1143 1 1 23 PHE CE1 C -1.103 -18.210 -5.186 1.00 . A A . 23 PHE CE1 1 1 3 1144 1 1 23 PHE CE2 C -0.995 -19.005 -7.438 1.00 . A A . 23 PHE CE2 1 1 3 1145 1 1 23 PHE CG C -1.790 -16.778 -6.994 1.00 . A A . 23 PHE CG 1 1 3 1146 1 1 23 PHE CZ C -0.803 -19.213 -6.086 1.00 . A A . 23 PHE CZ 1 1 3 1147 1 1 23 PHE H H -2.189 -12.450 -6.225 1.00 . A A . 23 PHE H 1 1 3 1148 1 1 23 PHE HA H -1.077 -14.449 -6.071 1.00 . A A . 23 PHE HA 1 1 3 1149 1 1 23 PHE HB2 H -3.323 -15.345 -7.098 1.00 . A A . 23 PHE HB2 1 1 3 1150 1 1 23 PHE HB3 H -2.360 -15.500 -8.563 1.00 . A A . 23 PHE HB3 1 1 3 1151 1 1 23 PHE HD1 H -1.828 -16.215 -4.936 1.00 . A A . 23 PHE HD1 1 1 3 1152 1 1 23 PHE HD2 H -1.633 -17.632 -8.944 1.00 . A A . 23 PHE HD2 1 1 3 1153 1 1 23 PHE HE1 H -0.955 -18.369 -4.128 1.00 . A A . 23 PHE HE1 1 1 3 1154 1 1 23 PHE HE2 H -0.760 -19.788 -8.143 1.00 . A A . 23 PHE HE2 1 1 3 1155 1 1 23 PHE HZ H -0.421 -20.159 -5.732 1.00 . A A . 23 PHE HZ 1 1 3 1156 1 1 23 PHE N N -2.300 -13.062 -6.983 1.00 . A A . 23 PHE N 1 1 3 1157 1 1 23 PHE O O 0.466 -14.987 -8.267 1.00 . A A . 23 PHE O 1 1 3 1158 1 1 24 DBU C C 0.373 -12.061 -10.818 1.00 . A A . 24 DBU C 1 1 3 1159 1 1 24 DBU CA C 0.778 -12.573 -9.474 1.00 . A A . 24 DBU CA 1 1 3 1160 1 1 24 DBU CB C 2.103 -12.692 -9.271 1.00 . A A . 24 DBU CB 1 1 3 1161 1 1 24 DBU CG C 2.764 -13.178 -8.019 1.00 . A A . 24 DBU CG 1 1 3 1162 1 1 24 DBU HG1 H 2.216 -12.920 -7.109 1.00 . A A . 24 DBU HG1 1 1 3 1163 1 1 24 DBU HG2 H 3.767 -12.746 -7.942 1.00 . A A . 24 DBU HG2 1 1 3 1164 1 1 24 DBU HG3 H 2.863 -14.267 -8.054 1.00 . A A . 24 DBU HG3 1 1 3 1165 1 1 24 DBU N N -0.216 -12.867 -8.587 1.00 . A A . 24 DBU N 1 1 3 1166 1 1 24 DBU O O 1.216 -11.673 -11.627 1.00 . A A . 24 DBU O 1 1 3 1167 1 1 25 CYS C C -1.172 -10.091 -12.534 1.00 . A A . 25 CYS C 1 1 3 1168 1 1 25 CYS CA C -1.459 -11.578 -12.347 1.00 . A A . 25 CYS CA 1 1 3 1169 1 1 25 CYS CB C -2.965 -11.832 -12.425 1.00 . A A . 25 CYS CB 1 1 3 1170 1 1 25 CYS H H -1.555 -12.374 -10.388 1.00 . A A . 25 CYS H 1 1 3 1171 1 1 25 CYS HA H -0.968 -12.129 -13.135 1.00 . A A . 25 CYS HA 1 1 3 1172 1 1 25 CYS HB2 H -3.473 -11.146 -11.763 1.00 . A A . 25 CYS HB2 1 1 3 1173 1 1 25 CYS HB3 H -3.300 -11.661 -13.437 1.00 . A A . 25 CYS HB3 1 1 3 1174 1 1 25 CYS N N -0.931 -12.053 -11.073 1.00 . A A . 25 CYS N 1 1 3 1175 1 1 25 CYS O O -0.385 -9.501 -11.793 1.00 . A A . 25 CYS O 1 1 3 1176 1 1 25 CYS SG S -3.460 -13.522 -11.955 1.00 . A A . 25 CYS SG 1 1 3 1177 1 1 26 CYS C C -2.784 -7.534 -14.658 1.00 . A A . 26 CYS C 1 1 3 1178 1 1 26 CYS CA C -1.631 -8.074 -13.816 1.00 . A A . 26 CYS CA 1 1 3 1179 1 1 26 CYS CB C -0.305 -7.848 -14.544 1.00 . A A . 26 CYS CB 1 1 3 1180 1 1 26 CYS H H -2.431 -10.015 -14.086 1.00 . A A . 26 CYS H 1 1 3 1181 1 1 26 CYS HA H -1.610 -7.545 -12.876 1.00 . A A . 26 CYS HA 1 1 3 1182 1 1 26 CYS HB2 H 0.489 -8.322 -13.986 1.00 . A A . 26 CYS HB2 1 1 3 1183 1 1 26 CYS HB3 H -0.362 -8.293 -15.527 1.00 . A A . 26 CYS HB3 1 1 3 1184 1 1 26 CYS N N -1.816 -9.491 -13.530 1.00 . A A . 26 CYS N 1 1 3 1185 1 1 26 CYS O O -2.591 -7.117 -15.800 1.00 . A A . 26 CYS O 1 1 3 1186 1 1 26 CYS SG S 0.139 -6.094 -14.754 1.00 . A A . 26 CYS SG 1 1 3 1187 1 1 27 SER C C -5.785 -5.874 -14.047 1.00 . A A . 27 SER C 1 1 3 1188 1 1 27 SER CA C -5.169 -7.061 -14.782 1.00 . A A . 27 SER CA 1 1 3 1189 1 1 27 SER CB C -6.200 -8.182 -14.918 1.00 . A A . 27 SER CB 1 1 3 1190 1 1 27 SER H H -4.073 -7.890 -13.171 1.00 . A A . 27 SER H 1 1 3 1191 1 1 27 SER HA H -4.865 -6.740 -15.767 1.00 . A A . 27 SER HA 1 1 3 1192 1 1 27 SER HB2 H -5.689 -9.125 -15.035 1.00 . A A . 27 SER HB2 1 1 3 1193 1 1 27 SER HB3 H -6.814 -8.212 -14.030 1.00 . A A . 27 SER HB3 1 1 3 1194 1 1 27 SER HG H -6.518 -7.601 -16.762 1.00 . A A . 27 SER HG 1 1 3 1195 1 1 27 SER N N -3.983 -7.545 -14.084 1.00 . A A . 27 SER N 1 1 3 1196 1 1 27 SER O O -5.867 -5.867 -12.819 1.00 . A A . 27 SER O 1 1 3 1197 1 1 27 SER OG O -7.035 -7.972 -16.044 1.00 . A A . 27 SER OG 1 1 4 1198 1 1 1 LYS C C 3.024 1.657 -2.115 1.00 . A A . 1 LYS C 1 1 4 1199 1 1 1 LYS CA C 3.789 0.674 -1.235 1.00 . A A . 1 LYS CA 1 1 4 1200 1 1 1 LYS CB C 2.851 0.076 -0.184 1.00 . A A . 1 LYS CB 1 1 4 1201 1 1 1 LYS CD C 1.275 -1.777 0.442 1.00 . A A . 1 LYS CD 1 1 4 1202 1 1 1 LYS CE C 0.447 -2.923 -0.119 1.00 . A A . 1 LYS CE 1 1 4 1203 1 1 1 LYS CG C 2.305 -1.290 -0.563 1.00 . A A . 1 LYS CG 1 1 4 1204 1 1 1 LYS H1 H 4.753 2.047 0.056 1.00 . A A . 1 LYS H1 1 1 4 1205 1 1 1 LYS HA H 4.175 -0.121 -1.855 1.00 . A A . 1 LYS HA 1 1 4 1206 1 1 1 LYS HB2 H 3.388 -0.020 0.748 1.00 . A A . 1 LYS HB2 1 1 4 1207 1 1 1 LYS HB3 H 2.016 0.747 -0.041 1.00 . A A . 1 LYS HB3 1 1 4 1208 1 1 1 LYS HD2 H 1.786 -2.119 1.330 1.00 . A A . 1 LYS HD2 1 1 4 1209 1 1 1 LYS HD3 H 0.617 -0.959 0.696 1.00 . A A . 1 LYS HD3 1 1 4 1210 1 1 1 LYS HE2 H 0.322 -2.773 -1.180 1.00 . A A . 1 LYS HE2 1 1 4 1211 1 1 1 LYS HE3 H 0.974 -3.849 0.054 1.00 . A A . 1 LYS HE3 1 1 4 1212 1 1 1 LYS HG2 H 1.839 -1.224 -1.536 1.00 . A A . 1 LYS HG2 1 1 4 1213 1 1 1 LYS HG3 H 3.122 -1.996 -0.600 1.00 . A A . 1 LYS HG3 1 1 4 1214 1 1 1 LYS HZ1 H -1.180 -3.996 0.633 1.00 . A A . 1 LYS HZ1 1 1 4 1215 1 1 1 LYS HZ2 H -1.602 -2.517 -0.070 1.00 . A A . 1 LYS HZ2 1 1 4 1216 1 1 1 LYS HZ3 H -0.873 -2.550 1.457 1.00 . A A . 1 LYS HZ3 1 1 4 1217 1 1 1 LYS N N 4.921 1.327 -0.589 1.00 . A A . 1 LYS N 1 1 4 1218 1 1 1 LYS NZ N -0.896 -3.001 0.520 1.00 . A A . 1 LYS NZ 1 1 4 1219 1 1 1 LYS O O 1.806 1.554 -2.264 1.00 . A A . 1 LYS O 1 1 4 1220 1 1 2 LYS C C 2.372 2.946 -4.707 1.00 . A A . 2 LYS C 1 1 4 1221 1 1 2 LYS CA C 3.135 3.609 -3.565 1.00 . A A . 2 LYS CA 1 1 4 1222 1 1 2 LYS CB C 4.206 4.546 -4.129 1.00 . A A . 2 LYS CB 1 1 4 1223 1 1 2 LYS CD C 3.879 6.860 -5.050 1.00 . A A . 2 LYS CD 1 1 4 1224 1 1 2 LYS CE C 2.473 6.847 -5.631 1.00 . A A . 2 LYS CE 1 1 4 1225 1 1 2 LYS CG C 3.971 6.009 -3.795 1.00 . A A . 2 LYS CG 1 1 4 1226 1 1 2 LYS H H 4.713 2.639 -2.540 1.00 . A A . 2 LYS H 1 1 4 1227 1 1 2 LYS HA H 2.441 4.185 -2.971 1.00 . A A . 2 LYS HA 1 1 4 1228 1 1 2 LYS HB2 H 5.166 4.257 -3.729 1.00 . A A . 2 LYS HB2 1 1 4 1229 1 1 2 LYS HB3 H 4.227 4.443 -5.204 1.00 . A A . 2 LYS HB3 1 1 4 1230 1 1 2 LYS HD2 H 4.145 7.877 -4.805 1.00 . A A . 2 LYS HD2 1 1 4 1231 1 1 2 LYS HD3 H 4.567 6.473 -5.788 1.00 . A A . 2 LYS HD3 1 1 4 1232 1 1 2 LYS HE2 H 2.338 5.935 -6.191 1.00 . A A . 2 LYS HE2 1 1 4 1233 1 1 2 LYS HE3 H 1.762 6.878 -4.818 1.00 . A A . 2 LYS HE3 1 1 4 1234 1 1 2 LYS HG2 H 3.046 6.099 -3.243 1.00 . A A . 2 LYS HG2 1 1 4 1235 1 1 2 LYS HG3 H 4.790 6.366 -3.188 1.00 . A A . 2 LYS HG3 1 1 4 1236 1 1 2 LYS HZ1 H 2.130 8.879 -5.970 1.00 . A A . 2 LYS HZ1 1 1 4 1237 1 1 2 LYS HZ2 H 1.364 7.861 -7.082 1.00 . A A . 2 LYS HZ2 1 1 4 1238 1 1 2 LYS HZ3 H 3.032 8.124 -7.186 1.00 . A A . 2 LYS HZ3 1 1 4 1239 1 1 2 LYS N N 3.745 2.609 -2.697 1.00 . A A . 2 LYS N 1 1 4 1240 1 1 2 LYS NZ N 2.233 8.009 -6.530 1.00 . A A . 2 LYS NZ 1 1 4 1241 1 1 2 LYS O O 1.324 3.432 -5.133 1.00 . A A . 2 LYS O 1 1 4 1242 1 1 3 LYS C C 3.060 -0.163 -6.626 1.00 . A A . 3 LYS C 1 1 4 1243 1 1 3 LYS CA C 2.272 1.099 -6.291 1.00 . A A . 3 LYS CA 1 1 4 1244 1 1 3 LYS CB C 2.160 1.988 -7.531 1.00 . A A . 3 LYS CB 1 1 4 1245 1 1 3 LYS CD C 0.097 1.703 -8.936 1.00 . A A . 3 LYS CD 1 1 4 1246 1 1 3 LYS CE C -1.344 1.342 -8.609 1.00 . A A . 3 LYS CE 1 1 4 1247 1 1 3 LYS CG C 0.748 2.478 -7.802 1.00 . A A . 3 LYS CG 1 1 4 1248 1 1 3 LYS H H 3.741 1.493 -4.818 1.00 . A A . 3 LYS H 1 1 4 1249 1 1 3 LYS HA H 1.281 0.816 -5.970 1.00 . A A . 3 LYS HA 1 1 4 1250 1 1 3 LYS HB2 H 2.799 2.849 -7.401 1.00 . A A . 3 LYS HB2 1 1 4 1251 1 1 3 LYS HB3 H 2.496 1.428 -8.392 1.00 . A A . 3 LYS HB3 1 1 4 1252 1 1 3 LYS HD2 H 0.110 2.310 -9.829 1.00 . A A . 3 LYS HD2 1 1 4 1253 1 1 3 LYS HD3 H 0.657 0.795 -9.108 1.00 . A A . 3 LYS HD3 1 1 4 1254 1 1 3 LYS HE2 H -1.772 2.131 -8.010 1.00 . A A . 3 LYS HE2 1 1 4 1255 1 1 3 LYS HE3 H -1.896 1.249 -9.532 1.00 . A A . 3 LYS HE3 1 1 4 1256 1 1 3 LYS HG2 H 0.155 2.353 -6.909 1.00 . A A . 3 LYS HG2 1 1 4 1257 1 1 3 LYS HG3 H 0.785 3.525 -8.069 1.00 . A A . 3 LYS HG3 1 1 4 1258 1 1 3 LYS HZ1 H -0.938 -0.694 -8.374 1.00 . A A . 3 LYS HZ1 1 1 4 1259 1 1 3 LYS HZ2 H -2.433 -0.216 -7.742 1.00 . A A . 3 LYS HZ2 1 1 4 1260 1 1 3 LYS HZ3 H -1.005 0.163 -6.917 1.00 . A A . 3 LYS HZ3 1 1 4 1261 1 1 3 LYS N N 2.904 1.832 -5.199 1.00 . A A . 3 LYS N 1 1 4 1262 1 1 3 LYS NZ N -1.436 0.059 -7.857 1.00 . A A . 3 LYS NZ 1 1 4 1263 1 1 3 LYS O O 4.191 -0.339 -6.172 1.00 . A A . 3 LYS O 1 1 4 1264 1 1 4 SER C C 3.206 -2.385 -9.339 1.00 . A A . 4 SER C 1 1 4 1265 1 1 4 SER CA C 3.101 -2.284 -7.820 1.00 . A A . 4 SER CA 1 1 4 1266 1 1 4 SER CB C 2.323 -3.481 -7.270 1.00 . A A . 4 SER CB 1 1 4 1267 1 1 4 SER H H 1.555 -0.840 -7.755 1.00 . A A . 4 SER H 1 1 4 1268 1 1 4 SER HA H 4.097 -2.290 -7.401 1.00 . A A . 4 SER HA 1 1 4 1269 1 1 4 SER HB2 H 2.780 -4.395 -7.619 1.00 . A A . 4 SER HB2 1 1 4 1270 1 1 4 SER HB3 H 2.346 -3.457 -6.190 1.00 . A A . 4 SER HB3 1 1 4 1271 1 1 4 SER HG H 0.403 -3.259 -6.952 1.00 . A A . 4 SER HG 1 1 4 1272 1 1 4 SER N N 2.456 -1.037 -7.425 1.00 . A A . 4 SER N 1 1 4 1273 1 1 4 SER O O 2.666 -1.552 -10.066 1.00 . A A . 4 SER O 1 1 4 1274 1 1 4 SER OG O 0.973 -3.453 -7.700 1.00 . A A . 4 SER OG 1 1 4 1275 1 1 5 GLY C C 5.105 -4.660 -11.568 1.00 . A A . 5 GLY C 1 1 4 1276 1 1 5 GLY CA C 4.069 -3.604 -11.240 1.00 . A A . 5 GLY CA 1 1 4 1277 1 1 5 GLY H H 4.314 -4.045 -9.184 1.00 . A A . 5 GLY H 1 1 4 1278 1 1 5 GLY HA2 H 3.121 -3.900 -11.663 1.00 . A A . 5 GLY HA2 1 1 4 1279 1 1 5 GLY HA3 H 4.373 -2.667 -11.685 1.00 . A A . 5 GLY HA3 1 1 4 1280 1 1 5 GLY N N 3.905 -3.412 -9.811 1.00 . A A . 5 GLY N 1 1 4 1281 1 1 5 GLY O O 6.032 -4.413 -12.340 1.00 . A A . 5 GLY O 1 1 4 1282 1 1 6 VAL C C 6.104 -7.163 -12.705 1.00 . A A . 6 VAL C 1 1 4 1283 1 1 6 VAL CA C 5.880 -6.940 -11.214 1.00 . A A . 6 VAL CA 1 1 4 1284 1 1 6 VAL CB C 5.374 -8.249 -10.580 1.00 . A A . 6 VAL CB 1 1 4 1285 1 1 6 VAL CG1 C 6.412 -9.351 -10.728 1.00 . A A . 6 VAL CG1 1 1 4 1286 1 1 6 VAL CG2 C 5.021 -8.031 -9.117 1.00 . A A . 6 VAL CG2 1 1 4 1287 1 1 6 VAL H H 4.192 -5.979 -10.375 1.00 . A A . 6 VAL H 1 1 4 1288 1 1 6 VAL HA H 6.823 -6.683 -10.753 1.00 . A A . 6 VAL HA 1 1 4 1289 1 1 6 VAL HB H 4.479 -8.556 -11.102 1.00 . A A . 6 VAL HB 1 1 4 1290 1 1 6 VAL HG11 H 5.948 -10.228 -11.156 1.00 . A A . 6 VAL HG11 1 1 4 1291 1 1 6 VAL HG12 H 7.208 -9.012 -11.374 1.00 . A A . 6 VAL HG12 1 1 4 1292 1 1 6 VAL HG13 H 6.816 -9.597 -9.757 1.00 . A A . 6 VAL HG13 1 1 4 1293 1 1 6 VAL HG21 H 4.781 -8.979 -8.659 1.00 . A A . 6 VAL HG21 1 1 4 1294 1 1 6 VAL HG22 H 5.862 -7.587 -8.605 1.00 . A A . 6 VAL HG22 1 1 4 1295 1 1 6 VAL HG23 H 4.169 -7.371 -9.046 1.00 . A A . 6 VAL HG23 1 1 4 1296 1 1 6 VAL N N 4.950 -5.842 -10.980 1.00 . A A . 6 VAL N 1 1 4 1297 1 1 6 VAL O O 7.083 -6.681 -13.275 1.00 . A A . 6 VAL O 1 1 4 1298 1 1 7 ILE C C 3.904 -8.266 -15.396 1.00 . A A . 7 ILE C 1 1 4 1299 1 1 7 ILE CA C 5.286 -8.182 -14.757 1.00 . A A . 7 ILE CA 1 1 4 1300 1 1 7 ILE CB C 6.040 -9.500 -15.018 1.00 . A A . 7 ILE CB 1 1 4 1301 1 1 7 ILE CD1 C 6.372 -11.810 -14.004 1.00 . A A . 7 ILE CD1 1 1 4 1302 1 1 7 ILE CG1 C 6.083 -10.348 -13.745 1.00 . A A . 7 ILE CG1 1 1 4 1303 1 1 7 ILE CG2 C 7.448 -9.214 -15.519 1.00 . A A . 7 ILE CG2 1 1 4 1304 1 1 7 ILE H H 4.432 -8.253 -12.822 1.00 . A A . 7 ILE H 1 1 4 1305 1 1 7 ILE HA H 5.837 -7.377 -15.222 1.00 . A A . 7 ILE HA 1 1 4 1306 1 1 7 ILE HB H 5.513 -10.044 -15.787 1.00 . A A . 7 ILE HB 1 1 4 1307 1 1 7 ILE HD11 H 7.306 -12.082 -13.533 1.00 . A A . 7 ILE HD11 1 1 4 1308 1 1 7 ILE HD12 H 5.575 -12.413 -13.597 1.00 . A A . 7 ILE HD12 1 1 4 1309 1 1 7 ILE HD13 H 6.445 -11.980 -15.068 1.00 . A A . 7 ILE HD13 1 1 4 1310 1 1 7 ILE HG12 H 6.853 -9.969 -13.093 1.00 . A A . 7 ILE HG12 1 1 4 1311 1 1 7 ILE HG13 H 5.128 -10.282 -13.245 1.00 . A A . 7 ILE HG13 1 1 4 1312 1 1 7 ILE HG21 H 7.845 -10.097 -15.999 1.00 . A A . 7 ILE HG21 1 1 4 1313 1 1 7 ILE HG22 H 7.419 -8.402 -16.229 1.00 . A A . 7 ILE HG22 1 1 4 1314 1 1 7 ILE HG23 H 8.078 -8.943 -14.686 1.00 . A A . 7 ILE HG23 1 1 4 1315 1 1 7 ILE N N 5.189 -7.897 -13.331 1.00 . A A . 7 ILE N 1 1 4 1316 1 1 7 ILE O O 3.128 -9.187 -15.139 1.00 . A A . 7 ILE O 1 1 4 1317 1 1 8 PRO C C 2.156 -8.317 -17.999 1.00 . A A . 8 PRO C 1 1 4 1318 1 1 8 PRO CA C 2.297 -7.223 -16.947 1.00 . A A . 8 PRO CA 1 1 4 1319 1 1 8 PRO CB C 2.315 -5.843 -17.608 1.00 . A A . 8 PRO CB 1 1 4 1320 1 1 8 PRO CD C 4.462 -6.153 -16.605 1.00 . A A . 8 PRO CD 1 1 4 1321 1 1 8 PRO CG C 3.759 -5.521 -17.775 1.00 . A A . 8 PRO CG 1 1 4 1322 1 1 8 PRO HA H 1.470 -7.282 -16.255 1.00 . A A . 8 PRO HA 1 1 4 1323 1 1 8 PRO HB2 H 1.808 -5.892 -18.562 1.00 . A A . 8 PRO HB2 1 1 4 1324 1 1 8 PRO HB3 H 1.822 -5.127 -16.969 1.00 . A A . 8 PRO HB3 1 1 4 1325 1 1 8 PRO HD2 H 5.442 -6.501 -16.897 1.00 . A A . 8 PRO HD2 1 1 4 1326 1 1 8 PRO HD3 H 4.537 -5.452 -15.786 1.00 . A A . 8 PRO HD3 1 1 4 1327 1 1 8 PRO HG2 H 4.124 -5.937 -18.701 1.00 . A A . 8 PRO HG2 1 1 4 1328 1 1 8 PRO HG3 H 3.900 -4.450 -17.762 1.00 . A A . 8 PRO HG3 1 1 4 1329 1 1 8 PRO N N 3.586 -7.282 -16.251 1.00 . A A . 8 PRO N 1 1 4 1330 1 1 8 PRO O O 3.038 -8.503 -18.836 1.00 . A A . 8 PRO O 1 1 4 1331 1 1 9 . C C 1.302 -11.420 -18.351 1.00 . A A . 9 DBB C 1 1 4 1332 1 1 9 . CA C 0.782 -10.122 -18.909 1.00 . A A . 9 DBB CA 1 1 4 1333 1 1 9 . CB C -0.724 -10.237 -19.153 1.00 . A A . 9 DBB CB 1 1 4 1334 1 1 9 . CG C -0.982 -11.217 -20.300 1.00 . A A . 9 DBB CG 1 1 4 1335 1 1 9 . H H 0.374 -8.842 -17.260 1.00 . A A . 9 DBB H 1 1 4 1336 1 1 9 . HA H 1.287 -9.902 -19.850 1.00 . A A . 9 DBB HA 1 1 4 1337 1 1 9 . HB2 H -1.126 -9.259 -19.414 1.00 . A A . 9 DBB HB2 1 1 4 1338 1 1 9 . HG1 H -0.193 -11.120 -21.046 1.00 . A A . 9 DBB HG1 1 1 4 1339 1 1 9 . HG2 H -0.994 -12.234 -19.913 1.00 . A A . 9 DBB HG2 1 1 4 1340 1 1 9 . HG3 H -1.945 -10.992 -20.759 1.00 . A A . 9 DBB HG3 1 1 4 1341 1 1 9 . N N 1.040 -9.038 -17.951 1.00 . A A . 9 DBB N 1 1 4 1342 1 1 9 . O O 1.946 -12.197 -19.056 1.00 . A A . 9 DBB O 1 1 4 1343 1 1 10 VAL C C 0.285 -13.673 -15.862 1.00 . A A . 10 VAL C 1 1 4 1344 1 1 10 VAL CA C 1.468 -12.885 -16.414 1.00 . A A . 10 VAL CA 1 1 4 1345 1 1 10 VAL CB C 2.448 -12.578 -15.265 1.00 . A A . 10 VAL CB 1 1 4 1346 1 1 10 VAL CG1 C 3.752 -12.018 -15.811 1.00 . A A . 10 VAL CG1 1 1 4 1347 1 1 10 VAL CG2 C 1.818 -11.613 -14.272 1.00 . A A . 10 VAL CG2 1 1 4 1348 1 1 10 VAL H H 0.506 -11.005 -16.564 1.00 . A A . 10 VAL H 1 1 4 1349 1 1 10 VAL HA H 1.982 -13.491 -17.145 1.00 . A A . 10 VAL HA 1 1 4 1350 1 1 10 VAL HB H 2.666 -13.501 -14.749 1.00 . A A . 10 VAL HB 1 1 4 1351 1 1 10 VAL HG11 H 4.121 -11.251 -15.146 1.00 . A A . 10 VAL HG11 1 1 4 1352 1 1 10 VAL HG12 H 4.481 -12.811 -15.888 1.00 . A A . 10 VAL HG12 1 1 4 1353 1 1 10 VAL HG13 H 3.579 -11.591 -16.789 1.00 . A A . 10 VAL HG13 1 1 4 1354 1 1 10 VAL HG21 H 1.032 -12.117 -13.730 1.00 . A A . 10 VAL HG21 1 1 4 1355 1 1 10 VAL HG22 H 2.570 -11.268 -13.578 1.00 . A A . 10 VAL HG22 1 1 4 1356 1 1 10 VAL HG23 H 1.405 -10.768 -14.803 1.00 . A A . 10 VAL HG23 1 1 4 1357 1 1 10 VAL N N 1.024 -11.663 -17.074 1.00 . A A . 10 VAL N 1 1 4 1358 1 1 10 VAL O O 0.430 -14.824 -15.454 1.00 . A A . 10 VAL O 1 1 4 1359 1 1 11 DAL C C -2.390 -14.926 -16.159 1.00 . A A . 11 DAL C 1 1 4 1360 1 1 11 DAL CA C -2.104 -13.691 -15.346 1.00 . A A . 11 DAL CA 1 1 4 1361 1 1 11 DAL CB C -1.902 -14.080 -13.879 1.00 . A A . 11 DAL CB 1 1 4 1362 1 1 11 DAL H H -0.937 -12.125 -16.190 1.00 . A A . 11 DAL H 1 1 4 1363 1 1 11 DAL HA H -2.942 -12.999 -15.426 1.00 . A A . 11 DAL HA 1 1 4 1364 1 1 11 DAL HB1 H -2.532 -14.935 -13.640 1.00 . A A . 11 DAL HB1 1 1 4 1365 1 1 11 DAL HB2 H -0.857 -14.342 -13.715 1.00 . A A . 11 DAL HB2 1 1 4 1366 1 1 11 DAL N N -0.885 -13.043 -15.852 1.00 . A A . 11 DAL N 1 1 4 1367 1 1 11 DAL O O -1.547 -15.384 -16.931 1.00 . A A . 11 DAL O 1 1 4 1368 1 1 12 HIS C C -4.880 -16.316 -17.905 1.00 . A A . 12 HIS C 1 1 4 1369 1 1 12 HIS CA C -3.991 -16.674 -16.718 1.00 . A A . 12 HIS CA 1 1 4 1370 1 1 12 HIS CB C -4.727 -17.639 -15.787 1.00 . A A . 12 HIS CB 1 1 4 1371 1 1 12 HIS CD2 C -3.442 -18.398 -13.666 1.00 . A A . 12 HIS CD2 1 1 4 1372 1 1 12 HIS CE1 C -2.426 -20.146 -14.515 1.00 . A A . 12 HIS CE1 1 1 4 1373 1 1 12 HIS CG C -3.812 -18.493 -14.965 1.00 . A A . 12 HIS CG 1 1 4 1374 1 1 12 HIS H H -4.218 -15.065 -15.360 1.00 . A A . 12 HIS H 1 1 4 1375 1 1 12 HIS HA H -3.097 -17.154 -17.085 1.00 . A A . 12 HIS HA 1 1 4 1376 1 1 12 HIS HB2 H -5.348 -17.072 -15.110 1.00 . A A . 12 HIS HB2 1 1 4 1377 1 1 12 HIS HB3 H -5.351 -18.293 -16.379 1.00 . A A . 12 HIS HB3 1 1 4 1378 1 1 12 HIS HD1 H -3.222 -19.930 -16.388 1.00 . A A . 12 HIS HD1 1 1 4 1379 1 1 12 HIS HD2 H -3.764 -17.646 -12.960 1.00 . A A . 12 HIS HD2 1 1 4 1380 1 1 12 HIS HE1 H -1.807 -21.024 -14.620 1.00 . A A . 12 HIS HE1 1 1 4 1381 1 1 12 HIS N N -3.589 -15.476 -15.989 1.00 . A A . 12 HIS N 1 1 4 1382 1 1 12 HIS ND1 N -3.158 -19.597 -15.469 1.00 . A A . 12 HIS ND1 1 1 4 1383 1 1 12 HIS NE2 N -2.581 -19.437 -13.412 1.00 . A A . 12 HIS NE2 1 1 4 1384 1 1 12 HIS O O -5.304 -17.190 -18.661 1.00 . A A . 12 HIS O 1 1 4 1385 1 1 13 ASP C C -6.114 -13.032 -19.132 1.00 . A A . 13 ASP C 1 1 4 1386 1 1 13 ASP CA C -5.997 -14.552 -19.156 1.00 . A A . 13 ASP CA 1 1 4 1387 1 1 13 ASP CB C -7.387 -15.185 -19.073 1.00 . A A . 13 ASP CB 1 1 4 1388 1 1 13 ASP CG C -7.988 -15.082 -17.685 1.00 . A A . 13 ASP CG 1 1 4 1389 1 1 13 ASP H H -4.791 -14.377 -17.425 1.00 . A A . 13 ASP H 1 1 4 1390 1 1 13 ASP HA H -5.531 -14.850 -20.083 1.00 . A A . 13 ASP HA 1 1 4 1391 1 1 13 ASP HB2 H -8.045 -14.684 -19.768 1.00 . A A . 13 ASP HB2 1 1 4 1392 1 1 13 ASP HB3 H -7.316 -16.229 -19.339 1.00 . A A . 13 ASP HB3 1 1 4 1393 1 1 13 ASP N N -5.158 -15.026 -18.061 1.00 . A A . 13 ASP N 1 1 4 1394 1 1 13 ASP O O -7.199 -12.479 -19.318 1.00 . A A . 13 ASP O 1 1 4 1395 1 1 13 ASP OD1 O -7.878 -16.061 -16.917 1.00 . A A . 13 ASP OD1 1 1 4 1396 1 1 13 ASP OD2 O -8.567 -14.023 -17.367 1.00 . A A . 13 ASP OD2 1 1 4 1397 1 1 14 CYS C C -4.486 -10.321 -20.176 1.00 . A A . 14 CYS C 1 1 4 1398 1 1 14 CYS CA C -4.967 -10.903 -18.850 1.00 . A A . 14 CYS CA 1 1 4 1399 1 1 14 CYS CB C -4.061 -10.427 -17.713 1.00 . A A . 14 CYS CB 1 1 4 1400 1 1 14 CYS H H -4.157 -12.857 -18.760 1.00 . A A . 14 CYS H 1 1 4 1401 1 1 14 CYS HA H -5.973 -10.561 -18.665 1.00 . A A . 14 CYS HA 1 1 4 1402 1 1 14 CYS HB2 H -4.215 -9.368 -17.560 1.00 . A A . 14 CYS HB2 1 1 4 1403 1 1 14 CYS HB3 H -4.322 -10.957 -16.809 1.00 . A A . 14 CYS HB3 1 1 4 1404 1 1 14 CYS N N -4.991 -12.360 -18.901 1.00 . A A . 14 CYS N 1 1 4 1405 1 1 14 CYS O O -4.201 -11.056 -21.122 1.00 . A A . 14 CYS O 1 1 4 1406 1 1 14 CYS SG S -2.284 -10.688 -18.017 1.00 . A A . 14 CYS SG 1 1 4 1407 1 1 15 HIS C C -2.837 -7.320 -21.129 1.00 . A A . 15 HIS C 1 1 4 1408 1 1 15 HIS CA C -3.950 -8.314 -21.446 1.00 . A A . 15 HIS CA 1 1 4 1409 1 1 15 HIS CB C -5.121 -7.592 -22.113 1.00 . A A . 15 HIS CB 1 1 4 1410 1 1 15 HIS CD2 C -6.428 -8.634 -24.096 1.00 . A A . 15 HIS CD2 1 1 4 1411 1 1 15 HIS CE1 C -4.934 -8.313 -25.668 1.00 . A A . 15 HIS CE1 1 1 4 1412 1 1 15 HIS CG C -5.363 -8.022 -23.527 1.00 . A A . 15 HIS CG 1 1 4 1413 1 1 15 HIS H H -4.638 -8.465 -19.450 1.00 . A A . 15 HIS H 1 1 4 1414 1 1 15 HIS HA H -3.565 -9.061 -22.124 1.00 . A A . 15 HIS HA 1 1 4 1415 1 1 15 HIS HB2 H -6.022 -7.784 -21.549 1.00 . A A . 15 HIS HB2 1 1 4 1416 1 1 15 HIS HB3 H -4.925 -6.529 -22.117 1.00 . A A . 15 HIS HB3 1 1 4 1417 1 1 15 HIS HD1 H -3.565 -7.415 -24.441 1.00 . A A . 15 HIS HD1 1 1 4 1418 1 1 15 HIS HD2 H -7.339 -8.933 -23.597 1.00 . A A . 15 HIS HD2 1 1 4 1419 1 1 15 HIS HE1 H -4.436 -8.305 -26.626 1.00 . A A . 15 HIS HE1 1 1 4 1420 1 1 15 HIS N N -4.397 -8.996 -20.237 1.00 . A A . 15 HIS N 1 1 4 1421 1 1 15 HIS ND1 N -4.444 -7.836 -24.538 1.00 . A A . 15 HIS ND1 1 1 4 1422 1 1 15 HIS NE2 N -6.136 -8.803 -25.427 1.00 . A A . 15 HIS NE2 1 1 4 1423 1 1 15 HIS O O -1.689 -7.510 -21.529 1.00 . A A . 15 HIS O 1 1 4 1424 1 1 16 MET C C -2.872 -4.144 -19.197 1.00 . A A . 16 MET C 1 1 4 1425 1 1 16 MET CA C -2.216 -5.235 -20.038 1.00 . A A . 16 MET CA 1 1 4 1426 1 1 16 MET CB C -1.587 -4.620 -21.290 1.00 . A A . 16 MET CB 1 1 4 1427 1 1 16 MET CE C 1.132 -3.963 -23.725 1.00 . A A . 16 MET CE 1 1 4 1428 1 1 16 MET CG C -0.112 -4.947 -21.453 1.00 . A A . 16 MET CG 1 1 4 1429 1 1 16 MET H H -4.117 -6.162 -20.119 1.00 . A A . 16 MET H 1 1 4 1430 1 1 16 MET HA H -1.442 -5.708 -19.453 1.00 . A A . 16 MET HA 1 1 4 1431 1 1 16 MET HB2 H -2.113 -4.986 -22.159 1.00 . A A . 16 MET HB2 1 1 4 1432 1 1 16 MET HB3 H -1.692 -3.546 -21.242 1.00 . A A . 16 MET HB3 1 1 4 1433 1 1 16 MET HE1 H 1.683 -4.890 -23.780 1.00 . A A . 16 MET HE1 1 1 4 1434 1 1 16 MET HE2 H 0.181 -4.080 -24.224 1.00 . A A . 16 MET HE2 1 1 4 1435 1 1 16 MET HE3 H 1.698 -3.179 -24.207 1.00 . A A . 16 MET HE3 1 1 4 1436 1 1 16 MET HG2 H 0.277 -5.279 -20.501 1.00 . A A . 16 MET HG2 1 1 4 1437 1 1 16 MET HG3 H -0.012 -5.742 -22.177 1.00 . A A . 16 MET HG3 1 1 4 1438 1 1 16 MET N N -3.186 -6.259 -20.409 1.00 . A A . 16 MET N 1 1 4 1439 1 1 16 MET O O -3.752 -3.427 -19.670 1.00 . A A . 16 MET O 1 1 4 1440 1 1 16 MET SD S 0.856 -3.532 -22.009 1.00 . A A . 16 MET SD 1 1 4 1441 1 1 17 ASN C C -1.974 -2.669 -15.950 1.00 . A A . 17 ASN C 1 1 4 1442 1 1 17 ASN CA C -2.982 -3.023 -17.039 1.00 . A A . 17 ASN CA 1 1 4 1443 1 1 17 ASN CB C -4.278 -3.531 -16.404 1.00 . A A . 17 ASN CB 1 1 4 1444 1 1 17 ASN CG C -5.411 -3.634 -17.407 1.00 . A A . 17 ASN CG 1 1 4 1445 1 1 17 ASN H H -1.732 -4.627 -17.626 1.00 . A A . 17 ASN H 1 1 4 1446 1 1 17 ASN HA H -3.198 -2.136 -17.616 1.00 . A A . 17 ASN HA 1 1 4 1447 1 1 17 ASN HB2 H -4.106 -4.511 -15.983 1.00 . A A . 17 ASN HB2 1 1 4 1448 1 1 17 ASN HB3 H -4.577 -2.853 -15.619 1.00 . A A . 17 ASN HB3 1 1 4 1449 1 1 17 ASN HD21 H -5.485 -1.653 -17.564 1.00 . A A . 17 ASN HD21 1 1 4 1450 1 1 17 ASN HD22 H -6.620 -2.526 -18.532 1.00 . A A . 17 ASN HD22 1 1 4 1451 1 1 17 ASN N N -2.436 -4.026 -17.947 1.00 . A A . 17 ASN N 1 1 4 1452 1 1 17 ASN ND2 N -5.886 -2.489 -17.882 1.00 . A A . 17 ASN ND2 1 1 4 1453 1 1 17 ASN O O -1.357 -1.605 -15.984 1.00 . A A . 17 ASN O 1 1 4 1454 1 1 17 ASN OD1 O -5.854 -4.731 -17.750 1.00 . A A . 17 ASN OD1 1 1 4 1455 1 1 18 DAL C C -1.460 -2.357 -12.907 1.00 . A A . 18 DAL C 1 1 4 1456 1 1 18 DAL CA C -0.872 -3.349 -13.877 1.00 . A A . 18 DAL CA 1 1 4 1457 1 1 18 DAL CB C -0.615 -4.676 -13.158 1.00 . A A . 18 DAL CB 1 1 4 1458 1 1 18 DAL H H -2.334 -4.398 -15.013 1.00 . A A . 18 DAL H 1 1 4 1459 1 1 18 DAL HA H 0.067 -2.961 -14.270 1.00 . A A . 18 DAL HA 1 1 4 1460 1 1 18 DAL HB1 H 0.028 -4.504 -12.296 1.00 . A A . 18 DAL HB1 1 1 4 1461 1 1 18 DAL HB2 H -1.564 -5.097 -12.825 1.00 . A A . 18 DAL HB2 1 1 4 1462 1 1 18 DAL N N -1.813 -3.568 -14.985 1.00 . A A . 18 DAL N 1 1 4 1463 1 1 18 DAL O O -0.918 -1.270 -12.710 1.00 . A A . 18 DAL O 1 1 4 1464 1 1 19 PHE C C -3.257 -2.490 -9.944 1.00 . A A . 19 PHE C 1 1 4 1465 1 1 19 PHE CA C -3.249 -1.860 -11.333 1.00 . A A . 19 PHE CA 1 1 4 1466 1 1 19 PHE CB C -4.683 -1.575 -11.785 1.00 . A A . 19 PHE CB 1 1 4 1467 1 1 19 PHE CD1 C -6.414 -2.716 -10.370 1.00 . A A . 19 PHE CD1 1 1 4 1468 1 1 19 PHE CD2 C -5.744 -3.763 -12.405 1.00 . A A . 19 PHE CD2 1 1 4 1469 1 1 19 PHE CE1 C -7.289 -3.756 -10.119 1.00 . A A . 19 PHE CE1 1 1 4 1470 1 1 19 PHE CE2 C -6.618 -4.805 -12.159 1.00 . A A . 19 PHE CE2 1 1 4 1471 1 1 19 PHE CG C -5.633 -2.707 -11.515 1.00 . A A . 19 PHE CG 1 1 4 1472 1 1 19 PHE CZ C -7.390 -4.802 -11.014 1.00 . A A . 19 PHE CZ 1 1 4 1473 1 1 19 PHE H H -2.964 -3.608 -12.493 1.00 . A A . 19 PHE H 1 1 4 1474 1 1 19 PHE HA H -2.703 -0.931 -11.291 1.00 . A A . 19 PHE HA 1 1 4 1475 1 1 19 PHE HB2 H -5.050 -0.703 -11.264 1.00 . A A . 19 PHE HB2 1 1 4 1476 1 1 19 PHE HB3 H -4.687 -1.383 -12.847 1.00 . A A . 19 PHE HB3 1 1 4 1477 1 1 19 PHE HD1 H -6.335 -1.897 -9.668 1.00 . A A . 19 PHE HD1 1 1 4 1478 1 1 19 PHE HD2 H -5.140 -3.767 -13.301 1.00 . A A . 19 PHE HD2 1 1 4 1479 1 1 19 PHE HE1 H -7.891 -3.750 -9.222 1.00 . A A . 19 PHE HE1 1 1 4 1480 1 1 19 PHE HE2 H -6.695 -5.622 -12.861 1.00 . A A . 19 PHE HE2 1 1 4 1481 1 1 19 PHE HZ H -8.074 -5.615 -10.820 1.00 . A A . 19 PHE HZ 1 1 4 1482 1 1 19 PHE N N -2.579 -2.729 -12.294 1.00 . A A . 19 PHE N 1 1 4 1483 1 1 19 PHE O O -3.369 -1.793 -8.936 1.00 . A A . 19 PHE O 1 1 4 1484 1 1 20 GLN C C -2.955 -6.035 -8.865 1.00 . A A . 20 GLN C 1 1 4 1485 1 1 20 GLN CA C -3.134 -4.538 -8.635 1.00 . A A . 20 GLN CA 1 1 4 1486 1 1 20 GLN CB C -4.433 -4.280 -7.869 1.00 . A A . 20 GLN CB 1 1 4 1487 1 1 20 GLN CD C -4.946 -5.261 -5.598 1.00 . A A . 20 GLN CD 1 1 4 1488 1 1 20 GLN CG C -4.240 -4.161 -6.366 1.00 . A A . 20 GLN CG 1 1 4 1489 1 1 20 GLN H H -3.053 -4.314 -10.738 1.00 . A A . 20 GLN H 1 1 4 1490 1 1 20 GLN HA H -2.303 -4.175 -8.048 1.00 . A A . 20 GLN HA 1 1 4 1491 1 1 20 GLN HB2 H -4.871 -3.361 -8.229 1.00 . A A . 20 GLN HB2 1 1 4 1492 1 1 20 GLN HB3 H -5.116 -5.094 -8.059 1.00 . A A . 20 GLN HB3 1 1 4 1493 1 1 20 GLN HE21 H -3.559 -6.572 -6.155 1.00 . A A . 20 GLN HE21 1 1 4 1494 1 1 20 GLN HE22 H -4.820 -7.194 -5.152 1.00 . A A . 20 GLN HE22 1 1 4 1495 1 1 20 GLN HG2 H -3.184 -4.210 -6.146 1.00 . A A . 20 GLN HG2 1 1 4 1496 1 1 20 GLN HG3 H -4.630 -3.207 -6.041 1.00 . A A . 20 GLN HG3 1 1 4 1497 1 1 20 GLN N N -3.139 -3.813 -9.900 1.00 . A A . 20 GLN N 1 1 4 1498 1 1 20 GLN NE2 N -4.386 -6.464 -5.639 1.00 . A A . 20 GLN NE2 1 1 4 1499 1 1 20 GLN O O -3.616 -6.625 -9.720 1.00 . A A . 20 GLN O 1 1 4 1500 1 1 20 GLN OE1 O -5.983 -5.032 -4.975 1.00 . A A . 20 GLN OE1 1 1 4 1501 1 1 21 PHE C C -2.527 -8.857 -7.139 1.00 . A A . 21 PHE C 1 1 4 1502 1 1 21 PHE CA C -1.790 -8.072 -8.219 1.00 . A A . 21 PHE CA 1 1 4 1503 1 1 21 PHE CB C -0.286 -8.341 -8.125 1.00 . A A . 21 PHE CB 1 1 4 1504 1 1 21 PHE CD1 C 0.640 -6.368 -9.366 1.00 . A A . 21 PHE CD1 1 1 4 1505 1 1 21 PHE CD2 C 1.105 -8.552 -10.202 1.00 . A A . 21 PHE CD2 1 1 4 1506 1 1 21 PHE CE1 C 1.366 -5.812 -10.404 1.00 . A A . 21 PHE CE1 1 1 4 1507 1 1 21 PHE CE2 C 1.832 -8.003 -11.241 1.00 . A A . 21 PHE CE2 1 1 4 1508 1 1 21 PHE CG C 0.502 -7.742 -9.253 1.00 . A A . 21 PHE CG 1 1 4 1509 1 1 21 PHE CZ C 1.961 -6.631 -11.343 1.00 . A A . 21 PHE CZ 1 1 4 1510 1 1 21 PHE H H -1.561 -6.119 -7.434 1.00 . A A . 21 PHE H 1 1 4 1511 1 1 21 PHE HA H -2.144 -8.394 -9.186 1.00 . A A . 21 PHE HA 1 1 4 1512 1 1 21 PHE HB2 H 0.089 -7.927 -7.201 1.00 . A A . 21 PHE HB2 1 1 4 1513 1 1 21 PHE HB3 H -0.118 -9.408 -8.130 1.00 . A A . 21 PHE HB3 1 1 4 1514 1 1 21 PHE HD1 H 0.174 -5.726 -8.632 1.00 . A A . 21 PHE HD1 1 1 4 1515 1 1 21 PHE HD2 H 1.004 -9.625 -10.124 1.00 . A A . 21 PHE HD2 1 1 4 1516 1 1 21 PHE HE1 H 1.464 -4.740 -10.480 1.00 . A A . 21 PHE HE1 1 1 4 1517 1 1 21 PHE HE2 H 2.297 -8.645 -11.974 1.00 . A A . 21 PHE HE2 1 1 4 1518 1 1 21 PHE HZ H 2.529 -6.200 -12.154 1.00 . A A . 21 PHE HZ 1 1 4 1519 1 1 21 PHE N N -2.057 -6.644 -8.098 1.00 . A A . 21 PHE N 1 1 4 1520 1 1 21 PHE O O -2.054 -8.976 -6.009 1.00 . A A . 21 PHE O 1 1 4 1521 1 1 22 VAL C C -3.955 -11.584 -6.409 1.00 . A A . 22 VAL C 1 1 4 1522 1 1 22 VAL CA C -4.496 -10.166 -6.557 1.00 . A A . 22 VAL CA 1 1 4 1523 1 1 22 VAL CB C -5.968 -10.234 -7.003 1.00 . A A . 22 VAL CB 1 1 4 1524 1 1 22 VAL CG1 C -6.583 -8.843 -7.028 1.00 . A A . 22 VAL CG1 1 1 4 1525 1 1 22 VAL CG2 C -6.081 -10.901 -8.366 1.00 . A A . 22 VAL CG2 1 1 4 1526 1 1 22 VAL H H -4.017 -9.263 -8.410 1.00 . A A . 22 VAL H 1 1 4 1527 1 1 22 VAL HA H -4.455 -9.674 -5.596 1.00 . A A . 22 VAL HA 1 1 4 1528 1 1 22 VAL HB H -6.513 -10.831 -6.287 1.00 . A A . 22 VAL HB 1 1 4 1529 1 1 22 VAL HG11 H -7.395 -8.796 -6.317 1.00 . A A . 22 VAL HG11 1 1 4 1530 1 1 22 VAL HG12 H -5.832 -8.112 -6.769 1.00 . A A . 22 VAL HG12 1 1 4 1531 1 1 22 VAL HG13 H -6.962 -8.635 -8.019 1.00 . A A . 22 VAL HG13 1 1 4 1532 1 1 22 VAL HG21 H -6.890 -11.616 -8.349 1.00 . A A . 22 VAL HG21 1 1 4 1533 1 1 22 VAL HG22 H -6.278 -10.152 -9.119 1.00 . A A . 22 VAL HG22 1 1 4 1534 1 1 22 VAL HG23 H -5.156 -11.408 -8.597 1.00 . A A . 22 VAL HG23 1 1 4 1535 1 1 22 VAL N N -3.691 -9.392 -7.495 1.00 . A A . 22 VAL N 1 1 4 1536 1 1 22 VAL O O -4.360 -12.324 -5.513 1.00 . A A . 22 VAL O 1 1 4 1537 1 1 23 PHE C C -1.297 -13.393 -8.270 1.00 . A A . 23 PHE C 1 1 4 1538 1 1 23 PHE CA C -2.439 -13.286 -7.264 1.00 . A A . 23 PHE CA 1 1 4 1539 1 1 23 PHE CB C -3.498 -14.350 -7.561 1.00 . A A . 23 PHE CB 1 1 4 1540 1 1 23 PHE CD1 C -3.083 -16.752 -8.157 1.00 . A A . 23 PHE CD1 1 1 4 1541 1 1 23 PHE CD2 C -2.633 -16.045 -5.925 1.00 . A A . 23 PHE CD2 1 1 4 1542 1 1 23 PHE CE1 C -2.683 -18.036 -7.835 1.00 . A A . 23 PHE CE1 1 1 4 1543 1 1 23 PHE CE2 C -2.232 -17.326 -5.597 1.00 . A A . 23 PHE CE2 1 1 4 1544 1 1 23 PHE CG C -3.062 -15.744 -7.208 1.00 . A A . 23 PHE CG 1 1 4 1545 1 1 23 PHE CZ C -2.258 -18.323 -6.553 1.00 . A A . 23 PHE CZ 1 1 4 1546 1 1 23 PHE H H -2.754 -11.321 -7.986 1.00 . A A . 23 PHE H 1 1 4 1547 1 1 23 PHE HA H -2.046 -13.449 -6.272 1.00 . A A . 23 PHE HA 1 1 4 1548 1 1 23 PHE HB2 H -4.390 -14.129 -6.996 1.00 . A A . 23 PHE HB2 1 1 4 1549 1 1 23 PHE HB3 H -3.730 -14.331 -8.615 1.00 . A A . 23 PHE HB3 1 1 4 1550 1 1 23 PHE HD1 H -3.416 -16.529 -9.161 1.00 . A A . 23 PHE HD1 1 1 4 1551 1 1 23 PHE HD2 H -2.613 -15.267 -5.176 1.00 . A A . 23 PHE HD2 1 1 4 1552 1 1 23 PHE HE1 H -2.705 -18.812 -8.585 1.00 . A A . 23 PHE HE1 1 1 4 1553 1 1 23 PHE HE2 H -1.900 -17.548 -4.594 1.00 . A A . 23 PHE HE2 1 1 4 1554 1 1 23 PHE HZ H -1.944 -19.324 -6.299 1.00 . A A . 23 PHE HZ 1 1 4 1555 1 1 23 PHE N N -3.037 -11.956 -7.295 1.00 . A A . 23 PHE N 1 1 4 1556 1 1 23 PHE O O -1.033 -14.465 -8.812 1.00 . A A . 23 PHE O 1 1 4 1557 1 1 24 DBU C C 0.127 -11.784 -10.787 1.00 . A A . 24 DBU C 1 1 4 1558 1 1 24 DBU CA C 0.417 -12.242 -9.395 1.00 . A A . 24 DBU CA 1 1 4 1559 1 1 24 DBU CB C 1.694 -12.582 -9.146 1.00 . A A . 24 DBU CB 1 1 4 1560 1 1 24 DBU CG C 2.241 -13.068 -7.841 1.00 . A A . 24 DBU CG 1 1 4 1561 1 1 24 DBU HG1 H 1.693 -13.920 -7.430 1.00 . A A . 24 DBU HG1 1 1 4 1562 1 1 24 DBU HG2 H 2.208 -12.260 -7.104 1.00 . A A . 24 DBU HG2 1 1 4 1563 1 1 24 DBU HG3 H 3.285 -13.372 -7.969 1.00 . A A . 24 DBU HG3 1 1 4 1564 1 1 24 DBU N N -0.625 -12.273 -8.514 1.00 . A A . 24 DBU N 1 1 4 1565 1 1 24 DBU O O 1.036 -11.418 -11.533 1.00 . A A . 24 DBU O 1 1 4 1566 1 1 25 CYS C C -1.550 -9.857 -12.607 1.00 . A A . 25 CYS C 1 1 4 1567 1 1 25 CYS CA C -1.566 -11.378 -12.488 1.00 . A A . 25 CYS CA 1 1 4 1568 1 1 25 CYS CB C -2.966 -11.911 -12.800 1.00 . A A . 25 CYS CB 1 1 4 1569 1 1 25 CYS H H -1.828 -12.103 -10.517 1.00 . A A . 25 CYS H 1 1 4 1570 1 1 25 CYS HA H -0.867 -11.790 -13.201 1.00 . A A . 25 CYS HA 1 1 4 1571 1 1 25 CYS HB2 H -3.696 -11.307 -12.281 1.00 . A A . 25 CYS HB2 1 1 4 1572 1 1 25 CYS HB3 H -3.140 -11.842 -13.864 1.00 . A A . 25 CYS HB3 1 1 4 1573 1 1 25 CYS N N -1.149 -11.800 -11.156 1.00 . A A . 25 CYS N 1 1 4 1574 1 1 25 CYS O O -1.273 -9.150 -11.637 1.00 . A A . 25 CYS O 1 1 4 1575 1 1 25 CYS SG S -3.229 -13.644 -12.306 1.00 . A A . 25 CYS SG 1 1 4 1576 1 1 26 CYS C C -3.111 -7.525 -14.843 1.00 . A A . 26 CYS C 1 1 4 1577 1 1 26 CYS CA C -1.869 -7.923 -14.050 1.00 . A A . 26 CYS CA 1 1 4 1578 1 1 26 CYS CB C -0.610 -7.496 -14.806 1.00 . A A . 26 CYS CB 1 1 4 1579 1 1 26 CYS H H -2.061 -9.974 -14.537 1.00 . A A . 26 CYS H 1 1 4 1580 1 1 26 CYS HA H -1.892 -7.422 -13.094 1.00 . A A . 26 CYS HA 1 1 4 1581 1 1 26 CYS HB2 H 0.119 -8.292 -14.753 1.00 . A A . 26 CYS HB2 1 1 4 1582 1 1 26 CYS HB3 H -0.864 -7.316 -15.840 1.00 . A A . 26 CYS HB3 1 1 4 1583 1 1 26 CYS N N -1.849 -9.359 -13.802 1.00 . A A . 26 CYS N 1 1 4 1584 1 1 26 CYS O O -3.095 -6.550 -15.594 1.00 . A A . 26 CYS O 1 1 4 1585 1 1 26 CYS SG S 0.173 -5.986 -14.154 1.00 . A A . 26 CYS SG 1 1 4 1586 1 1 27 SER C C -5.960 -6.625 -15.030 1.00 . A A . 27 SER C 1 1 4 1587 1 1 27 SER CA C -5.436 -8.017 -15.370 1.00 . A A . 27 SER CA 1 1 4 1588 1 1 27 SER CB C -6.485 -9.071 -15.012 1.00 . A A . 27 SER CB 1 1 4 1589 1 1 27 SER H H -4.137 -9.050 -14.056 1.00 . A A . 27 SER H 1 1 4 1590 1 1 27 SER HA H -5.238 -8.064 -16.431 1.00 . A A . 27 SER HA 1 1 4 1591 1 1 27 SER HB2 H -6.749 -8.973 -13.970 1.00 . A A . 27 SER HB2 1 1 4 1592 1 1 27 SER HB3 H -7.364 -8.922 -15.622 1.00 . A A . 27 SER HB3 1 1 4 1593 1 1 27 SER HG H -6.032 -10.882 -14.419 1.00 . A A . 27 SER HG 1 1 4 1594 1 1 27 SER N N -4.186 -8.287 -14.669 1.00 . A A . 27 SER N 1 1 4 1595 1 1 27 SER O O -6.881 -6.124 -15.672 1.00 . A A . 27 SER O 1 1 4 1596 1 1 27 SER OG O -5.990 -10.380 -15.236 1.00 . A A . 27 SER OG 1 1 5 1597 1 1 1 LYS C C 2.055 4.496 -6.190 1.00 . A A . 1 LYS C 1 1 5 1598 1 1 1 LYS CA C 0.965 4.580 -5.125 1.00 . A A . 1 LYS CA 1 1 5 1599 1 1 1 LYS CB C 1.246 5.753 -4.184 1.00 . A A . 1 LYS CB 1 1 5 1600 1 1 1 LYS CD C 2.538 6.600 -2.203 1.00 . A A . 1 LYS CD 1 1 5 1601 1 1 1 LYS CE C 3.689 7.562 -2.459 1.00 . A A . 1 LYS CE 1 1 5 1602 1 1 1 LYS CG C 2.451 5.536 -3.285 1.00 . A A . 1 LYS CG 1 1 5 1603 1 1 1 LYS H1 H 0.288 2.622 -4.692 1.00 . A A . 1 LYS H1 1 1 5 1604 1 1 1 LYS HA H 0.015 4.739 -5.612 1.00 . A A . 1 LYS HA 1 1 5 1605 1 1 1 LYS HB2 H 1.420 6.640 -4.775 1.00 . A A . 1 LYS HB2 1 1 5 1606 1 1 1 LYS HB3 H 0.380 5.912 -3.558 1.00 . A A . 1 LYS HB3 1 1 5 1607 1 1 1 LYS HD2 H 1.615 7.159 -2.185 1.00 . A A . 1 LYS HD2 1 1 5 1608 1 1 1 LYS HD3 H 2.689 6.118 -1.247 1.00 . A A . 1 LYS HD3 1 1 5 1609 1 1 1 LYS HE2 H 4.620 7.028 -2.340 1.00 . A A . 1 LYS HE2 1 1 5 1610 1 1 1 LYS HE3 H 3.613 7.932 -3.471 1.00 . A A . 1 LYS HE3 1 1 5 1611 1 1 1 LYS HG2 H 2.369 4.567 -2.815 1.00 . A A . 1 LYS HG2 1 1 5 1612 1 1 1 LYS HG3 H 3.349 5.572 -3.886 1.00 . A A . 1 LYS HG3 1 1 5 1613 1 1 1 LYS HZ1 H 4.201 9.513 -1.918 1.00 . A A . 1 LYS HZ1 1 1 5 1614 1 1 1 LYS HZ2 H 4.099 8.445 -0.611 1.00 . A A . 1 LYS HZ2 1 1 5 1615 1 1 1 LYS HZ3 H 2.688 9.019 -1.346 1.00 . A A . 1 LYS HZ3 1 1 5 1616 1 1 1 LYS N N 0.879 3.336 -4.370 1.00 . A A . 1 LYS N 1 1 5 1617 1 1 1 LYS NZ N 3.667 8.715 -1.517 1.00 . A A . 1 LYS NZ 1 1 5 1618 1 1 1 LYS O O 1.917 5.053 -7.279 1.00 . A A . 1 LYS O 1 1 5 1619 1 1 2 LYS C C 4.669 2.173 -6.897 1.00 . A A . 2 LYS C 1 1 5 1620 1 1 2 LYS CA C 4.250 3.636 -6.797 1.00 . A A . 2 LYS CA 1 1 5 1621 1 1 2 LYS CB C 5.439 4.489 -6.351 1.00 . A A . 2 LYS CB 1 1 5 1622 1 1 2 LYS CD C 7.265 4.464 -4.626 1.00 . A A . 2 LYS CD 1 1 5 1623 1 1 2 LYS CE C 7.565 4.733 -3.159 1.00 . A A . 2 LYS CE 1 1 5 1624 1 1 2 LYS CG C 5.771 4.347 -4.876 1.00 . A A . 2 LYS CG 1 1 5 1625 1 1 2 LYS H H 3.188 3.374 -4.984 1.00 . A A . 2 LYS H 1 1 5 1626 1 1 2 LYS HA H 3.921 3.971 -7.769 1.00 . A A . 2 LYS HA 1 1 5 1627 1 1 2 LYS HB2 H 6.309 4.200 -6.923 1.00 . A A . 2 LYS HB2 1 1 5 1628 1 1 2 LYS HB3 H 5.217 5.527 -6.550 1.00 . A A . 2 LYS HB3 1 1 5 1629 1 1 2 LYS HD2 H 7.743 3.541 -4.916 1.00 . A A . 2 LYS HD2 1 1 5 1630 1 1 2 LYS HD3 H 7.658 5.278 -5.219 1.00 . A A . 2 LYS HD3 1 1 5 1631 1 1 2 LYS HE2 H 7.239 5.732 -2.915 1.00 . A A . 2 LYS HE2 1 1 5 1632 1 1 2 LYS HE3 H 7.021 4.020 -2.557 1.00 . A A . 2 LYS HE3 1 1 5 1633 1 1 2 LYS HG2 H 5.263 5.125 -4.325 1.00 . A A . 2 LYS HG2 1 1 5 1634 1 1 2 LYS HG3 H 5.432 3.380 -4.531 1.00 . A A . 2 LYS HG3 1 1 5 1635 1 1 2 LYS HZ1 H 9.163 3.984 -2.042 1.00 . A A . 2 LYS HZ1 1 1 5 1636 1 1 2 LYS HZ2 H 9.418 5.545 -2.639 1.00 . A A . 2 LYS HZ2 1 1 5 1637 1 1 2 LYS HZ3 H 9.521 4.215 -3.679 1.00 . A A . 2 LYS HZ3 1 1 5 1638 1 1 2 LYS N N 3.137 3.796 -5.868 1.00 . A A . 2 LYS N 1 1 5 1639 1 1 2 LYS NZ N 9.019 4.611 -2.859 1.00 . A A . 2 LYS NZ 1 1 5 1640 1 1 2 LYS O O 5.809 1.820 -6.593 1.00 . A A . 2 LYS O 1 1 5 1641 1 1 3 LYS C C 2.788 -0.840 -7.997 1.00 . A A . 3 LYS C 1 1 5 1642 1 1 3 LYS CA C 4.014 -0.101 -7.471 1.00 . A A . 3 LYS CA 1 1 5 1643 1 1 3 LYS CB C 4.445 -0.696 -6.129 1.00 . A A . 3 LYS CB 1 1 5 1644 1 1 3 LYS CD C 6.174 -2.519 -6.149 1.00 . A A . 3 LYS CD 1 1 5 1645 1 1 3 LYS CE C 7.545 -2.823 -6.731 1.00 . A A . 3 LYS CE 1 1 5 1646 1 1 3 LYS CG C 5.927 -1.023 -6.056 1.00 . A A . 3 LYS CG 1 1 5 1647 1 1 3 LYS H H 2.850 1.666 -7.555 1.00 . A A . 3 LYS H 1 1 5 1648 1 1 3 LYS HA H 4.820 -0.214 -8.181 1.00 . A A . 3 LYS HA 1 1 5 1649 1 1 3 LYS HB2 H 4.214 0.010 -5.345 1.00 . A A . 3 LYS HB2 1 1 5 1650 1 1 3 LYS HB3 H 3.889 -1.606 -5.957 1.00 . A A . 3 LYS HB3 1 1 5 1651 1 1 3 LYS HD2 H 6.113 -2.947 -5.159 1.00 . A A . 3 LYS HD2 1 1 5 1652 1 1 3 LYS HD3 H 5.417 -2.961 -6.782 1.00 . A A . 3 LYS HD3 1 1 5 1653 1 1 3 LYS HE2 H 8.232 -2.048 -6.426 1.00 . A A . 3 LYS HE2 1 1 5 1654 1 1 3 LYS HE3 H 7.883 -3.774 -6.347 1.00 . A A . 3 LYS HE3 1 1 5 1655 1 1 3 LYS HG2 H 6.435 -0.534 -6.874 1.00 . A A . 3 LYS HG2 1 1 5 1656 1 1 3 LYS HG3 H 6.321 -0.659 -5.117 1.00 . A A . 3 LYS HG3 1 1 5 1657 1 1 3 LYS HZ1 H 8.387 -2.476 -8.611 1.00 . A A . 3 LYS HZ1 1 1 5 1658 1 1 3 LYS HZ2 H 6.701 -2.349 -8.582 1.00 . A A . 3 LYS HZ2 1 1 5 1659 1 1 3 LYS HZ3 H 7.435 -3.873 -8.534 1.00 . A A . 3 LYS HZ3 1 1 5 1660 1 1 3 LYS N N 3.741 1.324 -7.328 1.00 . A A . 3 LYS N 1 1 5 1661 1 1 3 LYS NZ N 7.515 -2.885 -8.219 1.00 . A A . 3 LYS NZ 1 1 5 1662 1 1 3 LYS O O 1.767 -0.931 -7.315 1.00 . A A . 3 LYS O 1 1 5 1663 1 1 4 SER C C 1.410 -3.311 -8.992 1.00 . A A . 4 SER C 1 1 5 1664 1 1 4 SER CA C 1.794 -2.096 -9.830 1.00 . A A . 4 SER CA 1 1 5 1665 1 1 4 SER CB C 2.176 -2.537 -11.244 1.00 . A A . 4 SER CB 1 1 5 1666 1 1 4 SER H H 3.736 -1.260 -9.706 1.00 . A A . 4 SER H 1 1 5 1667 1 1 4 SER HA H 0.946 -1.429 -9.887 1.00 . A A . 4 SER HA 1 1 5 1668 1 1 4 SER HB2 H 3.060 -3.155 -11.199 1.00 . A A . 4 SER HB2 1 1 5 1669 1 1 4 SER HB3 H 1.362 -3.103 -11.673 1.00 . A A . 4 SER HB3 1 1 5 1670 1 1 4 SER HG H 1.655 -0.874 -12.139 1.00 . A A . 4 SER HG 1 1 5 1671 1 1 4 SER N N 2.896 -1.367 -9.212 1.00 . A A . 4 SER N 1 1 5 1672 1 1 4 SER O O 0.229 -3.594 -8.793 1.00 . A A . 4 SER O 1 1 5 1673 1 1 4 SER OG O 2.443 -1.419 -12.073 1.00 . A A . 4 SER OG 1 1 5 1674 1 1 5 GLY C C 3.338 -6.166 -7.685 1.00 . A A . 5 GLY C 1 1 5 1675 1 1 5 GLY CA C 2.166 -5.204 -7.691 1.00 . A A . 5 GLY CA 1 1 5 1676 1 1 5 GLY H H 3.339 -3.754 -8.693 1.00 . A A . 5 GLY H 1 1 5 1677 1 1 5 GLY HA2 H 1.964 -4.893 -6.677 1.00 . A A . 5 GLY HA2 1 1 5 1678 1 1 5 GLY HA3 H 1.298 -5.716 -8.080 1.00 . A A . 5 GLY HA3 1 1 5 1679 1 1 5 GLY N N 2.417 -4.027 -8.502 1.00 . A A . 5 GLY N 1 1 5 1680 1 1 5 GLY O O 4.079 -6.246 -6.706 1.00 . A A . 5 GLY O 1 1 5 1681 1 1 6 VAL C C 5.183 -7.855 -10.305 1.00 . A A . 6 VAL C 1 1 5 1682 1 1 6 VAL CA C 4.595 -7.861 -8.899 1.00 . A A . 6 VAL CA 1 1 5 1683 1 1 6 VAL CB C 4.124 -9.287 -8.557 1.00 . A A . 6 VAL CB 1 1 5 1684 1 1 6 VAL CG1 C 5.303 -10.247 -8.531 1.00 . A A . 6 VAL CG1 1 1 5 1685 1 1 6 VAL CG2 C 3.387 -9.300 -7.226 1.00 . A A . 6 VAL CG2 1 1 5 1686 1 1 6 VAL H H 2.881 -6.790 -9.529 1.00 . A A . 6 VAL H 1 1 5 1687 1 1 6 VAL HA H 5.365 -7.580 -8.195 1.00 . A A . 6 VAL HA 1 1 5 1688 1 1 6 VAL HB H 3.440 -9.613 -9.326 1.00 . A A . 6 VAL HB 1 1 5 1689 1 1 6 VAL HG11 H 6.123 -9.825 -9.095 1.00 . A A . 6 VAL HG11 1 1 5 1690 1 1 6 VAL HG12 H 5.614 -10.410 -7.510 1.00 . A A . 6 VAL HG12 1 1 5 1691 1 1 6 VAL HG13 H 5.011 -11.188 -8.974 1.00 . A A . 6 VAL HG13 1 1 5 1692 1 1 6 VAL HG21 H 2.595 -8.566 -7.247 1.00 . A A . 6 VAL HG21 1 1 5 1693 1 1 6 VAL HG22 H 2.965 -10.280 -7.057 1.00 . A A . 6 VAL HG22 1 1 5 1694 1 1 6 VAL HG23 H 4.077 -9.063 -6.430 1.00 . A A . 6 VAL HG23 1 1 5 1695 1 1 6 VAL N N 3.505 -6.899 -8.781 1.00 . A A . 6 VAL N 1 1 5 1696 1 1 6 VAL O O 6.291 -7.363 -10.523 1.00 . A A . 6 VAL O 1 1 5 1697 1 1 7 ILE C C 3.722 -8.231 -13.604 1.00 . A A . 7 ILE C 1 1 5 1698 1 1 7 ILE CA C 4.883 -8.462 -12.642 1.00 . A A . 7 ILE CA 1 1 5 1699 1 1 7 ILE CB C 5.542 -9.815 -12.965 1.00 . A A . 7 ILE CB 1 1 5 1700 1 1 7 ILE CD1 C 7.336 -11.433 -12.163 1.00 . A A . 7 ILE CD1 1 1 5 1701 1 1 7 ILE CG1 C 6.774 -10.031 -12.083 1.00 . A A . 7 ILE CG1 1 1 5 1702 1 1 7 ILE CG2 C 5.920 -9.882 -14.438 1.00 . A A . 7 ILE CG2 1 1 5 1703 1 1 7 ILE H H 3.562 -8.780 -11.020 1.00 . A A . 7 ILE H 1 1 5 1704 1 1 7 ILE HA H 5.617 -7.682 -12.787 1.00 . A A . 7 ILE HA 1 1 5 1705 1 1 7 ILE HB H 4.825 -10.597 -12.767 1.00 . A A . 7 ILE HB 1 1 5 1706 1 1 7 ILE HD11 H 7.249 -11.912 -11.199 1.00 . A A . 7 ILE HD11 1 1 5 1707 1 1 7 ILE HD12 H 6.786 -12.001 -12.899 1.00 . A A . 7 ILE HD12 1 1 5 1708 1 1 7 ILE HD13 H 8.377 -11.388 -12.449 1.00 . A A . 7 ILE HD13 1 1 5 1709 1 1 7 ILE HG12 H 7.550 -9.346 -12.385 1.00 . A A . 7 ILE HG12 1 1 5 1710 1 1 7 ILE HG13 H 6.508 -9.838 -11.054 1.00 . A A . 7 ILE HG13 1 1 5 1711 1 1 7 ILE HG21 H 5.030 -10.028 -15.031 1.00 . A A . 7 ILE HG21 1 1 5 1712 1 1 7 ILE HG22 H 6.397 -8.958 -14.728 1.00 . A A . 7 ILE HG22 1 1 5 1713 1 1 7 ILE HG23 H 6.600 -10.705 -14.598 1.00 . A A . 7 ILE HG23 1 1 5 1714 1 1 7 ILE N N 4.435 -8.405 -11.256 1.00 . A A . 7 ILE N 1 1 5 1715 1 1 7 ILE O O 2.851 -9.083 -13.780 1.00 . A A . 7 ILE O 1 1 5 1716 1 1 8 PRO C C 2.745 -7.493 -16.491 1.00 . A A . 8 PRO C 1 1 5 1717 1 1 8 PRO CA C 2.663 -6.683 -15.201 1.00 . A A . 8 PRO CA 1 1 5 1718 1 1 8 PRO CB C 2.943 -5.204 -15.480 1.00 . A A . 8 PRO CB 1 1 5 1719 1 1 8 PRO CD C 4.716 -5.990 -14.082 1.00 . A A . 8 PRO CD 1 1 5 1720 1 1 8 PRO CG C 4.396 -5.034 -15.198 1.00 . A A . 8 PRO CG 1 1 5 1721 1 1 8 PRO HA H 1.677 -6.789 -14.772 1.00 . A A . 8 PRO HA 1 1 5 1722 1 1 8 PRO HB2 H 2.711 -4.979 -16.511 1.00 . A A . 8 PRO HB2 1 1 5 1723 1 1 8 PRO HB3 H 2.340 -4.590 -14.827 1.00 . A A . 8 PRO HB3 1 1 5 1724 1 1 8 PRO HD2 H 5.715 -6.384 -14.197 1.00 . A A . 8 PRO HD2 1 1 5 1725 1 1 8 PRO HD3 H 4.609 -5.501 -13.125 1.00 . A A . 8 PRO HD3 1 1 5 1726 1 1 8 PRO HG2 H 4.972 -5.279 -16.078 1.00 . A A . 8 PRO HG2 1 1 5 1727 1 1 8 PRO HG3 H 4.593 -4.018 -14.889 1.00 . A A . 8 PRO HG3 1 1 5 1728 1 1 8 PRO N N 3.709 -7.052 -14.244 1.00 . A A . 8 PRO N 1 1 5 1729 1 1 8 PRO O O 3.582 -7.224 -17.351 1.00 . A A . 8 PRO O 1 1 5 1730 1 1 9 . C C 2.289 -10.730 -17.445 1.00 . A A . 9 DBB C 1 1 5 1731 1 1 9 . CA C 1.843 -9.340 -17.812 1.00 . A A . 9 DBB CA 1 1 5 1732 1 1 9 . CB C 0.419 -9.391 -18.370 1.00 . A A . 9 DBB CB 1 1 5 1733 1 1 9 . CG C 0.421 -10.133 -19.708 1.00 . A A . 9 DBB CG 1 1 5 1734 1 1 9 . H H 1.226 -8.650 -15.897 1.00 . A A . 9 DBB H 1 1 5 1735 1 1 9 . HA H 2.514 -8.929 -18.566 1.00 . A A . 9 DBB HA 1 1 5 1736 1 1 9 . HB2 H 0.049 -8.377 -18.517 1.00 . A A . 9 DBB HB2 1 1 5 1737 1 1 9 . HG1 H 1.347 -9.918 -20.242 1.00 . A A . 9 DBB HG1 1 1 5 1738 1 1 9 . HG2 H 0.344 -11.205 -19.529 1.00 . A A . 9 DBB HG2 1 1 5 1739 1 1 9 . HG3 H -0.429 -9.803 -20.307 1.00 . A A . 9 DBB HG3 1 1 5 1740 1 1 9 . N N 1.869 -8.485 -16.617 1.00 . A A . 9 DBB N 1 1 5 1741 1 1 9 . O O 2.727 -11.500 -18.300 1.00 . A A . 9 DBB O 1 1 5 1742 1 1 10 VAL C C 1.398 -13.343 -15.678 1.00 . A A . 10 VAL C 1 1 5 1743 1 1 10 VAL CA C 2.578 -12.378 -15.676 1.00 . A A . 10 VAL CA 1 1 5 1744 1 1 10 VAL CB C 3.160 -12.298 -14.252 1.00 . A A . 10 VAL CB 1 1 5 1745 1 1 10 VAL CG1 C 2.103 -11.820 -13.269 1.00 . A A . 10 VAL CG1 1 1 5 1746 1 1 10 VAL CG2 C 3.720 -13.648 -13.830 1.00 . A A . 10 VAL CG2 1 1 5 1747 1 1 10 VAL H H 1.825 -10.405 -15.527 1.00 . A A . 10 VAL H 1 1 5 1748 1 1 10 VAL HA H 3.344 -12.760 -16.335 1.00 . A A . 10 VAL HA 1 1 5 1749 1 1 10 VAL HB H 3.968 -11.582 -14.255 1.00 . A A . 10 VAL HB 1 1 5 1750 1 1 10 VAL HG11 H 2.580 -11.510 -12.350 1.00 . A A . 10 VAL HG11 1 1 5 1751 1 1 10 VAL HG12 H 1.564 -10.986 -13.696 1.00 . A A . 10 VAL HG12 1 1 5 1752 1 1 10 VAL HG13 H 1.414 -12.626 -13.061 1.00 . A A . 10 VAL HG13 1 1 5 1753 1 1 10 VAL HG21 H 4.413 -14.000 -14.580 1.00 . A A . 10 VAL HG21 1 1 5 1754 1 1 10 VAL HG22 H 4.235 -13.546 -12.885 1.00 . A A . 10 VAL HG22 1 1 5 1755 1 1 10 VAL HG23 H 2.913 -14.357 -13.725 1.00 . A A . 10 VAL HG23 1 1 5 1756 1 1 10 VAL N N 2.181 -11.062 -16.162 1.00 . A A . 10 VAL N 1 1 5 1757 1 1 10 VAL O O 1.576 -14.556 -15.577 1.00 . A A . 10 VAL O 1 1 5 1758 1 1 11 DAL C C -0.986 -14.555 -16.987 1.00 . A A . 11 DAL C 1 1 5 1759 1 1 11 DAL CA C -1.028 -13.615 -15.810 1.00 . A A . 11 DAL CA 1 1 5 1760 1 1 11 DAL CB C -1.115 -14.423 -14.513 1.00 . A A . 11 DAL CB 1 1 5 1761 1 1 11 DAL H H 0.116 -11.821 -15.871 1.00 . A A . 11 DAL H 1 1 5 1762 1 1 11 DAL HA H -1.900 -12.966 -15.894 1.00 . A A . 11 DAL HA 1 1 5 1763 1 1 11 DAL HB1 H -1.764 -15.285 -14.664 1.00 . A A . 11 DAL HB1 1 1 5 1764 1 1 11 DAL HB2 H -0.119 -14.764 -14.231 1.00 . A A . 11 DAL HB2 1 1 5 1765 1 1 11 DAL N N 0.193 -12.795 -15.794 1.00 . A A . 11 DAL N 1 1 5 1766 1 1 11 DAL O O 0.080 -14.824 -17.542 1.00 . A A . 11 DAL O 1 1 5 1767 1 1 12 HIS C C -2.688 -15.254 -19.765 1.00 . A A . 12 HIS C 1 1 5 1768 1 1 12 HIS CA C -2.248 -15.985 -18.500 1.00 . A A . 12 HIS CA 1 1 5 1769 1 1 12 HIS CB C -3.230 -17.113 -18.181 1.00 . A A . 12 HIS CB 1 1 5 1770 1 1 12 HIS CD2 C -2.787 -19.668 -18.201 1.00 . A A . 12 HIS CD2 1 1 5 1771 1 1 12 HIS CE1 C -1.148 -19.721 -16.746 1.00 . A A . 12 HIS CE1 1 1 5 1772 1 1 12 HIS CG C -2.563 -18.397 -17.795 1.00 . A A . 12 HIS CG 1 1 5 1773 1 1 12 HIS H H -2.966 -14.811 -16.891 1.00 . A A . 12 HIS H 1 1 5 1774 1 1 12 HIS HA H -1.269 -16.409 -18.666 1.00 . A A . 12 HIS HA 1 1 5 1775 1 1 12 HIS HB2 H -3.863 -16.808 -17.360 1.00 . A A . 12 HIS HB2 1 1 5 1776 1 1 12 HIS HB3 H -3.843 -17.304 -19.050 1.00 . A A . 12 HIS HB3 1 1 5 1777 1 1 12 HIS HD1 H -1.136 -17.704 -16.408 1.00 . A A . 12 HIS HD1 1 1 5 1778 1 1 12 HIS HD2 H -3.530 -19.991 -18.917 1.00 . A A . 12 HIS HD2 1 1 5 1779 1 1 12 HIS HE1 H -0.359 -20.075 -16.100 1.00 . A A . 12 HIS HE1 1 1 5 1780 1 1 12 HIS N N -2.152 -15.063 -17.374 1.00 . A A . 12 HIS N 1 1 5 1781 1 1 12 HIS ND1 N -1.531 -18.464 -16.883 1.00 . A A . 12 HIS ND1 1 1 5 1782 1 1 12 HIS NE2 N -1.895 -20.472 -17.536 1.00 . A A . 12 HIS NE2 1 1 5 1783 1 1 12 HIS O O -2.625 -15.804 -20.865 1.00 . A A . 12 HIS O 1 1 5 1784 1 1 13 ASP C C -4.034 -11.826 -20.264 1.00 . A A . 13 ASP C 1 1 5 1785 1 1 13 ASP CA C -3.583 -13.207 -20.729 1.00 . A A . 13 ASP CA 1 1 5 1786 1 1 13 ASP CB C -4.727 -13.910 -21.462 1.00 . A A . 13 ASP CB 1 1 5 1787 1 1 13 ASP CG C -4.537 -13.911 -22.966 1.00 . A A . 13 ASP CG 1 1 5 1788 1 1 13 ASP H H -3.159 -13.631 -18.698 1.00 . A A . 13 ASP H 1 1 5 1789 1 1 13 ASP HA H -2.751 -13.091 -21.407 1.00 . A A . 13 ASP HA 1 1 5 1790 1 1 13 ASP HB2 H -4.786 -14.935 -21.125 1.00 . A A . 13 ASP HB2 1 1 5 1791 1 1 13 ASP HB3 H -5.655 -13.407 -21.234 1.00 . A A . 13 ASP HB3 1 1 5 1792 1 1 13 ASP N N -3.133 -14.013 -19.601 1.00 . A A . 13 ASP N 1 1 5 1793 1 1 13 ASP O O -4.961 -11.241 -20.826 1.00 . A A . 13 ASP O 1 1 5 1794 1 1 13 ASP OD1 O -5.356 -13.281 -23.668 1.00 . A A . 13 ASP OD1 1 1 5 1795 1 1 13 ASP OD2 O -3.569 -14.540 -23.441 1.00 . A A . 13 ASP OD2 1 1 5 1796 1 1 14 CYS C C -3.366 -8.894 -19.690 1.00 . A A . 14 CYS C 1 1 5 1797 1 1 14 CYS CA C -3.705 -9.997 -18.692 1.00 . A A . 14 CYS CA 1 1 5 1798 1 1 14 CYS CB C -2.956 -9.760 -17.379 1.00 . A A . 14 CYS CB 1 1 5 1799 1 1 14 CYS H H -2.643 -11.823 -18.827 1.00 . A A . 14 CYS H 1 1 5 1800 1 1 14 CYS HA H -4.767 -9.977 -18.499 1.00 . A A . 14 CYS HA 1 1 5 1801 1 1 14 CYS HB2 H -3.100 -8.734 -17.071 1.00 . A A . 14 CYS HB2 1 1 5 1802 1 1 14 CYS HB3 H -3.357 -10.417 -16.621 1.00 . A A . 14 CYS HB3 1 1 5 1803 1 1 14 CYS N N -3.373 -11.309 -19.234 1.00 . A A . 14 CYS N 1 1 5 1804 1 1 14 CYS O O -2.212 -8.481 -19.807 1.00 . A A . 14 CYS O 1 1 5 1805 1 1 14 CYS SG S -1.162 -10.059 -17.482 1.00 . A A . 14 CYS SG 1 1 5 1806 1 1 15 HIS C C -4.987 -6.119 -21.020 1.00 . A A . 15 HIS C 1 1 5 1807 1 1 15 HIS CA C -4.190 -7.364 -21.395 1.00 . A A . 15 HIS CA 1 1 5 1808 1 1 15 HIS CB C -4.608 -7.853 -22.782 1.00 . A A . 15 HIS CB 1 1 5 1809 1 1 15 HIS CD2 C -4.707 -6.337 -24.885 1.00 . A A . 15 HIS CD2 1 1 5 1810 1 1 15 HIS CE1 C -2.553 -6.025 -25.156 1.00 . A A . 15 HIS CE1 1 1 5 1811 1 1 15 HIS CG C -4.070 -7.014 -23.901 1.00 . A A . 15 HIS CG 1 1 5 1812 1 1 15 HIS H H -5.277 -8.790 -20.269 1.00 . A A . 15 HIS H 1 1 5 1813 1 1 15 HIS HA H -3.140 -7.113 -21.414 1.00 . A A . 15 HIS HA 1 1 5 1814 1 1 15 HIS HB2 H -4.251 -8.862 -22.924 1.00 . A A . 15 HIS HB2 1 1 5 1815 1 1 15 HIS HB3 H -5.687 -7.845 -22.850 1.00 . A A . 15 HIS HB3 1 1 5 1816 1 1 15 HIS HD1 H -1.998 -7.160 -23.547 1.00 . A A . 15 HIS HD1 1 1 5 1817 1 1 15 HIS HD2 H -5.775 -6.282 -25.039 1.00 . A A . 15 HIS HD2 1 1 5 1818 1 1 15 HIS HE1 H -1.605 -5.690 -25.549 1.00 . A A . 15 HIS HE1 1 1 5 1819 1 1 15 HIS N N -4.380 -8.420 -20.407 1.00 . A A . 15 HIS N 1 1 5 1820 1 1 15 HIS ND1 N -2.723 -6.800 -24.099 1.00 . A A . 15 HIS ND1 1 1 5 1821 1 1 15 HIS NE2 N -3.742 -5.731 -25.651 1.00 . A A . 15 HIS NE2 1 1 5 1822 1 1 15 HIS O O -5.896 -5.711 -21.742 1.00 . A A . 15 HIS O 1 1 5 1823 1 1 16 MET C C -4.349 -3.378 -18.717 1.00 . A A . 16 MET C 1 1 5 1824 1 1 16 MET CA C -5.324 -4.322 -19.414 1.00 . A A . 16 MET CA 1 1 5 1825 1 1 16 MET CB C -6.459 -4.697 -18.459 1.00 . A A . 16 MET CB 1 1 5 1826 1 1 16 MET CE C -9.931 -3.683 -18.485 1.00 . A A . 16 MET CE 1 1 5 1827 1 1 16 MET CG C -7.223 -3.498 -17.922 1.00 . A A . 16 MET CG 1 1 5 1828 1 1 16 MET H H -3.908 -5.893 -19.351 1.00 . A A . 16 MET H 1 1 5 1829 1 1 16 MET HA H -5.741 -3.819 -20.274 1.00 . A A . 16 MET HA 1 1 5 1830 1 1 16 MET HB2 H -7.155 -5.337 -18.980 1.00 . A A . 16 MET HB2 1 1 5 1831 1 1 16 MET HB3 H -6.044 -5.237 -17.620 1.00 . A A . 16 MET HB3 1 1 5 1832 1 1 16 MET HE1 H -10.757 -2.989 -18.518 1.00 . A A . 16 MET HE1 1 1 5 1833 1 1 16 MET HE2 H -10.153 -4.538 -19.106 1.00 . A A . 16 MET HE2 1 1 5 1834 1 1 16 MET HE3 H -9.773 -4.008 -17.467 1.00 . A A . 16 MET HE3 1 1 5 1835 1 1 16 MET HG2 H -7.728 -3.787 -17.012 1.00 . A A . 16 MET HG2 1 1 5 1836 1 1 16 MET HG3 H -6.520 -2.708 -17.705 1.00 . A A . 16 MET HG3 1 1 5 1837 1 1 16 MET N N -4.641 -5.521 -19.885 1.00 . A A . 16 MET N 1 1 5 1838 1 1 16 MET O O -3.920 -2.379 -19.292 1.00 . A A . 16 MET O 1 1 5 1839 1 1 16 MET SD S -8.450 -2.877 -19.089 1.00 . A A . 16 MET SD 1 1 5 1840 1 1 17 ASN C C -2.907 -3.442 -15.291 1.00 . A A . 17 ASN C 1 1 5 1841 1 1 17 ASN CA C -3.080 -2.883 -16.700 1.00 . A A . 17 ASN CA 1 1 5 1842 1 1 17 ASN CB C -3.582 -1.439 -16.629 1.00 . A A . 17 ASN CB 1 1 5 1843 1 1 17 ASN CG C -2.520 -0.437 -17.041 1.00 . A A . 17 ASN CG 1 1 5 1844 1 1 17 ASN H H -4.379 -4.512 -17.070 1.00 . A A . 17 ASN H 1 1 5 1845 1 1 17 ASN HA H -2.123 -2.898 -17.201 1.00 . A A . 17 ASN HA 1 1 5 1846 1 1 17 ASN HB2 H -4.430 -1.327 -17.289 1.00 . A A . 17 ASN HB2 1 1 5 1847 1 1 17 ASN HB3 H -3.886 -1.219 -15.617 1.00 . A A . 17 ASN HB3 1 1 5 1848 1 1 17 ASN HD21 H -3.679 0.220 -18.518 1.00 . A A . 17 ASN HD21 1 1 5 1849 1 1 17 ASN HD22 H -2.141 0.993 -18.369 1.00 . A A . 17 ASN HD22 1 1 5 1850 1 1 17 ASN N N -4.004 -3.702 -17.475 1.00 . A A . 17 ASN N 1 1 5 1851 1 1 17 ASN ND2 N -2.810 0.337 -18.081 1.00 . A A . 17 ASN ND2 1 1 5 1852 1 1 17 ASN O O -3.578 -4.398 -14.906 1.00 . A A . 17 ASN O 1 1 5 1853 1 1 17 ASN OD1 O -1.454 -0.360 -16.432 1.00 . A A . 17 ASN OD1 1 1 5 1854 1 1 18 DAL C C -2.937 -2.974 -12.288 1.00 . A A . 18 DAL C 1 1 5 1855 1 1 18 DAL CA C -1.739 -3.279 -13.150 1.00 . A A . 18 DAL CA 1 1 5 1856 1 1 18 DAL CB C -1.473 -4.786 -13.140 1.00 . A A . 18 DAL CB 1 1 5 1857 1 1 18 DAL H H -1.498 -2.081 -14.891 1.00 . A A . 18 DAL H 1 1 5 1858 1 1 18 DAL HA H -0.867 -2.753 -12.761 1.00 . A A . 18 DAL HA 1 1 5 1859 1 1 18 DAL HB1 H -0.475 -4.976 -12.745 1.00 . A A . 18 DAL HB1 1 1 5 1860 1 1 18 DAL HB2 H -2.213 -5.280 -12.511 1.00 . A A . 18 DAL HB2 1 1 5 1861 1 1 18 DAL N N -2.002 -2.838 -14.527 1.00 . A A . 18 DAL N 1 1 5 1862 1 1 18 DAL O O -2.921 -2.032 -11.495 1.00 . A A . 18 DAL O 1 1 5 1863 1 1 19 PHE C C -5.082 -4.222 -10.284 1.00 . A A . 19 PHE C 1 1 5 1864 1 1 19 PHE CA C -5.209 -3.586 -11.665 1.00 . A A . 19 PHE CA 1 1 5 1865 1 1 19 PHE CB C -6.405 -4.185 -12.407 1.00 . A A . 19 PHE CB 1 1 5 1866 1 1 19 PHE CD1 C -8.367 -3.035 -13.468 1.00 . A A . 19 PHE CD1 1 1 5 1867 1 1 19 PHE CD2 C -6.193 -2.617 -14.354 1.00 . A A . 19 PHE CD2 1 1 5 1868 1 1 19 PHE CE1 C -8.918 -2.184 -14.408 1.00 . A A . 19 PHE CE1 1 1 5 1869 1 1 19 PHE CE2 C -6.739 -1.765 -15.296 1.00 . A A . 19 PHE CE2 1 1 5 1870 1 1 19 PHE CG C -7.001 -3.260 -13.430 1.00 . A A . 19 PHE CG 1 1 5 1871 1 1 19 PHE CZ C -8.103 -1.549 -15.324 1.00 . A A . 19 PHE CZ 1 1 5 1872 1 1 19 PHE H H -3.940 -4.508 -13.086 1.00 . A A . 19 PHE H 1 1 5 1873 1 1 19 PHE HA H -5.365 -2.525 -11.546 1.00 . A A . 19 PHE HA 1 1 5 1874 1 1 19 PHE HB2 H -6.091 -5.083 -12.916 1.00 . A A . 19 PHE HB2 1 1 5 1875 1 1 19 PHE HB3 H -7.176 -4.431 -11.692 1.00 . A A . 19 PHE HB3 1 1 5 1876 1 1 19 PHE HD1 H -9.006 -3.532 -12.751 1.00 . A A . 19 PHE HD1 1 1 5 1877 1 1 19 PHE HD2 H -5.127 -2.785 -14.335 1.00 . A A . 19 PHE HD2 1 1 5 1878 1 1 19 PHE HE1 H -9.985 -2.018 -14.426 1.00 . A A . 19 PHE HE1 1 1 5 1879 1 1 19 PHE HE2 H -6.099 -1.269 -16.011 1.00 . A A . 19 PHE HE2 1 1 5 1880 1 1 19 PHE HZ H -8.531 -0.884 -16.058 1.00 . A A . 19 PHE HZ 1 1 5 1881 1 1 19 PHE N N -3.987 -3.774 -12.439 1.00 . A A . 19 PHE N 1 1 5 1882 1 1 19 PHE O O -5.212 -3.547 -9.264 1.00 . A A . 19 PHE O 1 1 5 1883 1 1 20 GLN C C -4.185 -7.675 -9.255 1.00 . A A . 20 GLN C 1 1 5 1884 1 1 20 GLN CA C -4.684 -6.255 -9.007 1.00 . A A . 20 GLN CA 1 1 5 1885 1 1 20 GLN CB C -6.018 -6.294 -8.260 1.00 . A A . 20 GLN CB 1 1 5 1886 1 1 20 GLN CD C -7.089 -6.069 -5.983 1.00 . A A . 20 GLN CD 1 1 5 1887 1 1 20 GLN CG C -5.976 -5.610 -6.903 1.00 . A A . 20 GLN CG 1 1 5 1888 1 1 20 GLN H H -4.734 -6.010 -11.108 1.00 . A A . 20 GLN H 1 1 5 1889 1 1 20 GLN HA H -3.958 -5.733 -8.402 1.00 . A A . 20 GLN HA 1 1 5 1890 1 1 20 GLN HB2 H -6.769 -5.805 -8.862 1.00 . A A . 20 GLN HB2 1 1 5 1891 1 1 20 GLN HB3 H -6.303 -7.325 -8.110 1.00 . A A . 20 GLN HB3 1 1 5 1892 1 1 20 GLN HE21 H -6.060 -7.705 -5.514 1.00 . A A . 20 GLN HE21 1 1 5 1893 1 1 20 GLN HE22 H -7.601 -7.543 -4.751 1.00 . A A . 20 GLN HE22 1 1 5 1894 1 1 20 GLN HG2 H -5.028 -5.828 -6.433 1.00 . A A . 20 GLN HG2 1 1 5 1895 1 1 20 GLN HG3 H -6.066 -4.544 -7.049 1.00 . A A . 20 GLN HG3 1 1 5 1896 1 1 20 GLN N N -4.827 -5.527 -10.262 1.00 . A A . 20 GLN N 1 1 5 1897 1 1 20 GLN NE2 N -6.899 -7.223 -5.352 1.00 . A A . 20 GLN NE2 1 1 5 1898 1 1 20 GLN O O -4.115 -8.128 -10.398 1.00 . A A . 20 GLN O 1 1 5 1899 1 1 20 GLN OE1 O -8.110 -5.396 -5.839 1.00 . A A . 20 GLN OE1 1 1 5 1900 1 1 21 PHE C C -4.220 -10.696 -7.472 1.00 . A A . 21 PHE C 1 1 5 1901 1 1 21 PHE CA C -3.346 -9.741 -8.280 1.00 . A A . 21 PHE CA 1 1 5 1902 1 1 21 PHE CB C -1.898 -9.821 -7.792 1.00 . A A . 21 PHE CB 1 1 5 1903 1 1 21 PHE CD1 C -0.969 -7.987 -9.231 1.00 . A A . 21 PHE CD1 1 1 5 1904 1 1 21 PHE CD2 C 0.104 -10.116 -9.276 1.00 . A A . 21 PHE CD2 1 1 5 1905 1 1 21 PHE CE1 C -0.053 -7.502 -10.146 1.00 . A A . 21 PHE CE1 1 1 5 1906 1 1 21 PHE CE2 C 1.023 -9.636 -10.191 1.00 . A A . 21 PHE CE2 1 1 5 1907 1 1 21 PHE CG C -0.901 -9.297 -8.786 1.00 . A A . 21 PHE CG 1 1 5 1908 1 1 21 PHE CZ C 0.943 -8.328 -10.627 1.00 . A A . 21 PHE CZ 1 1 5 1909 1 1 21 PHE H H -3.918 -7.957 -7.294 1.00 . A A . 21 PHE H 1 1 5 1910 1 1 21 PHE HA H -3.384 -10.030 -9.319 1.00 . A A . 21 PHE HA 1 1 5 1911 1 1 21 PHE HB2 H -1.798 -9.242 -6.887 1.00 . A A . 21 PHE HB2 1 1 5 1912 1 1 21 PHE HB3 H -1.652 -10.851 -7.585 1.00 . A A . 21 PHE HB3 1 1 5 1913 1 1 21 PHE HD1 H -1.749 -7.339 -8.856 1.00 . A A . 21 PHE HD1 1 1 5 1914 1 1 21 PHE HD2 H 0.167 -11.139 -8.937 1.00 . A A . 21 PHE HD2 1 1 5 1915 1 1 21 PHE HE1 H -0.119 -6.478 -10.484 1.00 . A A . 21 PHE HE1 1 1 5 1916 1 1 21 PHE HE2 H 1.801 -10.284 -10.565 1.00 . A A . 21 PHE HE2 1 1 5 1917 1 1 21 PHE HZ H 1.660 -7.951 -11.341 1.00 . A A . 21 PHE HZ 1 1 5 1918 1 1 21 PHE N N -3.840 -8.373 -8.178 1.00 . A A . 21 PHE N 1 1 5 1919 1 1 21 PHE O O -4.067 -10.817 -6.256 1.00 . A A . 21 PHE O 1 1 5 1920 1 1 22 VAL C C -5.343 -13.650 -7.251 1.00 . A A . 22 VAL C 1 1 5 1921 1 1 22 VAL CA C -6.036 -12.316 -7.503 1.00 . A A . 22 VAL CA 1 1 5 1922 1 1 22 VAL CB C -7.303 -12.559 -8.346 1.00 . A A . 22 VAL CB 1 1 5 1923 1 1 22 VAL CG1 C -8.169 -11.310 -8.380 1.00 . A A . 22 VAL CG1 1 1 5 1924 1 1 22 VAL CG2 C -6.929 -12.999 -9.753 1.00 . A A . 22 VAL CG2 1 1 5 1925 1 1 22 VAL H H -5.211 -11.232 -9.123 1.00 . A A . 22 VAL H 1 1 5 1926 1 1 22 VAL HA H -6.336 -11.892 -6.556 1.00 . A A . 22 VAL HA 1 1 5 1927 1 1 22 VAL HB H -7.872 -13.352 -7.883 1.00 . A A . 22 VAL HB 1 1 5 1928 1 1 22 VAL HG11 H -7.537 -10.434 -8.403 1.00 . A A . 22 VAL HG11 1 1 5 1929 1 1 22 VAL HG12 H -8.793 -11.328 -9.262 1.00 . A A . 22 VAL HG12 1 1 5 1930 1 1 22 VAL HG13 H -8.793 -11.280 -7.499 1.00 . A A . 22 VAL HG13 1 1 5 1931 1 1 22 VAL HG21 H -5.855 -13.056 -9.839 1.00 . A A . 22 VAL HG21 1 1 5 1932 1 1 22 VAL HG22 H -7.358 -13.970 -9.954 1.00 . A A . 22 VAL HG22 1 1 5 1933 1 1 22 VAL HG23 H -7.310 -12.284 -10.467 1.00 . A A . 22 VAL HG23 1 1 5 1934 1 1 22 VAL N N -5.138 -11.371 -8.156 1.00 . A A . 22 VAL N 1 1 5 1935 1 1 22 VAL O O -5.663 -14.358 -6.296 1.00 . A A . 22 VAL O 1 1 5 1936 1 1 23 PHE C C -2.257 -15.110 -8.595 1.00 . A A . 23 PHE C 1 1 5 1937 1 1 23 PHE CA C -3.650 -15.238 -7.985 1.00 . A A . 23 PHE CA 1 1 5 1938 1 1 23 PHE CB C -4.413 -16.378 -8.662 1.00 . A A . 23 PHE CB 1 1 5 1939 1 1 23 PHE CD1 C -5.868 -17.205 -6.792 1.00 . A A . 23 PHE CD1 1 1 5 1940 1 1 23 PHE CD2 C -6.921 -16.328 -8.743 1.00 . A A . 23 PHE CD2 1 1 5 1941 1 1 23 PHE CE1 C -7.106 -17.448 -6.229 1.00 . A A . 23 PHE CE1 1 1 5 1942 1 1 23 PHE CE2 C -8.162 -16.569 -8.185 1.00 . A A . 23 PHE CE2 1 1 5 1943 1 1 23 PHE CG C -5.761 -16.642 -8.053 1.00 . A A . 23 PHE CG 1 1 5 1944 1 1 23 PHE CZ C -8.255 -17.131 -6.927 1.00 . A A . 23 PHE CZ 1 1 5 1945 1 1 23 PHE H H -4.180 -13.381 -8.855 1.00 . A A . 23 PHE H 1 1 5 1946 1 1 23 PHE HA H -3.551 -15.456 -6.933 1.00 . A A . 23 PHE HA 1 1 5 1947 1 1 23 PHE HB2 H -4.562 -16.134 -9.703 1.00 . A A . 23 PHE HB2 1 1 5 1948 1 1 23 PHE HB3 H -3.831 -17.284 -8.588 1.00 . A A . 23 PHE HB3 1 1 5 1949 1 1 23 PHE HD1 H -4.969 -17.454 -6.244 1.00 . A A . 23 PHE HD1 1 1 5 1950 1 1 23 PHE HD2 H -6.850 -15.889 -9.728 1.00 . A A . 23 PHE HD2 1 1 5 1951 1 1 23 PHE HE1 H -7.175 -17.888 -5.245 1.00 . A A . 23 PHE HE1 1 1 5 1952 1 1 23 PHE HE2 H -9.058 -16.320 -8.733 1.00 . A A . 23 PHE HE2 1 1 5 1953 1 1 23 PHE HZ H -9.223 -17.320 -6.489 1.00 . A A . 23 PHE HZ 1 1 5 1954 1 1 23 PHE N N -4.390 -13.988 -8.114 1.00 . A A . 23 PHE N 1 1 5 1955 1 1 23 PHE O O -1.635 -16.107 -8.960 1.00 . A A . 23 PHE O 1 1 5 1956 1 1 24 DBU C C -0.481 -12.906 -10.532 1.00 . A A . 24 DBU C 1 1 5 1957 1 1 24 DBU CA C -0.540 -13.635 -9.230 1.00 . A A . 24 DBU CA 1 1 5 1958 1 1 24 DBU CB C 0.647 -13.984 -8.701 1.00 . A A . 24 DBU CB 1 1 5 1959 1 1 24 DBU CG C 0.860 -14.716 -7.413 1.00 . A A . 24 DBU CG 1 1 5 1960 1 1 24 DBU HG1 H 1.862 -14.580 -6.997 1.00 . A A . 24 DBU HG1 1 1 5 1961 1 1 24 DBU HG2 H 0.703 -15.788 -7.569 1.00 . A A . 24 DBU HG2 1 1 5 1962 1 1 24 DBU HG3 H 0.137 -14.369 -6.669 1.00 . A A . 24 DBU HG3 1 1 5 1963 1 1 24 DBU N N -1.774 -13.877 -8.700 1.00 . A A . 24 DBU N 1 1 5 1964 1 1 24 DBU O O 0.571 -12.401 -10.926 1.00 . A A . 24 DBU O 1 1 5 1965 1 1 25 CYS C C -1.822 -10.652 -12.317 1.00 . A A . 25 CYS C 1 1 5 1966 1 1 25 CYS CA C -1.693 -12.161 -12.507 1.00 . A A . 25 CYS CA 1 1 5 1967 1 1 25 CYS CB C -2.879 -12.687 -13.317 1.00 . A A . 25 CYS CB 1 1 5 1968 1 1 25 CYS H H -2.422 -13.265 -10.855 1.00 . A A . 25 CYS H 1 1 5 1969 1 1 25 CYS HA H -0.781 -12.366 -13.047 1.00 . A A . 25 CYS HA 1 1 5 1970 1 1 25 CYS HB2 H -3.796 -12.321 -12.878 1.00 . A A . 25 CYS HB2 1 1 5 1971 1 1 25 CYS HB3 H -2.802 -12.325 -14.331 1.00 . A A . 25 CYS HB3 1 1 5 1972 1 1 25 CYS N N -1.615 -12.843 -11.221 1.00 . A A . 25 CYS N 1 1 5 1973 1 1 25 CYS O O -2.087 -10.175 -11.212 1.00 . A A . 25 CYS O 1 1 5 1974 1 1 25 CYS SG S -2.986 -14.505 -13.383 1.00 . A A . 25 CYS SG 1 1 5 1975 1 1 26 CYS C C -3.155 -7.991 -13.646 1.00 . A A . 26 CYS C 1 1 5 1976 1 1 26 CYS CA C -1.730 -8.452 -13.354 1.00 . A A . 26 CYS CA 1 1 5 1977 1 1 26 CYS CB C -0.762 -7.825 -14.359 1.00 . A A . 26 CYS CB 1 1 5 1978 1 1 26 CYS H H -1.426 -10.344 -14.252 1.00 . A A . 26 CYS H 1 1 5 1979 1 1 26 CYS HA H -1.458 -8.133 -12.359 1.00 . A A . 26 CYS HA 1 1 5 1980 1 1 26 CYS HB2 H 0.250 -7.970 -14.012 1.00 . A A . 26 CYS HB2 1 1 5 1981 1 1 26 CYS HB3 H -0.882 -8.312 -15.315 1.00 . A A . 26 CYS HB3 1 1 5 1982 1 1 26 CYS N N -1.634 -9.906 -13.400 1.00 . A A . 26 CYS N 1 1 5 1983 1 1 26 CYS O O -3.612 -6.980 -13.114 1.00 . A A . 26 CYS O 1 1 5 1984 1 1 26 CYS SG S -1.009 -6.037 -14.612 1.00 . A A . 26 CYS SG 1 1 5 1985 1 1 27 SER C C -5.303 -6.997 -15.440 1.00 . A A . 27 SER C 1 1 5 1986 1 1 27 SER CA C -5.222 -8.407 -14.862 1.00 . A A . 27 SER CA 1 1 5 1987 1 1 27 SER CB C -6.141 -8.524 -13.644 1.00 . A A . 27 SER CB 1 1 5 1988 1 1 27 SER H H -3.430 -9.535 -14.887 1.00 . A A . 27 SER H 1 1 5 1989 1 1 27 SER HA H -5.545 -9.111 -15.614 1.00 . A A . 27 SER HA 1 1 5 1990 1 1 27 SER HB2 H -5.620 -9.042 -12.852 1.00 . A A . 27 SER HB2 1 1 5 1991 1 1 27 SER HB3 H -6.415 -7.534 -13.307 1.00 . A A . 27 SER HB3 1 1 5 1992 1 1 27 SER HG H -7.978 -9.097 -13.278 1.00 . A A . 27 SER HG 1 1 5 1993 1 1 27 SER N N -3.851 -8.740 -14.495 1.00 . A A . 27 SER N 1 1 5 1994 1 1 27 SER O O -4.609 -6.670 -16.401 1.00 . A A . 27 SER O 1 1 5 1995 1 1 27 SER OG O -7.320 -9.242 -13.962 1.00 . A A . 27 SER OG 1 1 6 1996 1 1 1 LYS C C 5.386 -1.925 1.368 1.00 . A A . 1 LYS C 1 1 6 1997 1 1 1 LYS CA C 6.714 -2.570 1.749 1.00 . A A . 1 LYS CA 1 1 6 1998 1 1 1 LYS CB C 6.461 -3.890 2.482 1.00 . A A . 1 LYS CB 1 1 6 1999 1 1 1 LYS CD C 6.733 -6.214 1.569 1.00 . A A . 1 LYS CD 1 1 6 2000 1 1 1 LYS CE C 8.006 -5.984 0.769 1.00 . A A . 1 LYS CE 1 1 6 2001 1 1 1 LYS CG C 5.861 -4.970 1.599 1.00 . A A . 1 LYS CG 1 1 6 2002 1 1 1 LYS H1 H 7.168 -1.415 3.464 1.00 . A A . 1 LYS H1 1 1 6 2003 1 1 1 LYS HA H 7.275 -2.770 0.848 1.00 . A A . 1 LYS HA 1 1 6 2004 1 1 1 LYS HB2 H 7.398 -4.255 2.875 1.00 . A A . 1 LYS HB2 1 1 6 2005 1 1 1 LYS HB3 H 5.783 -3.707 3.303 1.00 . A A . 1 LYS HB3 1 1 6 2006 1 1 1 LYS HD2 H 7.001 -6.480 2.581 1.00 . A A . 1 LYS HD2 1 1 6 2007 1 1 1 LYS HD3 H 6.176 -7.023 1.118 1.00 . A A . 1 LYS HD3 1 1 6 2008 1 1 1 LYS HE2 H 7.912 -6.481 -0.184 1.00 . A A . 1 LYS HE2 1 1 6 2009 1 1 1 LYS HE3 H 8.129 -4.922 0.611 1.00 . A A . 1 LYS HE3 1 1 6 2010 1 1 1 LYS HG2 H 4.887 -5.236 1.982 1.00 . A A . 1 LYS HG2 1 1 6 2011 1 1 1 LYS HG3 H 5.762 -4.587 0.593 1.00 . A A . 1 LYS HG3 1 1 6 2012 1 1 1 LYS HZ1 H 9.059 -6.481 2.503 1.00 . A A . 1 LYS HZ1 1 1 6 2013 1 1 1 LYS HZ2 H 10.041 -5.935 1.238 1.00 . A A . 1 LYS HZ2 1 1 6 2014 1 1 1 LYS HZ3 H 9.387 -7.494 1.188 1.00 . A A . 1 LYS HZ3 1 1 6 2015 1 1 1 LYS N N 7.508 -1.674 2.581 1.00 . A A . 1 LYS N 1 1 6 2016 1 1 1 LYS NZ N 9.207 -6.511 1.473 1.00 . A A . 1 LYS NZ 1 1 6 2017 1 1 1 LYS O O 4.320 -2.505 1.576 1.00 . A A . 1 LYS O 1 1 6 2018 1 1 2 LYS C C 4.200 0.134 -1.122 1.00 . A A . 2 LYS C 1 1 6 2019 1 1 2 LYS CA C 4.260 0.002 0.396 1.00 . A A . 2 LYS CA 1 1 6 2020 1 1 2 LYS CB C 4.231 1.390 1.040 1.00 . A A . 2 LYS CB 1 1 6 2021 1 1 2 LYS CD C 2.219 2.667 1.834 1.00 . A A . 2 LYS CD 1 1 6 2022 1 1 2 LYS CE C 1.402 3.040 3.062 1.00 . A A . 2 LYS CE 1 1 6 2023 1 1 2 LYS CG C 3.185 1.533 2.132 1.00 . A A . 2 LYS CG 1 1 6 2024 1 1 2 LYS H H 6.336 -0.310 0.670 1.00 . A A . 2 LYS H 1 1 6 2025 1 1 2 LYS HA H 3.401 -0.559 0.731 1.00 . A A . 2 LYS HA 1 1 6 2026 1 1 2 LYS HB2 H 5.201 1.595 1.471 1.00 . A A . 2 LYS HB2 1 1 6 2027 1 1 2 LYS HB3 H 4.025 2.125 0.275 1.00 . A A . 2 LYS HB3 1 1 6 2028 1 1 2 LYS HD2 H 2.781 3.532 1.514 1.00 . A A . 2 LYS HD2 1 1 6 2029 1 1 2 LYS HD3 H 1.548 2.359 1.045 1.00 . A A . 2 LYS HD3 1 1 6 2030 1 1 2 LYS HE2 H 0.355 3.030 2.797 1.00 . A A . 2 LYS HE2 1 1 6 2031 1 1 2 LYS HE3 H 1.584 2.308 3.835 1.00 . A A . 2 LYS HE3 1 1 6 2032 1 1 2 LYS HG2 H 2.628 0.611 2.207 1.00 . A A . 2 LYS HG2 1 1 6 2033 1 1 2 LYS HG3 H 3.682 1.732 3.071 1.00 . A A . 2 LYS HG3 1 1 6 2034 1 1 2 LYS HZ1 H 1.077 4.686 4.305 1.00 . A A . 2 LYS HZ1 1 1 6 2035 1 1 2 LYS HZ2 H 1.746 5.083 2.803 1.00 . A A . 2 LYS HZ2 1 1 6 2036 1 1 2 LYS HZ3 H 2.711 4.372 3.997 1.00 . A A . 2 LYS HZ3 1 1 6 2037 1 1 2 LYS N N 5.457 -0.722 0.809 1.00 . A A . 2 LYS N 1 1 6 2038 1 1 2 LYS NZ N 1.759 4.390 3.578 1.00 . A A . 2 LYS NZ 1 1 6 2039 1 1 2 LYS O O 5.069 -0.372 -1.834 1.00 . A A . 2 LYS O 1 1 6 2040 1 1 3 LYS C C 2.882 -0.319 -3.773 1.00 . A A . 3 LYS C 1 1 6 2041 1 1 3 LYS CA C 2.999 1.017 -3.046 1.00 . A A . 3 LYS CA 1 1 6 2042 1 1 3 LYS CB C 4.173 1.817 -3.615 1.00 . A A . 3 LYS CB 1 1 6 2043 1 1 3 LYS CD C 4.752 3.142 -5.669 1.00 . A A . 3 LYS CD 1 1 6 2044 1 1 3 LYS CE C 5.798 4.183 -5.303 1.00 . A A . 3 LYS CE 1 1 6 2045 1 1 3 LYS CG C 3.750 2.941 -4.545 1.00 . A A . 3 LYS CG 1 1 6 2046 1 1 3 LYS H H 2.511 1.195 -0.994 1.00 . A A . 3 LYS H 1 1 6 2047 1 1 3 LYS HA H 2.088 1.575 -3.196 1.00 . A A . 3 LYS HA 1 1 6 2048 1 1 3 LYS HB2 H 4.731 2.247 -2.796 1.00 . A A . 3 LYS HB2 1 1 6 2049 1 1 3 LYS HB3 H 4.817 1.146 -4.165 1.00 . A A . 3 LYS HB3 1 1 6 2050 1 1 3 LYS HD2 H 5.249 2.204 -5.869 1.00 . A A . 3 LYS HD2 1 1 6 2051 1 1 3 LYS HD3 H 4.226 3.469 -6.555 1.00 . A A . 3 LYS HD3 1 1 6 2052 1 1 3 LYS HE2 H 6.359 4.439 -6.189 1.00 . A A . 3 LYS HE2 1 1 6 2053 1 1 3 LYS HE3 H 5.296 5.063 -4.928 1.00 . A A . 3 LYS HE3 1 1 6 2054 1 1 3 LYS HG2 H 2.789 2.698 -4.974 1.00 . A A . 3 LYS HG2 1 1 6 2055 1 1 3 LYS HG3 H 3.672 3.856 -3.976 1.00 . A A . 3 LYS HG3 1 1 6 2056 1 1 3 LYS HZ1 H 7.097 2.743 -4.528 1.00 . A A . 3 LYS HZ1 1 1 6 2057 1 1 3 LYS HZ2 H 6.252 3.609 -3.346 1.00 . A A . 3 LYS HZ2 1 1 6 2058 1 1 3 LYS HZ3 H 7.544 4.334 -4.164 1.00 . A A . 3 LYS HZ3 1 1 6 2059 1 1 3 LYS N N 3.171 0.816 -1.612 1.00 . A A . 3 LYS N 1 1 6 2060 1 1 3 LYS NZ N 6.739 3.683 -4.262 1.00 . A A . 3 LYS NZ 1 1 6 2061 1 1 3 LYS O O 2.891 -1.380 -3.147 1.00 . A A . 3 LYS O 1 1 6 2062 1 1 4 SER C C 3.984 -1.816 -6.564 1.00 . A A . 4 SER C 1 1 6 2063 1 1 4 SER CA C 2.652 -1.467 -5.907 1.00 . A A . 4 SER CA 1 1 6 2064 1 1 4 SER CB C 1.575 -1.281 -6.978 1.00 . A A . 4 SER CB 1 1 6 2065 1 1 4 SER H H 2.771 0.614 -5.537 1.00 . A A . 4 SER H 1 1 6 2066 1 1 4 SER HA H 2.362 -2.277 -5.255 1.00 . A A . 4 SER HA 1 1 6 2067 1 1 4 SER HB2 H 2.024 -0.867 -7.868 1.00 . A A . 4 SER HB2 1 1 6 2068 1 1 4 SER HB3 H 1.133 -2.239 -7.210 1.00 . A A . 4 SER HB3 1 1 6 2069 1 1 4 SER HG H -0.293 -0.848 -6.578 1.00 . A A . 4 SER HG 1 1 6 2070 1 1 4 SER N N 2.773 -0.261 -5.096 1.00 . A A . 4 SER N 1 1 6 2071 1 1 4 SER O O 4.864 -0.967 -6.698 1.00 . A A . 4 SER O 1 1 6 2072 1 1 4 SER OG O 0.557 -0.403 -6.530 1.00 . A A . 4 SER OG 1 1 6 2073 1 1 5 GLY C C 5.165 -4.795 -8.400 1.00 . A A . 5 GLY C 1 1 6 2074 1 1 5 GLY CA C 5.350 -3.514 -7.610 1.00 . A A . 5 GLY CA 1 1 6 2075 1 1 5 GLY H H 3.388 -3.707 -6.839 1.00 . A A . 5 GLY H 1 1 6 2076 1 1 5 GLY HA2 H 5.695 -2.738 -8.277 1.00 . A A . 5 GLY HA2 1 1 6 2077 1 1 5 GLY HA3 H 6.099 -3.680 -6.849 1.00 . A A . 5 GLY HA3 1 1 6 2078 1 1 5 GLY N N 4.124 -3.074 -6.972 1.00 . A A . 5 GLY N 1 1 6 2079 1 1 5 GLY O O 5.721 -5.836 -8.049 1.00 . A A . 5 GLY O 1 1 6 2080 1 1 6 VAL C C 4.587 -5.636 -11.745 1.00 . A A . 6 VAL C 1 1 6 2081 1 1 6 VAL CA C 4.124 -5.881 -10.313 1.00 . A A . 6 VAL CA 1 1 6 2082 1 1 6 VAL CB C 2.627 -6.245 -10.325 1.00 . A A . 6 VAL CB 1 1 6 2083 1 1 6 VAL CG1 C 2.444 -7.755 -10.292 1.00 . A A . 6 VAL CG1 1 1 6 2084 1 1 6 VAL CG2 C 1.910 -5.587 -9.156 1.00 . A A . 6 VAL CG2 1 1 6 2085 1 1 6 VAL H H 3.967 -3.862 -9.700 1.00 . A A . 6 VAL H 1 1 6 2086 1 1 6 VAL HA H 4.673 -6.718 -9.905 1.00 . A A . 6 VAL HA 1 1 6 2087 1 1 6 VAL HB H 2.194 -5.873 -11.242 1.00 . A A . 6 VAL HB 1 1 6 2088 1 1 6 VAL HG11 H 1.619 -8.003 -9.641 1.00 . A A . 6 VAL HG11 1 1 6 2089 1 1 6 VAL HG12 H 2.238 -8.115 -11.289 1.00 . A A . 6 VAL HG12 1 1 6 2090 1 1 6 VAL HG13 H 3.346 -8.218 -9.920 1.00 . A A . 6 VAL HG13 1 1 6 2091 1 1 6 VAL HG21 H 2.503 -5.700 -8.261 1.00 . A A . 6 VAL HG21 1 1 6 2092 1 1 6 VAL HG22 H 1.770 -4.536 -9.365 1.00 . A A . 6 VAL HG22 1 1 6 2093 1 1 6 VAL HG23 H 0.948 -6.056 -9.013 1.00 . A A . 6 VAL HG23 1 1 6 2094 1 1 6 VAL N N 4.381 -4.719 -9.471 1.00 . A A . 6 VAL N 1 1 6 2095 1 1 6 VAL O O 5.243 -4.634 -12.032 1.00 . A A . 6 VAL O 1 1 6 2096 1 1 7 ILE C C 3.500 -6.918 -14.956 1.00 . A A . 7 ILE C 1 1 6 2097 1 1 7 ILE CA C 4.622 -6.440 -14.041 1.00 . A A . 7 ILE CA 1 1 6 2098 1 1 7 ILE CB C 5.898 -7.246 -14.348 1.00 . A A . 7 ILE CB 1 1 6 2099 1 1 7 ILE CD1 C 8.291 -7.649 -13.582 1.00 . A A . 7 ILE CD1 1 1 6 2100 1 1 7 ILE CG1 C 7.016 -6.862 -13.377 1.00 . A A . 7 ILE CG1 1 1 6 2101 1 1 7 ILE CG2 C 6.336 -7.016 -15.786 1.00 . A A . 7 ILE CG2 1 1 6 2102 1 1 7 ILE H H 3.720 -7.333 -12.348 1.00 . A A . 7 ILE H 1 1 6 2103 1 1 7 ILE HA H 4.820 -5.398 -14.246 1.00 . A A . 7 ILE HA 1 1 6 2104 1 1 7 ILE HB H 5.672 -8.294 -14.229 1.00 . A A . 7 ILE HB 1 1 6 2105 1 1 7 ILE HD11 H 9.008 -7.042 -14.116 1.00 . A A . 7 ILE HD11 1 1 6 2106 1 1 7 ILE HD12 H 8.700 -7.930 -12.623 1.00 . A A . 7 ILE HD12 1 1 6 2107 1 1 7 ILE HD13 H 8.076 -8.539 -14.156 1.00 . A A . 7 ILE HD13 1 1 6 2108 1 1 7 ILE HG12 H 7.249 -5.816 -13.501 1.00 . A A . 7 ILE HG12 1 1 6 2109 1 1 7 ILE HG13 H 6.678 -7.033 -12.365 1.00 . A A . 7 ILE HG13 1 1 6 2110 1 1 7 ILE HG21 H 5.533 -7.287 -16.455 1.00 . A A . 7 ILE HG21 1 1 6 2111 1 1 7 ILE HG22 H 6.582 -5.974 -15.925 1.00 . A A . 7 ILE HG22 1 1 6 2112 1 1 7 ILE HG23 H 7.203 -7.623 -16.000 1.00 . A A . 7 ILE HG23 1 1 6 2113 1 1 7 ILE N N 4.242 -6.557 -12.638 1.00 . A A . 7 ILE N 1 1 6 2114 1 1 7 ILE O O 2.920 -7.986 -14.763 1.00 . A A . 7 ILE O 1 1 6 2115 1 1 8 PRO C C 2.514 -7.592 -17.855 1.00 . A A . 8 PRO C 1 1 6 2116 1 1 8 PRO CA C 2.132 -6.429 -16.946 1.00 . A A . 8 PRO CA 1 1 6 2117 1 1 8 PRO CB C 1.992 -5.139 -17.759 1.00 . A A . 8 PRO CB 1 1 6 2118 1 1 8 PRO CD C 3.835 -4.820 -16.270 1.00 . A A . 8 PRO CD 1 1 6 2119 1 1 8 PRO CG C 3.318 -4.470 -17.638 1.00 . A A . 8 PRO CG 1 1 6 2120 1 1 8 PRO HA H 1.196 -6.650 -16.455 1.00 . A A . 8 PRO HA 1 1 6 2121 1 1 8 PRO HB2 H 1.763 -5.381 -18.787 1.00 . A A . 8 PRO HB2 1 1 6 2122 1 1 8 PRO HB3 H 1.204 -4.531 -17.342 1.00 . A A . 8 PRO HB3 1 1 6 2123 1 1 8 PRO HD2 H 4.910 -4.925 -16.288 1.00 . A A . 8 PRO HD2 1 1 6 2124 1 1 8 PRO HD3 H 3.540 -4.069 -15.551 1.00 . A A . 8 PRO HD3 1 1 6 2125 1 1 8 PRO HG2 H 3.988 -4.842 -18.398 1.00 . A A . 8 PRO HG2 1 1 6 2126 1 1 8 PRO HG3 H 3.199 -3.401 -17.731 1.00 . A A . 8 PRO HG3 1 1 6 2127 1 1 8 PRO N N 3.185 -6.109 -15.979 1.00 . A A . 8 PRO N 1 1 6 2128 1 1 8 PRO O O 3.360 -7.451 -18.736 1.00 . A A . 8 PRO O 1 1 6 2129 1 1 9 . C C 2.686 -11.033 -17.552 1.00 . A A . 9 DBB C 1 1 6 2130 1 1 9 . CA C 2.160 -9.938 -18.442 1.00 . A A . 9 DBB CA 1 1 6 2131 1 1 9 . CB C 0.869 -10.405 -19.118 1.00 . A A . 9 DBB CB 1 1 6 2132 1 1 9 . CG C 0.035 -9.188 -19.522 1.00 . A A . 9 DBB CG 1 1 6 2133 1 1 9 . H H 1.218 -8.791 -16.917 1.00 . A A . 9 DBB H 1 1 6 2134 1 1 9 . HA H 2.902 -9.698 -19.202 1.00 . A A . 9 DBB HA 1 1 6 2135 1 1 9 . HB2 H 0.299 -11.023 -18.425 1.00 . A A . 9 DBB HB2 1 1 6 2136 1 1 9 . HG1 H -0.352 -8.699 -18.628 1.00 . A A . 9 DBB HG1 1 1 6 2137 1 1 9 . HG2 H 0.658 -8.490 -20.079 1.00 . A A . 9 DBB HG2 1 1 6 2138 1 1 9 . HG3 H -0.798 -9.511 -20.148 1.00 . A A . 9 DBB HG3 1 1 6 2139 1 1 9 . N N 1.883 -8.741 -17.635 1.00 . A A . 9 DBB N 1 1 6 2140 1 1 9 . O O 3.550 -11.813 -17.954 1.00 . A A . 9 DBB O 1 1 6 2141 1 1 10 VAL C C 1.427 -13.017 -14.981 1.00 . A A . 10 VAL C 1 1 6 2142 1 1 10 VAL CA C 2.589 -12.112 -15.372 1.00 . A A . 10 VAL CA 1 1 6 2143 1 1 10 VAL CB C 3.178 -11.472 -14.100 1.00 . A A . 10 VAL CB 1 1 6 2144 1 1 10 VAL CG1 C 4.330 -10.544 -14.454 1.00 . A A . 10 VAL CG1 1 1 6 2145 1 1 10 VAL CG2 C 2.098 -10.725 -13.332 1.00 . A A . 10 VAL CG2 1 1 6 2146 1 1 10 VAL H H 1.481 -10.448 -16.068 1.00 . A A . 10 VAL H 1 1 6 2147 1 1 10 VAL HA H 3.359 -12.710 -15.837 1.00 . A A . 10 VAL HA 1 1 6 2148 1 1 10 VAL HB H 3.560 -12.260 -13.469 1.00 . A A . 10 VAL HB 1 1 6 2149 1 1 10 VAL HG11 H 5.266 -11.024 -14.209 1.00 . A A . 10 VAL HG11 1 1 6 2150 1 1 10 VAL HG12 H 4.303 -10.322 -15.510 1.00 . A A . 10 VAL HG12 1 1 6 2151 1 1 10 VAL HG13 H 4.239 -9.627 -13.890 1.00 . A A . 10 VAL HG13 1 1 6 2152 1 1 10 VAL HG21 H 1.406 -11.435 -12.904 1.00 . A A . 10 VAL HG21 1 1 6 2153 1 1 10 VAL HG22 H 2.553 -10.146 -12.541 1.00 . A A . 10 VAL HG22 1 1 6 2154 1 1 10 VAL HG23 H 1.569 -10.065 -14.002 1.00 . A A . 10 VAL HG23 1 1 6 2155 1 1 10 VAL N N 2.166 -11.097 -16.330 1.00 . A A . 10 VAL N 1 1 6 2156 1 1 10 VAL O O 1.623 -14.066 -14.369 1.00 . A A . 10 VAL O 1 1 6 2157 1 1 11 DAL C C -0.904 -14.733 -15.691 1.00 . A A . 11 DAL C 1 1 6 2158 1 1 11 DAL CA C -0.989 -13.384 -15.023 1.00 . A A . 11 DAL CA 1 1 6 2159 1 1 11 DAL CB C -1.092 -13.571 -13.508 1.00 . A A . 11 DAL CB 1 1 6 2160 1 1 11 DAL H H 0.124 -11.758 -15.826 1.00 . A A . 11 DAL H 1 1 6 2161 1 1 11 DAL HA H -1.870 -12.854 -15.385 1.00 . A A . 11 DAL HA 1 1 6 2162 1 1 11 DAL HB1 H -1.577 -14.522 -13.290 1.00 . A A . 11 DAL HB1 1 1 6 2163 1 1 11 DAL HB2 H -0.092 -13.565 -13.073 1.00 . A A . 11 DAL HB2 1 1 6 2164 1 1 11 DAL N N 0.216 -12.604 -15.339 1.00 . A A . 11 DAL N 1 1 6 2165 1 1 11 DAL O O 0.171 -15.160 -16.115 1.00 . A A . 11 DAL O 1 1 6 2166 1 1 12 HIS C C -2.567 -16.625 -17.861 1.00 . A A . 12 HIS C 1 1 6 2167 1 1 12 HIS CA C -2.095 -16.729 -16.414 1.00 . A A . 12 HIS CA 1 1 6 2168 1 1 12 HIS CB C -3.024 -17.654 -15.627 1.00 . A A . 12 HIS CB 1 1 6 2169 1 1 12 HIS CD2 C -1.787 -19.932 -15.521 1.00 . A A . 12 HIS CD2 1 1 6 2170 1 1 12 HIS CE1 C -3.193 -21.115 -16.718 1.00 . A A . 12 HIS CE1 1 1 6 2171 1 1 12 HIS CG C -2.793 -19.108 -15.900 1.00 . A A . 12 HIS CG 1 1 6 2172 1 1 12 HIS H H -2.865 -15.019 -15.433 1.00 . A A . 12 HIS H 1 1 6 2173 1 1 12 HIS HA H -1.097 -17.141 -16.404 1.00 . A A . 12 HIS HA 1 1 6 2174 1 1 12 HIS HB2 H -2.875 -17.488 -14.571 1.00 . A A . 12 HIS HB2 1 1 6 2175 1 1 12 HIS HB3 H -4.049 -17.426 -15.883 1.00 . A A . 12 HIS HB3 1 1 6 2176 1 1 12 HIS HD1 H -4.485 -19.569 -17.067 1.00 . A A . 12 HIS HD1 1 1 6 2177 1 1 12 HIS HD2 H -0.930 -19.663 -14.920 1.00 . A A . 12 HIS HD2 1 1 6 2178 1 1 12 HIS HE1 H -3.660 -21.938 -17.238 1.00 . A A . 12 HIS HE1 1 1 6 2179 1 1 12 HIS N N -2.042 -15.412 -15.789 1.00 . A A . 12 HIS N 1 1 6 2180 1 1 12 HIS ND1 N -3.656 -19.880 -16.649 1.00 . A A . 12 HIS ND1 1 1 6 2181 1 1 12 HIS NE2 N -2.059 -21.173 -16.041 1.00 . A A . 12 HIS NE2 1 1 6 2182 1 1 12 HIS O O -2.328 -17.523 -18.669 1.00 . A A . 12 HIS O 1 1 6 2183 1 1 13 ASP C C -3.203 -13.999 -20.107 1.00 . A A . 13 ASP C 1 1 6 2184 1 1 13 ASP CA C -3.746 -15.303 -19.530 1.00 . A A . 13 ASP CA 1 1 6 2185 1 1 13 ASP CB C -5.275 -15.275 -19.526 1.00 . A A . 13 ASP CB 1 1 6 2186 1 1 13 ASP CG C -5.865 -15.638 -20.875 1.00 . A A . 13 ASP CG 1 1 6 2187 1 1 13 ASP H H -3.399 -14.845 -17.493 1.00 . A A . 13 ASP H 1 1 6 2188 1 1 13 ASP HA H -3.412 -16.122 -20.149 1.00 . A A . 13 ASP HA 1 1 6 2189 1 1 13 ASP HB2 H -5.640 -15.981 -18.794 1.00 . A A . 13 ASP HB2 1 1 6 2190 1 1 13 ASP HB3 H -5.610 -14.283 -19.262 1.00 . A A . 13 ASP HB3 1 1 6 2191 1 1 13 ASP N N -3.240 -15.524 -18.181 1.00 . A A . 13 ASP N 1 1 6 2192 1 1 13 ASP O O -3.965 -13.139 -20.550 1.00 . A A . 13 ASP O 1 1 6 2193 1 1 13 ASP OD1 O -5.757 -14.817 -21.810 1.00 . A A . 13 ASP OD1 1 1 6 2194 1 1 13 ASP OD2 O -6.433 -16.743 -20.996 1.00 . A A . 13 ASP OD2 1 1 6 2195 1 1 14 CYS C C -1.793 -12.294 -21.990 1.00 . A A . 14 CYS C 1 1 6 2196 1 1 14 CYS CA C -1.236 -12.660 -20.618 1.00 . A A . 14 CYS CA 1 1 6 2197 1 1 14 CYS CB C 0.277 -12.869 -20.708 1.00 . A A . 14 CYS CB 1 1 6 2198 1 1 14 CYS H H -1.327 -14.580 -19.731 1.00 . A A . 14 CYS H 1 1 6 2199 1 1 14 CYS HA H -1.438 -11.850 -19.933 1.00 . A A . 14 CYS HA 1 1 6 2200 1 1 14 CYS HB2 H 0.604 -13.448 -19.857 1.00 . A A . 14 CYS HB2 1 1 6 2201 1 1 14 CYS HB3 H 0.505 -13.410 -21.614 1.00 . A A . 14 CYS HB3 1 1 6 2202 1 1 14 CYS N N -1.882 -13.859 -20.097 1.00 . A A . 14 CYS N 1 1 6 2203 1 1 14 CYS O O -1.587 -13.014 -22.968 1.00 . A A . 14 CYS O 1 1 6 2204 1 1 14 CYS SG S 1.241 -11.323 -20.728 1.00 . A A . 14 CYS SG 1 1 6 2205 1 1 15 HIS C C -2.928 -9.197 -23.458 1.00 . A A . 15 HIS C 1 1 6 2206 1 1 15 HIS CA C -3.086 -10.707 -23.309 1.00 . A A . 15 HIS CA 1 1 6 2207 1 1 15 HIS CB C -4.565 -11.086 -23.374 1.00 . A A . 15 HIS CB 1 1 6 2208 1 1 15 HIS CD2 C -5.560 -12.474 -25.326 1.00 . A A . 15 HIS CD2 1 1 6 2209 1 1 15 HIS CE1 C -4.737 -14.432 -24.779 1.00 . A A . 15 HIS CE1 1 1 6 2210 1 1 15 HIS CG C -4.835 -12.309 -24.195 1.00 . A A . 15 HIS CG 1 1 6 2211 1 1 15 HIS H H -2.629 -10.639 -21.243 1.00 . A A . 15 HIS H 1 1 6 2212 1 1 15 HIS HA H -2.563 -11.193 -24.119 1.00 . A A . 15 HIS HA 1 1 6 2213 1 1 15 HIS HB2 H -4.927 -11.272 -22.374 1.00 . A A . 15 HIS HB2 1 1 6 2214 1 1 15 HIS HB3 H -5.121 -10.266 -23.806 1.00 . A A . 15 HIS HB3 1 1 6 2215 1 1 15 HIS HD1 H -3.766 -13.763 -23.108 1.00 . A A . 15 HIS HD1 1 1 6 2216 1 1 15 HIS HD2 H -6.099 -11.705 -25.861 1.00 . A A . 15 HIS HD2 1 1 6 2217 1 1 15 HIS HE1 H -4.499 -15.485 -24.787 1.00 . A A . 15 HIS HE1 1 1 6 2218 1 1 15 HIS N N -2.499 -11.170 -22.056 1.00 . A A . 15 HIS N 1 1 6 2219 1 1 15 HIS ND1 N -4.334 -13.554 -23.878 1.00 . A A . 15 HIS ND1 1 1 6 2220 1 1 15 HIS NE2 N -5.483 -13.802 -25.669 1.00 . A A . 15 HIS NE2 1 1 6 2221 1 1 15 HIS O O -2.096 -8.724 -24.232 1.00 . A A . 15 HIS O 1 1 6 2222 1 1 16 MET C C -4.704 -6.377 -21.811 1.00 . A A . 16 MET C 1 1 6 2223 1 1 16 MET CA C -3.680 -6.990 -22.761 1.00 . A A . 16 MET CA 1 1 6 2224 1 1 16 MET CB C -3.931 -6.497 -24.187 1.00 . A A . 16 MET CB 1 1 6 2225 1 1 16 MET CE C -6.496 -7.834 -27.163 1.00 . A A . 16 MET CE 1 1 6 2226 1 1 16 MET CG C -5.141 -7.138 -24.847 1.00 . A A . 16 MET CG 1 1 6 2227 1 1 16 MET H H -4.374 -8.882 -22.113 1.00 . A A . 16 MET H 1 1 6 2228 1 1 16 MET HA H -2.692 -6.683 -22.452 1.00 . A A . 16 MET HA 1 1 6 2229 1 1 16 MET HB2 H -4.084 -5.429 -24.164 1.00 . A A . 16 MET HB2 1 1 6 2230 1 1 16 MET HB3 H -3.062 -6.716 -24.789 1.00 . A A . 16 MET HB3 1 1 6 2231 1 1 16 MET HE1 H -5.974 -8.779 -27.202 1.00 . A A . 16 MET HE1 1 1 6 2232 1 1 16 MET HE2 H -7.350 -7.921 -26.508 1.00 . A A . 16 MET HE2 1 1 6 2233 1 1 16 MET HE3 H -6.828 -7.564 -28.155 1.00 . A A . 16 MET HE3 1 1 6 2234 1 1 16 MET HG2 H -5.002 -8.209 -24.861 1.00 . A A . 16 MET HG2 1 1 6 2235 1 1 16 MET HG3 H -6.019 -6.899 -24.266 1.00 . A A . 16 MET HG3 1 1 6 2236 1 1 16 MET N N -3.731 -8.447 -22.711 1.00 . A A . 16 MET N 1 1 6 2237 1 1 16 MET O O -5.879 -6.741 -21.832 1.00 . A A . 16 MET O 1 1 6 2238 1 1 16 MET SD S -5.393 -6.568 -26.539 1.00 . A A . 16 MET SD 1 1 6 2239 1 1 17 ASN C C -4.361 -3.745 -19.207 1.00 . A A . 17 ASN C 1 1 6 2240 1 1 17 ASN CA C -5.128 -4.783 -20.021 1.00 . A A . 17 ASN CA 1 1 6 2241 1 1 17 ASN CB C -5.765 -5.812 -19.085 1.00 . A A . 17 ASN CB 1 1 6 2242 1 1 17 ASN CG C -7.246 -5.998 -19.351 1.00 . A A . 17 ASN CG 1 1 6 2243 1 1 17 ASN H H -3.303 -5.198 -21.009 1.00 . A A . 17 ASN H 1 1 6 2244 1 1 17 ASN HA H -5.908 -4.284 -20.576 1.00 . A A . 17 ASN HA 1 1 6 2245 1 1 17 ASN HB2 H -5.273 -6.765 -19.219 1.00 . A A . 17 ASN HB2 1 1 6 2246 1 1 17 ASN HB3 H -5.639 -5.488 -18.063 1.00 . A A . 17 ASN HB3 1 1 6 2247 1 1 17 ASN HD21 H -6.943 -7.897 -19.855 1.00 . A A . 17 ASN HD21 1 1 6 2248 1 1 17 ASN HD22 H -8.580 -7.351 -19.934 1.00 . A A . 17 ASN HD22 1 1 6 2249 1 1 17 ASN N N -4.250 -5.446 -20.979 1.00 . A A . 17 ASN N 1 1 6 2250 1 1 17 ASN ND2 N -7.628 -7.204 -19.754 1.00 . A A . 17 ASN ND2 1 1 6 2251 1 1 17 ASN O O -4.473 -2.545 -19.451 1.00 . A A . 17 ASN O 1 1 6 2252 1 1 17 ASN OD1 O -8.037 -5.067 -19.195 1.00 . A A . 17 ASN OD1 1 1 6 2253 1 1 18 DAL C C -3.685 -2.267 -16.794 1.00 . A A . 18 DAL C 1 1 6 2254 1 1 18 DAL CA C -2.787 -3.324 -17.385 1.00 . A A . 18 DAL CA 1 1 6 2255 1 1 18 DAL CB C -2.145 -4.136 -16.258 1.00 . A A . 18 DAL CB 1 1 6 2256 1 1 18 DAL H H -3.533 -5.186 -18.095 1.00 . A A . 18 DAL H 1 1 6 2257 1 1 18 DAL HA H -2.008 -2.848 -17.980 1.00 . A A . 18 DAL HA 1 1 6 2258 1 1 18 DAL HB1 H -1.255 -3.620 -15.899 1.00 . A A . 18 DAL HB1 1 1 6 2259 1 1 18 DAL HB2 H -2.856 -4.246 -15.440 1.00 . A A . 18 DAL HB2 1 1 6 2260 1 1 18 DAL N N -3.580 -4.218 -18.241 1.00 . A A . 18 DAL N 1 1 6 2261 1 1 18 DAL O O -3.510 -1.075 -17.049 1.00 . A A . 18 DAL O 1 1 6 2262 1 1 19 PHE C C -5.492 -1.861 -13.844 1.00 . A A . 19 PHE C 1 1 6 2263 1 1 19 PHE CA C -5.594 -1.780 -15.364 1.00 . A A . 19 PHE CA 1 1 6 2264 1 1 19 PHE CB C -7.025 -2.091 -15.808 1.00 . A A . 19 PHE CB 1 1 6 2265 1 1 19 PHE CD1 C -8.469 -3.254 -14.118 1.00 . A A . 19 PHE CD1 1 1 6 2266 1 1 19 PHE CD2 C -7.239 -4.587 -15.666 1.00 . A A . 19 PHE CD2 1 1 6 2267 1 1 19 PHE CE1 C -8.991 -4.398 -13.542 1.00 . A A . 19 PHE CE1 1 1 6 2268 1 1 19 PHE CE2 C -7.757 -5.734 -15.095 1.00 . A A . 19 PHE CE2 1 1 6 2269 1 1 19 PHE CG C -7.589 -3.335 -15.185 1.00 . A A . 19 PHE CG 1 1 6 2270 1 1 19 PHE CZ C -8.633 -5.639 -14.031 1.00 . A A . 19 PHE CZ 1 1 6 2271 1 1 19 PHE H H -4.746 -3.663 -15.833 1.00 . A A . 19 PHE H 1 1 6 2272 1 1 19 PHE HA H -5.338 -0.780 -15.678 1.00 . A A . 19 PHE HA 1 1 6 2273 1 1 19 PHE HB2 H -7.665 -1.265 -15.537 1.00 . A A . 19 PHE HB2 1 1 6 2274 1 1 19 PHE HB3 H -7.042 -2.217 -16.880 1.00 . A A . 19 PHE HB3 1 1 6 2275 1 1 19 PHE HD1 H -8.749 -2.283 -13.735 1.00 . A A . 19 PHE HD1 1 1 6 2276 1 1 19 PHE HD2 H -6.553 -4.663 -16.497 1.00 . A A . 19 PHE HD2 1 1 6 2277 1 1 19 PHE HE1 H -9.675 -4.320 -12.711 1.00 . A A . 19 PHE HE1 1 1 6 2278 1 1 19 PHE HE2 H -7.476 -6.703 -15.478 1.00 . A A . 19 PHE HE2 1 1 6 2279 1 1 19 PHE HZ H -9.040 -6.534 -13.583 1.00 . A A . 19 PHE HZ 1 1 6 2280 1 1 19 PHE N N -4.657 -2.701 -15.998 1.00 . A A . 19 PHE N 1 1 6 2281 1 1 19 PHE O O -5.654 -0.860 -13.147 1.00 . A A . 19 PHE O 1 1 6 2282 1 1 20 GLN C C -4.802 -4.736 -11.590 1.00 . A A . 20 GLN C 1 1 6 2283 1 1 20 GLN CA C -5.100 -3.273 -11.901 1.00 . A A . 20 GLN CA 1 1 6 2284 1 1 20 GLN CB C -6.383 -2.839 -11.189 1.00 . A A . 20 GLN CB 1 1 6 2285 1 1 20 GLN CD C -6.666 -2.375 -8.722 1.00 . A A . 20 GLN CD 1 1 6 2286 1 1 20 GLN CG C -6.146 -1.862 -10.049 1.00 . A A . 20 GLN CG 1 1 6 2287 1 1 20 GLN H H -5.104 -3.820 -13.945 1.00 . A A . 20 GLN H 1 1 6 2288 1 1 20 GLN HA H -4.280 -2.668 -11.545 1.00 . A A . 20 GLN HA 1 1 6 2289 1 1 20 GLN HB2 H -7.038 -2.370 -11.907 1.00 . A A . 20 GLN HB2 1 1 6 2290 1 1 20 GLN HB3 H -6.871 -3.715 -10.787 1.00 . A A . 20 GLN HB3 1 1 6 2291 1 1 20 GLN HE21 H -8.148 -1.050 -8.761 1.00 . A A . 20 GLN HE21 1 1 6 2292 1 1 20 GLN HE22 H -8.108 -2.091 -7.383 1.00 . A A . 20 GLN HE22 1 1 6 2293 1 1 20 GLN HG2 H -5.084 -1.685 -9.958 1.00 . A A . 20 GLN HG2 1 1 6 2294 1 1 20 GLN HG3 H -6.645 -0.932 -10.280 1.00 . A A . 20 GLN HG3 1 1 6 2295 1 1 20 GLN N N -5.223 -3.061 -13.338 1.00 . A A . 20 GLN N 1 1 6 2296 1 1 20 GLN NE2 N -7.750 -1.779 -8.239 1.00 . A A . 20 GLN NE2 1 1 6 2297 1 1 20 GLN O O -5.310 -5.639 -12.255 1.00 . A A . 20 GLN O 1 1 6 2298 1 1 20 GLN OE1 O -6.100 -3.299 -8.136 1.00 . A A . 20 GLN OE1 1 1 6 2299 1 1 21 PHE C C -4.415 -6.765 -8.963 1.00 . A A . 21 PHE C 1 1 6 2300 1 1 21 PHE CA C -3.607 -6.317 -10.177 1.00 . A A . 21 PHE CA 1 1 6 2301 1 1 21 PHE CB C -2.111 -6.391 -9.864 1.00 . A A . 21 PHE CB 1 1 6 2302 1 1 21 PHE CD1 C -0.622 -6.614 -11.871 1.00 . A A . 21 PHE CD1 1 1 6 2303 1 1 21 PHE CD2 C -1.049 -4.430 -11.015 1.00 . A A . 21 PHE CD2 1 1 6 2304 1 1 21 PHE CE1 C 0.176 -6.073 -12.862 1.00 . A A . 21 PHE CE1 1 1 6 2305 1 1 21 PHE CE2 C -0.252 -3.884 -12.003 1.00 . A A . 21 PHE CE2 1 1 6 2306 1 1 21 PHE CG C -1.244 -5.800 -10.938 1.00 . A A . 21 PHE CG 1 1 6 2307 1 1 21 PHE CZ C 0.362 -4.707 -12.927 1.00 . A A . 21 PHE CZ 1 1 6 2308 1 1 21 PHE H H -3.601 -4.202 -10.083 1.00 . A A . 21 PHE H 1 1 6 2309 1 1 21 PHE HA H -3.826 -6.975 -11.003 1.00 . A A . 21 PHE HA 1 1 6 2310 1 1 21 PHE HB2 H -1.915 -5.854 -8.948 1.00 . A A . 21 PHE HB2 1 1 6 2311 1 1 21 PHE HB3 H -1.828 -7.425 -9.738 1.00 . A A . 21 PHE HB3 1 1 6 2312 1 1 21 PHE HD1 H -0.767 -7.684 -11.821 1.00 . A A . 21 PHE HD1 1 1 6 2313 1 1 21 PHE HD2 H -1.528 -3.785 -10.292 1.00 . A A . 21 PHE HD2 1 1 6 2314 1 1 21 PHE HE1 H 0.655 -6.720 -13.582 1.00 . A A . 21 PHE HE1 1 1 6 2315 1 1 21 PHE HE2 H -0.108 -2.815 -12.052 1.00 . A A . 21 PHE HE2 1 1 6 2316 1 1 21 PHE HZ H 0.985 -4.282 -13.700 1.00 . A A . 21 PHE HZ 1 1 6 2317 1 1 21 PHE N N -3.974 -4.963 -10.575 1.00 . A A . 21 PHE N 1 1 6 2318 1 1 21 PHE O O -4.230 -6.255 -7.857 1.00 . A A . 21 PHE O 1 1 6 2319 1 1 22 VAL C C -5.388 -9.250 -7.251 1.00 . A A . 22 VAL C 1 1 6 2320 1 1 22 VAL CA C -6.149 -8.239 -8.101 1.00 . A A . 22 VAL CA 1 1 6 2321 1 1 22 VAL CB C -7.424 -8.905 -8.652 1.00 . A A . 22 VAL CB 1 1 6 2322 1 1 22 VAL CG1 C -8.369 -9.271 -7.518 1.00 . A A . 22 VAL CG1 1 1 6 2323 1 1 22 VAL CG2 C -8.111 -7.991 -9.655 1.00 . A A . 22 VAL CG2 1 1 6 2324 1 1 22 VAL H H -5.414 -8.088 -10.080 1.00 . A A . 22 VAL H 1 1 6 2325 1 1 22 VAL HA H -6.444 -7.408 -7.477 1.00 . A A . 22 VAL HA 1 1 6 2326 1 1 22 VAL HB H -7.140 -9.814 -9.161 1.00 . A A . 22 VAL HB 1 1 6 2327 1 1 22 VAL HG11 H -8.149 -10.272 -7.175 1.00 . A A . 22 VAL HG11 1 1 6 2328 1 1 22 VAL HG12 H -8.241 -8.574 -6.703 1.00 . A A . 22 VAL HG12 1 1 6 2329 1 1 22 VAL HG13 H -9.389 -9.229 -7.871 1.00 . A A . 22 VAL HG13 1 1 6 2330 1 1 22 VAL HG21 H -7.688 -8.151 -10.636 1.00 . A A . 22 VAL HG21 1 1 6 2331 1 1 22 VAL HG22 H -9.169 -8.212 -9.679 1.00 . A A . 22 VAL HG22 1 1 6 2332 1 1 22 VAL HG23 H -7.966 -6.962 -9.363 1.00 . A A . 22 VAL HG23 1 1 6 2333 1 1 22 VAL N N -5.313 -7.721 -9.177 1.00 . A A . 22 VAL N 1 1 6 2334 1 1 22 VAL O O -5.769 -9.534 -6.115 1.00 . A A . 22 VAL O 1 1 6 2335 1 1 23 PHE C C -2.217 -11.077 -7.878 1.00 . A A . 23 PHE C 1 1 6 2336 1 1 23 PHE CA C -3.493 -10.770 -7.101 1.00 . A A . 23 PHE CA 1 1 6 2337 1 1 23 PHE CB C -4.288 -12.058 -6.874 1.00 . A A . 23 PHE CB 1 1 6 2338 1 1 23 PHE CD1 C -3.538 -12.607 -4.543 1.00 . A A . 23 PHE CD1 1 1 6 2339 1 1 23 PHE CD2 C -3.186 -14.227 -6.257 1.00 . A A . 23 PHE CD2 1 1 6 2340 1 1 23 PHE CE1 C -2.960 -13.455 -3.617 1.00 . A A . 23 PHE CE1 1 1 6 2341 1 1 23 PHE CE2 C -2.607 -15.079 -5.336 1.00 . A A . 23 PHE CE2 1 1 6 2342 1 1 23 PHE CG C -3.658 -12.982 -5.871 1.00 . A A . 23 PHE CG 1 1 6 2343 1 1 23 PHE CZ C -2.493 -14.692 -4.015 1.00 . A A . 23 PHE CZ 1 1 6 2344 1 1 23 PHE H H -4.056 -9.523 -8.716 1.00 . A A . 23 PHE H 1 1 6 2345 1 1 23 PHE HA H -3.226 -10.349 -6.144 1.00 . A A . 23 PHE HA 1 1 6 2346 1 1 23 PHE HB2 H -5.275 -11.806 -6.517 1.00 . A A . 23 PHE HB2 1 1 6 2347 1 1 23 PHE HB3 H -4.372 -12.590 -7.810 1.00 . A A . 23 PHE HB3 1 1 6 2348 1 1 23 PHE HD1 H -3.903 -11.638 -4.231 1.00 . A A . 23 PHE HD1 1 1 6 2349 1 1 23 PHE HD2 H -3.274 -14.530 -7.289 1.00 . A A . 23 PHE HD2 1 1 6 2350 1 1 23 PHE HE1 H -2.872 -13.149 -2.585 1.00 . A A . 23 PHE HE1 1 1 6 2351 1 1 23 PHE HE2 H -2.243 -16.046 -5.649 1.00 . A A . 23 PHE HE2 1 1 6 2352 1 1 23 PHE HZ H -2.041 -15.357 -3.293 1.00 . A A . 23 PHE HZ 1 1 6 2353 1 1 23 PHE N N -4.309 -9.790 -7.807 1.00 . A A . 23 PHE N 1 1 6 2354 1 1 23 PHE O O -1.734 -12.209 -7.877 1.00 . A A . 23 PHE O 1 1 6 2355 1 1 24 DBU C C -0.659 -10.169 -10.760 1.00 . A A . 24 DBU C 1 1 6 2356 1 1 24 DBU CA C -0.533 -10.211 -9.272 1.00 . A A . 24 DBU CA 1 1 6 2357 1 1 24 DBU CB C 0.712 -10.394 -8.796 1.00 . A A . 24 DBU CB 1 1 6 2358 1 1 24 DBU CG C 1.104 -10.471 -7.355 1.00 . A A . 24 DBU CG 1 1 6 2359 1 1 24 DBU HG1 H 1.857 -9.732 -7.068 1.00 . A A . 24 DBU HG1 1 1 6 2360 1 1 24 DBU HG2 H 1.509 -11.465 -7.136 1.00 . A A . 24 DBU HG2 1 1 6 2361 1 1 24 DBU HG3 H 0.224 -10.316 -6.724 1.00 . A A . 24 DBU HG3 1 1 6 2362 1 1 24 DBU N N -1.675 -10.060 -8.540 1.00 . A A . 24 DBU N 1 1 6 2363 1 1 24 DBU O O 0.209 -9.638 -11.453 1.00 . A A . 24 DBU O 1 1 6 2364 1 1 25 CYS C C -2.436 -9.388 -13.212 1.00 . A A . 25 CYS C 1 1 6 2365 1 1 25 CYS CA C -1.992 -10.759 -12.710 1.00 . A A . 25 CYS CA 1 1 6 2366 1 1 25 CYS CB C -3.054 -11.807 -13.048 1.00 . A A . 25 CYS CB 1 1 6 2367 1 1 25 CYS H H -2.406 -11.139 -10.669 1.00 . A A . 25 CYS H 1 1 6 2368 1 1 25 CYS HA H -1.067 -11.026 -13.198 1.00 . A A . 25 CYS HA 1 1 6 2369 1 1 25 CYS HB2 H -4.025 -11.432 -12.756 1.00 . A A . 25 CYS HB2 1 1 6 2370 1 1 25 CYS HB3 H -3.049 -11.983 -14.114 1.00 . A A . 25 CYS HB3 1 1 6 2371 1 1 25 CYS N N -1.749 -10.732 -11.272 1.00 . A A . 25 CYS N 1 1 6 2372 1 1 25 CYS O O -2.784 -8.508 -12.424 1.00 . A A . 25 CYS O 1 1 6 2373 1 1 25 CYS SG S -2.808 -13.410 -12.219 1.00 . A A . 25 CYS SG 1 1 6 2374 1 1 26 CYS C C -4.279 -8.002 -15.587 1.00 . A A . 26 CYS C 1 1 6 2375 1 1 26 CYS CA C -2.821 -7.951 -15.139 1.00 . A A . 26 CYS CA 1 1 6 2376 1 1 26 CYS CB C -1.920 -7.629 -16.333 1.00 . A A . 26 CYS CB 1 1 6 2377 1 1 26 CYS H H -2.133 -9.953 -15.107 1.00 . A A . 26 CYS H 1 1 6 2378 1 1 26 CYS HA H -2.711 -7.175 -14.397 1.00 . A A . 26 CYS HA 1 1 6 2379 1 1 26 CYS HB2 H -1.008 -8.203 -16.251 1.00 . A A . 26 CYS HB2 1 1 6 2380 1 1 26 CYS HB3 H -2.431 -7.904 -17.244 1.00 . A A . 26 CYS HB3 1 1 6 2381 1 1 26 CYS N N -2.421 -9.214 -14.530 1.00 . A A . 26 CYS N 1 1 6 2382 1 1 26 CYS O O -4.911 -6.966 -15.793 1.00 . A A . 26 CYS O 1 1 6 2383 1 1 26 CYS SG S -1.457 -5.872 -16.463 1.00 . A A . 26 CYS SG 1 1 6 2384 1 1 27 SER C C -6.616 -10.853 -15.994 1.00 . A A . 27 SER C 1 1 6 2385 1 1 27 SER CA C -6.187 -9.399 -16.162 1.00 . A A . 27 SER CA 1 1 6 2386 1 1 27 SER CB C -6.355 -8.971 -17.621 1.00 . A A . 27 SER CB 1 1 6 2387 1 1 27 SER H H -4.250 -10.001 -15.555 1.00 . A A . 27 SER H 1 1 6 2388 1 1 27 SER HA H -6.813 -8.777 -15.539 1.00 . A A . 27 SER HA 1 1 6 2389 1 1 27 SER HB2 H -7.398 -8.782 -17.820 1.00 . A A . 27 SER HB2 1 1 6 2390 1 1 27 SER HB3 H -5.785 -8.070 -17.796 1.00 . A A . 27 SER HB3 1 1 6 2391 1 1 27 SER HG H -5.049 -9.722 -18.873 1.00 . A A . 27 SER HG 1 1 6 2392 1 1 27 SER N N -4.805 -9.213 -15.735 1.00 . A A . 27 SER N 1 1 6 2393 1 1 27 SER O O -7.697 -11.136 -15.479 1.00 . A A . 27 SER O 1 1 6 2394 1 1 27 SER OG O -5.896 -9.980 -18.504 1.00 . A A . 27 SER OG 1 1 7 2395 1 1 1 LYS C C 7.644 0.153 -4.561 1.00 . A A . 1 LYS C 1 1 7 2396 1 1 1 LYS CA C 8.415 -0.814 -5.454 1.00 . A A . 1 LYS CA 1 1 7 2397 1 1 1 LYS CB C 9.579 -1.428 -4.673 1.00 . A A . 1 LYS CB 1 1 7 2398 1 1 1 LYS CD C 10.352 -3.127 -2.992 1.00 . A A . 1 LYS CD 1 1 7 2399 1 1 1 LYS CE C 9.924 -4.208 -2.011 1.00 . A A . 1 LYS CE 1 1 7 2400 1 1 1 LYS CG C 9.163 -2.557 -3.746 1.00 . A A . 1 LYS CG 1 1 7 2401 1 1 1 LYS H1 H 9.726 -0.466 -7.078 1.00 . A A . 1 LYS H1 1 1 7 2402 1 1 1 LYS HA H 7.749 -1.603 -5.769 1.00 . A A . 1 LYS HA 1 1 7 2403 1 1 1 LYS HB2 H 10.304 -1.814 -5.374 1.00 . A A . 1 LYS HB2 1 1 7 2404 1 1 1 LYS HB3 H 10.044 -0.655 -4.078 1.00 . A A . 1 LYS HB3 1 1 7 2405 1 1 1 LYS HD2 H 11.046 -3.553 -3.700 1.00 . A A . 1 LYS HD2 1 1 7 2406 1 1 1 LYS HD3 H 10.836 -2.329 -2.446 1.00 . A A . 1 LYS HD3 1 1 7 2407 1 1 1 LYS HE2 H 9.368 -3.748 -1.209 1.00 . A A . 1 LYS HE2 1 1 7 2408 1 1 1 LYS HE3 H 9.292 -4.914 -2.529 1.00 . A A . 1 LYS HE3 1 1 7 2409 1 1 1 LYS HG2 H 8.445 -2.179 -3.033 1.00 . A A . 1 LYS HG2 1 1 7 2410 1 1 1 LYS HG3 H 8.710 -3.343 -4.333 1.00 . A A . 1 LYS HG3 1 1 7 2411 1 1 1 LYS HZ1 H 11.182 -5.870 -1.878 1.00 . A A . 1 LYS HZ1 1 1 7 2412 1 1 1 LYS HZ2 H 10.971 -5.052 -0.413 1.00 . A A . 1 LYS HZ2 1 1 7 2413 1 1 1 LYS HZ3 H 11.966 -4.395 -1.613 1.00 . A A . 1 LYS HZ3 1 1 7 2414 1 1 1 LYS N N 8.907 -0.140 -6.649 1.00 . A A . 1 LYS N 1 1 7 2415 1 1 1 LYS NZ N 11.093 -4.932 -1.439 1.00 . A A . 1 LYS NZ 1 1 7 2416 1 1 1 LYS O O 8.078 0.474 -3.455 1.00 . A A . 1 LYS O 1 1 7 2417 1 1 2 LYS C C 4.384 1.868 -5.059 1.00 . A A . 2 LYS C 1 1 7 2418 1 1 2 LYS CA C 5.663 1.542 -4.295 1.00 . A A . 2 LYS CA 1 1 7 2419 1 1 2 LYS CB C 6.435 2.830 -3.999 1.00 . A A . 2 LYS CB 1 1 7 2420 1 1 2 LYS CD C 7.304 4.411 -2.252 1.00 . A A . 2 LYS CD 1 1 7 2421 1 1 2 LYS CE C 7.141 4.922 -0.829 1.00 . A A . 2 LYS CE 1 1 7 2422 1 1 2 LYS CG C 6.331 3.284 -2.554 1.00 . A A . 2 LYS CG 1 1 7 2423 1 1 2 LYS H H 6.203 0.321 -5.937 1.00 . A A . 2 LYS H 1 1 7 2424 1 1 2 LYS HA H 5.399 1.069 -3.361 1.00 . A A . 2 LYS HA 1 1 7 2425 1 1 2 LYS HB2 H 7.478 2.670 -4.231 1.00 . A A . 2 LYS HB2 1 1 7 2426 1 1 2 LYS HB3 H 6.052 3.618 -4.631 1.00 . A A . 2 LYS HB3 1 1 7 2427 1 1 2 LYS HD2 H 8.313 4.049 -2.379 1.00 . A A . 2 LYS HD2 1 1 7 2428 1 1 2 LYS HD3 H 7.123 5.225 -2.940 1.00 . A A . 2 LYS HD3 1 1 7 2429 1 1 2 LYS HE2 H 6.283 4.442 -0.384 1.00 . A A . 2 LYS HE2 1 1 7 2430 1 1 2 LYS HE3 H 8.027 4.669 -0.266 1.00 . A A . 2 LYS HE3 1 1 7 2431 1 1 2 LYS HG2 H 5.326 3.630 -2.366 1.00 . A A . 2 LYS HG2 1 1 7 2432 1 1 2 LYS HG3 H 6.552 2.447 -1.906 1.00 . A A . 2 LYS HG3 1 1 7 2433 1 1 2 LYS HZ1 H 6.323 6.654 0.005 1.00 . A A . 2 LYS HZ1 1 1 7 2434 1 1 2 LYS HZ2 H 6.512 6.726 -1.674 1.00 . A A . 2 LYS HZ2 1 1 7 2435 1 1 2 LYS HZ3 H 7.861 6.877 -0.665 1.00 . A A . 2 LYS HZ3 1 1 7 2436 1 1 2 LYS N N 6.496 0.614 -5.048 1.00 . A A . 2 LYS N 1 1 7 2437 1 1 2 LYS NZ N 6.946 6.398 -0.788 1.00 . A A . 2 LYS NZ 1 1 7 2438 1 1 2 LYS O O 3.294 1.894 -4.486 1.00 . A A . 2 LYS O 1 1 7 2439 1 1 3 LYS C C 2.279 1.392 -7.051 1.00 . A A . 3 LYS C 1 1 7 2440 1 1 3 LYS CA C 3.378 2.438 -7.202 1.00 . A A . 3 LYS CA 1 1 7 2441 1 1 3 LYS CB C 3.810 2.532 -8.667 1.00 . A A . 3 LYS CB 1 1 7 2442 1 1 3 LYS CD C 3.056 3.892 -10.639 1.00 . A A . 3 LYS CD 1 1 7 2443 1 1 3 LYS CE C 2.947 5.287 -11.236 1.00 . A A . 3 LYS CE 1 1 7 2444 1 1 3 LYS CG C 3.677 3.927 -9.253 1.00 . A A . 3 LYS CG 1 1 7 2445 1 1 3 LYS H H 5.417 2.081 -6.757 1.00 . A A . 3 LYS H 1 1 7 2446 1 1 3 LYS HA H 2.993 3.396 -6.887 1.00 . A A . 3 LYS HA 1 1 7 2447 1 1 3 LYS HB2 H 4.844 2.229 -8.745 1.00 . A A . 3 LYS HB2 1 1 7 2448 1 1 3 LYS HB3 H 3.201 1.858 -9.253 1.00 . A A . 3 LYS HB3 1 1 7 2449 1 1 3 LYS HD2 H 3.673 3.284 -11.285 1.00 . A A . 3 LYS HD2 1 1 7 2450 1 1 3 LYS HD3 H 2.068 3.461 -10.571 1.00 . A A . 3 LYS HD3 1 1 7 2451 1 1 3 LYS HE2 H 2.554 5.956 -10.485 1.00 . A A . 3 LYS HE2 1 1 7 2452 1 1 3 LYS HE3 H 3.933 5.616 -11.531 1.00 . A A . 3 LYS HE3 1 1 7 2453 1 1 3 LYS HG2 H 3.050 4.521 -8.604 1.00 . A A . 3 LYS HG2 1 1 7 2454 1 1 3 LYS HG3 H 4.658 4.375 -9.318 1.00 . A A . 3 LYS HG3 1 1 7 2455 1 1 3 LYS HZ1 H 2.595 5.101 -13.286 1.00 . A A . 3 LYS HZ1 1 1 7 2456 1 1 3 LYS HZ2 H 1.618 6.253 -12.525 1.00 . A A . 3 LYS HZ2 1 1 7 2457 1 1 3 LYS HZ3 H 1.297 4.605 -12.320 1.00 . A A . 3 LYS HZ3 1 1 7 2458 1 1 3 LYS N N 4.522 2.116 -6.357 1.00 . A A . 3 LYS N 1 1 7 2459 1 1 3 LYS NZ N 2.051 5.313 -12.425 1.00 . A A . 3 LYS NZ 1 1 7 2460 1 1 3 LYS O O 1.094 1.701 -7.169 1.00 . A A . 3 LYS O 1 1 7 2461 1 1 4 SER C C 2.334 -2.067 -5.790 1.00 . A A . 4 SER C 1 1 7 2462 1 1 4 SER CA C 1.729 -0.941 -6.622 1.00 . A A . 4 SER CA 1 1 7 2463 1 1 4 SER CB C 1.294 -1.477 -7.988 1.00 . A A . 4 SER CB 1 1 7 2464 1 1 4 SER H H 3.639 -0.032 -6.705 1.00 . A A . 4 SER H 1 1 7 2465 1 1 4 SER HA H 0.864 -0.552 -6.106 1.00 . A A . 4 SER HA 1 1 7 2466 1 1 4 SER HB2 H 1.412 -2.549 -8.005 1.00 . A A . 4 SER HB2 1 1 7 2467 1 1 4 SER HB3 H 0.256 -1.226 -8.156 1.00 . A A . 4 SER HB3 1 1 7 2468 1 1 4 SER HG H 1.510 -0.398 -9.608 1.00 . A A . 4 SER HG 1 1 7 2469 1 1 4 SER N N 2.680 0.152 -6.787 1.00 . A A . 4 SER N 1 1 7 2470 1 1 4 SER O O 1.907 -2.322 -4.665 1.00 . A A . 4 SER O 1 1 7 2471 1 1 4 SER OG O 2.074 -0.915 -9.028 1.00 . A A . 4 SER OG 1 1 7 2472 1 1 5 GLY C C 4.084 -5.085 -6.497 1.00 . A A . 5 GLY C 1 1 7 2473 1 1 5 GLY CA C 3.982 -3.831 -5.651 1.00 . A A . 5 GLY CA 1 1 7 2474 1 1 5 GLY H H 3.633 -2.492 -7.254 1.00 . A A . 5 GLY H 1 1 7 2475 1 1 5 GLY HA2 H 4.976 -3.520 -5.365 1.00 . A A . 5 GLY HA2 1 1 7 2476 1 1 5 GLY HA3 H 3.416 -4.057 -4.760 1.00 . A A . 5 GLY HA3 1 1 7 2477 1 1 5 GLY N N 3.334 -2.739 -6.354 1.00 . A A . 5 GLY N 1 1 7 2478 1 1 5 GLY O O 4.909 -5.958 -6.228 1.00 . A A . 5 GLY O 1 1 7 2479 1 1 6 VAL C C 3.702 -5.952 -9.810 1.00 . A A . 6 VAL C 1 1 7 2480 1 1 6 VAL CA C 3.240 -6.333 -8.408 1.00 . A A . 6 VAL CA 1 1 7 2481 1 1 6 VAL CB C 1.840 -6.970 -8.497 1.00 . A A . 6 VAL CB 1 1 7 2482 1 1 6 VAL CG1 C 1.938 -8.486 -8.423 1.00 . A A . 6 VAL CG1 1 1 7 2483 1 1 6 VAL CG2 C 0.940 -6.432 -7.396 1.00 . A A . 6 VAL CG2 1 1 7 2484 1 1 6 VAL H H 2.607 -4.448 -7.684 1.00 . A A . 6 VAL H 1 1 7 2485 1 1 6 VAL HA H 3.921 -7.067 -8.002 1.00 . A A . 6 VAL HA 1 1 7 2486 1 1 6 VAL HB H 1.406 -6.705 -9.450 1.00 . A A . 6 VAL HB 1 1 7 2487 1 1 6 VAL HG11 H 2.810 -8.817 -8.967 1.00 . A A . 6 VAL HG11 1 1 7 2488 1 1 6 VAL HG12 H 2.018 -8.793 -7.391 1.00 . A A . 6 VAL HG12 1 1 7 2489 1 1 6 VAL HG13 H 1.053 -8.925 -8.862 1.00 . A A . 6 VAL HG13 1 1 7 2490 1 1 6 VAL HG21 H 1.464 -6.467 -6.453 1.00 . A A . 6 VAL HG21 1 1 7 2491 1 1 6 VAL HG22 H 0.669 -5.409 -7.619 1.00 . A A . 6 VAL HG22 1 1 7 2492 1 1 6 VAL HG23 H 0.046 -7.034 -7.334 1.00 . A A . 6 VAL HG23 1 1 7 2493 1 1 6 VAL N N 3.242 -5.176 -7.521 1.00 . A A . 6 VAL N 1 1 7 2494 1 1 6 VAL O O 4.245 -4.867 -10.021 1.00 . A A . 6 VAL O 1 1 7 2495 1 1 7 ILE C C 2.824 -7.130 -13.118 1.00 . A A . 7 ILE C 1 1 7 2496 1 1 7 ILE CA C 3.876 -6.607 -12.146 1.00 . A A . 7 ILE CA 1 1 7 2497 1 1 7 ILE CB C 5.230 -7.265 -12.471 1.00 . A A . 7 ILE CB 1 1 7 2498 1 1 7 ILE CD1 C 7.659 -7.401 -11.721 1.00 . A A . 7 ILE CD1 1 1 7 2499 1 1 7 ILE CG1 C 6.326 -6.704 -11.562 1.00 . A A . 7 ILE CG1 1 1 7 2500 1 1 7 ILE CG2 C 5.587 -7.049 -13.934 1.00 . A A . 7 ILE CG2 1 1 7 2501 1 1 7 ILE H H 3.047 -7.696 -10.533 1.00 . A A . 7 ILE H 1 1 7 2502 1 1 7 ILE HA H 3.976 -5.539 -12.281 1.00 . A A . 7 ILE HA 1 1 7 2503 1 1 7 ILE HB H 5.139 -8.327 -12.300 1.00 . A A . 7 ILE HB 1 1 7 2504 1 1 7 ILE HD11 H 7.554 -8.227 -12.408 1.00 . A A . 7 ILE HD11 1 1 7 2505 1 1 7 ILE HD12 H 8.387 -6.703 -12.104 1.00 . A A . 7 ILE HD12 1 1 7 2506 1 1 7 ILE HD13 H 7.987 -7.773 -10.761 1.00 . A A . 7 ILE HD13 1 1 7 2507 1 1 7 ILE HG12 H 6.470 -5.659 -11.785 1.00 . A A . 7 ILE HG12 1 1 7 2508 1 1 7 ILE HG13 H 6.017 -6.809 -10.532 1.00 . A A . 7 ILE HG13 1 1 7 2509 1 1 7 ILE HG21 H 6.542 -6.550 -14.002 1.00 . A A . 7 ILE HG21 1 1 7 2510 1 1 7 ILE HG22 H 5.645 -8.004 -14.435 1.00 . A A . 7 ILE HG22 1 1 7 2511 1 1 7 ILE HG23 H 4.829 -6.441 -14.404 1.00 . A A . 7 ILE HG23 1 1 7 2512 1 1 7 ILE N N 3.483 -6.850 -10.764 1.00 . A A . 7 ILE N 1 1 7 2513 1 1 7 ILE O O 2.440 -8.300 -13.085 1.00 . A A . 7 ILE O 1 1 7 2514 1 1 8 PRO C C 1.878 -7.529 -16.081 1.00 . A A . 8 PRO C 1 1 7 2515 1 1 8 PRO CA C 1.333 -6.596 -15.005 1.00 . A A . 8 PRO CA 1 1 7 2516 1 1 8 PRO CB C 0.952 -5.244 -15.613 1.00 . A A . 8 PRO CB 1 1 7 2517 1 1 8 PRO CD C 2.758 -4.835 -14.102 1.00 . A A . 8 PRO CD 1 1 7 2518 1 1 8 PRO CG C 2.148 -4.382 -15.399 1.00 . A A . 8 PRO CG 1 1 7 2519 1 1 8 PRO HA H 0.463 -7.045 -14.548 1.00 . A A . 8 PRO HA 1 1 7 2520 1 1 8 PRO HB2 H 0.736 -5.368 -16.665 1.00 . A A . 8 PRO HB2 1 1 7 2521 1 1 8 PRO HB3 H 0.085 -4.849 -15.106 1.00 . A A . 8 PRO HB3 1 1 7 2522 1 1 8 PRO HD2 H 3.834 -4.750 -14.141 1.00 . A A . 8 PRO HD2 1 1 7 2523 1 1 8 PRO HD3 H 2.362 -4.261 -13.278 1.00 . A A . 8 PRO HD3 1 1 7 2524 1 1 8 PRO HG2 H 2.847 -4.517 -16.210 1.00 . A A . 8 PRO HG2 1 1 7 2525 1 1 8 PRO HG3 H 1.846 -3.347 -15.330 1.00 . A A . 8 PRO HG3 1 1 7 2526 1 1 8 PRO N N 2.346 -6.246 -14.005 1.00 . A A . 8 PRO N 1 1 7 2527 1 1 8 PRO O O 2.805 -7.177 -16.809 1.00 . A A . 8 PRO O 1 1 7 2528 1 1 9 . C C 2.349 -10.890 -16.469 1.00 . A A . 9 DBB C 1 1 7 2529 1 1 9 . CA C 1.727 -9.712 -17.170 1.00 . A A . 9 DBB CA 1 1 7 2530 1 1 9 . CB C 0.517 -10.179 -17.981 1.00 . A A . 9 DBB CB 1 1 7 2531 1 1 9 . CG C -0.319 -11.146 -17.139 1.00 . A A . 9 DBB CG 1 1 7 2532 1 1 9 . H H 0.561 -8.943 -15.566 1.00 . A A . 9 DBB H 1 1 7 2533 1 1 9 . HA H 2.459 -9.258 -17.839 1.00 . A A . 9 DBB HA 1 1 7 2534 1 1 9 . HB2 H 0.857 -10.685 -18.883 1.00 . A A . 9 DBB HB2 1 1 7 2535 1 1 9 . HG1 H 0.262 -12.044 -16.932 1.00 . A A . 9 DBB HG1 1 1 7 2536 1 1 9 . HG2 H -0.594 -10.666 -16.200 1.00 . A A . 9 DBB HG2 1 1 7 2537 1 1 9 . HG3 H -1.223 -11.415 -17.687 1.00 . A A . 9 DBB HG3 1 1 7 2538 1 1 9 . N N 1.296 -8.720 -16.175 1.00 . A A . 9 DBB N 1 1 7 2539 1 1 9 . O O 3.159 -11.614 -17.048 1.00 . A A . 9 DBB O 1 1 7 2540 1 1 10 VAL C C 1.442 -13.279 -14.219 1.00 . A A . 10 VAL C 1 1 7 2541 1 1 10 VAL CA C 2.497 -12.197 -14.421 1.00 . A A . 10 VAL CA 1 1 7 2542 1 1 10 VAL CB C 2.995 -11.718 -13.044 1.00 . A A . 10 VAL CB 1 1 7 2543 1 1 10 VAL CG1 C 4.078 -10.662 -13.206 1.00 . A A . 10 VAL CG1 1 1 7 2544 1 1 10 VAL CG2 C 1.836 -11.183 -12.216 1.00 . A A . 10 VAL CG2 1 1 7 2545 1 1 10 VAL H H 1.321 -10.479 -14.803 1.00 . A A . 10 VAL H 1 1 7 2546 1 1 10 VAL HA H 3.335 -12.620 -14.956 1.00 . A A . 10 VAL HA 1 1 7 2547 1 1 10 VAL HB H 3.422 -12.563 -12.524 1.00 . A A . 10 VAL HB 1 1 7 2548 1 1 10 VAL HG11 H 3.952 -9.899 -12.452 1.00 . A A . 10 VAL HG11 1 1 7 2549 1 1 10 VAL HG12 H 5.049 -11.122 -13.095 1.00 . A A . 10 VAL HG12 1 1 7 2550 1 1 10 VAL HG13 H 4.001 -10.215 -14.186 1.00 . A A . 10 VAL HG13 1 1 7 2551 1 1 10 VAL HG21 H 1.245 -10.510 -12.819 1.00 . A A . 10 VAL HG21 1 1 7 2552 1 1 10 VAL HG22 H 1.220 -12.006 -11.885 1.00 . A A . 10 VAL HG22 1 1 7 2553 1 1 10 VAL HG23 H 2.221 -10.654 -11.357 1.00 . A A . 10 VAL HG23 1 1 7 2554 1 1 10 VAL N N 1.971 -11.090 -15.210 1.00 . A A . 10 VAL N 1 1 7 2555 1 1 10 VAL O O 1.760 -14.410 -13.854 1.00 . A A . 10 VAL O 1 1 7 2556 1 1 11 DAL C C -0.744 -15.023 -15.259 1.00 . A A . 11 DAL C 1 1 7 2557 1 1 11 DAL CA C -0.928 -13.872 -14.303 1.00 . A A . 11 DAL CA 1 1 7 2558 1 1 11 DAL CB C -0.948 -14.400 -12.867 1.00 . A A . 11 DAL CB 1 1 7 2559 1 1 11 DAL H H -0.006 -12.007 -14.748 1.00 . A A . 11 DAL H 1 1 7 2560 1 1 11 DAL HA H -1.869 -13.366 -14.519 1.00 . A A . 11 DAL HA 1 1 7 2561 1 1 11 DAL HB1 H -1.257 -15.445 -12.868 1.00 . A A . 11 DAL HB1 1 1 7 2562 1 1 11 DAL HB2 H 0.049 -14.316 -12.436 1.00 . A A . 11 DAL HB2 1 1 7 2563 1 1 11 DAL N N 0.184 -12.923 -14.460 1.00 . A A . 11 DAL N 1 1 7 2564 1 1 11 DAL O O 0.132 -15.867 -15.070 1.00 . A A . 11 DAL O 1 1 7 2565 1 1 12 HIS C C -1.448 -15.540 -18.704 1.00 . A A . 12 HIS C 1 1 7 2566 1 1 12 HIS CA C -1.501 -16.123 -17.295 1.00 . A A . 12 HIS CA 1 1 7 2567 1 1 12 HIS CB C -2.702 -17.060 -17.163 1.00 . A A . 12 HIS CB 1 1 7 2568 1 1 12 HIS CD2 C -2.306 -19.336 -18.342 1.00 . A A . 12 HIS CD2 1 1 7 2569 1 1 12 HIS CE1 C -1.719 -20.509 -16.585 1.00 . A A . 12 HIS CE1 1 1 7 2570 1 1 12 HIS CG C -2.345 -18.510 -17.270 1.00 . A A . 12 HIS CG 1 1 7 2571 1 1 12 HIS H H -2.252 -14.360 -16.394 1.00 . A A . 12 HIS H 1 1 7 2572 1 1 12 HIS HA H -0.597 -16.684 -17.117 1.00 . A A . 12 HIS HA 1 1 7 2573 1 1 12 HIS HB2 H -3.168 -16.903 -16.201 1.00 . A A . 12 HIS HB2 1 1 7 2574 1 1 12 HIS HB3 H -3.415 -16.834 -17.944 1.00 . A A . 12 HIS HB3 1 1 7 2575 1 1 12 HIS HD1 H -1.904 -18.961 -15.260 1.00 . A A . 12 HIS HD1 1 1 7 2576 1 1 12 HIS HD2 H -2.540 -19.072 -19.364 1.00 . A A . 12 HIS HD2 1 1 7 2577 1 1 12 HIS HE1 H -1.405 -21.326 -15.954 1.00 . A A . 12 HIS HE1 1 1 7 2578 1 1 12 HIS N N -1.574 -15.062 -16.297 1.00 . A A . 12 HIS N 1 1 7 2579 1 1 12 HIS ND1 N -1.973 -19.276 -16.185 1.00 . A A . 12 HIS ND1 1 1 7 2580 1 1 12 HIS NE2 N -1.914 -20.572 -17.890 1.00 . A A . 12 HIS NE2 1 1 7 2581 1 1 12 HIS O O -0.738 -16.050 -19.571 1.00 . A A . 12 HIS O 1 1 7 2582 1 1 13 ASP C C -3.025 -12.511 -20.160 1.00 . A A . 13 ASP C 1 1 7 2583 1 1 13 ASP CA C -2.243 -13.819 -20.230 1.00 . A A . 13 ASP CA 1 1 7 2584 1 1 13 ASP CB C -2.870 -14.748 -21.270 1.00 . A A . 13 ASP CB 1 1 7 2585 1 1 13 ASP CG C -1.833 -15.402 -22.162 1.00 . A A . 13 ASP CG 1 1 7 2586 1 1 13 ASP H H -2.749 -14.110 -18.195 1.00 . A A . 13 ASP H 1 1 7 2587 1 1 13 ASP HA H -1.227 -13.601 -20.522 1.00 . A A . 13 ASP HA 1 1 7 2588 1 1 13 ASP HB2 H -3.423 -15.525 -20.762 1.00 . A A . 13 ASP HB2 1 1 7 2589 1 1 13 ASP HB3 H -3.546 -14.178 -21.891 1.00 . A A . 13 ASP HB3 1 1 7 2590 1 1 13 ASP N N -2.204 -14.471 -18.926 1.00 . A A . 13 ASP N 1 1 7 2591 1 1 13 ASP O O -4.249 -12.499 -20.296 1.00 . A A . 13 ASP O 1 1 7 2592 1 1 13 ASP OD1 O -1.932 -16.627 -22.388 1.00 . A A . 13 ASP OD1 1 1 7 2593 1 1 13 ASP OD2 O -0.924 -14.690 -22.635 1.00 . A A . 13 ASP OD2 1 1 7 2594 1 1 14 CYS C C -2.691 -9.290 -21.129 1.00 . A A . 14 CYS C 1 1 7 2595 1 1 14 CYS CA C -2.937 -10.097 -19.858 1.00 . A A . 14 CYS CA 1 1 7 2596 1 1 14 CYS CB C -2.401 -9.335 -18.645 1.00 . A A . 14 CYS CB 1 1 7 2597 1 1 14 CYS H H -1.338 -11.484 -19.847 1.00 . A A . 14 CYS H 1 1 7 2598 1 1 14 CYS HA H -4.000 -10.243 -19.739 1.00 . A A . 14 CYS HA 1 1 7 2599 1 1 14 CYS HB2 H -2.963 -8.420 -18.526 1.00 . A A . 14 CYS HB2 1 1 7 2600 1 1 14 CYS HB3 H -2.526 -9.945 -17.762 1.00 . A A . 14 CYS HB3 1 1 7 2601 1 1 14 CYS N N -2.311 -11.411 -19.947 1.00 . A A . 14 CYS N 1 1 7 2602 1 1 14 CYS O O -2.115 -9.792 -22.095 1.00 . A A . 14 CYS O 1 1 7 2603 1 1 14 CYS SG S -0.639 -8.888 -18.766 1.00 . A A . 14 CYS SG 1 1 7 2604 1 1 15 HIS C C -2.592 -5.744 -21.829 1.00 . A A . 15 HIS C 1 1 7 2605 1 1 15 HIS CA C -2.957 -7.157 -22.273 1.00 . A A . 15 HIS CA 1 1 7 2606 1 1 15 HIS CB C -4.234 -7.126 -23.114 1.00 . A A . 15 HIS CB 1 1 7 2607 1 1 15 HIS CD2 C -6.266 -5.847 -22.133 1.00 . A A . 15 HIS CD2 1 1 7 2608 1 1 15 HIS CE1 C -7.131 -7.478 -20.950 1.00 . A A . 15 HIS CE1 1 1 7 2609 1 1 15 HIS CG C -5.480 -6.935 -22.304 1.00 . A A . 15 HIS CG 1 1 7 2610 1 1 15 HIS H H -3.581 -7.692 -20.322 1.00 . A A . 15 HIS H 1 1 7 2611 1 1 15 HIS HA H -2.151 -7.552 -22.873 1.00 . A A . 15 HIS HA 1 1 7 2612 1 1 15 HIS HB2 H -4.171 -6.313 -23.821 1.00 . A A . 15 HIS HB2 1 1 7 2613 1 1 15 HIS HB3 H -4.326 -8.059 -23.651 1.00 . A A . 15 HIS HB3 1 1 7 2614 1 1 15 HIS HD1 H -5.709 -8.855 -21.466 1.00 . A A . 15 HIS HD1 1 1 7 2615 1 1 15 HIS HD2 H -6.120 -4.873 -22.579 1.00 . A A . 15 HIS HD2 1 1 7 2616 1 1 15 HIS HE1 H -7.780 -8.040 -20.295 1.00 . A A . 15 HIS HE1 1 1 7 2617 1 1 15 HIS N N -3.130 -8.035 -21.121 1.00 . A A . 15 HIS N 1 1 7 2618 1 1 15 HIS ND1 N -6.048 -7.940 -21.549 1.00 . A A . 15 HIS ND1 1 1 7 2619 1 1 15 HIS NE2 N -7.285 -6.210 -21.287 1.00 . A A . 15 HIS NE2 1 1 7 2620 1 1 15 HIS O O -2.965 -4.765 -22.474 1.00 . A A . 15 HIS O 1 1 7 2621 1 1 16 MET C C -2.654 -3.536 -19.745 1.00 . A A . 16 MET C 1 1 7 2622 1 1 16 MET CA C -1.446 -4.353 -20.193 1.00 . A A . 16 MET CA 1 1 7 2623 1 1 16 MET CB C -0.653 -3.578 -21.246 1.00 . A A . 16 MET CB 1 1 7 2624 1 1 16 MET CE C 2.641 -1.238 -20.228 1.00 . A A . 16 MET CE 1 1 7 2625 1 1 16 MET CG C 0.189 -2.453 -20.667 1.00 . A A . 16 MET CG 1 1 7 2626 1 1 16 MET H H -1.595 -6.464 -20.252 1.00 . A A . 16 MET H 1 1 7 2627 1 1 16 MET HA H -0.812 -4.534 -19.338 1.00 . A A . 16 MET HA 1 1 7 2628 1 1 16 MET HB2 H 0.005 -4.262 -21.761 1.00 . A A . 16 MET HB2 1 1 7 2629 1 1 16 MET HB3 H -1.343 -3.151 -21.958 1.00 . A A . 16 MET HB3 1 1 7 2630 1 1 16 MET HE1 H 2.561 -0.563 -21.068 1.00 . A A . 16 MET HE1 1 1 7 2631 1 1 16 MET HE2 H 2.097 -0.833 -19.388 1.00 . A A . 16 MET HE2 1 1 7 2632 1 1 16 MET HE3 H 3.681 -1.358 -19.961 1.00 . A A . 16 MET HE3 1 1 7 2633 1 1 16 MET HG2 H 0.025 -1.560 -21.251 1.00 . A A . 16 MET HG2 1 1 7 2634 1 1 16 MET HG3 H -0.124 -2.276 -19.648 1.00 . A A . 16 MET HG3 1 1 7 2635 1 1 16 MET N N -1.862 -5.647 -20.723 1.00 . A A . 16 MET N 1 1 7 2636 1 1 16 MET O O -3.035 -2.566 -20.399 1.00 . A A . 16 MET O 1 1 7 2637 1 1 16 MET SD S 1.952 -2.830 -20.674 1.00 . A A . 16 MET SD 1 1 7 2638 1 1 17 ASN C C -4.325 -3.111 -16.575 1.00 . A A . 17 ASN C 1 1 7 2639 1 1 17 ASN CA C -4.416 -3.239 -18.093 1.00 . A A . 17 ASN CA 1 1 7 2640 1 1 17 ASN CB C -5.699 -3.979 -18.478 1.00 . A A . 17 ASN CB 1 1 7 2641 1 1 17 ASN CG C -6.589 -3.158 -19.390 1.00 . A A . 17 ASN CG 1 1 7 2642 1 1 17 ASN H H -2.901 -4.716 -18.150 1.00 . A A . 17 ASN H 1 1 7 2643 1 1 17 ASN HA H -4.439 -2.250 -18.525 1.00 . A A . 17 ASN HA 1 1 7 2644 1 1 17 ASN HB2 H -5.439 -4.895 -18.989 1.00 . A A . 17 ASN HB2 1 1 7 2645 1 1 17 ASN HB3 H -6.253 -4.217 -17.582 1.00 . A A . 17 ASN HB3 1 1 7 2646 1 1 17 ASN HD21 H -7.103 -1.981 -17.871 1.00 . A A . 17 ASN HD21 1 1 7 2647 1 1 17 ASN HD22 H -7.817 -1.595 -19.396 1.00 . A A . 17 ASN HD22 1 1 7 2648 1 1 17 ASN N N -3.251 -3.935 -18.627 1.00 . A A . 17 ASN N 1 1 7 2649 1 1 17 ASN ND2 N -7.235 -2.142 -18.829 1.00 . A A . 17 ASN ND2 1 1 7 2650 1 1 17 ASN O O -4.106 -2.023 -16.046 1.00 . A A . 17 ASN O 1 1 7 2651 1 1 17 ASN OD1 O -6.694 -3.433 -20.586 1.00 . A A . 17 ASN OD1 1 1 7 2652 1 1 18 DAL C C -5.788 -3.915 -13.848 1.00 . A A . 18 DAL C 1 1 7 2653 1 1 18 DAL CA C -4.431 -4.246 -14.413 1.00 . A A . 18 DAL CA 1 1 7 2654 1 1 18 DAL CB C -4.004 -5.636 -13.936 1.00 . A A . 18 DAL CB 1 1 7 2655 1 1 18 DAL H H -4.667 -5.070 -16.361 1.00 . A A . 18 DAL H 1 1 7 2656 1 1 18 DAL HA H -3.705 -3.506 -14.074 1.00 . A A . 18 DAL HA 1 1 7 2657 1 1 18 DAL HB1 H -4.184 -5.724 -12.865 1.00 . A A . 18 DAL HB1 1 1 7 2658 1 1 18 DAL HB2 H -4.581 -6.394 -14.465 1.00 . A A . 18 DAL HB2 1 1 7 2659 1 1 18 DAL N N -4.495 -4.232 -15.882 1.00 . A A . 18 DAL N 1 1 7 2660 1 1 18 DAL O O -5.998 -2.831 -13.304 1.00 . A A . 18 DAL O 1 1 7 2661 1 1 19 PHE C C -8.168 -5.038 -11.997 1.00 . A A . 19 PHE C 1 1 7 2662 1 1 19 PHE CA C -8.075 -4.657 -13.471 1.00 . A A . 19 PHE CA 1 1 7 2663 1 1 19 PHE CB C -9.070 -5.485 -14.287 1.00 . A A . 19 PHE CB 1 1 7 2664 1 1 19 PHE CD1 C -10.224 -3.883 -15.837 1.00 . A A . 19 PHE CD1 1 1 7 2665 1 1 19 PHE CD2 C -8.685 -5.449 -16.766 1.00 . A A . 19 PHE CD2 1 1 7 2666 1 1 19 PHE CE1 C -10.466 -3.368 -17.097 1.00 . A A . 19 PHE CE1 1 1 7 2667 1 1 19 PHE CE2 C -8.922 -4.938 -18.028 1.00 . A A . 19 PHE CE2 1 1 7 2668 1 1 19 PHE CG C -9.331 -4.928 -15.658 1.00 . A A . 19 PHE CG 1 1 7 2669 1 1 19 PHE CZ C -9.815 -3.897 -18.194 1.00 . A A . 19 PHE CZ 1 1 7 2670 1 1 19 PHE H H -6.493 -5.697 -14.418 1.00 . A A . 19 PHE H 1 1 7 2671 1 1 19 PHE HA H -8.319 -3.611 -13.576 1.00 . A A . 19 PHE HA 1 1 7 2672 1 1 19 PHE HB2 H -8.684 -6.486 -14.405 1.00 . A A . 19 PHE HB2 1 1 7 2673 1 1 19 PHE HB3 H -10.011 -5.526 -13.759 1.00 . A A . 19 PHE HB3 1 1 7 2674 1 1 19 PHE HD1 H -10.734 -3.469 -14.979 1.00 . A A . 19 PHE HD1 1 1 7 2675 1 1 19 PHE HD2 H -7.987 -6.264 -16.639 1.00 . A A . 19 PHE HD2 1 1 7 2676 1 1 19 PHE HE1 H -11.165 -2.554 -17.222 1.00 . A A . 19 PHE HE1 1 1 7 2677 1 1 19 PHE HE2 H -8.412 -5.354 -18.885 1.00 . A A . 19 PHE HE2 1 1 7 2678 1 1 19 PHE HZ H -10.002 -3.496 -19.179 1.00 . A A . 19 PHE HZ 1 1 7 2679 1 1 19 PHE N N -6.721 -4.853 -13.975 1.00 . A A . 19 PHE N 1 1 7 2680 1 1 19 PHE O O -8.879 -4.398 -11.223 1.00 . A A . 19 PHE O 1 1 7 2681 1 1 20 GLN C C -6.524 -7.758 -10.067 1.00 . A A . 20 GLN C 1 1 7 2682 1 1 20 GLN CA C -7.446 -6.555 -10.235 1.00 . A A . 20 GLN CA 1 1 7 2683 1 1 20 GLN CB C -8.866 -6.920 -9.800 1.00 . A A . 20 GLN CB 1 1 7 2684 1 1 20 GLN CD C -10.606 -6.686 -7.983 1.00 . A A . 20 GLN CD 1 1 7 2685 1 1 20 GLN CG C -9.385 -6.079 -8.645 1.00 . A A . 20 GLN CG 1 1 7 2686 1 1 20 GLN H H -6.898 -6.556 -12.279 1.00 . A A . 20 GLN H 1 1 7 2687 1 1 20 GLN HA H -7.085 -5.750 -9.613 1.00 . A A . 20 GLN HA 1 1 7 2688 1 1 20 GLN HB2 H -9.532 -6.790 -10.640 1.00 . A A . 20 GLN HB2 1 1 7 2689 1 1 20 GLN HB3 H -8.881 -7.957 -9.497 1.00 . A A . 20 GLN HB3 1 1 7 2690 1 1 20 GLN HE21 H -10.179 -5.749 -6.282 1.00 . A A . 20 GLN HE21 1 1 7 2691 1 1 20 GLN HE22 H -11.598 -6.735 -6.261 1.00 . A A . 20 GLN HE22 1 1 7 2692 1 1 20 GLN HG2 H -8.603 -5.985 -7.906 1.00 . A A . 20 GLN HG2 1 1 7 2693 1 1 20 GLN HG3 H -9.645 -5.100 -9.019 1.00 . A A . 20 GLN HG3 1 1 7 2694 1 1 20 GLN N N -7.445 -6.087 -11.616 1.00 . A A . 20 GLN N 1 1 7 2695 1 1 20 GLN NE2 N -10.816 -6.358 -6.713 1.00 . A A . 20 GLN NE2 1 1 7 2696 1 1 20 GLN O O -6.291 -8.511 -11.013 1.00 . A A . 20 GLN O 1 1 7 2697 1 1 20 GLN OE1 O -11.353 -7.441 -8.605 1.00 . A A . 20 GLN OE1 1 1 7 2698 1 1 21 PHE C C -5.731 -9.998 -7.554 1.00 . A A . 21 PHE C 1 1 7 2699 1 1 21 PHE CA C -5.104 -9.044 -8.566 1.00 . A A . 21 PHE CA 1 1 7 2700 1 1 21 PHE CB C -3.768 -8.521 -8.032 1.00 . A A . 21 PHE CB 1 1 7 2701 1 1 21 PHE CD1 C -3.333 -6.829 -9.833 1.00 . A A . 21 PHE CD1 1 1 7 2702 1 1 21 PHE CD2 C -1.635 -8.433 -9.351 1.00 . A A . 21 PHE CD2 1 1 7 2703 1 1 21 PHE CE1 C -2.531 -6.269 -10.810 1.00 . A A . 21 PHE CE1 1 1 7 2704 1 1 21 PHE CE2 C -0.829 -7.877 -10.326 1.00 . A A . 21 PHE CE2 1 1 7 2705 1 1 21 PHE CG C -2.895 -7.915 -9.093 1.00 . A A . 21 PHE CG 1 1 7 2706 1 1 21 PHE CZ C -1.278 -6.794 -11.057 1.00 . A A . 21 PHE CZ 1 1 7 2707 1 1 21 PHE H H -6.225 -7.298 -8.145 1.00 . A A . 21 PHE H 1 1 7 2708 1 1 21 PHE HA H -4.929 -9.578 -9.487 1.00 . A A . 21 PHE HA 1 1 7 2709 1 1 21 PHE HB2 H -3.958 -7.763 -7.287 1.00 . A A . 21 PHE HB2 1 1 7 2710 1 1 21 PHE HB3 H -3.226 -9.338 -7.580 1.00 . A A . 21 PHE HB3 1 1 7 2711 1 1 21 PHE HD1 H -4.313 -6.417 -9.641 1.00 . A A . 21 PHE HD1 1 1 7 2712 1 1 21 PHE HD2 H -1.283 -9.280 -8.781 1.00 . A A . 21 PHE HD2 1 1 7 2713 1 1 21 PHE HE1 H -2.885 -5.423 -11.380 1.00 . A A . 21 PHE HE1 1 1 7 2714 1 1 21 PHE HE2 H 0.150 -8.290 -10.518 1.00 . A A . 21 PHE HE2 1 1 7 2715 1 1 21 PHE HZ H -0.650 -6.358 -11.820 1.00 . A A . 21 PHE HZ 1 1 7 2716 1 1 21 PHE N N -6.002 -7.932 -8.858 1.00 . A A . 21 PHE N 1 1 7 2717 1 1 21 PHE O O -5.630 -9.792 -6.344 1.00 . A A . 21 PHE O 1 1 7 2718 1 1 22 VAL C C -6.001 -13.009 -6.626 1.00 . A A . 22 VAL C 1 1 7 2719 1 1 22 VAL CA C -7.021 -12.031 -7.199 1.00 . A A . 22 VAL CA 1 1 7 2720 1 1 22 VAL CB C -8.101 -12.821 -7.962 1.00 . A A . 22 VAL CB 1 1 7 2721 1 1 22 VAL CG1 C -9.180 -11.884 -8.483 1.00 . A A . 22 VAL CG1 1 1 7 2722 1 1 22 VAL CG2 C -7.476 -13.612 -9.102 1.00 . A A . 22 VAL CG2 1 1 7 2723 1 1 22 VAL H H -6.424 -11.154 -9.030 1.00 . A A . 22 VAL H 1 1 7 2724 1 1 22 VAL HA H -7.498 -11.505 -6.384 1.00 . A A . 22 VAL HA 1 1 7 2725 1 1 22 VAL HB H -8.560 -13.518 -7.277 1.00 . A A . 22 VAL HB 1 1 7 2726 1 1 22 VAL HG11 H -9.468 -11.197 -7.700 1.00 . A A . 22 VAL HG11 1 1 7 2727 1 1 22 VAL HG12 H -8.800 -11.330 -9.328 1.00 . A A . 22 VAL HG12 1 1 7 2728 1 1 22 VAL HG13 H -10.041 -12.461 -8.787 1.00 . A A . 22 VAL HG13 1 1 7 2729 1 1 22 VAL HG21 H -8.255 -14.087 -9.679 1.00 . A A . 22 VAL HG21 1 1 7 2730 1 1 22 VAL HG22 H -6.913 -12.944 -9.738 1.00 . A A . 22 VAL HG22 1 1 7 2731 1 1 22 VAL HG23 H -6.816 -14.365 -8.698 1.00 . A A . 22 VAL HG23 1 1 7 2732 1 1 22 VAL N N -6.378 -11.044 -8.058 1.00 . A A . 22 VAL N 1 1 7 2733 1 1 22 VAL O O -6.309 -13.783 -5.719 1.00 . A A . 22 VAL O 1 1 7 2734 1 1 23 PHE C C -2.399 -13.510 -7.389 1.00 . A A . 23 PHE C 1 1 7 2735 1 1 23 PHE CA C -3.719 -13.852 -6.704 1.00 . A A . 23 PHE CA 1 1 7 2736 1 1 23 PHE CB C -4.086 -15.312 -6.977 1.00 . A A . 23 PHE CB 1 1 7 2737 1 1 23 PHE CD1 C -2.646 -17.365 -6.894 1.00 . A A . 23 PHE CD1 1 1 7 2738 1 1 23 PHE CD2 C -3.000 -16.147 -4.875 1.00 . A A . 23 PHE CD2 1 1 7 2739 1 1 23 PHE CE1 C -1.854 -18.271 -6.213 1.00 . A A . 23 PHE CE1 1 1 7 2740 1 1 23 PHE CE2 C -2.208 -17.049 -4.189 1.00 . A A . 23 PHE CE2 1 1 7 2741 1 1 23 PHE CG C -3.226 -16.294 -6.234 1.00 . A A . 23 PHE CG 1 1 7 2742 1 1 23 PHE CZ C -1.636 -18.113 -4.858 1.00 . A A . 23 PHE CZ 1 1 7 2743 1 1 23 PHE H H -4.602 -12.330 -7.882 1.00 . A A . 23 PHE H 1 1 7 2744 1 1 23 PHE HA H -3.606 -13.710 -5.641 1.00 . A A . 23 PHE HA 1 1 7 2745 1 1 23 PHE HB2 H -5.111 -15.480 -6.683 1.00 . A A . 23 PHE HB2 1 1 7 2746 1 1 23 PHE HB3 H -3.982 -15.511 -8.033 1.00 . A A . 23 PHE HB3 1 1 7 2747 1 1 23 PHE HD1 H -2.816 -17.490 -7.954 1.00 . A A . 23 PHE HD1 1 1 7 2748 1 1 23 PHE HD2 H -3.447 -15.316 -4.349 1.00 . A A . 23 PHE HD2 1 1 7 2749 1 1 23 PHE HE1 H -1.408 -19.101 -6.740 1.00 . A A . 23 PHE HE1 1 1 7 2750 1 1 23 PHE HE2 H -2.040 -16.924 -3.130 1.00 . A A . 23 PHE HE2 1 1 7 2751 1 1 23 PHE HZ H -1.017 -18.819 -4.324 1.00 . A A . 23 PHE HZ 1 1 7 2752 1 1 23 PHE N N -4.786 -12.969 -7.162 1.00 . A A . 23 PHE N 1 1 7 2753 1 1 23 PHE O O -1.570 -14.385 -7.632 1.00 . A A . 23 PHE O 1 1 7 2754 1 1 24 DBU C C -1.148 -11.515 -9.778 1.00 . A A . 24 DBU C 1 1 7 2755 1 1 24 DBU CA C -1.073 -11.803 -8.314 1.00 . A A . 24 DBU CA 1 1 7 2756 1 1 24 DBU CB C 0.128 -11.607 -7.741 1.00 . A A . 24 DBU CB 1 1 7 2757 1 1 24 DBU CG C 0.465 -11.821 -6.299 1.00 . A A . 24 DBU CG 1 1 7 2758 1 1 24 DBU HG1 H -0.287 -11.422 -5.613 1.00 . A A . 24 DBU HG1 1 1 7 2759 1 1 24 DBU HG2 H 1.420 -11.338 -6.068 1.00 . A A . 24 DBU HG2 1 1 7 2760 1 1 24 DBU HG3 H 0.566 -12.892 -6.100 1.00 . A A . 24 DBU HG3 1 1 7 2761 1 1 24 DBU N N -2.214 -12.231 -7.699 1.00 . A A . 24 DBU N 1 1 7 2762 1 1 24 DBU O O -0.311 -10.796 -10.324 1.00 . A A . 24 DBU O 1 1 7 2763 1 1 25 CYS C C -2.845 -10.462 -12.157 1.00 . A A . 25 CYS C 1 1 7 2764 1 1 25 CYS CA C -2.345 -11.874 -11.867 1.00 . A A . 25 CYS CA 1 1 7 2765 1 1 25 CYS CB C -3.333 -12.901 -12.423 1.00 . A A . 25 CYS CB 1 1 7 2766 1 1 25 CYS H H -2.794 -12.639 -9.945 1.00 . A A . 25 CYS H 1 1 7 2767 1 1 25 CYS HA H -1.388 -12.010 -12.349 1.00 . A A . 25 CYS HA 1 1 7 2768 1 1 25 CYS HB2 H -4.310 -12.715 -12.001 1.00 . A A . 25 CYS HB2 1 1 7 2769 1 1 25 CYS HB3 H -3.385 -12.796 -13.496 1.00 . A A . 25 CYS HB3 1 1 7 2770 1 1 25 CYS N N -2.158 -12.075 -10.435 1.00 . A A . 25 CYS N 1 1 7 2771 1 1 25 CYS O O -3.334 -9.769 -11.265 1.00 . A A . 25 CYS O 1 1 7 2772 1 1 25 CYS SG S -2.893 -14.631 -12.056 1.00 . A A . 25 CYS SG 1 1 7 2773 1 1 26 CYS C C -4.178 -8.802 -14.952 1.00 . A A . 26 CYS C 1 1 7 2774 1 1 26 CYS CA C -3.157 -8.713 -13.821 1.00 . A A . 26 CYS CA 1 1 7 2775 1 1 26 CYS CB C -1.959 -7.873 -14.266 1.00 . A A . 26 CYS CB 1 1 7 2776 1 1 26 CYS H H -2.320 -10.640 -14.079 1.00 . A A . 26 CYS H 1 1 7 2777 1 1 26 CYS HA H -3.622 -8.240 -12.970 1.00 . A A . 26 CYS HA 1 1 7 2778 1 1 26 CYS HB2 H -1.122 -8.080 -13.615 1.00 . A A . 26 CYS HB2 1 1 7 2779 1 1 26 CYS HB3 H -1.696 -8.141 -15.279 1.00 . A A . 26 CYS HB3 1 1 7 2780 1 1 26 CYS N N -2.719 -10.042 -13.412 1.00 . A A . 26 CYS N 1 1 7 2781 1 1 26 CYS O O -3.856 -8.552 -16.114 1.00 . A A . 26 CYS O 1 1 7 2782 1 1 26 CYS SG S -2.256 -6.076 -14.227 1.00 . A A . 26 CYS SG 1 1 7 2783 1 1 27 SER C C -7.814 -8.846 -15.000 1.00 . A A . 27 SER C 1 1 7 2784 1 1 27 SER CA C -6.477 -9.285 -15.589 1.00 . A A . 27 SER CA 1 1 7 2785 1 1 27 SER CB C -6.575 -10.729 -16.085 1.00 . A A . 27 SER CB 1 1 7 2786 1 1 27 SER H H -5.604 -9.346 -13.661 1.00 . A A . 27 SER H 1 1 7 2787 1 1 27 SER HA H -6.236 -8.642 -16.422 1.00 . A A . 27 SER HA 1 1 7 2788 1 1 27 SER HB2 H -6.243 -11.398 -15.306 1.00 . A A . 27 SER HB2 1 1 7 2789 1 1 27 SER HB3 H -7.602 -10.951 -16.338 1.00 . A A . 27 SER HB3 1 1 7 2790 1 1 27 SER HG H -5.764 -10.130 -17.765 1.00 . A A . 27 SER HG 1 1 7 2791 1 1 27 SER N N -5.410 -9.160 -14.603 1.00 . A A . 27 SER N 1 1 7 2792 1 1 27 SER O O -8.219 -9.314 -13.936 1.00 . A A . 27 SER O 1 1 7 2793 1 1 27 SER OG O -5.768 -10.929 -17.233 1.00 . A A . 27 SER OG 1 1 8 2794 1 1 1 LYS C C 5.749 1.337 0.013 1.00 . A A . 1 LYS C 1 1 8 2795 1 1 1 LYS CA C 5.749 2.492 1.009 1.00 . A A . 1 LYS CA 1 1 8 2796 1 1 1 LYS CB C 7.079 3.245 0.933 1.00 . A A . 1 LYS CB 1 1 8 2797 1 1 1 LYS CD C 7.055 5.728 0.555 1.00 . A A . 1 LYS CD 1 1 8 2798 1 1 1 LYS CE C 8.454 6.292 0.362 1.00 . A A . 1 LYS CE 1 1 8 2799 1 1 1 LYS CG C 7.042 4.614 1.589 1.00 . A A . 1 LYS CG 1 1 8 2800 1 1 1 LYS H1 H 6.267 1.628 2.871 1.00 . A A . 1 LYS H1 1 1 8 2801 1 1 1 LYS HA H 4.947 3.169 0.757 1.00 . A A . 1 LYS HA 1 1 8 2802 1 1 1 LYS HB2 H 7.841 2.655 1.422 1.00 . A A . 1 LYS HB2 1 1 8 2803 1 1 1 LYS HB3 H 7.347 3.373 -0.106 1.00 . A A . 1 LYS HB3 1 1 8 2804 1 1 1 LYS HD2 H 6.704 5.336 -0.388 1.00 . A A . 1 LYS HD2 1 1 8 2805 1 1 1 LYS HD3 H 6.399 6.521 0.884 1.00 . A A . 1 LYS HD3 1 1 8 2806 1 1 1 LYS HE2 H 8.394 7.157 -0.281 1.00 . A A . 1 LYS HE2 1 1 8 2807 1 1 1 LYS HE3 H 8.845 6.587 1.325 1.00 . A A . 1 LYS HE3 1 1 8 2808 1 1 1 LYS HG2 H 6.141 4.696 2.179 1.00 . A A . 1 LYS HG2 1 1 8 2809 1 1 1 LYS HG3 H 7.905 4.720 2.230 1.00 . A A . 1 LYS HG3 1 1 8 2810 1 1 1 LYS HZ1 H 9.592 4.542 0.433 1.00 . A A . 1 LYS HZ1 1 1 8 2811 1 1 1 LYS HZ2 H 10.263 5.756 -0.536 1.00 . A A . 1 LYS HZ2 1 1 8 2812 1 1 1 LYS HZ3 H 8.933 4.869 -1.090 1.00 . A A . 1 LYS HZ3 1 1 8 2813 1 1 1 LYS N N 5.519 2.009 2.365 1.00 . A A . 1 LYS N 1 1 8 2814 1 1 1 LYS NZ N 9.375 5.295 -0.251 1.00 . A A . 1 LYS NZ 1 1 8 2815 1 1 1 LYS O O 6.776 0.695 -0.210 1.00 . A A . 1 LYS O 1 1 8 2816 1 1 2 LYS C C 3.863 0.521 -2.865 1.00 . A A . 2 LYS C 1 1 8 2817 1 1 2 LYS CA C 4.457 0.002 -1.560 1.00 . A A . 2 LYS CA 1 1 8 2818 1 1 2 LYS CB C 3.579 -1.118 -0.997 1.00 . A A . 2 LYS CB 1 1 8 2819 1 1 2 LYS CD C 1.437 -1.549 0.243 1.00 . A A . 2 LYS CD 1 1 8 2820 1 1 2 LYS CE C 1.322 -3.010 -0.163 1.00 . A A . 2 LYS CE 1 1 8 2821 1 1 2 LYS CG C 2.121 -0.724 -0.834 1.00 . A A . 2 LYS CG 1 1 8 2822 1 1 2 LYS H H 3.807 1.624 -0.366 1.00 . A A . 2 LYS H 1 1 8 2823 1 1 2 LYS HA H 5.443 -0.391 -1.758 1.00 . A A . 2 LYS HA 1 1 8 2824 1 1 2 LYS HB2 H 3.628 -1.967 -1.663 1.00 . A A . 2 LYS HB2 1 1 8 2825 1 1 2 LYS HB3 H 3.962 -1.407 -0.029 1.00 . A A . 2 LYS HB3 1 1 8 2826 1 1 2 LYS HD2 H 2.013 -1.484 1.154 1.00 . A A . 2 LYS HD2 1 1 8 2827 1 1 2 LYS HD3 H 0.446 -1.152 0.413 1.00 . A A . 2 LYS HD3 1 1 8 2828 1 1 2 LYS HE2 H 0.907 -3.062 -1.157 1.00 . A A . 2 LYS HE2 1 1 8 2829 1 1 2 LYS HE3 H 2.309 -3.449 -0.161 1.00 . A A . 2 LYS HE3 1 1 8 2830 1 1 2 LYS HG2 H 2.068 0.320 -0.561 1.00 . A A . 2 LYS HG2 1 1 8 2831 1 1 2 LYS HG3 H 1.608 -0.879 -1.773 1.00 . A A . 2 LYS HG3 1 1 8 2832 1 1 2 LYS HZ1 H 0.294 -4.738 0.402 1.00 . A A . 2 LYS HZ1 1 1 8 2833 1 1 2 LYS HZ2 H -0.471 -3.304 0.867 1.00 . A A . 2 LYS HZ2 1 1 8 2834 1 1 2 LYS HZ3 H 0.896 -3.843 1.705 1.00 . A A . 2 LYS HZ3 1 1 8 2835 1 1 2 LYS N N 4.591 1.077 -0.585 1.00 . A A . 2 LYS N 1 1 8 2836 1 1 2 LYS NZ N 0.449 -3.777 0.768 1.00 . A A . 2 LYS NZ 1 1 8 2837 1 1 2 LYS O O 3.340 1.634 -2.922 1.00 . A A . 2 LYS O 1 1 8 2838 1 1 3 LYS C C 3.623 -1.036 -6.233 1.00 . A A . 3 LYS C 1 1 8 2839 1 1 3 LYS CA C 3.412 0.082 -5.217 1.00 . A A . 3 LYS CA 1 1 8 2840 1 1 3 LYS CB C 4.078 1.368 -5.712 1.00 . A A . 3 LYS CB 1 1 8 2841 1 1 3 LYS CD C 2.685 2.988 -7.033 1.00 . A A . 3 LYS CD 1 1 8 2842 1 1 3 LYS CE C 1.817 4.235 -6.976 1.00 . A A . 3 LYS CE 1 1 8 2843 1 1 3 LYS CG C 3.172 2.585 -5.651 1.00 . A A . 3 LYS CG 1 1 8 2844 1 1 3 LYS H H 4.372 -1.169 -3.805 1.00 . A A . 3 LYS H 1 1 8 2845 1 1 3 LYS HA H 2.353 0.256 -5.106 1.00 . A A . 3 LYS HA 1 1 8 2846 1 1 3 LYS HB2 H 4.950 1.564 -5.105 1.00 . A A . 3 LYS HB2 1 1 8 2847 1 1 3 LYS HB3 H 4.388 1.227 -6.737 1.00 . A A . 3 LYS HB3 1 1 8 2848 1 1 3 LYS HD2 H 3.540 3.187 -7.662 1.00 . A A . 3 LYS HD2 1 1 8 2849 1 1 3 LYS HD3 H 2.108 2.176 -7.452 1.00 . A A . 3 LYS HD3 1 1 8 2850 1 1 3 LYS HE2 H 1.496 4.389 -5.957 1.00 . A A . 3 LYS HE2 1 1 8 2851 1 1 3 LYS HE3 H 2.404 5.082 -7.301 1.00 . A A . 3 LYS HE3 1 1 8 2852 1 1 3 LYS HG2 H 2.317 2.355 -5.033 1.00 . A A . 3 LYS HG2 1 1 8 2853 1 1 3 LYS HG3 H 3.720 3.410 -5.218 1.00 . A A . 3 LYS HG3 1 1 8 2854 1 1 3 LYS HZ1 H 0.763 4.643 -8.733 1.00 . A A . 3 LYS HZ1 1 1 8 2855 1 1 3 LYS HZ2 H -0.219 4.500 -7.363 1.00 . A A . 3 LYS HZ2 1 1 8 2856 1 1 3 LYS HZ3 H 0.440 3.116 -8.079 1.00 . A A . 3 LYS HZ3 1 1 8 2857 1 1 3 LYS N N 3.944 -0.293 -3.912 1.00 . A A . 3 LYS N 1 1 8 2858 1 1 3 LYS NZ N 0.616 4.115 -7.849 1.00 . A A . 3 LYS NZ 1 1 8 2859 1 1 3 LYS O O 2.769 -1.284 -7.083 1.00 . A A . 3 LYS O 1 1 8 2860 1 1 4 SER C C 4.991 -4.146 -6.343 1.00 . A A . 4 SER C 1 1 8 2861 1 1 4 SER CA C 5.091 -2.798 -7.050 1.00 . A A . 4 SER CA 1 1 8 2862 1 1 4 SER CB C 6.497 -2.611 -7.622 1.00 . A A . 4 SER CB 1 1 8 2863 1 1 4 SER H H 5.408 -1.462 -5.438 1.00 . A A . 4 SER H 1 1 8 2864 1 1 4 SER HA H 4.376 -2.776 -7.860 1.00 . A A . 4 SER HA 1 1 8 2865 1 1 4 SER HB2 H 7.219 -3.036 -6.941 1.00 . A A . 4 SER HB2 1 1 8 2866 1 1 4 SER HB3 H 6.564 -3.113 -8.577 1.00 . A A . 4 SER HB3 1 1 8 2867 1 1 4 SER HG H 7.746 -1.124 -7.881 1.00 . A A . 4 SER HG 1 1 8 2868 1 1 4 SER N N 4.766 -1.707 -6.138 1.00 . A A . 4 SER N 1 1 8 2869 1 1 4 SER O O 4.504 -4.234 -5.217 1.00 . A A . 4 SER O 1 1 8 2870 1 1 4 SER OG O 6.796 -1.238 -7.805 1.00 . A A . 4 SER OG 1 1 8 2871 1 1 5 GLY C C 5.070 -7.591 -7.457 1.00 . A A . 5 GLY C 1 1 8 2872 1 1 5 GLY CA C 5.413 -6.525 -6.435 1.00 . A A . 5 GLY CA 1 1 8 2873 1 1 5 GLY H H 5.836 -5.064 -7.908 1.00 . A A . 5 GLY H 1 1 8 2874 1 1 5 GLY HA2 H 6.377 -6.751 -6.004 1.00 . A A . 5 GLY HA2 1 1 8 2875 1 1 5 GLY HA3 H 4.668 -6.540 -5.653 1.00 . A A . 5 GLY HA3 1 1 8 2876 1 1 5 GLY N N 5.458 -5.195 -7.013 1.00 . A A . 5 GLY N 1 1 8 2877 1 1 5 GLY O O 5.371 -8.768 -7.261 1.00 . A A . 5 GLY O 1 1 8 2878 1 1 6 VAL C C 4.522 -7.611 -10.970 1.00 . A A . 6 VAL C 1 1 8 2879 1 1 6 VAL CA C 4.052 -8.106 -9.607 1.00 . A A . 6 VAL CA 1 1 8 2880 1 1 6 VAL CB C 2.526 -8.310 -9.646 1.00 . A A . 6 VAL CB 1 1 8 2881 1 1 6 VAL CG1 C 2.189 -9.772 -9.899 1.00 . A A . 6 VAL CG1 1 1 8 2882 1 1 6 VAL CG2 C 1.891 -7.825 -8.351 1.00 . A A . 6 VAL CG2 1 1 8 2883 1 1 6 VAL H H 4.225 -6.226 -8.649 1.00 . A A . 6 VAL H 1 1 8 2884 1 1 6 VAL HA H 4.517 -9.059 -9.400 1.00 . A A . 6 VAL HA 1 1 8 2885 1 1 6 VAL HB H 2.125 -7.725 -10.460 1.00 . A A . 6 VAL HB 1 1 8 2886 1 1 6 VAL HG11 H 1.885 -9.897 -10.928 1.00 . A A . 6 VAL HG11 1 1 8 2887 1 1 6 VAL HG12 H 3.059 -10.381 -9.702 1.00 . A A . 6 VAL HG12 1 1 8 2888 1 1 6 VAL HG13 H 1.383 -10.073 -9.247 1.00 . A A . 6 VAL HG13 1 1 8 2889 1 1 6 VAL HG21 H 2.472 -8.176 -7.512 1.00 . A A . 6 VAL HG21 1 1 8 2890 1 1 6 VAL HG22 H 1.866 -6.745 -8.345 1.00 . A A . 6 VAL HG22 1 1 8 2891 1 1 6 VAL HG23 H 0.884 -8.208 -8.278 1.00 . A A . 6 VAL HG23 1 1 8 2892 1 1 6 VAL N N 4.437 -7.178 -8.550 1.00 . A A . 6 VAL N 1 1 8 2893 1 1 6 VAL O O 5.282 -6.646 -11.064 1.00 . A A . 6 VAL O 1 1 8 2894 1 1 7 ILE C C 3.262 -8.066 -14.340 1.00 . A A . 7 ILE C 1 1 8 2895 1 1 7 ILE CA C 4.439 -7.906 -13.384 1.00 . A A . 7 ILE CA 1 1 8 2896 1 1 7 ILE CB C 5.621 -8.751 -13.895 1.00 . A A . 7 ILE CB 1 1 8 2897 1 1 7 ILE CD1 C 7.413 -7.202 -12.966 1.00 . A A . 7 ILE CD1 1 1 8 2898 1 1 7 ILE CG1 C 6.827 -8.596 -12.967 1.00 . A A . 7 ILE CG1 1 1 8 2899 1 1 7 ILE CG2 C 5.984 -8.348 -15.317 1.00 . A A . 7 ILE CG2 1 1 8 2900 1 1 7 ILE H H 3.464 -9.039 -11.886 1.00 . A A . 7 ILE H 1 1 8 2901 1 1 7 ILE HA H 4.742 -6.869 -13.374 1.00 . A A . 7 ILE HA 1 1 8 2902 1 1 7 ILE HB H 5.315 -9.786 -13.907 1.00 . A A . 7 ILE HB 1 1 8 2903 1 1 7 ILE HD11 H 7.550 -6.869 -11.947 1.00 . A A . 7 ILE HD11 1 1 8 2904 1 1 7 ILE HD12 H 8.365 -7.210 -13.474 1.00 . A A . 7 ILE HD12 1 1 8 2905 1 1 7 ILE HD13 H 6.739 -6.528 -13.476 1.00 . A A . 7 ILE HD13 1 1 8 2906 1 1 7 ILE HG12 H 6.528 -8.831 -11.957 1.00 . A A . 7 ILE HG12 1 1 8 2907 1 1 7 ILE HG13 H 7.601 -9.282 -13.277 1.00 . A A . 7 ILE HG13 1 1 8 2908 1 1 7 ILE HG21 H 6.313 -7.320 -15.326 1.00 . A A . 7 ILE HG21 1 1 8 2909 1 1 7 ILE HG22 H 6.779 -8.983 -15.678 1.00 . A A . 7 ILE HG22 1 1 8 2910 1 1 7 ILE HG23 H 5.120 -8.456 -15.954 1.00 . A A . 7 ILE HG23 1 1 8 2911 1 1 7 ILE N N 4.066 -8.279 -12.025 1.00 . A A . 7 ILE N 1 1 8 2912 1 1 7 ILE O O 2.587 -9.095 -14.366 1.00 . A A . 7 ILE O 1 1 8 2913 1 1 8 PRO C C 2.172 -7.989 -17.280 1.00 . A A . 8 PRO C 1 1 8 2914 1 1 8 PRO CA C 1.916 -7.028 -16.124 1.00 . A A . 8 PRO CA 1 1 8 2915 1 1 8 PRO CB C 1.887 -5.582 -16.627 1.00 . A A . 8 PRO CB 1 1 8 2916 1 1 8 PRO CD C 3.775 -5.768 -15.172 1.00 . A A . 8 PRO CD 1 1 8 2917 1 1 8 PRO CG C 3.272 -5.078 -16.410 1.00 . A A . 8 PRO CG 1 1 8 2918 1 1 8 PRO HA H 0.971 -7.268 -15.659 1.00 . A A . 8 PRO HA 1 1 8 2919 1 1 8 PRO HB2 H 1.620 -5.568 -17.675 1.00 . A A . 8 PRO HB2 1 1 8 2920 1 1 8 PRO HB3 H 1.167 -5.014 -16.059 1.00 . A A . 8 PRO HB3 1 1 8 2921 1 1 8 PRO HD2 H 4.834 -5.961 -15.252 1.00 . A A . 8 PRO HD2 1 1 8 2922 1 1 8 PRO HD3 H 3.564 -5.172 -14.296 1.00 . A A . 8 PRO HD3 1 1 8 2923 1 1 8 PRO HG2 H 3.892 -5.330 -17.258 1.00 . A A . 8 PRO HG2 1 1 8 2924 1 1 8 PRO HG3 H 3.254 -4.008 -16.262 1.00 . A A . 8 PRO HG3 1 1 8 2925 1 1 8 PRO N N 3.011 -7.026 -15.148 1.00 . A A . 8 PRO N 1 1 8 2926 1 1 8 PRO O O 2.934 -7.684 -18.196 1.00 . A A . 8 PRO O 1 1 8 2927 1 1 9 . C C 2.191 -11.447 -17.672 1.00 . A A . 9 DBB C 1 1 8 2928 1 1 9 . CA C 1.688 -10.165 -18.282 1.00 . A A . 9 DBB CA 1 1 8 2929 1 1 9 . CB C 0.338 -10.415 -18.956 1.00 . A A . 9 DBB CB 1 1 8 2930 1 1 9 . CG C -0.324 -9.075 -19.286 1.00 . A A . 9 DBB CG 1 1 8 2931 1 1 9 . H H 0.934 -9.337 -16.473 1.00 . A A . 9 DBB H 1 1 8 2932 1 1 9 . HA H 2.404 -9.809 -19.022 1.00 . A A . 9 DBB HA 1 1 8 2933 1 1 9 . HB2 H -0.305 -10.982 -18.284 1.00 . A A . 9 DBB HB2 1 1 8 2934 1 1 9 . HG1 H 0.366 -8.461 -19.865 1.00 . A A . 9 DBB HG1 1 1 8 2935 1 1 9 . HG2 H -1.230 -9.250 -19.865 1.00 . A A . 9 DBB HG2 1 1 8 2936 1 1 9 . HG3 H -0.579 -8.559 -18.359 1.00 . A A . 9 DBB HG3 1 1 8 2937 1 1 9 . N N 1.529 -9.151 -17.230 1.00 . A A . 9 DBB N 1 1 8 2938 1 1 9 . O O 3.025 -12.139 -18.255 1.00 . A A . 9 DBB O 1 1 8 2939 1 1 10 VAL C C 0.885 -13.891 -15.524 1.00 . A A . 10 VAL C 1 1 8 2940 1 1 10 VAL CA C 2.084 -12.989 -15.791 1.00 . A A . 10 VAL CA 1 1 8 2941 1 1 10 VAL CB C 2.778 -12.666 -14.454 1.00 . A A . 10 VAL CB 1 1 8 2942 1 1 10 VAL CG1 C 4.089 -11.933 -14.696 1.00 . A A . 10 VAL CG1 1 1 8 2943 1 1 10 VAL CG2 C 1.857 -11.849 -13.560 1.00 . A A . 10 VAL CG2 1 1 8 2944 1 1 10 VAL H H 1.020 -11.181 -16.073 1.00 . A A . 10 VAL H 1 1 8 2945 1 1 10 VAL HA H 2.787 -13.516 -16.419 1.00 . A A . 10 VAL HA 1 1 8 2946 1 1 10 VAL HB H 2.999 -13.597 -13.953 1.00 . A A . 10 VAL HB 1 1 8 2947 1 1 10 VAL HG11 H 4.723 -12.035 -13.827 1.00 . A A . 10 VAL HG11 1 1 8 2948 1 1 10 VAL HG12 H 4.585 -12.357 -15.556 1.00 . A A . 10 VAL HG12 1 1 8 2949 1 1 10 VAL HG13 H 3.888 -10.887 -14.873 1.00 . A A . 10 VAL HG13 1 1 8 2950 1 1 10 VAL HG21 H 2.416 -11.040 -13.114 1.00 . A A . 10 VAL HG21 1 1 8 2951 1 1 10 VAL HG22 H 1.048 -11.445 -14.150 1.00 . A A . 10 VAL HG22 1 1 8 2952 1 1 10 VAL HG23 H 1.455 -12.482 -12.783 1.00 . A A . 10 VAL HG23 1 1 8 2953 1 1 10 VAL N N 1.682 -11.772 -16.488 1.00 . A A . 10 VAL N 1 1 8 2954 1 1 10 VAL O O 1.036 -15.016 -15.051 1.00 . A A . 10 VAL O 1 1 8 2955 1 1 11 DAL C C -1.499 -15.414 -16.455 1.00 . A A . 11 DAL C 1 1 8 2956 1 1 11 DAL CA C -1.543 -14.157 -15.624 1.00 . A A . 11 DAL CA 1 1 8 2957 1 1 11 DAL CB C -1.669 -14.527 -14.145 1.00 . A A . 11 DAL CB 1 1 8 2958 1 1 11 DAL H H -0.362 -12.485 -16.207 1.00 . A A . 11 DAL H 1 1 8 2959 1 1 11 DAL HA H -2.400 -13.553 -15.923 1.00 . A A . 11 DAL HA 1 1 8 2960 1 1 11 DAL HB1 H -2.219 -15.463 -14.049 1.00 . A A . 11 DAL HB1 1 1 8 2961 1 1 11 DAL HB2 H -0.675 -14.645 -13.714 1.00 . A A . 11 DAL HB2 1 1 8 2962 1 1 11 DAL N N -0.307 -13.389 -15.832 1.00 . A A . 11 DAL N 1 1 8 2963 1 1 11 DAL O O -0.440 -15.813 -16.940 1.00 . A A . 11 DAL O 1 1 8 2964 1 1 12 HIS C C -3.249 -16.979 -18.819 1.00 . A A . 12 HIS C 1 1 8 2965 1 1 12 HIS CA C -2.750 -17.273 -17.407 1.00 . A A . 12 HIS CA 1 1 8 2966 1 1 12 HIS CB C -3.683 -18.271 -16.721 1.00 . A A . 12 HIS CB 1 1 8 2967 1 1 12 HIS CD2 C -1.986 -20.208 -16.417 1.00 . A A . 12 HIS CD2 1 1 8 2968 1 1 12 HIS CE1 C -2.434 -20.702 -14.329 1.00 . A A . 12 HIS CE1 1 1 8 2969 1 1 12 HIS CG C -2.962 -19.368 -16.001 1.00 . A A . 12 HIS CG 1 1 8 2970 1 1 12 HIS H H -3.466 -15.678 -16.213 1.00 . A A . 12 HIS H 1 1 8 2971 1 1 12 HIS HA H -1.762 -17.702 -17.470 1.00 . A A . 12 HIS HA 1 1 8 2972 1 1 12 HIS HB2 H -4.293 -17.746 -16.001 1.00 . A A . 12 HIS HB2 1 1 8 2973 1 1 12 HIS HB3 H -4.323 -18.725 -17.464 1.00 . A A . 12 HIS HB3 1 1 8 2974 1 1 12 HIS HD1 H -3.882 -19.274 -14.108 1.00 . A A . 12 HIS HD1 1 1 8 2975 1 1 12 HIS HD2 H -1.534 -20.230 -17.399 1.00 . A A . 12 HIS HD2 1 1 8 2976 1 1 12 HIS HE1 H -2.415 -21.174 -13.358 1.00 . A A . 12 HIS HE1 1 1 8 2977 1 1 12 HIS N N -2.656 -16.046 -16.624 1.00 . A A . 12 HIS N 1 1 8 2978 1 1 12 HIS ND1 N -3.221 -19.704 -14.689 1.00 . A A . 12 HIS ND1 1 1 8 2979 1 1 12 HIS NE2 N -1.675 -21.027 -15.360 1.00 . A A . 12 HIS NE2 1 1 8 2980 1 1 12 HIS O O -3.344 -17.879 -19.654 1.00 . A A . 12 HIS O 1 1 8 2981 1 1 13 ASP C C -3.180 -14.198 -20.972 1.00 . A A . 13 ASP C 1 1 8 2982 1 1 13 ASP CA C -4.055 -15.304 -20.389 1.00 . A A . 13 ASP CA 1 1 8 2983 1 1 13 ASP CB C -5.504 -14.825 -20.289 1.00 . A A . 13 ASP CB 1 1 8 2984 1 1 13 ASP CG C -6.494 -15.873 -20.760 1.00 . A A . 13 ASP CG 1 1 8 2985 1 1 13 ASP H H -3.469 -15.044 -18.371 1.00 . A A . 13 ASP H 1 1 8 2986 1 1 13 ASP HA H -4.013 -16.161 -21.043 1.00 . A A . 13 ASP HA 1 1 8 2987 1 1 13 ASP HB2 H -5.727 -14.583 -19.260 1.00 . A A . 13 ASP HB2 1 1 8 2988 1 1 13 ASP HB3 H -5.627 -13.941 -20.897 1.00 . A A . 13 ASP HB3 1 1 8 2989 1 1 13 ASP N N -3.566 -15.716 -19.078 1.00 . A A . 13 ASP N 1 1 8 2990 1 1 13 ASP O O -2.746 -14.277 -22.122 1.00 . A A . 13 ASP O 1 1 8 2991 1 1 13 ASP OD1 O -6.439 -16.249 -21.950 1.00 . A A . 13 ASP OD1 1 1 8 2992 1 1 13 ASP OD2 O -7.322 -16.317 -19.938 1.00 . A A . 13 ASP OD2 1 1 8 2993 1 1 14 CYS C C -2.737 -11.343 -21.808 1.00 . A A . 14 CYS C 1 1 8 2994 1 1 14 CYS CA C -2.106 -12.045 -20.609 1.00 . A A . 14 CYS CA 1 1 8 2995 1 1 14 CYS CB C -0.698 -12.524 -20.968 1.00 . A A . 14 CYS CB 1 1 8 2996 1 1 14 CYS H H -3.302 -13.161 -19.267 1.00 . A A . 14 CYS H 1 1 8 2997 1 1 14 CYS HA H -2.040 -11.344 -19.791 1.00 . A A . 14 CYS HA 1 1 8 2998 1 1 14 CYS HB2 H -0.491 -13.440 -20.434 1.00 . A A . 14 CYS HB2 1 1 8 2999 1 1 14 CYS HB3 H -0.651 -12.715 -22.030 1.00 . A A . 14 CYS HB3 1 1 8 3000 1 1 14 CYS N N -2.927 -13.167 -20.173 1.00 . A A . 14 CYS N 1 1 8 3001 1 1 14 CYS O O -2.655 -11.825 -22.938 1.00 . A A . 14 CYS O 1 1 8 3002 1 1 14 CYS SG S 0.620 -11.335 -20.558 1.00 . A A . 14 CYS SG 1 1 8 3003 1 1 15 HIS C C -3.650 -7.952 -22.506 1.00 . A A . 15 HIS C 1 1 8 3004 1 1 15 HIS CA C -4.011 -9.430 -22.612 1.00 . A A . 15 HIS CA 1 1 8 3005 1 1 15 HIS CB C -5.529 -9.602 -22.545 1.00 . A A . 15 HIS CB 1 1 8 3006 1 1 15 HIS CD2 C -6.585 -10.358 -24.790 1.00 . A A . 15 HIS CD2 1 1 8 3007 1 1 15 HIS CE1 C -6.640 -12.517 -24.407 1.00 . A A . 15 HIS CE1 1 1 8 3008 1 1 15 HIS CG C -6.068 -10.566 -23.556 1.00 . A A . 15 HIS CG 1 1 8 3009 1 1 15 HIS H H -3.398 -9.867 -20.633 1.00 . A A . 15 HIS H 1 1 8 3010 1 1 15 HIS HA H -3.657 -9.808 -23.560 1.00 . A A . 15 HIS HA 1 1 8 3011 1 1 15 HIS HB2 H -5.800 -9.965 -21.564 1.00 . A A . 15 HIS HB2 1 1 8 3012 1 1 15 HIS HB3 H -6.001 -8.645 -22.713 1.00 . A A . 15 HIS HB3 1 1 8 3013 1 1 15 HIS HD1 H -5.815 -12.394 -22.540 1.00 . A A . 15 HIS HD1 1 1 8 3014 1 1 15 HIS HD2 H -6.701 -9.404 -25.285 1.00 . A A . 15 HIS HD2 1 1 8 3015 1 1 15 HIS HE1 H -6.802 -13.577 -24.527 1.00 . A A . 15 HIS HE1 1 1 8 3016 1 1 15 HIS N N -3.367 -10.200 -21.554 1.00 . A A . 15 HIS N 1 1 8 3017 1 1 15 HIS ND1 N -6.118 -11.928 -23.346 1.00 . A A . 15 HIS ND1 1 1 8 3018 1 1 15 HIS NE2 N -6.932 -11.586 -25.298 1.00 . A A . 15 HIS NE2 1 1 8 3019 1 1 15 HIS O O -2.819 -7.451 -23.264 1.00 . A A . 15 HIS O 1 1 8 3020 1 1 16 MET C C -4.905 -5.282 -20.244 1.00 . A A . 16 MET C 1 1 8 3021 1 1 16 MET CA C -4.023 -5.839 -21.358 1.00 . A A . 16 MET CA 1 1 8 3022 1 1 16 MET CB C -4.267 -5.063 -22.654 1.00 . A A . 16 MET CB 1 1 8 3023 1 1 16 MET CE C -2.764 -2.341 -24.977 1.00 . A A . 16 MET CE 1 1 8 3024 1 1 16 MET CG C -2.994 -4.528 -23.290 1.00 . A A . 16 MET CG 1 1 8 3025 1 1 16 MET H H -4.931 -7.715 -20.989 1.00 . A A . 16 MET H 1 1 8 3026 1 1 16 MET HA H -2.988 -5.727 -21.071 1.00 . A A . 16 MET HA 1 1 8 3027 1 1 16 MET HB2 H -4.752 -5.715 -23.364 1.00 . A A . 16 MET HB2 1 1 8 3028 1 1 16 MET HB3 H -4.917 -4.227 -22.442 1.00 . A A . 16 MET HB3 1 1 8 3029 1 1 16 MET HE1 H -1.797 -2.651 -25.345 1.00 . A A . 16 MET HE1 1 1 8 3030 1 1 16 MET HE2 H -3.540 -2.862 -25.519 1.00 . A A . 16 MET HE2 1 1 8 3031 1 1 16 MET HE3 H -2.879 -1.276 -25.119 1.00 . A A . 16 MET HE3 1 1 8 3032 1 1 16 MET HG2 H -2.145 -4.938 -22.765 1.00 . A A . 16 MET HG2 1 1 8 3033 1 1 16 MET HG3 H -2.965 -4.844 -24.322 1.00 . A A . 16 MET HG3 1 1 8 3034 1 1 16 MET N N -4.279 -7.260 -21.562 1.00 . A A . 16 MET N 1 1 8 3035 1 1 16 MET O O -6.101 -5.070 -20.435 1.00 . A A . 16 MET O 1 1 8 3036 1 1 16 MET SD S -2.893 -2.729 -23.233 1.00 . A A . 16 MET SD 1 1 8 3037 1 1 17 ASN C C -4.091 -4.223 -16.776 1.00 . A A . 17 ASN C 1 1 8 3038 1 1 17 ASN CA C -5.037 -4.518 -17.937 1.00 . A A . 17 ASN CA 1 1 8 3039 1 1 17 ASN CB C -6.116 -5.506 -17.492 1.00 . A A . 17 ASN CB 1 1 8 3040 1 1 17 ASN CG C -7.352 -4.810 -16.956 1.00 . A A . 17 ASN CG 1 1 8 3041 1 1 17 ASN H H -3.348 -5.238 -18.990 1.00 . A A . 17 ASN H 1 1 8 3042 1 1 17 ASN HA H -5.509 -3.597 -18.245 1.00 . A A . 17 ASN HA 1 1 8 3043 1 1 17 ASN HB2 H -6.407 -6.115 -18.336 1.00 . A A . 17 ASN HB2 1 1 8 3044 1 1 17 ASN HB3 H -5.717 -6.141 -16.716 1.00 . A A . 17 ASN HB3 1 1 8 3045 1 1 17 ASN HD21 H -7.637 -6.275 -15.642 1.00 . A A . 17 ASN HD21 1 1 8 3046 1 1 17 ASN HD22 H -8.795 -4.993 -15.601 1.00 . A A . 17 ASN HD22 1 1 8 3047 1 1 17 ASN N N -4.305 -5.049 -19.082 1.00 . A A . 17 ASN N 1 1 8 3048 1 1 17 ASN ND2 N -7.993 -5.421 -15.966 1.00 . A A . 17 ASN ND2 1 1 8 3049 1 1 17 ASN O O -4.352 -4.608 -15.638 1.00 . A A . 17 ASN O 1 1 8 3050 1 1 17 ASN OD1 O -7.726 -3.735 -17.426 1.00 . A A . 17 ASN OD1 1 1 8 3051 1 1 18 DAL C C -2.572 -2.130 -15.137 1.00 . A A . 18 DAL C 1 1 8 3052 1 1 18 DAL CA C -2.001 -3.187 -16.048 1.00 . A A . 18 DAL CA 1 1 8 3053 1 1 18 DAL CB C -1.654 -4.433 -15.230 1.00 . A A . 18 DAL CB 1 1 8 3054 1 1 18 DAL H H -2.841 -3.257 -18.001 1.00 . A A . 18 DAL H 1 1 8 3055 1 1 18 DAL HA H -1.100 -2.805 -16.528 1.00 . A A . 18 DAL HA 1 1 8 3056 1 1 18 DAL HB1 H -0.572 -4.560 -15.201 1.00 . A A . 18 DAL HB1 1 1 8 3057 1 1 18 DAL HB2 H -2.033 -4.317 -14.214 1.00 . A A . 18 DAL HB2 1 1 8 3058 1 1 18 DAL N N -2.993 -3.537 -17.074 1.00 . A A . 18 DAL N 1 1 8 3059 1 1 18 DAL O O -2.150 -0.974 -15.169 1.00 . A A . 18 DAL O 1 1 8 3060 1 1 19 PHE C C -3.982 -2.058 -11.943 1.00 . A A . 19 PHE C 1 1 8 3061 1 1 19 PHE CA C -4.177 -1.599 -13.386 1.00 . A A . 19 PHE CA 1 1 8 3062 1 1 19 PHE CB C -5.670 -1.477 -13.696 1.00 . A A . 19 PHE CB 1 1 8 3063 1 1 19 PHE CD1 C -6.732 0.496 -14.827 1.00 . A A . 19 PHE CD1 1 1 8 3064 1 1 19 PHE CD2 C -5.470 -1.029 -16.157 1.00 . A A . 19 PHE CD2 1 1 8 3065 1 1 19 PHE CE1 C -7.003 1.256 -15.949 1.00 . A A . 19 PHE CE1 1 1 8 3066 1 1 19 PHE CE2 C -5.738 -0.272 -17.282 1.00 . A A . 19 PHE CE2 1 1 8 3067 1 1 19 PHE CG C -5.963 -0.653 -14.918 1.00 . A A . 19 PHE CG 1 1 8 3068 1 1 19 PHE CZ C -6.506 0.871 -17.178 1.00 . A A . 19 PHE CZ 1 1 8 3069 1 1 19 PHE H H -3.834 -3.459 -14.337 1.00 . A A . 19 PHE H 1 1 8 3070 1 1 19 PHE HA H -3.712 -0.633 -13.510 1.00 . A A . 19 PHE HA 1 1 8 3071 1 1 19 PHE HB2 H -6.079 -2.463 -13.856 1.00 . A A . 19 PHE HB2 1 1 8 3072 1 1 19 PHE HB3 H -6.169 -1.017 -12.857 1.00 . A A . 19 PHE HB3 1 1 8 3073 1 1 19 PHE HD1 H -7.121 0.798 -13.865 1.00 . A A . 19 PHE HD1 1 1 8 3074 1 1 19 PHE HD2 H -4.870 -1.923 -16.241 1.00 . A A . 19 PHE HD2 1 1 8 3075 1 1 19 PHE HE1 H -7.604 2.150 -15.863 1.00 . A A . 19 PHE HE1 1 1 8 3076 1 1 19 PHE HE2 H -5.348 -0.576 -18.243 1.00 . A A . 19 PHE HE2 1 1 8 3077 1 1 19 PHE HZ H -6.716 1.464 -18.056 1.00 . A A . 19 PHE HZ 1 1 8 3078 1 1 19 PHE N N -3.540 -2.524 -14.316 1.00 . A A . 19 PHE N 1 1 8 3079 1 1 19 PHE O O -3.722 -1.248 -11.054 1.00 . A A . 19 PHE O 1 1 8 3080 1 1 20 GLN C C -3.995 -5.452 -10.434 1.00 . A A . 20 GLN C 1 1 8 3081 1 1 20 GLN CA C -3.949 -3.928 -10.387 1.00 . A A . 20 GLN CA 1 1 8 3082 1 1 20 GLN CB C -5.038 -3.402 -9.452 1.00 . A A . 20 GLN CB 1 1 8 3083 1 1 20 GLN CD C -5.930 -3.699 -7.107 1.00 . A A . 20 GLN CD 1 1 8 3084 1 1 20 GLN CG C -4.698 -3.550 -7.978 1.00 . A A . 20 GLN CG 1 1 8 3085 1 1 20 GLN H H -4.317 -3.957 -12.471 1.00 . A A . 20 GLN H 1 1 8 3086 1 1 20 GLN HA H -2.985 -3.621 -10.011 1.00 . A A . 20 GLN HA 1 1 8 3087 1 1 20 GLN HB2 H -5.199 -2.354 -9.659 1.00 . A A . 20 GLN HB2 1 1 8 3088 1 1 20 GLN HB3 H -5.953 -3.943 -9.644 1.00 . A A . 20 GLN HB3 1 1 8 3089 1 1 20 GLN HE21 H -6.234 -1.735 -7.157 1.00 . A A . 20 GLN HE21 1 1 8 3090 1 1 20 GLN HE22 H -7.380 -2.649 -6.244 1.00 . A A . 20 GLN HE22 1 1 8 3091 1 1 20 GLN HG2 H -4.079 -4.425 -7.850 1.00 . A A . 20 GLN HG2 1 1 8 3092 1 1 20 GLN HG3 H -4.153 -2.675 -7.658 1.00 . A A . 20 GLN HG3 1 1 8 3093 1 1 20 GLN N N -4.109 -3.362 -11.721 1.00 . A A . 20 GLN N 1 1 8 3094 1 1 20 GLN NE2 N -6.581 -2.582 -6.804 1.00 . A A . 20 GLN NE2 1 1 8 3095 1 1 20 GLN O O -4.707 -6.037 -11.250 1.00 . A A . 20 GLN O 1 1 8 3096 1 1 20 GLN OE1 O -6.293 -4.807 -6.710 1.00 . A A . 20 GLN OE1 1 1 8 3097 1 1 21 PHE C C -4.012 -8.070 -8.327 1.00 . A A . 21 PHE C 1 1 8 3098 1 1 21 PHE CA C -3.183 -7.546 -9.495 1.00 . A A . 21 PHE CA 1 1 8 3099 1 1 21 PHE CB C -1.735 -8.025 -9.363 1.00 . A A . 21 PHE CB 1 1 8 3100 1 1 21 PHE CD1 C -0.423 -8.040 -11.502 1.00 . A A . 21 PHE CD1 1 1 8 3101 1 1 21 PHE CD2 C -0.293 -6.111 -10.106 1.00 . A A . 21 PHE CD2 1 1 8 3102 1 1 21 PHE CE1 C 0.439 -7.448 -12.406 1.00 . A A . 21 PHE CE1 1 1 8 3103 1 1 21 PHE CE2 C 0.569 -5.514 -11.007 1.00 . A A . 21 PHE CE2 1 1 8 3104 1 1 21 PHE CG C -0.799 -7.379 -10.343 1.00 . A A . 21 PHE CG 1 1 8 3105 1 1 21 PHE CZ C 0.936 -6.184 -12.158 1.00 . A A . 21 PHE CZ 1 1 8 3106 1 1 21 PHE H H -2.684 -5.567 -8.928 1.00 . A A . 21 PHE H 1 1 8 3107 1 1 21 PHE HA H -3.597 -7.927 -10.415 1.00 . A A . 21 PHE HA 1 1 8 3108 1 1 21 PHE HB2 H -1.379 -7.803 -8.369 1.00 . A A . 21 PHE HB2 1 1 8 3109 1 1 21 PHE HB3 H -1.701 -9.092 -9.523 1.00 . A A . 21 PHE HB3 1 1 8 3110 1 1 21 PHE HD1 H -0.812 -9.029 -11.697 1.00 . A A . 21 PHE HD1 1 1 8 3111 1 1 21 PHE HD2 H -0.578 -5.586 -9.206 1.00 . A A . 21 PHE HD2 1 1 8 3112 1 1 21 PHE HE1 H 0.723 -7.974 -13.305 1.00 . A A . 21 PHE HE1 1 1 8 3113 1 1 21 PHE HE2 H 0.957 -4.526 -10.810 1.00 . A A . 21 PHE HE2 1 1 8 3114 1 1 21 PHE HZ H 1.609 -5.719 -12.863 1.00 . A A . 21 PHE HZ 1 1 8 3115 1 1 21 PHE N N -3.230 -6.089 -9.553 1.00 . A A . 21 PHE N 1 1 8 3116 1 1 21 PHE O O -3.739 -7.760 -7.167 1.00 . A A . 21 PHE O 1 1 8 3117 1 1 22 VAL C C -5.290 -10.701 -7.021 1.00 . A A . 22 VAL C 1 1 8 3118 1 1 22 VAL CA C -5.898 -9.437 -7.619 1.00 . A A . 22 VAL CA 1 1 8 3119 1 1 22 VAL CB C -7.290 -9.770 -8.188 1.00 . A A . 22 VAL CB 1 1 8 3120 1 1 22 VAL CG1 C -8.201 -10.305 -7.094 1.00 . A A . 22 VAL CG1 1 1 8 3121 1 1 22 VAL CG2 C -7.901 -8.544 -8.850 1.00 . A A . 22 VAL CG2 1 1 8 3122 1 1 22 VAL H H -5.196 -9.080 -9.583 1.00 . A A . 22 VAL H 1 1 8 3123 1 1 22 VAL HA H -6.019 -8.702 -6.836 1.00 . A A . 22 VAL HA 1 1 8 3124 1 1 22 VAL HB H -7.175 -10.539 -8.938 1.00 . A A . 22 VAL HB 1 1 8 3125 1 1 22 VAL HG11 H -7.939 -11.330 -6.877 1.00 . A A . 22 VAL HG11 1 1 8 3126 1 1 22 VAL HG12 H -8.084 -9.706 -6.203 1.00 . A A . 22 VAL HG12 1 1 8 3127 1 1 22 VAL HG13 H -9.228 -10.259 -7.426 1.00 . A A . 22 VAL HG13 1 1 8 3128 1 1 22 VAL HG21 H -8.060 -7.777 -8.107 1.00 . A A . 22 VAL HG21 1 1 8 3129 1 1 22 VAL HG22 H -7.231 -8.174 -9.612 1.00 . A A . 22 VAL HG22 1 1 8 3130 1 1 22 VAL HG23 H -8.845 -8.811 -9.301 1.00 . A A . 22 VAL HG23 1 1 8 3131 1 1 22 VAL N N -5.028 -8.868 -8.641 1.00 . A A . 22 VAL N 1 1 8 3132 1 1 22 VAL O O -5.545 -11.038 -5.865 1.00 . A A . 22 VAL O 1 1 8 3133 1 1 23 PHE C C -2.594 -12.921 -8.197 1.00 . A A . 23 PHE C 1 1 8 3134 1 1 23 PHE CA C -3.840 -12.625 -7.367 1.00 . A A . 23 PHE CA 1 1 8 3135 1 1 23 PHE CB C -4.816 -13.800 -7.454 1.00 . A A . 23 PHE CB 1 1 8 3136 1 1 23 PHE CD1 C -4.065 -16.192 -7.347 1.00 . A A . 23 PHE CD1 1 1 8 3137 1 1 23 PHE CD2 C -4.244 -14.969 -5.308 1.00 . A A . 23 PHE CD2 1 1 8 3138 1 1 23 PHE CE1 C -3.651 -17.309 -6.645 1.00 . A A . 23 PHE CE1 1 1 8 3139 1 1 23 PHE CE2 C -3.829 -16.082 -4.601 1.00 . A A . 23 PHE CE2 1 1 8 3140 1 1 23 PHE CG C -4.366 -15.011 -6.688 1.00 . A A . 23 PHE CG 1 1 8 3141 1 1 23 PHE CZ C -3.534 -17.253 -5.270 1.00 . A A . 23 PHE CZ 1 1 8 3142 1 1 23 PHE H H -4.321 -11.077 -8.729 1.00 . A A . 23 PHE H 1 1 8 3143 1 1 23 PHE HA H -3.547 -12.487 -6.337 1.00 . A A . 23 PHE HA 1 1 8 3144 1 1 23 PHE HB2 H -5.773 -13.495 -7.058 1.00 . A A . 23 PHE HB2 1 1 8 3145 1 1 23 PHE HB3 H -4.933 -14.085 -8.489 1.00 . A A . 23 PHE HB3 1 1 8 3146 1 1 23 PHE HD1 H -4.157 -16.237 -8.424 1.00 . A A . 23 PHE HD1 1 1 8 3147 1 1 23 PHE HD2 H -4.476 -14.054 -4.784 1.00 . A A . 23 PHE HD2 1 1 8 3148 1 1 23 PHE HE1 H -3.420 -18.223 -7.172 1.00 . A A . 23 PHE HE1 1 1 8 3149 1 1 23 PHE HE2 H -3.739 -16.036 -3.526 1.00 . A A . 23 PHE HE2 1 1 8 3150 1 1 23 PHE HZ H -3.209 -18.124 -4.720 1.00 . A A . 23 PHE HZ 1 1 8 3151 1 1 23 PHE N N -4.485 -11.397 -7.817 1.00 . A A . 23 PHE N 1 1 8 3152 1 1 23 PHE O O -2.218 -14.078 -8.380 1.00 . A A . 23 PHE O 1 1 8 3153 1 1 24 DBU C C -0.944 -11.689 -10.912 1.00 . A A . 24 DBU C 1 1 8 3154 1 1 24 DBU CA C -0.834 -12.003 -9.456 1.00 . A A . 24 DBU CA 1 1 8 3155 1 1 24 DBU CB C 0.382 -12.393 -9.033 1.00 . A A . 24 DBU CB 1 1 8 3156 1 1 24 DBU CG C 0.754 -12.761 -7.631 1.00 . A A . 24 DBU CG 1 1 8 3157 1 1 24 DBU HG1 H 1.042 -13.810 -7.519 1.00 . A A . 24 DBU HG1 1 1 8 3158 1 1 24 DBU HG2 H -0.092 -12.571 -6.964 1.00 . A A . 24 DBU HG2 1 1 8 3159 1 1 24 DBU HG3 H 1.595 -12.145 -7.299 1.00 . A A . 24 DBU HG3 1 1 8 3160 1 1 24 DBU N N -1.959 -11.866 -8.697 1.00 . A A . 24 DBU N 1 1 8 3161 1 1 24 DBU O O -0.026 -11.124 -11.508 1.00 . A A . 24 DBU O 1 1 8 3162 1 1 25 CYS C C -2.618 -10.334 -13.176 1.00 . A A . 25 CYS C 1 1 8 3163 1 1 25 CYS CA C -2.308 -11.807 -12.925 1.00 . A A . 25 CYS CA 1 1 8 3164 1 1 25 CYS CB C -3.461 -12.675 -13.432 1.00 . A A . 25 CYS CB 1 1 8 3165 1 1 25 CYS H H -2.770 -12.501 -10.979 1.00 . A A . 25 CYS H 1 1 8 3166 1 1 25 CYS HA H -1.409 -12.069 -13.460 1.00 . A A . 25 CYS HA 1 1 8 3167 1 1 25 CYS HB2 H -4.396 -12.249 -13.099 1.00 . A A . 25 CYS HB2 1 1 8 3168 1 1 25 CYS HB3 H -3.443 -12.690 -14.512 1.00 . A A . 25 CYS HB3 1 1 8 3169 1 1 25 CYS N N -2.075 -12.054 -11.507 1.00 . A A . 25 CYS N 1 1 8 3170 1 1 25 CYS O O -2.934 -9.587 -12.249 1.00 . A A . 25 CYS O 1 1 8 3171 1 1 25 CYS SG S -3.403 -14.401 -12.852 1.00 . A A . 25 CYS SG 1 1 8 3172 1 1 26 CYS C C -4.236 -8.375 -15.284 1.00 . A A . 26 CYS C 1 1 8 3173 1 1 26 CYS CA C -2.794 -8.539 -14.811 1.00 . A A . 26 CYS CA 1 1 8 3174 1 1 26 CYS CB C -1.831 -8.091 -15.912 1.00 . A A . 26 CYS CB 1 1 8 3175 1 1 26 CYS H H -2.268 -10.565 -15.132 1.00 . A A . 26 CYS H 1 1 8 3176 1 1 26 CYS HA H -2.642 -7.923 -13.938 1.00 . A A . 26 CYS HA 1 1 8 3177 1 1 26 CYS HB2 H -0.852 -8.501 -15.712 1.00 . A A . 26 CYS HB2 1 1 8 3178 1 1 26 CYS HB3 H -2.184 -8.463 -16.862 1.00 . A A . 26 CYS HB3 1 1 8 3179 1 1 26 CYS N N -2.525 -9.922 -14.436 1.00 . A A . 26 CYS N 1 1 8 3180 1 1 26 CYS O O -4.987 -7.560 -14.747 1.00 . A A . 26 CYS O 1 1 8 3181 1 1 26 CYS SG S -1.654 -6.283 -16.054 1.00 . A A . 26 CYS SG 1 1 8 3182 1 1 27 SER C C -6.963 -9.769 -15.902 1.00 . A A . 27 SER C 1 1 8 3183 1 1 27 SER CA C -5.965 -9.094 -16.838 1.00 . A A . 27 SER CA 1 1 8 3184 1 1 27 SER CB C -6.011 -9.759 -18.215 1.00 . A A . 27 SER CB 1 1 8 3185 1 1 27 SER H H -3.971 -9.785 -16.676 1.00 . A A . 27 SER H 1 1 8 3186 1 1 27 SER HA H -6.234 -8.053 -16.942 1.00 . A A . 27 SER HA 1 1 8 3187 1 1 27 SER HB2 H -5.074 -9.592 -18.724 1.00 . A A . 27 SER HB2 1 1 8 3188 1 1 27 SER HB3 H -6.170 -10.821 -18.094 1.00 . A A . 27 SER HB3 1 1 8 3189 1 1 27 SER HG H -6.904 -8.291 -19.157 1.00 . A A . 27 SER HG 1 1 8 3190 1 1 27 SER N N -4.615 -9.155 -16.291 1.00 . A A . 27 SER N 1 1 8 3191 1 1 27 SER O O -8.169 -9.553 -16.003 1.00 . A A . 27 SER O 1 1 8 3192 1 1 27 SER OG O -7.060 -9.226 -19.005 1.00 . A A . 27 SER OG 1 1 9 3193 1 1 1 LYS C C -0.813 -0.341 -1.922 1.00 . A A . 1 LYS C 1 1 9 3194 1 1 1 LYS CA C -2.124 -1.082 -1.683 1.00 . A A . 1 LYS CA 1 1 9 3195 1 1 1 LYS CB C -3.302 -0.218 -2.137 1.00 . A A . 1 LYS CB 1 1 9 3196 1 1 1 LYS CD C -5.789 0.133 -2.179 1.00 . A A . 1 LYS CD 1 1 9 3197 1 1 1 LYS CE C -7.149 -0.515 -1.966 1.00 . A A . 1 LYS CE 1 1 9 3198 1 1 1 LYS CG C -4.659 -0.801 -1.782 1.00 . A A . 1 LYS CG 1 1 9 3199 1 1 1 LYS H1 H -1.594 -1.137 0.366 1.00 . A A . 1 LYS H1 1 1 9 3200 1 1 1 LYS HA H -2.117 -1.997 -2.256 1.00 . A A . 1 LYS HA 1 1 9 3201 1 1 1 LYS HB2 H -3.219 0.755 -1.675 1.00 . A A . 1 LYS HB2 1 1 9 3202 1 1 1 LYS HB3 H -3.254 -0.101 -3.211 1.00 . A A . 1 LYS HB3 1 1 9 3203 1 1 1 LYS HD2 H -5.732 1.029 -1.578 1.00 . A A . 1 LYS HD2 1 1 9 3204 1 1 1 LYS HD3 H -5.682 0.390 -3.223 1.00 . A A . 1 LYS HD3 1 1 9 3205 1 1 1 LYS HE2 H -7.882 0.016 -2.552 1.00 . A A . 1 LYS HE2 1 1 9 3206 1 1 1 LYS HE3 H -7.099 -1.542 -2.296 1.00 . A A . 1 LYS HE3 1 1 9 3207 1 1 1 LYS HG2 H -4.784 -1.740 -2.300 1.00 . A A . 1 LYS HG2 1 1 9 3208 1 1 1 LYS HG3 H -4.700 -0.969 -0.715 1.00 . A A . 1 LYS HG3 1 1 9 3209 1 1 1 LYS HZ1 H -8.552 -0.782 -0.442 1.00 . A A . 1 LYS HZ1 1 1 9 3210 1 1 1 LYS HZ2 H -7.459 0.476 -0.153 1.00 . A A . 1 LYS HZ2 1 1 9 3211 1 1 1 LYS HZ3 H -6.963 -1.132 0.022 1.00 . A A . 1 LYS HZ3 1 1 9 3212 1 1 1 LYS N N -2.272 -1.437 -0.276 1.00 . A A . 1 LYS N 1 1 9 3213 1 1 1 LYS NZ N -7.559 -0.486 -0.534 1.00 . A A . 1 LYS NZ 1 1 9 3214 1 1 1 LYS O O -0.442 0.549 -1.156 1.00 . A A . 1 LYS O 1 1 9 3215 1 1 2 LYS C C 1.496 -0.312 -4.802 1.00 . A A . 2 LYS C 1 1 9 3216 1 1 2 LYS CA C 1.153 -0.080 -3.334 1.00 . A A . 2 LYS CA 1 1 9 3217 1 1 2 LYS CB C 2.274 -0.625 -2.445 1.00 . A A . 2 LYS CB 1 1 9 3218 1 1 2 LYS CD C 4.059 -0.126 -0.749 1.00 . A A . 2 LYS CD 1 1 9 3219 1 1 2 LYS CE C 5.435 0.512 -0.860 1.00 . A A . 2 LYS CE 1 1 9 3220 1 1 2 LYS CG C 3.090 0.460 -1.764 1.00 . A A . 2 LYS CG 1 1 9 3221 1 1 2 LYS H H -0.464 -1.428 -3.563 1.00 . A A . 2 LYS H 1 1 9 3222 1 1 2 LYS HA H 1.052 0.981 -3.163 1.00 . A A . 2 LYS HA 1 1 9 3223 1 1 2 LYS HB2 H 1.839 -1.252 -1.681 1.00 . A A . 2 LYS HB2 1 1 9 3224 1 1 2 LYS HB3 H 2.940 -1.221 -3.052 1.00 . A A . 2 LYS HB3 1 1 9 3225 1 1 2 LYS HD2 H 3.673 0.047 0.245 1.00 . A A . 2 LYS HD2 1 1 9 3226 1 1 2 LYS HD3 H 4.149 -1.189 -0.923 1.00 . A A . 2 LYS HD3 1 1 9 3227 1 1 2 LYS HE2 H 5.341 1.450 -1.385 1.00 . A A . 2 LYS HE2 1 1 9 3228 1 1 2 LYS HE3 H 5.814 0.694 0.135 1.00 . A A . 2 LYS HE3 1 1 9 3229 1 1 2 LYS HG2 H 3.652 0.998 -2.512 1.00 . A A . 2 LYS HG2 1 1 9 3230 1 1 2 LYS HG3 H 2.419 1.139 -1.257 1.00 . A A . 2 LYS HG3 1 1 9 3231 1 1 2 LYS HZ1 H 7.368 -0.152 -1.291 1.00 . A A . 2 LYS HZ1 1 1 9 3232 1 1 2 LYS HZ2 H 6.317 -0.195 -2.616 1.00 . A A . 2 LYS HZ2 1 1 9 3233 1 1 2 LYS HZ3 H 6.188 -1.361 -1.396 1.00 . A A . 2 LYS HZ3 1 1 9 3234 1 1 2 LYS N N -0.116 -0.712 -2.991 1.00 . A A . 2 LYS N 1 1 9 3235 1 1 2 LYS NZ N 6.394 -0.360 -1.592 1.00 . A A . 2 LYS NZ 1 1 9 3236 1 1 2 LYS O O 1.323 -1.413 -5.325 1.00 . A A . 2 LYS O 1 1 9 3237 1 1 3 LYS C C 3.295 -0.534 -7.111 1.00 . A A . 3 LYS C 1 1 9 3238 1 1 3 LYS CA C 2.356 0.644 -6.869 1.00 . A A . 3 LYS CA 1 1 9 3239 1 1 3 LYS CB C 3.023 1.943 -7.326 1.00 . A A . 3 LYS CB 1 1 9 3240 1 1 3 LYS CD C 2.592 3.913 -8.824 1.00 . A A . 3 LYS CD 1 1 9 3241 1 1 3 LYS CE C 1.614 5.015 -9.202 1.00 . A A . 3 LYS CE 1 1 9 3242 1 1 3 LYS CG C 2.035 3.027 -7.723 1.00 . A A . 3 LYS CG 1 1 9 3243 1 1 3 LYS H H 2.100 1.585 -4.990 1.00 . A A . 3 LYS H 1 1 9 3244 1 1 3 LYS HA H 1.453 0.492 -7.441 1.00 . A A . 3 LYS HA 1 1 9 3245 1 1 3 LYS HB2 H 3.635 2.321 -6.520 1.00 . A A . 3 LYS HB2 1 1 9 3246 1 1 3 LYS HB3 H 3.653 1.731 -8.177 1.00 . A A . 3 LYS HB3 1 1 9 3247 1 1 3 LYS HD2 H 3.511 4.364 -8.481 1.00 . A A . 3 LYS HD2 1 1 9 3248 1 1 3 LYS HD3 H 2.791 3.305 -9.696 1.00 . A A . 3 LYS HD3 1 1 9 3249 1 1 3 LYS HE2 H 2.078 5.653 -9.938 1.00 . A A . 3 LYS HE2 1 1 9 3250 1 1 3 LYS HE3 H 0.728 4.563 -9.624 1.00 . A A . 3 LYS HE3 1 1 9 3251 1 1 3 LYS HG2 H 1.126 2.562 -8.075 1.00 . A A . 3 LYS HG2 1 1 9 3252 1 1 3 LYS HG3 H 1.817 3.637 -6.858 1.00 . A A . 3 LYS HG3 1 1 9 3253 1 1 3 LYS HZ1 H 0.998 6.807 -8.325 1.00 . A A . 3 LYS HZ1 1 1 9 3254 1 1 3 LYS HZ2 H 2.006 5.873 -7.339 1.00 . A A . 3 LYS HZ2 1 1 9 3255 1 1 3 LYS HZ3 H 0.389 5.426 -7.560 1.00 . A A . 3 LYS HZ3 1 1 9 3256 1 1 3 LYS N N 1.985 0.733 -5.462 1.00 . A A . 3 LYS N 1 1 9 3257 1 1 3 LYS NZ N 1.224 5.838 -8.024 1.00 . A A . 3 LYS NZ 1 1 9 3258 1 1 3 LYS O O 4.450 -0.516 -6.686 1.00 . A A . 3 LYS O 1 1 9 3259 1 1 4 SER C C 3.738 -2.931 -9.600 1.00 . A A . 4 SER C 1 1 9 3260 1 1 4 SER CA C 3.585 -2.742 -8.094 1.00 . A A . 4 SER CA 1 1 9 3261 1 1 4 SER CB C 2.937 -3.982 -7.476 1.00 . A A . 4 SER CB 1 1 9 3262 1 1 4 SER H H 1.864 -1.509 -8.110 1.00 . A A . 4 SER H 1 1 9 3263 1 1 4 SER HA H 4.564 -2.603 -7.659 1.00 . A A . 4 SER HA 1 1 9 3264 1 1 4 SER HB2 H 3.294 -4.864 -7.986 1.00 . A A . 4 SER HB2 1 1 9 3265 1 1 4 SER HB3 H 3.201 -4.039 -6.429 1.00 . A A . 4 SER HB3 1 1 9 3266 1 1 4 SER HG H 1.150 -3.605 -6.766 1.00 . A A . 4 SER HG 1 1 9 3267 1 1 4 SER N N 2.792 -1.555 -7.798 1.00 . A A . 4 SER N 1 1 9 3268 1 1 4 SER O O 3.049 -2.288 -10.391 1.00 . A A . 4 SER O 1 1 9 3269 1 1 4 SER OG O 1.525 -3.929 -7.588 1.00 . A A . 4 SER OG 1 1 9 3270 1 1 5 GLY C C 5.903 -5.168 -11.630 1.00 . A A . 5 GLY C 1 1 9 3271 1 1 5 GLY CA C 4.874 -4.080 -11.399 1.00 . A A . 5 GLY CA 1 1 9 3272 1 1 5 GLY H H 5.166 -4.305 -9.314 1.00 . A A . 5 GLY H 1 1 9 3273 1 1 5 GLY HA2 H 3.942 -4.378 -11.854 1.00 . A A . 5 GLY HA2 1 1 9 3274 1 1 5 GLY HA3 H 5.218 -3.170 -11.869 1.00 . A A . 5 GLY HA3 1 1 9 3275 1 1 5 GLY N N 4.646 -3.821 -9.989 1.00 . A A . 5 GLY N 1 1 9 3276 1 1 5 GLY O O 7.050 -4.885 -11.978 1.00 . A A . 5 GLY O 1 1 9 3277 1 1 6 VAL C C 6.505 -7.925 -13.095 1.00 . A A . 6 VAL C 1 1 9 3278 1 1 6 VAL CA C 6.390 -7.553 -11.621 1.00 . A A . 6 VAL CA 1 1 9 3279 1 1 6 VAL CB C 5.910 -8.784 -10.829 1.00 . A A . 6 VAL CB 1 1 9 3280 1 1 6 VAL CG1 C 6.818 -9.975 -11.090 1.00 . A A . 6 VAL CG1 1 1 9 3281 1 1 6 VAL CG2 C 5.846 -8.468 -9.342 1.00 . A A . 6 VAL CG2 1 1 9 3282 1 1 6 VAL H H 4.569 -6.580 -11.156 1.00 . A A . 6 VAL H 1 1 9 3283 1 1 6 VAL HA H 7.367 -7.273 -11.253 1.00 . A A . 6 VAL HA 1 1 9 3284 1 1 6 VAL HB H 4.915 -9.037 -11.165 1.00 . A A . 6 VAL HB 1 1 9 3285 1 1 6 VAL HG11 H 6.940 -10.542 -10.179 1.00 . A A . 6 VAL HG11 1 1 9 3286 1 1 6 VAL HG12 H 6.378 -10.604 -11.851 1.00 . A A . 6 VAL HG12 1 1 9 3287 1 1 6 VAL HG13 H 7.783 -9.625 -11.426 1.00 . A A . 6 VAL HG13 1 1 9 3288 1 1 6 VAL HG21 H 5.430 -7.482 -9.202 1.00 . A A . 6 VAL HG21 1 1 9 3289 1 1 6 VAL HG22 H 5.220 -9.196 -8.846 1.00 . A A . 6 VAL HG22 1 1 9 3290 1 1 6 VAL HG23 H 6.840 -8.503 -8.923 1.00 . A A . 6 VAL HG23 1 1 9 3291 1 1 6 VAL N N 5.495 -6.418 -11.433 1.00 . A A . 6 VAL N 1 1 9 3292 1 1 6 VAL O O 7.491 -7.593 -13.754 1.00 . A A . 6 VAL O 1 1 9 3293 1 1 7 ILE C C 4.072 -8.941 -15.590 1.00 . A A . 7 ILE C 1 1 9 3294 1 1 7 ILE CA C 5.477 -9.029 -15.004 1.00 . A A . 7 ILE CA 1 1 9 3295 1 1 7 ILE CB C 6.000 -10.468 -15.169 1.00 . A A . 7 ILE CB 1 1 9 3296 1 1 7 ILE CD1 C 8.415 -9.777 -15.579 1.00 . A A . 7 ILE CD1 1 1 9 3297 1 1 7 ILE CG1 C 7.457 -10.560 -14.710 1.00 . A A . 7 ILE CG1 1 1 9 3298 1 1 7 ILE CG2 C 5.866 -10.918 -16.616 1.00 . A A . 7 ILE CG2 1 1 9 3299 1 1 7 ILE H H 4.734 -8.849 -13.031 1.00 . A A . 7 ILE H 1 1 9 3300 1 1 7 ILE HA H 6.128 -8.365 -15.554 1.00 . A A . 7 ILE HA 1 1 9 3301 1 1 7 ILE HB H 5.396 -11.120 -14.557 1.00 . A A . 7 ILE HB 1 1 9 3302 1 1 7 ILE HD11 H 9.403 -9.805 -15.143 1.00 . A A . 7 ILE HD11 1 1 9 3303 1 1 7 ILE HD12 H 8.444 -10.211 -16.567 1.00 . A A . 7 ILE HD12 1 1 9 3304 1 1 7 ILE HD13 H 8.082 -8.751 -15.647 1.00 . A A . 7 ILE HD13 1 1 9 3305 1 1 7 ILE HG12 H 7.536 -10.179 -13.704 1.00 . A A . 7 ILE HG12 1 1 9 3306 1 1 7 ILE HG13 H 7.766 -11.596 -14.723 1.00 . A A . 7 ILE HG13 1 1 9 3307 1 1 7 ILE HG21 H 4.821 -10.958 -16.885 1.00 . A A . 7 ILE HG21 1 1 9 3308 1 1 7 ILE HG22 H 6.375 -10.217 -17.259 1.00 . A A . 7 ILE HG22 1 1 9 3309 1 1 7 ILE HG23 H 6.305 -11.897 -16.731 1.00 . A A . 7 ILE HG23 1 1 9 3310 1 1 7 ILE N N 5.491 -8.614 -13.606 1.00 . A A . 7 ILE N 1 1 9 3311 1 1 7 ILE O O 3.182 -9.721 -15.253 1.00 . A A . 7 ILE O 1 1 9 3312 1 1 8 PRO C C 2.229 -8.871 -18.126 1.00 . A A . 8 PRO C 1 1 9 3313 1 1 8 PRO CA C 2.573 -7.756 -17.145 1.00 . A A . 8 PRO CA 1 1 9 3314 1 1 8 PRO CB C 2.764 -6.431 -17.887 1.00 . A A . 8 PRO CB 1 1 9 3315 1 1 8 PRO CD C 4.883 -7.001 -16.940 1.00 . A A . 8 PRO CD 1 1 9 3316 1 1 8 PRO CG C 4.232 -6.336 -18.121 1.00 . A A . 8 PRO CG 1 1 9 3317 1 1 8 PRO HA H 1.775 -7.654 -16.423 1.00 . A A . 8 PRO HA 1 1 9 3318 1 1 8 PRO HB2 H 2.216 -6.455 -18.819 1.00 . A A . 8 PRO HB2 1 1 9 3319 1 1 8 PRO HB3 H 2.408 -5.616 -17.275 1.00 . A A . 8 PRO HB3 1 1 9 3320 1 1 8 PRO HD2 H 5.788 -7.506 -17.242 1.00 . A A . 8 PRO HD2 1 1 9 3321 1 1 8 PRO HD3 H 5.093 -6.277 -16.167 1.00 . A A . 8 PRO HD3 1 1 9 3322 1 1 8 PRO HG2 H 4.494 -6.851 -19.032 1.00 . A A . 8 PRO HG2 1 1 9 3323 1 1 8 PRO HG3 H 4.528 -5.299 -18.176 1.00 . A A . 8 PRO HG3 1 1 9 3324 1 1 8 PRO N N 3.867 -7.968 -16.490 1.00 . A A . 8 PRO N 1 1 9 3325 1 1 8 PRO O O 2.663 -8.853 -19.277 1.00 . A A . 8 PRO O 1 1 9 3326 1 1 9 . C C 1.320 -12.264 -17.782 1.00 . A A . 9 DBB C 1 1 9 3327 1 1 9 . CA C 1.042 -10.973 -18.506 1.00 . A A . 9 DBB CA 1 1 9 3328 1 1 9 . CB C -0.454 -10.871 -18.813 1.00 . A A . 9 DBB CB 1 1 9 3329 1 1 9 . CG C -0.946 -9.459 -18.485 1.00 . A A . 9 DBB CG 1 1 9 3330 1 1 9 . H H 1.133 -9.799 -16.735 1.00 . A A . 9 DBB H 1 1 9 3331 1 1 9 . HA H 1.606 -10.950 -19.439 1.00 . A A . 9 DBB HA 1 1 9 3332 1 1 9 . HB2 H -0.999 -11.595 -18.209 1.00 . A A . 9 DBB HB2 1 1 9 3333 1 1 9 . HG1 H -0.306 -8.728 -18.978 1.00 . A A . 9 DBB HG1 1 1 9 3334 1 1 9 . HG2 H -1.971 -9.342 -18.836 1.00 . A A . 9 DBB HG2 1 1 9 3335 1 1 9 . HG3 H -0.911 -9.305 -17.406 1.00 . A A . 9 DBB HG3 1 1 9 3336 1 1 9 . N N 1.447 -9.841 -17.662 1.00 . A A . 9 DBB N 1 1 9 3337 1 1 9 . O O 1.807 -13.228 -18.374 1.00 . A A . 9 DBB O 1 1 9 3338 1 1 10 VAL C C -0.074 -13.961 -15.044 1.00 . A A . 10 VAL C 1 1 9 3339 1 1 10 VAL CA C 1.228 -13.480 -15.676 1.00 . A A . 10 VAL CA 1 1 9 3340 1 1 10 VAL CB C 2.259 -13.217 -14.562 1.00 . A A . 10 VAL CB 1 1 9 3341 1 1 10 VAL CG1 C 2.360 -14.417 -13.633 1.00 . A A . 10 VAL CG1 1 1 9 3342 1 1 10 VAL CG2 C 3.616 -12.881 -15.162 1.00 . A A . 10 VAL CG2 1 1 9 3343 1 1 10 VAL H H 0.623 -11.492 -16.075 1.00 . A A . 10 VAL H 1 1 9 3344 1 1 10 VAL HA H 1.613 -14.259 -16.318 1.00 . A A . 10 VAL HA 1 1 9 3345 1 1 10 VAL HB H 1.925 -12.368 -13.984 1.00 . A A . 10 VAL HB 1 1 9 3346 1 1 10 VAL HG11 H 2.575 -15.303 -14.212 1.00 . A A . 10 VAL HG11 1 1 9 3347 1 1 10 VAL HG12 H 3.151 -14.252 -12.917 1.00 . A A . 10 VAL HG12 1 1 9 3348 1 1 10 VAL HG13 H 1.423 -14.547 -13.111 1.00 . A A . 10 VAL HG13 1 1 9 3349 1 1 10 VAL HG21 H 3.907 -13.660 -15.851 1.00 . A A . 10 VAL HG21 1 1 9 3350 1 1 10 VAL HG22 H 3.554 -11.940 -15.690 1.00 . A A . 10 VAL HG22 1 1 9 3351 1 1 10 VAL HG23 H 4.349 -12.804 -14.374 1.00 . A A . 10 VAL HG23 1 1 9 3352 1 1 10 VAL N N 1.009 -12.291 -16.490 1.00 . A A . 10 VAL N 1 1 9 3353 1 1 10 VAL O O -0.190 -15.116 -14.640 1.00 . A A . 10 VAL O 1 1 9 3354 1 1 11 DAL C C -3.019 -14.473 -15.202 1.00 . A A . 11 DAL C 1 1 9 3355 1 1 11 DAL CA C -2.358 -13.399 -14.377 1.00 . A A . 11 DAL CA 1 1 9 3356 1 1 11 DAL CB C -2.158 -13.905 -12.946 1.00 . A A . 11 DAL CB 1 1 9 3357 1 1 11 DAL H H -0.899 -12.158 -15.304 1.00 . A A . 11 DAL H 1 1 9 3358 1 1 11 DAL HA H -2.989 -12.510 -14.363 1.00 . A A . 11 DAL HA 1 1 9 3359 1 1 11 DAL HB1 H -3.014 -14.512 -12.652 1.00 . A A . 11 DAL HB1 1 1 9 3360 1 1 11 DAL HB2 H -1.251 -14.509 -12.899 1.00 . A A . 11 DAL HB2 1 1 9 3361 1 1 11 DAL N N -1.052 -13.064 -14.964 1.00 . A A . 11 DAL N 1 1 9 3362 1 1 11 DAL O O -2.381 -15.452 -15.593 1.00 . A A . 11 DAL O 1 1 9 3363 1 1 12 HIS C C -5.510 -14.648 -17.588 1.00 . A A . 12 HIS C 1 1 9 3364 1 1 12 HIS CA C -5.064 -15.260 -16.264 1.00 . A A . 12 HIS CA 1 1 9 3365 1 1 12 HIS CB C -6.281 -15.751 -15.479 1.00 . A A . 12 HIS CB 1 1 9 3366 1 1 12 HIS CD2 C -7.300 -18.010 -16.245 1.00 . A A . 12 HIS CD2 1 1 9 3367 1 1 12 HIS CE1 C -6.095 -19.347 -14.993 1.00 . A A . 12 HIS CE1 1 1 9 3368 1 1 12 HIS CG C -6.458 -17.238 -15.519 1.00 . A A . 12 HIS CG 1 1 9 3369 1 1 12 HIS H H -4.761 -13.495 -15.135 1.00 . A A . 12 HIS H 1 1 9 3370 1 1 12 HIS HA H -4.416 -16.099 -16.470 1.00 . A A . 12 HIS HA 1 1 9 3371 1 1 12 HIS HB2 H -6.177 -15.457 -14.445 1.00 . A A . 12 HIS HB2 1 1 9 3372 1 1 12 HIS HB3 H -7.172 -15.299 -15.890 1.00 . A A . 12 HIS HB3 1 1 9 3373 1 1 12 HIS HD1 H -5.018 -17.849 -14.108 1.00 . A A . 12 HIS HD1 1 1 9 3374 1 1 12 HIS HD2 H -8.030 -17.664 -16.963 1.00 . A A . 12 HIS HD2 1 1 9 3375 1 1 12 HIS HE1 H -5.689 -20.235 -14.534 1.00 . A A . 12 HIS HE1 1 1 9 3376 1 1 12 HIS N N -4.308 -14.295 -15.473 1.00 . A A . 12 HIS N 1 1 9 3377 1 1 12 HIS ND1 N -5.718 -18.105 -14.744 1.00 . A A . 12 HIS ND1 1 1 9 3378 1 1 12 HIS NE2 N -7.055 -19.316 -15.900 1.00 . A A . 12 HIS NE2 1 1 9 3379 1 1 12 HIS O O -6.051 -13.542 -17.620 1.00 . A A . 12 HIS O 1 1 9 3380 1 1 13 ASP C C -4.670 -13.855 -20.511 1.00 . A A . 13 ASP C 1 1 9 3381 1 1 13 ASP CA C -5.658 -14.901 -20.004 1.00 . A A . 13 ASP CA 1 1 9 3382 1 1 13 ASP CB C -7.071 -14.315 -19.976 1.00 . A A . 13 ASP CB 1 1 9 3383 1 1 13 ASP CG C -7.916 -14.787 -21.142 1.00 . A A . 13 ASP CG 1 1 9 3384 1 1 13 ASP H H -4.845 -16.247 -18.586 1.00 . A A . 13 ASP H 1 1 9 3385 1 1 13 ASP HA H -5.643 -15.747 -20.673 1.00 . A A . 13 ASP HA 1 1 9 3386 1 1 13 ASP HB2 H -7.558 -14.611 -19.059 1.00 . A A . 13 ASP HB2 1 1 9 3387 1 1 13 ASP HB3 H -7.007 -13.237 -20.014 1.00 . A A . 13 ASP HB3 1 1 9 3388 1 1 13 ASP N N -5.280 -15.373 -18.677 1.00 . A A . 13 ASP N 1 1 9 3389 1 1 13 ASP O O -4.133 -13.977 -21.613 1.00 . A A . 13 ASP O 1 1 9 3390 1 1 13 ASP OD1 O -8.248 -15.990 -21.186 1.00 . A A . 13 ASP OD1 1 1 9 3391 1 1 13 ASP OD2 O -8.248 -13.953 -22.010 1.00 . A A . 13 ASP OD2 1 1 9 3392 1 1 14 CYS C C -4.045 -10.967 -21.259 1.00 . A A . 14 CYS C 1 1 9 3393 1 1 14 CYS CA C -3.513 -11.760 -20.068 1.00 . A A . 14 CYS CA 1 1 9 3394 1 1 14 CYS CB C -2.136 -12.338 -20.400 1.00 . A A . 14 CYS CB 1 1 9 3395 1 1 14 CYS H H -4.894 -12.787 -18.836 1.00 . A A . 14 CYS H 1 1 9 3396 1 1 14 CYS HA H -3.421 -11.096 -19.222 1.00 . A A . 14 CYS HA 1 1 9 3397 1 1 14 CYS HB2 H -1.810 -12.963 -19.581 1.00 . A A . 14 CYS HB2 1 1 9 3398 1 1 14 CYS HB3 H -2.212 -12.937 -21.295 1.00 . A A . 14 CYS HB3 1 1 9 3399 1 1 14 CYS N N -4.435 -12.828 -19.702 1.00 . A A . 14 CYS N 1 1 9 3400 1 1 14 CYS O O -4.340 -11.532 -22.313 1.00 . A A . 14 CYS O 1 1 9 3401 1 1 14 CYS SG S -0.850 -11.079 -20.681 1.00 . A A . 14 CYS SG 1 1 9 3402 1 1 15 HIS C C -3.875 -7.476 -22.183 1.00 . A A . 15 HIS C 1 1 9 3403 1 1 15 HIS CA C -4.659 -8.784 -22.144 1.00 . A A . 15 HIS CA 1 1 9 3404 1 1 15 HIS CB C -6.147 -8.494 -21.942 1.00 . A A . 15 HIS CB 1 1 9 3405 1 1 15 HIS CD2 C -7.382 -10.717 -22.450 1.00 . A A . 15 HIS CD2 1 1 9 3406 1 1 15 HIS CE1 C -8.429 -10.093 -24.273 1.00 . A A . 15 HIS CE1 1 1 9 3407 1 1 15 HIS CG C -7.046 -9.428 -22.691 1.00 . A A . 15 HIS CG 1 1 9 3408 1 1 15 HIS H H -3.913 -9.264 -20.221 1.00 . A A . 15 HIS H 1 1 9 3409 1 1 15 HIS HA H -4.526 -9.297 -23.084 1.00 . A A . 15 HIS HA 1 1 9 3410 1 1 15 HIS HB2 H -6.384 -8.578 -20.891 1.00 . A A . 15 HIS HB2 1 1 9 3411 1 1 15 HIS HB3 H -6.360 -7.489 -22.275 1.00 . A A . 15 HIS HB3 1 1 9 3412 1 1 15 HIS HD1 H -7.679 -8.189 -24.273 1.00 . A A . 15 HIS HD1 1 1 9 3413 1 1 15 HIS HD2 H -7.039 -11.327 -21.627 1.00 . A A . 15 HIS HD2 1 1 9 3414 1 1 15 HIS HE1 H -9.055 -10.101 -25.152 1.00 . A A . 15 HIS HE1 1 1 9 3415 1 1 15 HIS N N -4.164 -9.655 -21.084 1.00 . A A . 15 HIS N 1 1 9 3416 1 1 15 HIS ND1 N -7.717 -9.067 -23.840 1.00 . A A . 15 HIS ND1 1 1 9 3417 1 1 15 HIS NE2 N -8.242 -11.107 -23.448 1.00 . A A . 15 HIS NE2 1 1 9 3418 1 1 15 HIS O O -3.137 -7.212 -23.132 1.00 . A A . 15 HIS O 1 1 9 3419 1 1 16 MET C C -3.713 -4.647 -19.776 1.00 . A A . 16 MET C 1 1 9 3420 1 1 16 MET CA C -3.347 -5.381 -21.063 1.00 . A A . 16 MET CA 1 1 9 3421 1 1 16 MET CB C -3.689 -4.512 -22.274 1.00 . A A . 16 MET CB 1 1 9 3422 1 1 16 MET CE C -2.023 -2.852 -25.533 1.00 . A A . 16 MET CE 1 1 9 3423 1 1 16 MET CG C -2.498 -4.232 -23.176 1.00 . A A . 16 MET CG 1 1 9 3424 1 1 16 MET H H -4.642 -6.927 -20.420 1.00 . A A . 16 MET H 1 1 9 3425 1 1 16 MET HA H -2.286 -5.579 -21.061 1.00 . A A . 16 MET HA 1 1 9 3426 1 1 16 MET HB2 H -4.446 -5.012 -22.859 1.00 . A A . 16 MET HB2 1 1 9 3427 1 1 16 MET HB3 H -4.079 -3.567 -21.927 1.00 . A A . 16 MET HB3 1 1 9 3428 1 1 16 MET HE1 H -1.160 -3.184 -26.091 1.00 . A A . 16 MET HE1 1 1 9 3429 1 1 16 MET HE2 H -2.663 -2.265 -26.174 1.00 . A A . 16 MET HE2 1 1 9 3430 1 1 16 MET HE3 H -1.700 -2.249 -24.696 1.00 . A A . 16 MET HE3 1 1 9 3431 1 1 16 MET HG2 H -2.106 -3.253 -22.941 1.00 . A A . 16 MET HG2 1 1 9 3432 1 1 16 MET HG3 H -1.738 -4.976 -22.987 1.00 . A A . 16 MET HG3 1 1 9 3433 1 1 16 MET N N -4.040 -6.661 -21.146 1.00 . A A . 16 MET N 1 1 9 3434 1 1 16 MET O O -4.854 -4.222 -19.597 1.00 . A A . 16 MET O 1 1 9 3435 1 1 16 MET SD S -2.927 -4.275 -24.927 1.00 . A A . 16 MET SD 1 1 9 3436 1 1 17 ASN C C -1.684 -3.801 -16.778 1.00 . A A . 17 ASN C 1 1 9 3437 1 1 17 ASN CA C -2.960 -3.822 -17.614 1.00 . A A . 17 ASN CA 1 1 9 3438 1 1 17 ASN CB C -4.083 -4.506 -16.833 1.00 . A A . 17 ASN CB 1 1 9 3439 1 1 17 ASN CG C -5.165 -3.534 -16.403 1.00 . A A . 17 ASN CG 1 1 9 3440 1 1 17 ASN H H -1.850 -4.864 -19.084 1.00 . A A . 17 ASN H 1 1 9 3441 1 1 17 ASN HA H -3.252 -2.805 -17.830 1.00 . A A . 17 ASN HA 1 1 9 3442 1 1 17 ASN HB2 H -4.535 -5.265 -17.455 1.00 . A A . 17 ASN HB2 1 1 9 3443 1 1 17 ASN HB3 H -3.670 -4.969 -15.950 1.00 . A A . 17 ASN HB3 1 1 9 3444 1 1 17 ASN HD21 H -5.670 -3.219 -18.301 1.00 . A A . 17 ASN HD21 1 1 9 3445 1 1 17 ASN HD22 H -6.583 -2.342 -17.125 1.00 . A A . 17 ASN HD22 1 1 9 3446 1 1 17 ASN N N -2.739 -4.503 -18.884 1.00 . A A . 17 ASN N 1 1 9 3447 1 1 17 ASN ND2 N -5.878 -2.975 -17.375 1.00 . A A . 17 ASN ND2 1 1 9 3448 1 1 17 ASN O O -0.601 -4.110 -17.274 1.00 . A A . 17 ASN O 1 1 9 3449 1 1 17 ASN OD1 O -5.357 -3.287 -15.213 1.00 . A A . 17 ASN OD1 1 1 9 3450 1 1 18 DAL C C -0.883 -2.271 -13.592 1.00 . A A . 18 DAL C 1 1 9 3451 1 1 18 DAL CA C -0.670 -3.374 -14.596 1.00 . A A . 18 DAL CA 1 1 9 3452 1 1 18 DAL CB C -0.529 -4.711 -13.864 1.00 . A A . 18 DAL CB 1 1 9 3453 1 1 18 DAL H H -2.710 -3.200 -15.172 1.00 . A A . 18 DAL H 1 1 9 3454 1 1 18 DAL HA H 0.237 -3.176 -15.168 1.00 . A A . 18 DAL HA 1 1 9 3455 1 1 18 DAL HB1 H -0.188 -4.533 -12.844 1.00 . A A . 18 DAL HB1 1 1 9 3456 1 1 18 DAL HB2 H -1.496 -5.214 -13.841 1.00 . A A . 18 DAL HB2 1 1 9 3457 1 1 18 DAL N N -1.821 -3.435 -15.508 1.00 . A A . 18 DAL N 1 1 9 3458 1 1 18 DAL O O -0.225 -1.231 -13.647 1.00 . A A . 18 DAL O 1 1 9 3459 1 1 19 PHE C C -1.739 -2.028 -10.251 1.00 . A A . 19 PHE C 1 1 9 3460 1 1 19 PHE CA C -2.111 -1.504 -11.635 1.00 . A A . 19 PHE CA 1 1 9 3461 1 1 19 PHE CB C -3.596 -1.137 -11.672 1.00 . A A . 19 PHE CB 1 1 9 3462 1 1 19 PHE CD1 C -3.976 -0.727 -14.118 1.00 . A A . 19 PHE CD1 1 1 9 3463 1 1 19 PHE CD2 C -4.299 1.085 -12.602 1.00 . A A . 19 PHE CD2 1 1 9 3464 1 1 19 PHE CE1 C -4.315 0.094 -15.177 1.00 . A A . 19 PHE CE1 1 1 9 3465 1 1 19 PHE CE2 C -4.639 1.910 -13.657 1.00 . A A . 19 PHE CE2 1 1 9 3466 1 1 19 PHE CG C -3.964 -0.242 -12.820 1.00 . A A . 19 PHE CG 1 1 9 3467 1 1 19 PHE CZ C -4.646 1.414 -14.946 1.00 . A A . 19 PHE CZ 1 1 9 3468 1 1 19 PHE H H -2.299 -3.340 -12.672 1.00 . A A . 19 PHE H 1 1 9 3469 1 1 19 PHE HA H -1.526 -0.621 -11.842 1.00 . A A . 19 PHE HA 1 1 9 3470 1 1 19 PHE HB2 H -4.180 -2.041 -11.756 1.00 . A A . 19 PHE HB2 1 1 9 3471 1 1 19 PHE HB3 H -3.856 -0.629 -10.756 1.00 . A A . 19 PHE HB3 1 1 9 3472 1 1 19 PHE HD1 H -3.717 -1.761 -14.300 1.00 . A A . 19 PHE HD1 1 1 9 3473 1 1 19 PHE HD2 H -4.293 1.474 -11.595 1.00 . A A . 19 PHE HD2 1 1 9 3474 1 1 19 PHE HE1 H -4.319 -0.298 -16.184 1.00 . A A . 19 PHE HE1 1 1 9 3475 1 1 19 PHE HE2 H -4.897 2.943 -13.474 1.00 . A A . 19 PHE HE2 1 1 9 3476 1 1 19 PHE HZ H -4.911 2.057 -15.772 1.00 . A A . 19 PHE HZ 1 1 9 3477 1 1 19 PHE N N -1.808 -2.492 -12.664 1.00 . A A . 19 PHE N 1 1 9 3478 1 1 19 PHE O O -1.221 -1.288 -9.415 1.00 . A A . 19 PHE O 1 1 9 3479 1 1 20 GLN C C -1.633 -5.449 -8.870 1.00 . A A . 20 GLN C 1 1 9 3480 1 1 20 GLN CA C -1.701 -3.931 -8.736 1.00 . A A . 20 GLN CA 1 1 9 3481 1 1 20 GLN CB C -2.754 -3.546 -7.694 1.00 . A A . 20 GLN CB 1 1 9 3482 1 1 20 GLN CD C -3.148 -1.149 -7.000 1.00 . A A . 20 GLN CD 1 1 9 3483 1 1 20 GLN CG C -2.324 -2.404 -6.789 1.00 . A A . 20 GLN CG 1 1 9 3484 1 1 20 GLN H H -2.420 -3.847 -10.725 1.00 . A A . 20 GLN H 1 1 9 3485 1 1 20 GLN HA H -0.738 -3.568 -8.412 1.00 . A A . 20 GLN HA 1 1 9 3486 1 1 20 GLN HB2 H -3.658 -3.251 -8.206 1.00 . A A . 20 GLN HB2 1 1 9 3487 1 1 20 GLN HB3 H -2.963 -4.407 -7.077 1.00 . A A . 20 GLN HB3 1 1 9 3488 1 1 20 GLN HE21 H -2.910 -0.641 -5.093 1.00 . A A . 20 GLN HE21 1 1 9 3489 1 1 20 GLN HE22 H -3.848 0.449 -6.048 1.00 . A A . 20 GLN HE22 1 1 9 3490 1 1 20 GLN HG2 H -2.430 -2.716 -5.761 1.00 . A A . 20 GLN HG2 1 1 9 3491 1 1 20 GLN HG3 H -1.287 -2.174 -6.988 1.00 . A A . 20 GLN HG3 1 1 9 3492 1 1 20 GLN N N -2.007 -3.308 -10.018 1.00 . A A . 20 GLN N 1 1 9 3493 1 1 20 GLN NE2 N -3.320 -0.368 -5.940 1.00 . A A . 20 GLN NE2 1 1 9 3494 1 1 20 GLN O O -2.198 -6.026 -9.799 1.00 . A A . 20 GLN O 1 1 9 3495 1 1 20 GLN OE1 O -3.625 -0.885 -8.104 1.00 . A A . 20 GLN OE1 1 1 9 3496 1 1 21 PHE C C -1.418 -8.162 -6.704 1.00 . A A . 21 PHE C 1 1 9 3497 1 1 21 PHE CA C -0.795 -7.541 -7.951 1.00 . A A . 21 PHE CA 1 1 9 3498 1 1 21 PHE CB C 0.683 -7.928 -8.044 1.00 . A A . 21 PHE CB 1 1 9 3499 1 1 21 PHE CD1 C 1.848 -8.936 -10.024 1.00 . A A . 21 PHE CD1 1 1 9 3500 1 1 21 PHE CD2 C 1.156 -6.658 -10.155 1.00 . A A . 21 PHE CD2 1 1 9 3501 1 1 21 PHE CE1 C 2.361 -8.858 -11.305 1.00 . A A . 21 PHE CE1 1 1 9 3502 1 1 21 PHE CE2 C 1.667 -6.574 -11.437 1.00 . A A . 21 PHE CE2 1 1 9 3503 1 1 21 PHE CG C 1.240 -7.839 -9.436 1.00 . A A . 21 PHE CG 1 1 9 3504 1 1 21 PHE CZ C 2.271 -7.675 -12.012 1.00 . A A . 21 PHE CZ 1 1 9 3505 1 1 21 PHE H H -0.510 -5.574 -7.221 1.00 . A A . 21 PHE H 1 1 9 3506 1 1 21 PHE HA H -1.311 -7.915 -8.822 1.00 . A A . 21 PHE HA 1 1 9 3507 1 1 21 PHE HB2 H 1.260 -7.269 -7.413 1.00 . A A . 21 PHE HB2 1 1 9 3508 1 1 21 PHE HB3 H 0.803 -8.945 -7.701 1.00 . A A . 21 PHE HB3 1 1 9 3509 1 1 21 PHE HD1 H 1.919 -9.863 -9.472 1.00 . A A . 21 PHE HD1 1 1 9 3510 1 1 21 PHE HD2 H 0.684 -5.796 -9.707 1.00 . A A . 21 PHE HD2 1 1 9 3511 1 1 21 PHE HE1 H 2.833 -9.720 -11.752 1.00 . A A . 21 PHE HE1 1 1 9 3512 1 1 21 PHE HE2 H 1.596 -5.648 -11.987 1.00 . A A . 21 PHE HE2 1 1 9 3513 1 1 21 PHE HZ H 2.671 -7.611 -13.013 1.00 . A A . 21 PHE HZ 1 1 9 3514 1 1 21 PHE N N -0.938 -6.090 -7.936 1.00 . A A . 21 PHE N 1 1 9 3515 1 1 21 PHE O O -0.851 -8.094 -5.614 1.00 . A A . 21 PHE O 1 1 9 3516 1 1 22 VAL C C -2.708 -10.775 -5.458 1.00 . A A . 22 VAL C 1 1 9 3517 1 1 22 VAL CA C -3.291 -9.400 -5.763 1.00 . A A . 22 VAL CA 1 1 9 3518 1 1 22 VAL CB C -4.795 -9.546 -6.060 1.00 . A A . 22 VAL CB 1 1 9 3519 1 1 22 VAL CG1 C -5.413 -8.191 -6.370 1.00 . A A . 22 VAL CG1 1 1 9 3520 1 1 22 VAL CG2 C -5.019 -10.519 -7.208 1.00 . A A . 22 VAL CG2 1 1 9 3521 1 1 22 VAL H H -2.992 -8.787 -7.767 1.00 . A A . 22 VAL H 1 1 9 3522 1 1 22 VAL HA H -3.176 -8.770 -4.893 1.00 . A A . 22 VAL HA 1 1 9 3523 1 1 22 VAL HB H -5.278 -9.944 -5.179 1.00 . A A . 22 VAL HB 1 1 9 3524 1 1 22 VAL HG11 H -6.489 -8.267 -6.321 1.00 . A A . 22 VAL HG11 1 1 9 3525 1 1 22 VAL HG12 H -5.069 -7.465 -5.648 1.00 . A A . 22 VAL HG12 1 1 9 3526 1 1 22 VAL HG13 H -5.119 -7.881 -7.362 1.00 . A A . 22 VAL HG13 1 1 9 3527 1 1 22 VAL HG21 H -5.752 -10.110 -7.887 1.00 . A A . 22 VAL HG21 1 1 9 3528 1 1 22 VAL HG22 H -4.089 -10.676 -7.735 1.00 . A A . 22 VAL HG22 1 1 9 3529 1 1 22 VAL HG23 H -5.375 -11.461 -6.818 1.00 . A A . 22 VAL HG23 1 1 9 3530 1 1 22 VAL N N -2.590 -8.766 -6.874 1.00 . A A . 22 VAL N 1 1 9 3531 1 1 22 VAL O O -2.920 -11.325 -4.378 1.00 . A A . 22 VAL O 1 1 9 3532 1 1 23 PHE C C -0.465 -12.975 -7.444 1.00 . A A . 23 PHE C 1 1 9 3533 1 1 23 PHE CA C -1.357 -12.638 -6.253 1.00 . A A . 23 PHE CA 1 1 9 3534 1 1 23 PHE CB C -2.435 -13.712 -6.089 1.00 . A A . 23 PHE CB 1 1 9 3535 1 1 23 PHE CD1 C -1.325 -15.135 -4.345 1.00 . A A . 23 PHE CD1 1 1 9 3536 1 1 23 PHE CD2 C -1.973 -16.159 -6.399 1.00 . A A . 23 PHE CD2 1 1 9 3537 1 1 23 PHE CE1 C -0.832 -16.344 -3.893 1.00 . A A . 23 PHE CE1 1 1 9 3538 1 1 23 PHE CE2 C -1.482 -17.371 -5.952 1.00 . A A . 23 PHE CE2 1 1 9 3539 1 1 23 PHE CG C -1.900 -15.028 -5.601 1.00 . A A . 23 PHE CG 1 1 9 3540 1 1 23 PHE CZ C -0.910 -17.464 -4.698 1.00 . A A . 23 PHE CZ 1 1 9 3541 1 1 23 PHE H H -1.839 -10.838 -7.258 1.00 . A A . 23 PHE H 1 1 9 3542 1 1 23 PHE HA H -0.751 -12.609 -5.361 1.00 . A A . 23 PHE HA 1 1 9 3543 1 1 23 PHE HB2 H -3.170 -13.368 -5.376 1.00 . A A . 23 PHE HB2 1 1 9 3544 1 1 23 PHE HB3 H -2.914 -13.879 -7.042 1.00 . A A . 23 PHE HB3 1 1 9 3545 1 1 23 PHE HD1 H -1.263 -14.259 -3.715 1.00 . A A . 23 PHE HD1 1 1 9 3546 1 1 23 PHE HD2 H -2.419 -16.088 -7.380 1.00 . A A . 23 PHE HD2 1 1 9 3547 1 1 23 PHE HE1 H -0.385 -16.413 -2.912 1.00 . A A . 23 PHE HE1 1 1 9 3548 1 1 23 PHE HE2 H -1.544 -18.245 -6.584 1.00 . A A . 23 PHE HE2 1 1 9 3549 1 1 23 PHE HZ H -0.526 -18.410 -4.347 1.00 . A A . 23 PHE HZ 1 1 9 3550 1 1 23 PHE N N -1.972 -11.326 -6.418 1.00 . A A . 23 PHE N 1 1 9 3551 1 1 23 PHE O O -0.461 -14.105 -7.929 1.00 . A A . 23 PHE O 1 1 9 3552 1 1 24 DBU C C 0.626 -11.760 -10.319 1.00 . A A . 24 DBU C 1 1 9 3553 1 1 24 DBU CA C 1.128 -12.162 -8.971 1.00 . A A . 24 DBU CA 1 1 9 3554 1 1 24 DBU CB C 2.375 -12.666 -8.938 1.00 . A A . 24 DBU CB 1 1 9 3555 1 1 24 DBU CG C 3.105 -13.139 -7.721 1.00 . A A . 24 DBU CG 1 1 9 3556 1 1 24 DBU HG1 H 2.973 -14.205 -7.521 1.00 . A A . 24 DBU HG1 1 1 9 3557 1 1 24 DBU HG2 H 2.755 -12.586 -6.843 1.00 . A A . 24 DBU HG2 1 1 9 3558 1 1 24 DBU HG3 H 4.177 -12.950 -7.837 1.00 . A A . 24 DBU HG3 1 1 9 3559 1 1 24 DBU N N 0.289 -11.984 -7.909 1.00 . A A . 24 DBU N 1 1 9 3560 1 1 24 DBU O O 1.407 -11.564 -11.251 1.00 . A A . 24 DBU O 1 1 9 3561 1 1 25 CYS C C -1.149 -9.748 -11.951 1.00 . A A . 25 CYS C 1 1 9 3562 1 1 25 CYS CA C -1.309 -11.246 -11.703 1.00 . A A . 25 CYS CA 1 1 9 3563 1 1 25 CYS CB C -2.793 -11.619 -11.704 1.00 . A A . 25 CYS CB 1 1 9 3564 1 1 25 CYS H H -1.262 -11.802 -9.661 1.00 . A A . 25 CYS H 1 1 9 3565 1 1 25 CYS HA H -0.811 -11.784 -12.495 1.00 . A A . 25 CYS HA 1 1 9 3566 1 1 25 CYS HB2 H -3.329 -10.932 -11.065 1.00 . A A . 25 CYS HB2 1 1 9 3567 1 1 25 CYS HB3 H -3.175 -11.539 -12.711 1.00 . A A . 25 CYS HB3 1 1 9 3568 1 1 25 CYS N N -0.691 -11.632 -10.441 1.00 . A A . 25 CYS N 1 1 9 3569 1 1 25 CYS O O -0.866 -8.982 -11.029 1.00 . A A . 25 CYS O 1 1 9 3570 1 1 25 CYS SG S -3.135 -13.307 -11.111 1.00 . A A . 25 CYS SG 1 1 9 3571 1 1 26 CYS C C -2.469 -7.447 -14.286 1.00 . A A . 26 CYS C 1 1 9 3572 1 1 26 CYS CA C -1.211 -7.934 -13.572 1.00 . A A . 26 CYS CA 1 1 9 3573 1 1 26 CYS CB C 0.011 -7.726 -14.470 1.00 . A A . 26 CYS CB 1 1 9 3574 1 1 26 CYS H H -1.558 -9.997 -13.893 1.00 . A A . 26 CYS H 1 1 9 3575 1 1 26 CYS HA H -1.082 -7.361 -12.666 1.00 . A A . 26 CYS HA 1 1 9 3576 1 1 26 CYS HB2 H 0.834 -8.310 -14.084 1.00 . A A . 26 CYS HB2 1 1 9 3577 1 1 26 CYS HB3 H -0.225 -8.063 -15.468 1.00 . A A . 26 CYS HB3 1 1 9 3578 1 1 26 CYS N N -1.334 -9.338 -13.201 1.00 . A A . 26 CYS N 1 1 9 3579 1 1 26 CYS O O -2.391 -6.738 -15.289 1.00 . A A . 26 CYS O 1 1 9 3580 1 1 26 CYS SG S 0.565 -5.995 -14.583 1.00 . A A . 26 CYS SG 1 1 9 3581 1 1 27 SER C C -4.918 -7.722 -15.849 1.00 . A A . 27 SER C 1 1 9 3582 1 1 27 SER CA C -4.902 -7.441 -14.349 1.00 . A A . 27 SER CA 1 1 9 3583 1 1 27 SER CB C -5.169 -5.956 -14.095 1.00 . A A . 27 SER CB 1 1 9 3584 1 1 27 SER H H -3.624 -8.399 -12.960 1.00 . A A . 27 SER H 1 1 9 3585 1 1 27 SER HA H -5.679 -8.023 -13.877 1.00 . A A . 27 SER HA 1 1 9 3586 1 1 27 SER HB2 H -4.229 -5.431 -14.022 1.00 . A A . 27 SER HB2 1 1 9 3587 1 1 27 SER HB3 H -5.745 -5.551 -14.915 1.00 . A A . 27 SER HB3 1 1 9 3588 1 1 27 SER HG H -5.849 -4.843 -12.634 1.00 . A A . 27 SER HG 1 1 9 3589 1 1 27 SER N N -3.627 -7.834 -13.761 1.00 . A A . 27 SER N 1 1 9 3590 1 1 27 SER O O -5.793 -8.428 -16.348 1.00 . A A . 27 SER O 1 1 9 3591 1 1 27 SER OG O -5.892 -5.766 -12.891 1.00 . A A . 27 SER OG 1 1 10 3592 1 1 1 LYS C C 0.954 2.321 -5.954 1.00 . A A . 1 LYS C 1 1 10 3593 1 1 1 LYS CA C 0.059 3.394 -5.343 1.00 . A A . 1 LYS CA 1 1 10 3594 1 1 1 LYS CB C 0.701 4.772 -5.521 1.00 . A A . 1 LYS CB 1 1 10 3595 1 1 1 LYS CD C -0.113 6.940 -4.549 1.00 . A A . 1 LYS CD 1 1 10 3596 1 1 1 LYS CE C 0.995 7.921 -4.903 1.00 . A A . 1 LYS CE 1 1 10 3597 1 1 1 LYS CG C -0.307 5.902 -5.641 1.00 . A A . 1 LYS CG 1 1 10 3598 1 1 1 LYS H1 H -0.896 2.507 -3.674 1.00 . A A . 1 LYS H1 1 1 10 3599 1 1 1 LYS HA H -0.895 3.382 -5.849 1.00 . A A . 1 LYS HA 1 1 10 3600 1 1 1 LYS HB2 H 1.336 4.972 -4.671 1.00 . A A . 1 LYS HB2 1 1 10 3601 1 1 1 LYS HB3 H 1.305 4.760 -6.417 1.00 . A A . 1 LYS HB3 1 1 10 3602 1 1 1 LYS HD2 H -1.034 7.488 -4.416 1.00 . A A . 1 LYS HD2 1 1 10 3603 1 1 1 LYS HD3 H 0.145 6.437 -3.627 1.00 . A A . 1 LYS HD3 1 1 10 3604 1 1 1 LYS HE2 H 1.450 7.610 -5.831 1.00 . A A . 1 LYS HE2 1 1 10 3605 1 1 1 LYS HE3 H 0.562 8.903 -5.025 1.00 . A A . 1 LYS HE3 1 1 10 3606 1 1 1 LYS HG2 H -0.187 6.379 -6.602 1.00 . A A . 1 LYS HG2 1 1 10 3607 1 1 1 LYS HG3 H -1.304 5.492 -5.562 1.00 . A A . 1 LYS HG3 1 1 10 3608 1 1 1 LYS HZ1 H 2.970 7.740 -4.249 1.00 . A A . 1 LYS HZ1 1 1 10 3609 1 1 1 LYS HZ2 H 1.822 7.305 -3.086 1.00 . A A . 1 LYS HZ2 1 1 10 3610 1 1 1 LYS HZ3 H 2.088 8.937 -3.441 1.00 . A A . 1 LYS HZ3 1 1 10 3611 1 1 1 LYS N N -0.181 3.128 -3.929 1.00 . A A . 1 LYS N 1 1 10 3612 1 1 1 LYS NZ N 2.042 7.980 -3.845 1.00 . A A . 1 LYS NZ 1 1 10 3613 1 1 1 LYS O O 1.967 1.936 -5.370 1.00 . A A . 1 LYS O 1 1 10 3614 1 1 2 LYS C C 1.455 -0.447 -6.979 1.00 . A A . 2 LYS C 1 1 10 3615 1 1 2 LYS CA C 1.343 0.816 -7.827 1.00 . A A . 2 LYS CA 1 1 10 3616 1 1 2 LYS CB C 2.741 1.339 -8.168 1.00 . A A . 2 LYS CB 1 1 10 3617 1 1 2 LYS CD C 3.776 2.666 -10.033 1.00 . A A . 2 LYS CD 1 1 10 3618 1 1 2 LYS CE C 3.995 4.070 -10.576 1.00 . A A . 2 LYS CE 1 1 10 3619 1 1 2 LYS CG C 2.729 2.652 -8.931 1.00 . A A . 2 LYS CG 1 1 10 3620 1 1 2 LYS H H -0.244 2.189 -7.550 1.00 . A A . 2 LYS H 1 1 10 3621 1 1 2 LYS HA H 0.825 0.575 -8.743 1.00 . A A . 2 LYS HA 1 1 10 3622 1 1 2 LYS HB2 H 3.291 1.485 -7.250 1.00 . A A . 2 LYS HB2 1 1 10 3623 1 1 2 LYS HB3 H 3.251 0.601 -8.770 1.00 . A A . 2 LYS HB3 1 1 10 3624 1 1 2 LYS HD2 H 4.709 2.296 -9.635 1.00 . A A . 2 LYS HD2 1 1 10 3625 1 1 2 LYS HD3 H 3.446 2.025 -10.838 1.00 . A A . 2 LYS HD3 1 1 10 3626 1 1 2 LYS HE2 H 3.303 4.240 -11.386 1.00 . A A . 2 LYS HE2 1 1 10 3627 1 1 2 LYS HE3 H 3.806 4.781 -9.785 1.00 . A A . 2 LYS HE3 1 1 10 3628 1 1 2 LYS HG2 H 1.754 2.792 -9.374 1.00 . A A . 2 LYS HG2 1 1 10 3629 1 1 2 LYS HG3 H 2.934 3.460 -8.243 1.00 . A A . 2 LYS HG3 1 1 10 3630 1 1 2 LYS HZ1 H 6.064 3.835 -10.414 1.00 . A A . 2 LYS HZ1 1 1 10 3631 1 1 2 LYS HZ2 H 5.595 5.274 -11.168 1.00 . A A . 2 LYS HZ2 1 1 10 3632 1 1 2 LYS HZ3 H 5.494 3.808 -12.007 1.00 . A A . 2 LYS HZ3 1 1 10 3633 1 1 2 LYS N N 0.574 1.842 -7.134 1.00 . A A . 2 LYS N 1 1 10 3634 1 1 2 LYS NZ N 5.384 4.260 -11.077 1.00 . A A . 2 LYS NZ 1 1 10 3635 1 1 2 LYS O O 2.553 -0.939 -6.720 1.00 . A A . 2 LYS O 1 1 10 3636 1 1 3 LYS C C 1.076 -3.297 -6.386 1.00 . A A . 3 LYS C 1 1 10 3637 1 1 3 LYS CA C 0.278 -2.174 -5.731 1.00 . A A . 3 LYS CA 1 1 10 3638 1 1 3 LYS CB C -1.167 -2.625 -5.506 1.00 . A A . 3 LYS CB 1 1 10 3639 1 1 3 LYS CD C -2.459 -3.923 -3.788 1.00 . A A . 3 LYS CD 1 1 10 3640 1 1 3 LYS CE C -2.192 -4.551 -2.428 1.00 . A A . 3 LYS CE 1 1 10 3641 1 1 3 LYS CG C -1.550 -2.733 -4.040 1.00 . A A . 3 LYS CG 1 1 10 3642 1 1 3 LYS H H -0.534 -0.529 -6.787 1.00 . A A . 3 LYS H 1 1 10 3643 1 1 3 LYS HA H 0.726 -1.941 -4.776 1.00 . A A . 3 LYS HA 1 1 10 3644 1 1 3 LYS HB2 H -1.830 -1.915 -5.979 1.00 . A A . 3 LYS HB2 1 1 10 3645 1 1 3 LYS HB3 H -1.305 -3.593 -5.965 1.00 . A A . 3 LYS HB3 1 1 10 3646 1 1 3 LYS HD2 H -3.487 -3.595 -3.824 1.00 . A A . 3 LYS HD2 1 1 10 3647 1 1 3 LYS HD3 H -2.289 -4.665 -4.556 1.00 . A A . 3 LYS HD3 1 1 10 3648 1 1 3 LYS HE2 H -2.744 -5.475 -2.358 1.00 . A A . 3 LYS HE2 1 1 10 3649 1 1 3 LYS HE3 H -1.135 -4.755 -2.343 1.00 . A A . 3 LYS HE3 1 1 10 3650 1 1 3 LYS HG2 H -0.653 -2.848 -3.451 1.00 . A A . 3 LYS HG2 1 1 10 3651 1 1 3 LYS HG3 H -2.064 -1.829 -3.745 1.00 . A A . 3 LYS HG3 1 1 10 3652 1 1 3 LYS HZ1 H -3.327 -4.120 -0.729 1.00 . A A . 3 LYS HZ1 1 1 10 3653 1 1 3 LYS HZ2 H -2.998 -2.769 -1.693 1.00 . A A . 3 LYS HZ2 1 1 10 3654 1 1 3 LYS HZ3 H -1.784 -3.427 -0.715 1.00 . A A . 3 LYS HZ3 1 1 10 3655 1 1 3 LYS N N 0.310 -0.967 -6.548 1.00 . A A . 3 LYS N 1 1 10 3656 1 1 3 LYS NZ N -2.604 -3.654 -1.313 1.00 . A A . 3 LYS NZ 1 1 10 3657 1 1 3 LYS O O 0.725 -3.771 -7.467 1.00 . A A . 3 LYS O 1 1 10 3658 1 1 4 SER C C 3.446 -4.475 -7.671 1.00 . A A . 4 SER C 1 1 10 3659 1 1 4 SER CA C 2.997 -4.785 -6.246 1.00 . A A . 4 SER CA 1 1 10 3660 1 1 4 SER CB C 2.252 -6.120 -6.212 1.00 . A A . 4 SER CB 1 1 10 3661 1 1 4 SER H H 2.377 -3.301 -4.869 1.00 . A A . 4 SER H 1 1 10 3662 1 1 4 SER HA H 3.870 -4.853 -5.613 1.00 . A A . 4 SER HA 1 1 10 3663 1 1 4 SER HB2 H 1.770 -6.237 -5.254 1.00 . A A . 4 SER HB2 1 1 10 3664 1 1 4 SER HB3 H 1.507 -6.134 -6.994 1.00 . A A . 4 SER HB3 1 1 10 3665 1 1 4 SER HG H 2.902 -7.928 -5.825 1.00 . A A . 4 SER HG 1 1 10 3666 1 1 4 SER N N 2.149 -3.719 -5.726 1.00 . A A . 4 SER N 1 1 10 3667 1 1 4 SER O O 3.230 -3.374 -8.176 1.00 . A A . 4 SER O 1 1 10 3668 1 1 4 SER OG O 3.142 -7.206 -6.411 1.00 . A A . 4 SER OG 1 1 10 3669 1 1 5 GLY C C 5.520 -6.345 -10.102 1.00 . A A . 5 GLY C 1 1 10 3670 1 1 5 GLY CA C 4.541 -5.270 -9.675 1.00 . A A . 5 GLY CA 1 1 10 3671 1 1 5 GLY H H 4.215 -6.314 -7.861 1.00 . A A . 5 GLY H 1 1 10 3672 1 1 5 GLY HA2 H 3.692 -5.285 -10.342 1.00 . A A . 5 GLY HA2 1 1 10 3673 1 1 5 GLY HA3 H 5.027 -4.308 -9.747 1.00 . A A . 5 GLY HA3 1 1 10 3674 1 1 5 GLY N N 4.071 -5.456 -8.314 1.00 . A A . 5 GLY N 1 1 10 3675 1 1 5 GLY O O 6.572 -6.048 -10.668 1.00 . A A . 5 GLY O 1 1 10 3676 1 1 6 VAL C C 6.386 -8.693 -11.672 1.00 . A A . 6 VAL C 1 1 10 3677 1 1 6 VAL CA C 6.033 -8.723 -10.189 1.00 . A A . 6 VAL CA 1 1 10 3678 1 1 6 VAL CB C 5.361 -10.070 -9.860 1.00 . A A . 6 VAL CB 1 1 10 3679 1 1 6 VAL CG1 C 6.249 -11.229 -10.286 1.00 . A A . 6 VAL CG1 1 1 10 3680 1 1 6 VAL CG2 C 5.035 -10.154 -8.376 1.00 . A A . 6 VAL CG2 1 1 10 3681 1 1 6 VAL H H 4.325 -7.774 -9.376 1.00 . A A . 6 VAL H 1 1 10 3682 1 1 6 VAL HA H 6.942 -8.648 -9.610 1.00 . A A . 6 VAL HA 1 1 10 3683 1 1 6 VAL HB H 4.436 -10.132 -10.414 1.00 . A A . 6 VAL HB 1 1 10 3684 1 1 6 VAL HG11 H 7.282 -10.911 -10.280 1.00 . A A . 6 VAL HG11 1 1 10 3685 1 1 6 VAL HG12 H 6.120 -12.053 -9.600 1.00 . A A . 6 VAL HG12 1 1 10 3686 1 1 6 VAL HG13 H 5.977 -11.543 -11.283 1.00 . A A . 6 VAL HG13 1 1 10 3687 1 1 6 VAL HG21 H 4.548 -9.243 -8.063 1.00 . A A . 6 VAL HG21 1 1 10 3688 1 1 6 VAL HG22 H 4.378 -10.993 -8.199 1.00 . A A . 6 VAL HG22 1 1 10 3689 1 1 6 VAL HG23 H 5.948 -10.287 -7.814 1.00 . A A . 6 VAL HG23 1 1 10 3690 1 1 6 VAL N N 5.176 -7.600 -9.829 1.00 . A A . 6 VAL N 1 1 10 3691 1 1 6 VAL O O 7.501 -8.331 -12.047 1.00 . A A . 6 VAL O 1 1 10 3692 1 1 7 ILE C C 4.377 -8.661 -14.695 1.00 . A A . 7 ILE C 1 1 10 3693 1 1 7 ILE CA C 5.638 -9.089 -13.952 1.00 . A A . 7 ILE CA 1 1 10 3694 1 1 7 ILE CB C 6.062 -10.486 -14.446 1.00 . A A . 7 ILE CB 1 1 10 3695 1 1 7 ILE CD1 C 7.764 -12.340 -14.068 1.00 . A A . 7 ILE CD1 1 1 10 3696 1 1 7 ILE CG1 C 7.381 -10.903 -13.792 1.00 . A A . 7 ILE CG1 1 1 10 3697 1 1 7 ILE CG2 C 6.188 -10.496 -15.962 1.00 . A A . 7 ILE CG2 1 1 10 3698 1 1 7 ILE H H 4.561 -9.353 -12.150 1.00 . A A . 7 ILE H 1 1 10 3699 1 1 7 ILE HA H 6.432 -8.393 -14.181 1.00 . A A . 7 ILE HA 1 1 10 3700 1 1 7 ILE HB H 5.292 -11.190 -14.168 1.00 . A A . 7 ILE HB 1 1 10 3701 1 1 7 ILE HD11 H 6.876 -12.913 -14.292 1.00 . A A . 7 ILE HD11 1 1 10 3702 1 1 7 ILE HD12 H 8.439 -12.378 -14.909 1.00 . A A . 7 ILE HD12 1 1 10 3703 1 1 7 ILE HD13 H 8.249 -12.757 -13.197 1.00 . A A . 7 ILE HD13 1 1 10 3704 1 1 7 ILE HG12 H 8.174 -10.272 -14.162 1.00 . A A . 7 ILE HG12 1 1 10 3705 1 1 7 ILE HG13 H 7.298 -10.780 -12.722 1.00 . A A . 7 ILE HG13 1 1 10 3706 1 1 7 ILE HG21 H 5.219 -10.321 -16.405 1.00 . A A . 7 ILE HG21 1 1 10 3707 1 1 7 ILE HG22 H 6.870 -9.718 -16.271 1.00 . A A . 7 ILE HG22 1 1 10 3708 1 1 7 ILE HG23 H 6.565 -11.454 -16.285 1.00 . A A . 7 ILE HG23 1 1 10 3709 1 1 7 ILE N N 5.429 -9.075 -12.510 1.00 . A A . 7 ILE N 1 1 10 3710 1 1 7 ILE O O 3.341 -9.323 -14.643 1.00 . A A . 7 ILE O 1 1 10 3711 1 1 8 PRO C C 3.010 -7.839 -17.395 1.00 . A A . 8 PRO C 1 1 10 3712 1 1 8 PRO CA C 3.343 -6.985 -16.177 1.00 . A A . 8 PRO CA 1 1 10 3713 1 1 8 PRO CB C 3.843 -5.605 -16.611 1.00 . A A . 8 PRO CB 1 1 10 3714 1 1 8 PRO CD C 5.671 -6.687 -15.514 1.00 . A A . 8 PRO CD 1 1 10 3715 1 1 8 PRO CG C 5.328 -5.726 -16.618 1.00 . A A . 8 PRO CG 1 1 10 3716 1 1 8 PRO HA H 2.460 -6.874 -15.565 1.00 . A A . 8 PRO HA 1 1 10 3717 1 1 8 PRO HB2 H 3.459 -5.374 -17.595 1.00 . A A . 8 PRO HB2 1 1 10 3718 1 1 8 PRO HB3 H 3.511 -4.859 -15.904 1.00 . A A . 8 PRO HB3 1 1 10 3719 1 1 8 PRO HD2 H 6.532 -7.280 -15.784 1.00 . A A . 8 PRO HD2 1 1 10 3720 1 1 8 PRO HD3 H 5.852 -6.154 -14.592 1.00 . A A . 8 PRO HD3 1 1 10 3721 1 1 8 PRO HG2 H 5.660 -6.113 -17.569 1.00 . A A . 8 PRO HG2 1 1 10 3722 1 1 8 PRO HG3 H 5.775 -4.761 -16.427 1.00 . A A . 8 PRO HG3 1 1 10 3723 1 1 8 PRO N N 4.466 -7.527 -15.407 1.00 . A A . 8 PRO N 1 1 10 3724 1 1 8 PRO O O 3.325 -7.472 -18.526 1.00 . A A . 8 PRO O 1 1 10 3725 1 1 9 . C C 2.393 -11.298 -17.883 1.00 . A A . 9 DBB C 1 1 10 3726 1 1 9 . CA C 1.993 -9.893 -18.244 1.00 . A A . 9 DBB CA 1 1 10 3727 1 1 9 . CB C 0.479 -9.831 -18.457 1.00 . A A . 9 DBB CB 1 1 10 3728 1 1 9 . CG C -0.189 -9.254 -17.207 1.00 . A A . 9 DBB CG 1 1 10 3729 1 1 9 . H H 2.147 -9.218 -16.233 1.00 . A A . 9 DBB H 1 1 10 3730 1 1 9 . HA H 2.501 -9.594 -19.161 1.00 . A A . 9 DBB HA 1 1 10 3731 1 1 9 . HB2 H 0.097 -10.834 -18.643 1.00 . A A . 9 DBB HB2 1 1 10 3732 1 1 9 . HG1 H 0.171 -9.784 -16.325 1.00 . A A . 9 DBB HG1 1 1 10 3733 1 1 9 . HG2 H 0.053 -8.196 -17.121 1.00 . A A . 9 DBB HG2 1 1 10 3734 1 1 9 . HG3 H -1.270 -9.374 -17.286 1.00 . A A . 9 DBB HG3 1 1 10 3735 1 1 9 . N N 2.371 -8.980 -17.157 1.00 . A A . 9 DBB N 1 1 10 3736 1 1 9 . O O 3.004 -12.006 -18.683 1.00 . A A . 9 DBB O 1 1 10 3737 1 1 10 VAL C C 1.118 -13.822 -15.809 1.00 . A A . 10 VAL C 1 1 10 3738 1 1 10 VAL CA C 2.377 -13.052 -16.195 1.00 . A A . 10 VAL CA 1 1 10 3739 1 1 10 VAL CB C 3.327 -13.004 -14.984 1.00 . A A . 10 VAL CB 1 1 10 3740 1 1 10 VAL CG1 C 2.652 -12.326 -13.801 1.00 . A A . 10 VAL CG1 1 1 10 3741 1 1 10 VAL CG2 C 3.789 -14.405 -14.613 1.00 . A A . 10 VAL CG2 1 1 10 3742 1 1 10 VAL H H 1.563 -11.102 -16.074 1.00 . A A . 10 VAL H 1 1 10 3743 1 1 10 VAL HA H 2.876 -13.577 -16.997 1.00 . A A . 10 VAL HA 1 1 10 3744 1 1 10 VAL HB H 4.195 -12.422 -15.256 1.00 . A A . 10 VAL HB 1 1 10 3745 1 1 10 VAL HG11 H 2.731 -12.959 -12.930 1.00 . A A . 10 VAL HG11 1 1 10 3746 1 1 10 VAL HG12 H 3.134 -11.379 -13.605 1.00 . A A . 10 VAL HG12 1 1 10 3747 1 1 10 VAL HG13 H 1.610 -12.158 -14.030 1.00 . A A . 10 VAL HG13 1 1 10 3748 1 1 10 VAL HG21 H 4.864 -14.415 -14.514 1.00 . A A . 10 VAL HG21 1 1 10 3749 1 1 10 VAL HG22 H 3.338 -14.697 -13.675 1.00 . A A . 10 VAL HG22 1 1 10 3750 1 1 10 VAL HG23 H 3.491 -15.099 -15.385 1.00 . A A . 10 VAL HG23 1 1 10 3751 1 1 10 VAL N N 2.049 -11.712 -16.667 1.00 . A A . 10 VAL N 1 1 10 3752 1 1 10 VAL O O 1.166 -15.026 -15.562 1.00 . A A . 10 VAL O 1 1 10 3753 1 1 11 DAL C C -1.644 -14.787 -16.425 1.00 . A A . 11 DAL C 1 1 10 3754 1 1 11 DAL CA C -1.290 -13.739 -15.401 1.00 . A A . 11 DAL CA 1 1 10 3755 1 1 11 DAL CB C -1.172 -14.391 -14.022 1.00 . A A . 11 DAL CB 1 1 10 3756 1 1 11 DAL H H 0.018 -12.160 -15.967 1.00 . A A . 11 DAL H 1 1 10 3757 1 1 11 DAL HA H -2.069 -12.977 -15.377 1.00 . A A . 11 DAL HA 1 1 10 3758 1 1 11 DAL HB1 H -1.738 -15.322 -14.010 1.00 . A A . 11 DAL HB1 1 1 10 3759 1 1 11 DAL HB2 H -0.124 -14.602 -13.809 1.00 . A A . 11 DAL HB2 1 1 10 3760 1 1 11 DAL N N -0.007 -13.117 -15.759 1.00 . A A . 11 DAL N 1 1 10 3761 1 1 11 DAL O O -0.946 -15.792 -16.566 1.00 . A A . 11 DAL O 1 1 10 3762 1 1 12 HIS C C -3.709 -14.749 -19.396 1.00 . A A . 12 HIS C 1 1 10 3763 1 1 12 HIS CA C -3.185 -15.493 -18.172 1.00 . A A . 12 HIS CA 1 1 10 3764 1 1 12 HIS CB C -4.274 -16.409 -17.612 1.00 . A A . 12 HIS CB 1 1 10 3765 1 1 12 HIS CD2 C -2.962 -18.600 -17.158 1.00 . A A . 12 HIS CD2 1 1 10 3766 1 1 12 HIS CE1 C -3.394 -18.795 -15.018 1.00 . A A . 12 HIS CE1 1 1 10 3767 1 1 12 HIS CG C -3.740 -17.551 -16.803 1.00 . A A . 12 HIS CG 1 1 10 3768 1 1 12 HIS H H -3.250 -13.739 -16.989 1.00 . A A . 12 HIS H 1 1 10 3769 1 1 12 HIS HA H -2.338 -16.094 -18.467 1.00 . A A . 12 HIS HA 1 1 10 3770 1 1 12 HIS HB2 H -4.930 -15.832 -16.977 1.00 . A A . 12 HIS HB2 1 1 10 3771 1 1 12 HIS HB3 H -4.845 -16.821 -18.432 1.00 . A A . 12 HIS HB3 1 1 10 3772 1 1 12 HIS HD1 H -4.532 -17.098 -14.904 1.00 . A A . 12 HIS HD1 1 1 10 3773 1 1 12 HIS HD2 H -2.571 -18.804 -18.145 1.00 . A A . 12 HIS HD2 1 1 10 3774 1 1 12 HIS HE1 H -3.417 -19.165 -14.004 1.00 . A A . 12 HIS HE1 1 1 10 3775 1 1 12 HIS N N -2.735 -14.557 -17.148 1.00 . A A . 12 HIS N 1 1 10 3776 1 1 12 HIS ND1 N -3.994 -17.702 -15.456 1.00 . A A . 12 HIS ND1 1 1 10 3777 1 1 12 HIS NE2 N -2.761 -19.358 -16.031 1.00 . A A . 12 HIS NE2 1 1 10 3778 1 1 12 HIS O O -3.434 -15.132 -20.533 1.00 . A A . 12 HIS O 1 1 10 3779 1 1 13 ASP C C -4.173 -11.652 -20.505 1.00 . A A . 13 ASP C 1 1 10 3780 1 1 13 ASP CA C -5.029 -12.886 -20.238 1.00 . A A . 13 ASP CA 1 1 10 3781 1 1 13 ASP CB C -6.460 -12.465 -19.900 1.00 . A A . 13 ASP CB 1 1 10 3782 1 1 13 ASP CG C -7.409 -13.645 -19.829 1.00 . A A . 13 ASP CG 1 1 10 3783 1 1 13 ASP H H -4.650 -13.428 -18.227 1.00 . A A . 13 ASP H 1 1 10 3784 1 1 13 ASP HA H -5.044 -13.497 -21.128 1.00 . A A . 13 ASP HA 1 1 10 3785 1 1 13 ASP HB2 H -6.465 -11.965 -18.942 1.00 . A A . 13 ASP HB2 1 1 10 3786 1 1 13 ASP HB3 H -6.817 -11.784 -20.658 1.00 . A A . 13 ASP HB3 1 1 10 3787 1 1 13 ASP N N -4.466 -13.684 -19.155 1.00 . A A . 13 ASP N 1 1 10 3788 1 1 13 ASP O O -3.829 -11.357 -21.650 1.00 . A A . 13 ASP O 1 1 10 3789 1 1 13 ASP OD1 O -8.375 -13.583 -19.040 1.00 . A A . 13 ASP OD1 1 1 10 3790 1 1 13 ASP OD2 O -7.186 -14.630 -20.562 1.00 . A A . 13 ASP OD2 1 1 10 3791 1 1 14 CYS C C -3.767 -8.637 -20.316 1.00 . A A . 14 CYS C 1 1 10 3792 1 1 14 CYS CA C -3.017 -9.730 -19.559 1.00 . A A . 14 CYS CA 1 1 10 3793 1 1 14 CYS CB C -1.701 -10.048 -20.271 1.00 . A A . 14 CYS CB 1 1 10 3794 1 1 14 CYS H H -4.136 -11.218 -18.553 1.00 . A A . 14 CYS H 1 1 10 3795 1 1 14 CYS HA H -2.801 -9.376 -18.562 1.00 . A A . 14 CYS HA 1 1 10 3796 1 1 14 CYS HB2 H -1.371 -11.034 -19.978 1.00 . A A . 14 CYS HB2 1 1 10 3797 1 1 14 CYS HB3 H -1.864 -10.030 -21.338 1.00 . A A . 14 CYS HB3 1 1 10 3798 1 1 14 CYS N N -3.832 -10.933 -19.441 1.00 . A A . 14 CYS N 1 1 10 3799 1 1 14 CYS O O -3.505 -8.392 -21.494 1.00 . A A . 14 CYS O 1 1 10 3800 1 1 14 CYS SG S -0.352 -8.881 -19.896 1.00 . A A . 14 CYS SG 1 1 10 3801 1 1 15 HIS C C -5.719 -5.781 -19.248 1.00 . A A . 15 HIS C 1 1 10 3802 1 1 15 HIS CA C -5.488 -6.917 -20.239 1.00 . A A . 15 HIS CA 1 1 10 3803 1 1 15 HIS CB C -6.830 -7.461 -20.730 1.00 . A A . 15 HIS CB 1 1 10 3804 1 1 15 HIS CD2 C -8.715 -7.926 -19.011 1.00 . A A . 15 HIS CD2 1 1 10 3805 1 1 15 HIS CE1 C -8.041 -9.893 -18.319 1.00 . A A . 15 HIS CE1 1 1 10 3806 1 1 15 HIS CG C -7.583 -8.229 -19.688 1.00 . A A . 15 HIS CG 1 1 10 3807 1 1 15 HIS H H -4.863 -8.226 -18.696 1.00 . A A . 15 HIS H 1 1 10 3808 1 1 15 HIS HA H -4.934 -6.535 -21.083 1.00 . A A . 15 HIS HA 1 1 10 3809 1 1 15 HIS HB2 H -7.451 -6.637 -21.048 1.00 . A A . 15 HIS HB2 1 1 10 3810 1 1 15 HIS HB3 H -6.658 -8.120 -21.569 1.00 . A A . 15 HIS HB3 1 1 10 3811 1 1 15 HIS HD1 H -6.394 -9.961 -19.531 1.00 . A A . 15 HIS HD1 1 1 10 3812 1 1 15 HIS HD2 H -9.304 -7.025 -19.115 1.00 . A A . 15 HIS HD2 1 1 10 3813 1 1 15 HIS HE1 H -7.983 -10.832 -17.788 1.00 . A A . 15 HIS HE1 1 1 10 3814 1 1 15 HIS N N -4.700 -7.984 -19.632 1.00 . A A . 15 HIS N 1 1 10 3815 1 1 15 HIS ND1 N -7.185 -9.467 -19.230 1.00 . A A . 15 HIS ND1 1 1 10 3816 1 1 15 HIS NE2 N -8.979 -8.976 -18.167 1.00 . A A . 15 HIS NE2 1 1 10 3817 1 1 15 HIS O O -6.777 -5.692 -18.626 1.00 . A A . 15 HIS O 1 1 10 3818 1 1 16 MET C C -3.577 -2.899 -18.288 1.00 . A A . 16 MET C 1 1 10 3819 1 1 16 MET CA C -4.816 -3.783 -18.190 1.00 . A A . 16 MET CA 1 1 10 3820 1 1 16 MET CB C -4.992 -4.277 -16.753 1.00 . A A . 16 MET CB 1 1 10 3821 1 1 16 MET CE C -8.109 -3.035 -14.322 1.00 . A A . 16 MET CE 1 1 10 3822 1 1 16 MET CG C -6.408 -4.116 -16.224 1.00 . A A . 16 MET CG 1 1 10 3823 1 1 16 MET H H -3.901 -5.038 -19.629 1.00 . A A . 16 MET H 1 1 10 3824 1 1 16 MET HA H -5.682 -3.202 -18.470 1.00 . A A . 16 MET HA 1 1 10 3825 1 1 16 MET HB2 H -4.731 -5.323 -16.709 1.00 . A A . 16 MET HB2 1 1 10 3826 1 1 16 MET HB3 H -4.326 -3.721 -16.109 1.00 . A A . 16 MET HB3 1 1 10 3827 1 1 16 MET HE1 H -8.211 -2.531 -13.373 1.00 . A A . 16 MET HE1 1 1 10 3828 1 1 16 MET HE2 H -8.288 -2.334 -15.123 1.00 . A A . 16 MET HE2 1 1 10 3829 1 1 16 MET HE3 H -8.827 -3.841 -14.380 1.00 . A A . 16 MET HE3 1 1 10 3830 1 1 16 MET HG2 H -6.898 -3.329 -16.778 1.00 . A A . 16 MET HG2 1 1 10 3831 1 1 16 MET HG3 H -6.940 -5.044 -16.375 1.00 . A A . 16 MET HG3 1 1 10 3832 1 1 16 MET N N -4.721 -4.914 -19.106 1.00 . A A . 16 MET N 1 1 10 3833 1 1 16 MET O O -3.607 -1.840 -18.913 1.00 . A A . 16 MET O 1 1 10 3834 1 1 16 MET SD S -6.453 -3.701 -14.470 1.00 . A A . 16 MET SD 1 1 10 3835 1 1 17 ASN C C -0.160 -3.308 -16.881 1.00 . A A . 17 ASN C 1 1 10 3836 1 1 17 ASN CA C -1.240 -2.588 -17.683 1.00 . A A . 17 ASN CA 1 1 10 3837 1 1 17 ASN CB C -1.459 -1.183 -17.119 1.00 . A A . 17 ASN CB 1 1 10 3838 1 1 17 ASN CG C -0.876 -0.104 -18.010 1.00 . A A . 17 ASN CG 1 1 10 3839 1 1 17 ASN H H -2.526 -4.193 -17.184 1.00 . A A . 17 ASN H 1 1 10 3840 1 1 17 ASN HA H -0.916 -2.508 -18.710 1.00 . A A . 17 ASN HA 1 1 10 3841 1 1 17 ASN HB2 H -2.520 -1.004 -17.017 1.00 . A A . 17 ASN HB2 1 1 10 3842 1 1 17 ASN HB3 H -0.992 -1.115 -16.148 1.00 . A A . 17 ASN HB3 1 1 10 3843 1 1 17 ASN HD21 H 0.110 0.672 -16.468 1.00 . A A . 17 ASN HD21 1 1 10 3844 1 1 17 ASN HD22 H 0.326 1.479 -17.980 1.00 . A A . 17 ASN HD22 1 1 10 3845 1 1 17 ASN N N -2.489 -3.341 -17.666 1.00 . A A . 17 ASN N 1 1 10 3846 1 1 17 ASN ND2 N -0.064 0.770 -17.427 1.00 . A A . 17 ASN ND2 1 1 10 3847 1 1 17 ASN O O 0.847 -3.749 -17.433 1.00 . A A . 17 ASN O 1 1 10 3848 1 1 17 ASN OD1 O -1.151 -0.058 -19.209 1.00 . A A . 17 ASN OD1 1 1 10 3849 1 1 18 DAL C C 0.873 -3.215 -13.502 1.00 . A A . 18 DAL C 1 1 10 3850 1 1 18 DAL CA C 0.583 -4.096 -14.690 1.00 . A A . 18 DAL CA 1 1 10 3851 1 1 18 DAL CB C -0.010 -5.422 -14.209 1.00 . A A . 18 DAL CB 1 1 10 3852 1 1 18 DAL H H -1.201 -3.052 -15.194 1.00 . A A . 18 DAL H 1 1 10 3853 1 1 18 DAL HA H 1.507 -4.287 -15.236 1.00 . A A . 18 DAL HA 1 1 10 3854 1 1 18 DAL HB1 H 0.503 -6.249 -14.699 1.00 . A A . 18 DAL HB1 1 1 10 3855 1 1 18 DAL HB2 H 0.117 -5.506 -13.129 1.00 . A A . 18 DAL HB2 1 1 10 3856 1 1 18 DAL N N -0.379 -3.424 -15.575 1.00 . A A . 18 DAL N 1 1 10 3857 1 1 18 DAL O O 1.942 -2.611 -13.411 1.00 . A A . 18 DAL O 1 1 10 3858 1 1 19 PHE C C -0.873 -2.781 -10.282 1.00 . A A . 19 PHE C 1 1 10 3859 1 1 19 PHE CA C 0.073 -2.317 -11.386 1.00 . A A . 19 PHE CA 1 1 10 3860 1 1 19 PHE CB C -0.189 -0.845 -11.712 1.00 . A A . 19 PHE CB 1 1 10 3861 1 1 19 PHE CD1 C -2.367 0.289 -11.196 1.00 . A A . 19 PHE CD1 1 1 10 3862 1 1 19 PHE CD2 C -2.243 -1.100 -13.130 1.00 . A A . 19 PHE CD2 1 1 10 3863 1 1 19 PHE CE1 C -3.692 0.566 -11.475 1.00 . A A . 19 PHE CE1 1 1 10 3864 1 1 19 PHE CE2 C -3.568 -0.825 -13.415 1.00 . A A . 19 PHE CE2 1 1 10 3865 1 1 19 PHE CG C -1.629 -0.546 -12.019 1.00 . A A . 19 PHE CG 1 1 10 3866 1 1 19 PHE CZ C -4.293 0.008 -12.586 1.00 . A A . 19 PHE CZ 1 1 10 3867 1 1 19 PHE H H -0.913 -3.641 -12.712 1.00 . A A . 19 PHE H 1 1 10 3868 1 1 19 PHE HA H 1.090 -2.425 -11.041 1.00 . A A . 19 PHE HA 1 1 10 3869 1 1 19 PHE HB2 H 0.103 -0.239 -10.868 1.00 . A A . 19 PHE HB2 1 1 10 3870 1 1 19 PHE HB3 H 0.400 -0.564 -12.572 1.00 . A A . 19 PHE HB3 1 1 10 3871 1 1 19 PHE HD1 H -1.897 0.726 -10.326 1.00 . A A . 19 PHE HD1 1 1 10 3872 1 1 19 PHE HD2 H -1.678 -1.752 -13.779 1.00 . A A . 19 PHE HD2 1 1 10 3873 1 1 19 PHE HE1 H -4.256 1.218 -10.824 1.00 . A A . 19 PHE HE1 1 1 10 3874 1 1 19 PHE HE2 H -4.036 -1.264 -14.284 1.00 . A A . 19 PHE HE2 1 1 10 3875 1 1 19 PHE HZ H -5.328 0.224 -12.806 1.00 . A A . 19 PHE HZ 1 1 10 3876 1 1 19 PHE N N -0.083 -3.136 -12.582 1.00 . A A . 19 PHE N 1 1 10 3877 1 1 19 PHE O O -1.403 -1.969 -9.524 1.00 . A A . 19 PHE O 1 1 10 3878 1 1 20 GLN C C -2.022 -6.182 -9.317 1.00 . A A . 20 GLN C 1 1 10 3879 1 1 20 GLN CA C -1.962 -4.663 -9.190 1.00 . A A . 20 GLN CA 1 1 10 3880 1 1 20 GLN CB C -3.368 -4.073 -9.318 1.00 . A A . 20 GLN CB 1 1 10 3881 1 1 20 GLN CD C -5.148 -3.983 -7.528 1.00 . A A . 20 GLN CD 1 1 10 3882 1 1 20 GLN CG C -3.857 -3.387 -8.053 1.00 . A A . 20 GLN CG 1 1 10 3883 1 1 20 GLN H H -0.628 -4.687 -10.833 1.00 . A A . 20 GLN H 1 1 10 3884 1 1 20 GLN HA H -1.563 -4.411 -8.220 1.00 . A A . 20 GLN HA 1 1 10 3885 1 1 20 GLN HB2 H -3.370 -3.349 -10.119 1.00 . A A . 20 GLN HB2 1 1 10 3886 1 1 20 GLN HB3 H -4.058 -4.868 -9.560 1.00 . A A . 20 GLN HB3 1 1 10 3887 1 1 20 GLN HE21 H -6.194 -2.971 -8.883 1.00 . A A . 20 GLN HE21 1 1 10 3888 1 1 20 GLN HE22 H -7.114 -3.974 -7.819 1.00 . A A . 20 GLN HE22 1 1 10 3889 1 1 20 GLN HG2 H -3.098 -3.483 -7.290 1.00 . A A . 20 GLN HG2 1 1 10 3890 1 1 20 GLN HG3 H -4.020 -2.341 -8.267 1.00 . A A . 20 GLN HG3 1 1 10 3891 1 1 20 GLN N N -1.079 -4.091 -10.200 1.00 . A A . 20 GLN N 1 1 10 3892 1 1 20 GLN NE2 N -6.266 -3.604 -8.137 1.00 . A A . 20 GLN NE2 1 1 10 3893 1 1 20 GLN O O -2.437 -6.714 -10.347 1.00 . A A . 20 GLN O 1 1 10 3894 1 1 20 GLN OE1 O -5.142 -4.774 -6.584 1.00 . A A . 20 GLN OE1 1 1 10 3895 1 1 21 PHE C C -2.495 -8.870 -7.135 1.00 . A A . 21 PHE C 1 1 10 3896 1 1 21 PHE CA C -1.609 -8.334 -8.256 1.00 . A A . 21 PHE CA 1 1 10 3897 1 1 21 PHE CB C -0.185 -8.869 -8.097 1.00 . A A . 21 PHE CB 1 1 10 3898 1 1 21 PHE CD1 C 1.210 -9.902 -9.909 1.00 . A A . 21 PHE CD1 1 1 10 3899 1 1 21 PHE CD2 C 0.836 -7.547 -9.970 1.00 . A A . 21 PHE CD2 1 1 10 3900 1 1 21 PHE CE1 C 1.966 -9.815 -11.063 1.00 . A A . 21 PHE CE1 1 1 10 3901 1 1 21 PHE CE2 C 1.590 -7.455 -11.124 1.00 . A A . 21 PHE CE2 1 1 10 3902 1 1 21 PHE CG C 0.637 -8.771 -9.350 1.00 . A A . 21 PHE CG 1 1 10 3903 1 1 21 PHE CZ C 2.157 -8.590 -11.671 1.00 . A A . 21 PHE CZ 1 1 10 3904 1 1 21 PHE H H -1.285 -6.395 -7.470 1.00 . A A . 21 PHE H 1 1 10 3905 1 1 21 PHE HA H -2.006 -8.667 -9.203 1.00 . A A . 21 PHE HA 1 1 10 3906 1 1 21 PHE HB2 H 0.319 -8.306 -7.326 1.00 . A A . 21 PHE HB2 1 1 10 3907 1 1 21 PHE HB3 H -0.229 -9.908 -7.808 1.00 . A A . 21 PHE HB3 1 1 10 3908 1 1 21 PHE HD1 H 1.061 -10.861 -9.434 1.00 . A A . 21 PHE HD1 1 1 10 3909 1 1 21 PHE HD2 H 0.394 -6.659 -9.543 1.00 . A A . 21 PHE HD2 1 1 10 3910 1 1 21 PHE HE1 H 2.407 -10.705 -11.488 1.00 . A A . 21 PHE HE1 1 1 10 3911 1 1 21 PHE HE2 H 1.739 -6.495 -11.597 1.00 . A A . 21 PHE HE2 1 1 10 3912 1 1 21 PHE HZ H 2.747 -8.520 -12.573 1.00 . A A . 21 PHE HZ 1 1 10 3913 1 1 21 PHE N N -1.604 -6.875 -8.263 1.00 . A A . 21 PHE N 1 1 10 3914 1 1 21 PHE O O -2.530 -8.314 -6.037 1.00 . A A . 21 PHE O 1 1 10 3915 1 1 22 VAL C C -3.634 -11.977 -6.086 1.00 . A A . 22 VAL C 1 1 10 3916 1 1 22 VAL CA C -4.094 -10.567 -6.437 1.00 . A A . 22 VAL CA 1 1 10 3917 1 1 22 VAL CB C -5.546 -10.625 -6.949 1.00 . A A . 22 VAL CB 1 1 10 3918 1 1 22 VAL CG1 C -6.480 -11.107 -5.850 1.00 . A A . 22 VAL CG1 1 1 10 3919 1 1 22 VAL CG2 C -5.981 -9.265 -7.472 1.00 . A A . 22 VAL CG2 1 1 10 3920 1 1 22 VAL H H -3.138 -10.352 -8.313 1.00 . A A . 22 VAL H 1 1 10 3921 1 1 22 VAL HA H -4.074 -9.959 -5.544 1.00 . A A . 22 VAL HA 1 1 10 3922 1 1 22 VAL HB H -5.591 -11.332 -7.764 1.00 . A A . 22 VAL HB 1 1 10 3923 1 1 22 VAL HG11 H -7.353 -10.471 -5.815 1.00 . A A . 22 VAL HG11 1 1 10 3924 1 1 22 VAL HG12 H -6.782 -12.124 -6.054 1.00 . A A . 22 VAL HG12 1 1 10 3925 1 1 22 VAL HG13 H -5.969 -11.067 -4.899 1.00 . A A . 22 VAL HG13 1 1 10 3926 1 1 22 VAL HG21 H -5.662 -8.496 -6.783 1.00 . A A . 22 VAL HG21 1 1 10 3927 1 1 22 VAL HG22 H -5.533 -9.090 -8.439 1.00 . A A . 22 VAL HG22 1 1 10 3928 1 1 22 VAL HG23 H -7.057 -9.242 -7.564 1.00 . A A . 22 VAL HG23 1 1 10 3929 1 1 22 VAL N N -3.209 -9.954 -7.420 1.00 . A A . 22 VAL N 1 1 10 3930 1 1 22 VAL O O -4.079 -12.559 -5.097 1.00 . A A . 22 VAL O 1 1 10 3931 1 1 23 PHE C C -1.217 -14.248 -7.767 1.00 . A A . 23 PHE C 1 1 10 3932 1 1 23 PHE CA C -2.216 -13.864 -6.679 1.00 . A A . 23 PHE CA 1 1 10 3933 1 1 23 PHE CB C -3.360 -14.879 -6.641 1.00 . A A . 23 PHE CB 1 1 10 3934 1 1 23 PHE CD1 C -5.770 -14.455 -7.200 1.00 . A A . 23 PHE CD1 1 1 10 3935 1 1 23 PHE CD2 C -4.175 -14.436 -8.972 1.00 . A A . 23 PHE CD2 1 1 10 3936 1 1 23 PHE CE1 C -6.781 -14.182 -8.102 1.00 . A A . 23 PHE CE1 1 1 10 3937 1 1 23 PHE CE2 C -5.182 -14.163 -9.879 1.00 . A A . 23 PHE CE2 1 1 10 3938 1 1 23 PHE CG C -4.457 -14.584 -7.624 1.00 . A A . 23 PHE CG 1 1 10 3939 1 1 23 PHE CZ C -6.487 -14.037 -9.443 1.00 . A A . 23 PHE CZ 1 1 10 3940 1 1 23 PHE H H -2.421 -12.007 -7.675 1.00 . A A . 23 PHE H 1 1 10 3941 1 1 23 PHE HA H -1.711 -13.868 -5.726 1.00 . A A . 23 PHE HA 1 1 10 3942 1 1 23 PHE HB2 H -2.970 -15.860 -6.865 1.00 . A A . 23 PHE HB2 1 1 10 3943 1 1 23 PHE HB3 H -3.793 -14.886 -5.651 1.00 . A A . 23 PHE HB3 1 1 10 3944 1 1 23 PHE HD1 H -6.001 -14.568 -6.150 1.00 . A A . 23 PHE HD1 1 1 10 3945 1 1 23 PHE HD2 H -3.155 -14.535 -9.315 1.00 . A A . 23 PHE HD2 1 1 10 3946 1 1 23 PHE HE1 H -7.800 -14.085 -7.757 1.00 . A A . 23 PHE HE1 1 1 10 3947 1 1 23 PHE HE2 H -4.949 -14.050 -10.927 1.00 . A A . 23 PHE HE2 1 1 10 3948 1 1 23 PHE HZ H -7.275 -13.824 -10.149 1.00 . A A . 23 PHE HZ 1 1 10 3949 1 1 23 PHE N N -2.738 -12.521 -6.903 1.00 . A A . 23 PHE N 1 1 10 3950 1 1 23 PHE O O -1.135 -15.409 -8.166 1.00 . A A . 23 PHE O 1 1 10 3951 1 1 24 DBU C C 0.217 -12.869 -10.556 1.00 . A A . 24 DBU C 1 1 10 3952 1 1 24 DBU CA C 0.468 -13.482 -9.217 1.00 . A A . 24 DBU CA 1 1 10 3953 1 1 24 DBU CB C 1.602 -14.198 -9.105 1.00 . A A . 24 DBU CB 1 1 10 3954 1 1 24 DBU CG C 2.081 -14.908 -7.878 1.00 . A A . 24 DBU CG 1 1 10 3955 1 1 24 DBU HG1 H 3.170 -14.996 -7.824 1.00 . A A . 24 DBU HG1 1 1 10 3956 1 1 24 DBU HG2 H 1.661 -15.918 -7.850 1.00 . A A . 24 DBU HG2 1 1 10 3957 1 1 24 DBU HG3 H 1.742 -14.372 -6.987 1.00 . A A . 24 DBU HG3 1 1 10 3958 1 1 24 DBU N N -0.461 -13.264 -8.242 1.00 . A A . 24 DBU N 1 1 10 3959 1 1 24 DBU O O 1.151 -12.598 -11.311 1.00 . A A . 24 DBU O 1 1 10 3960 1 1 25 CYS C C -1.640 -10.544 -12.005 1.00 . A A . 25 CYS C 1 1 10 3961 1 1 25 CYS CA C -1.434 -12.050 -12.145 1.00 . A A . 25 CYS CA 1 1 10 3962 1 1 25 CYS CB C -2.712 -12.703 -12.675 1.00 . A A . 25 CYS CB 1 1 10 3963 1 1 25 CYS H H -1.755 -12.882 -10.225 1.00 . A A . 25 CYS H 1 1 10 3964 1 1 25 CYS HA H -0.633 -12.228 -12.846 1.00 . A A . 25 CYS HA 1 1 10 3965 1 1 25 CYS HB2 H -3.557 -12.330 -12.114 1.00 . A A . 25 CYS HB2 1 1 10 3966 1 1 25 CYS HB3 H -2.835 -12.443 -13.716 1.00 . A A . 25 CYS HB3 1 1 10 3967 1 1 25 CYS N N -1.054 -12.643 -10.869 1.00 . A A . 25 CYS N 1 1 10 3968 1 1 25 CYS O O -1.460 -9.979 -10.926 1.00 . A A . 25 CYS O 1 1 10 3969 1 1 25 CYS SG S -2.725 -14.520 -12.550 1.00 . A A . 25 CYS SG 1 1 10 3970 1 1 26 CYS C C -3.741 -8.148 -13.163 1.00 . A A . 26 CYS C 1 1 10 3971 1 1 26 CYS CA C -2.248 -8.460 -13.106 1.00 . A A . 26 CYS CA 1 1 10 3972 1 1 26 CYS CB C -1.534 -7.810 -14.292 1.00 . A A . 26 CYS CB 1 1 10 3973 1 1 26 CYS H H -2.145 -10.405 -13.935 1.00 . A A . 26 CYS H 1 1 10 3974 1 1 26 CYS HA H -1.844 -8.058 -12.189 1.00 . A A . 26 CYS HA 1 1 10 3975 1 1 26 CYS HB2 H -0.470 -7.970 -14.194 1.00 . A A . 26 CYS HB2 1 1 10 3976 1 1 26 CYS HB3 H -1.879 -8.270 -15.206 1.00 . A A . 26 CYS HB3 1 1 10 3977 1 1 26 CYS N N -2.018 -9.900 -13.104 1.00 . A A . 26 CYS N 1 1 10 3978 1 1 26 CYS O O -4.196 -7.139 -12.626 1.00 . A A . 26 CYS O 1 1 10 3979 1 1 26 CYS SG S -1.811 -6.015 -14.434 1.00 . A A . 26 CYS SG 1 1 10 3980 1 1 27 SER C C -6.695 -9.954 -13.236 1.00 . A A . 27 SER C 1 1 10 3981 1 1 27 SER CA C -5.938 -8.839 -13.951 1.00 . A A . 27 SER CA 1 1 10 3982 1 1 27 SER CB C -6.336 -8.801 -15.428 1.00 . A A . 27 SER CB 1 1 10 3983 1 1 27 SER H H -4.076 -9.808 -14.227 1.00 . A A . 27 SER H 1 1 10 3984 1 1 27 SER HA H -6.195 -7.895 -13.493 1.00 . A A . 27 SER HA 1 1 10 3985 1 1 27 SER HB2 H -7.369 -9.100 -15.527 1.00 . A A . 27 SER HB2 1 1 10 3986 1 1 27 SER HB3 H -6.214 -7.797 -15.805 1.00 . A A . 27 SER HB3 1 1 10 3987 1 1 27 SER HG H -6.080 -10.371 -16.572 1.00 . A A . 27 SER HG 1 1 10 3988 1 1 27 SER N N -4.497 -9.022 -13.819 1.00 . A A . 27 SER N 1 1 10 3989 1 1 27 SER O O -6.197 -10.540 -12.277 1.00 . A A . 27 SER O 1 1 10 3990 1 1 27 SER OG O -5.531 -9.679 -16.195 1.00 . A A . 27 SER OG 1 1 11 3991 1 1 1 LYS C C 6.957 -1.118 0.661 1.00 . A A . 1 LYS C 1 1 11 3992 1 1 1 LYS CA C 7.156 -2.330 1.566 1.00 . A A . 1 LYS CA 1 1 11 3993 1 1 1 LYS CB C 6.140 -2.298 2.710 1.00 . A A . 1 LYS CB 1 1 11 3994 1 1 1 LYS CD C 4.154 -3.685 3.373 1.00 . A A . 1 LYS CD 1 1 11 3995 1 1 1 LYS CE C 4.312 -5.155 3.014 1.00 . A A . 1 LYS CE 1 1 11 3996 1 1 1 LYS CG C 4.758 -2.784 2.309 1.00 . A A . 1 LYS CG 1 1 11 3997 1 1 1 LYS H1 H 8.778 -1.707 2.776 1.00 . A A . 1 LYS H1 1 1 11 3998 1 1 1 LYS HA H 7.005 -3.227 0.986 1.00 . A A . 1 LYS HA 1 1 11 3999 1 1 1 LYS HB2 H 6.500 -2.923 3.513 1.00 . A A . 1 LYS HB2 1 1 11 4000 1 1 1 LYS HB3 H 6.051 -1.282 3.068 1.00 . A A . 1 LYS HB3 1 1 11 4001 1 1 1 LYS HD2 H 4.651 -3.501 4.313 1.00 . A A . 1 LYS HD2 1 1 11 4002 1 1 1 LYS HD3 H 3.101 -3.458 3.469 1.00 . A A . 1 LYS HD3 1 1 11 4003 1 1 1 LYS HE2 H 3.639 -5.388 2.202 1.00 . A A . 1 LYS HE2 1 1 11 4004 1 1 1 LYS HE3 H 5.330 -5.327 2.698 1.00 . A A . 1 LYS HE3 1 1 11 4005 1 1 1 LYS HG2 H 4.113 -1.930 2.167 1.00 . A A . 1 LYS HG2 1 1 11 4006 1 1 1 LYS HG3 H 4.835 -3.337 1.383 1.00 . A A . 1 LYS HG3 1 1 11 4007 1 1 1 LYS HZ1 H 3.007 -6.334 4.140 1.00 . A A . 1 LYS HZ1 1 1 11 4008 1 1 1 LYS HZ2 H 4.184 -5.543 5.062 1.00 . A A . 1 LYS HZ2 1 1 11 4009 1 1 1 LYS HZ3 H 4.604 -6.894 4.134 1.00 . A A . 1 LYS HZ3 1 1 11 4010 1 1 1 LYS N N 8.514 -2.364 2.098 1.00 . A A . 1 LYS N 1 1 11 4011 1 1 1 LYS NZ N 4.006 -6.044 4.168 1.00 . A A . 1 LYS NZ 1 1 11 4012 1 1 1 LYS O O 7.075 0.025 1.101 1.00 . A A . 1 LYS O 1 1 11 4013 1 1 2 LYS C C 5.110 -0.502 -2.308 1.00 . A A . 2 LYS C 1 1 11 4014 1 1 2 LYS CA C 6.433 -0.308 -1.574 1.00 . A A . 2 LYS CA 1 1 11 4015 1 1 2 LYS CB C 7.584 -0.260 -2.581 1.00 . A A . 2 LYS CB 1 1 11 4016 1 1 2 LYS CD C 10.083 -0.043 -2.712 1.00 . A A . 2 LYS CD 1 1 11 4017 1 1 2 LYS CE C 11.218 -0.136 -1.703 1.00 . A A . 2 LYS CE 1 1 11 4018 1 1 2 LYS CG C 8.809 0.479 -2.070 1.00 . A A . 2 LYS CG 1 1 11 4019 1 1 2 LYS H H 6.572 -2.310 -0.898 1.00 . A A . 2 LYS H 1 1 11 4020 1 1 2 LYS HA H 6.398 0.626 -1.035 1.00 . A A . 2 LYS HA 1 1 11 4021 1 1 2 LYS HB2 H 7.875 -1.271 -2.825 1.00 . A A . 2 LYS HB2 1 1 11 4022 1 1 2 LYS HB3 H 7.241 0.233 -3.479 1.00 . A A . 2 LYS HB3 1 1 11 4023 1 1 2 LYS HD2 H 9.896 -1.027 -3.116 1.00 . A A . 2 LYS HD2 1 1 11 4024 1 1 2 LYS HD3 H 10.375 0.626 -3.509 1.00 . A A . 2 LYS HD3 1 1 11 4025 1 1 2 LYS HE2 H 11.123 0.676 -0.998 1.00 . A A . 2 LYS HE2 1 1 11 4026 1 1 2 LYS HE3 H 11.141 -1.077 -1.180 1.00 . A A . 2 LYS HE3 1 1 11 4027 1 1 2 LYS HG2 H 8.707 1.529 -2.300 1.00 . A A . 2 LYS HG2 1 1 11 4028 1 1 2 LYS HG3 H 8.876 0.348 -0.999 1.00 . A A . 2 LYS HG3 1 1 11 4029 1 1 2 LYS HZ1 H 13.038 -0.971 -2.297 1.00 . A A . 2 LYS HZ1 1 1 11 4030 1 1 2 LYS HZ2 H 13.137 0.668 -1.891 1.00 . A A . 2 LYS HZ2 1 1 11 4031 1 1 2 LYS HZ3 H 12.442 0.201 -3.362 1.00 . A A . 2 LYS HZ3 1 1 11 4032 1 1 2 LYS N N 6.652 -1.377 -0.606 1.00 . A A . 2 LYS N 1 1 11 4033 1 1 2 LYS NZ N 12.552 -0.053 -2.360 1.00 . A A . 2 LYS NZ 1 1 11 4034 1 1 2 LYS O O 4.830 -1.581 -2.831 1.00 . A A . 2 LYS O 1 1 11 4035 1 1 3 LYS C C 3.160 0.018 -4.456 1.00 . A A . 3 LYS C 1 1 11 4036 1 1 3 LYS CA C 3.006 0.498 -3.016 1.00 . A A . 3 LYS CA 1 1 11 4037 1 1 3 LYS CB C 2.341 1.876 -2.995 1.00 . A A . 3 LYS CB 1 1 11 4038 1 1 3 LYS CD C 0.277 2.790 -1.895 1.00 . A A . 3 LYS CD 1 1 11 4039 1 1 3 LYS CE C -0.684 1.757 -2.463 1.00 . A A . 3 LYS CE 1 1 11 4040 1 1 3 LYS CG C 1.661 2.203 -1.677 1.00 . A A . 3 LYS CG 1 1 11 4041 1 1 3 LYS H H 4.578 1.383 -1.909 1.00 . A A . 3 LYS H 1 1 11 4042 1 1 3 LYS HA H 2.382 -0.202 -2.481 1.00 . A A . 3 LYS HA 1 1 11 4043 1 1 3 LYS HB2 H 3.093 2.628 -3.185 1.00 . A A . 3 LYS HB2 1 1 11 4044 1 1 3 LYS HB3 H 1.598 1.915 -3.779 1.00 . A A . 3 LYS HB3 1 1 11 4045 1 1 3 LYS HD2 H -0.109 3.141 -0.949 1.00 . A A . 3 LYS HD2 1 1 11 4046 1 1 3 LYS HD3 H 0.351 3.618 -2.585 1.00 . A A . 3 LYS HD3 1 1 11 4047 1 1 3 LYS HE2 H -0.121 0.883 -2.755 1.00 . A A . 3 LYS HE2 1 1 11 4048 1 1 3 LYS HE3 H -1.396 1.486 -1.697 1.00 . A A . 3 LYS HE3 1 1 11 4049 1 1 3 LYS HG2 H 1.569 1.298 -1.095 1.00 . A A . 3 LYS HG2 1 1 11 4050 1 1 3 LYS HG3 H 2.266 2.919 -1.139 1.00 . A A . 3 LYS HG3 1 1 11 4051 1 1 3 LYS HZ1 H -1.372 3.316 -3.670 1.00 . A A . 3 LYS HZ1 1 1 11 4052 1 1 3 LYS HZ2 H -2.420 1.990 -3.601 1.00 . A A . 3 LYS HZ2 1 1 11 4053 1 1 3 LYS HZ3 H -1.003 1.901 -4.522 1.00 . A A . 3 LYS HZ3 1 1 11 4054 1 1 3 LYS N N 4.299 0.550 -2.344 1.00 . A A . 3 LYS N 1 1 11 4055 1 1 3 LYS NZ N -1.421 2.277 -3.647 1.00 . A A . 3 LYS NZ 1 1 11 4056 1 1 3 LYS O O 3.997 0.524 -5.203 1.00 . A A . 3 LYS O 1 1 11 4057 1 1 4 SER C C 3.757 -2.135 -6.473 1.00 . A A . 4 SER C 1 1 11 4058 1 1 4 SER CA C 2.394 -1.511 -6.189 1.00 . A A . 4 SER CA 1 1 11 4059 1 1 4 SER CB C 2.097 -0.418 -7.218 1.00 . A A . 4 SER CB 1 1 11 4060 1 1 4 SER H H 1.700 -1.324 -4.197 1.00 . A A . 4 SER H 1 1 11 4061 1 1 4 SER HA H 1.638 -2.277 -6.262 1.00 . A A . 4 SER HA 1 1 11 4062 1 1 4 SER HB2 H 2.941 0.251 -7.282 1.00 . A A . 4 SER HB2 1 1 11 4063 1 1 4 SER HB3 H 1.924 -0.874 -8.182 1.00 . A A . 4 SER HB3 1 1 11 4064 1 1 4 SER HG H 0.311 0.306 -7.570 1.00 . A A . 4 SER HG 1 1 11 4065 1 1 4 SER N N 2.346 -0.961 -4.839 1.00 . A A . 4 SER N 1 1 11 4066 1 1 4 SER O O 4.709 -1.946 -5.717 1.00 . A A . 4 SER O 1 1 11 4067 1 1 4 SER OG O 0.949 0.328 -6.853 1.00 . A A . 4 SER OG 1 1 11 4068 1 1 5 GLY C C 4.877 -4.831 -8.673 1.00 . A A . 5 GLY C 1 1 11 4069 1 1 5 GLY CA C 5.091 -3.524 -7.936 1.00 . A A . 5 GLY CA 1 1 11 4070 1 1 5 GLY H H 3.049 -2.998 -8.135 1.00 . A A . 5 GLY H 1 1 11 4071 1 1 5 GLY HA2 H 5.655 -2.855 -8.567 1.00 . A A . 5 GLY HA2 1 1 11 4072 1 1 5 GLY HA3 H 5.658 -3.720 -7.037 1.00 . A A . 5 GLY HA3 1 1 11 4073 1 1 5 GLY N N 3.842 -2.882 -7.570 1.00 . A A . 5 GLY N 1 1 11 4074 1 1 5 GLY O O 5.393 -5.873 -8.268 1.00 . A A . 5 GLY O 1 1 11 4075 1 1 6 VAL C C 4.276 -5.780 -11.999 1.00 . A A . 6 VAL C 1 1 11 4076 1 1 6 VAL CA C 3.829 -5.967 -10.554 1.00 . A A . 6 VAL CA 1 1 11 4077 1 1 6 VAL CB C 2.328 -6.313 -10.533 1.00 . A A . 6 VAL CB 1 1 11 4078 1 1 6 VAL CG1 C 2.128 -7.817 -10.424 1.00 . A A . 6 VAL CG1 1 1 11 4079 1 1 6 VAL CG2 C 1.631 -5.591 -9.390 1.00 . A A . 6 VAL CG2 1 1 11 4080 1 1 6 VAL H H 3.727 -3.919 -10.031 1.00 . A A . 6 VAL H 1 1 11 4081 1 1 6 VAL HA H 4.374 -6.794 -10.122 1.00 . A A . 6 VAL HA 1 1 11 4082 1 1 6 VAL HB H 1.890 -5.980 -11.462 1.00 . A A . 6 VAL HB 1 1 11 4083 1 1 6 VAL HG11 H 3.034 -8.275 -10.053 1.00 . A A . 6 VAL HG11 1 1 11 4084 1 1 6 VAL HG12 H 1.314 -8.025 -9.746 1.00 . A A . 6 VAL HG12 1 1 11 4085 1 1 6 VAL HG13 H 1.896 -8.220 -11.399 1.00 . A A . 6 VAL HG13 1 1 11 4086 1 1 6 VAL HG21 H 2.220 -5.690 -8.490 1.00 . A A . 6 VAL HG21 1 1 11 4087 1 1 6 VAL HG22 H 1.524 -4.544 -9.636 1.00 . A A . 6 VAL HG22 1 1 11 4088 1 1 6 VAL HG23 H 0.655 -6.024 -9.231 1.00 . A A . 6 VAL HG23 1 1 11 4089 1 1 6 VAL N N 4.111 -4.778 -9.758 1.00 . A A . 6 VAL N 1 1 11 4090 1 1 6 VAL O O 4.953 -4.806 -12.329 1.00 . A A . 6 VAL O 1 1 11 4091 1 1 7 ILE C C 3.106 -7.139 -15.150 1.00 . A A . 7 ILE C 1 1 11 4092 1 1 7 ILE CA C 4.253 -6.657 -14.268 1.00 . A A . 7 ILE CA 1 1 11 4093 1 1 7 ILE CB C 5.506 -7.502 -14.567 1.00 . A A . 7 ILE CB 1 1 11 4094 1 1 7 ILE CD1 C 6.731 -7.781 -12.354 1.00 . A A . 7 ILE CD1 1 1 11 4095 1 1 7 ILE CG1 C 6.671 -7.057 -13.681 1.00 . A A . 7 ILE CG1 1 1 11 4096 1 1 7 ILE CG2 C 5.880 -7.392 -16.038 1.00 . A A . 7 ILE CG2 1 1 11 4097 1 1 7 ILE H H 3.354 -7.471 -12.534 1.00 . A A . 7 ILE H 1 1 11 4098 1 1 7 ILE HA H 4.471 -5.627 -14.511 1.00 . A A . 7 ILE HA 1 1 11 4099 1 1 7 ILE HB H 5.275 -8.535 -14.356 1.00 . A A . 7 ILE HB 1 1 11 4100 1 1 7 ILE HD11 H 6.032 -8.604 -12.360 1.00 . A A . 7 ILE HD11 1 1 11 4101 1 1 7 ILE HD12 H 7.730 -8.157 -12.193 1.00 . A A . 7 ILE HD12 1 1 11 4102 1 1 7 ILE HD13 H 6.472 -7.096 -11.559 1.00 . A A . 7 ILE HD13 1 1 11 4103 1 1 7 ILE HG12 H 7.599 -7.239 -14.199 1.00 . A A . 7 ILE HG12 1 1 11 4104 1 1 7 ILE HG13 H 6.576 -6.000 -13.479 1.00 . A A . 7 ILE HG13 1 1 11 4105 1 1 7 ILE HG21 H 5.023 -7.642 -16.647 1.00 . A A . 7 ILE HG21 1 1 11 4106 1 1 7 ILE HG22 H 6.192 -6.381 -16.255 1.00 . A A . 7 ILE HG22 1 1 11 4107 1 1 7 ILE HG23 H 6.688 -8.074 -16.256 1.00 . A A . 7 ILE HG23 1 1 11 4108 1 1 7 ILE N N 3.893 -6.719 -12.857 1.00 . A A . 7 ILE N 1 1 11 4109 1 1 7 ILE O O 2.499 -8.182 -14.907 1.00 . A A . 7 ILE O 1 1 11 4110 1 1 8 PRO C C 2.065 -7.902 -18.008 1.00 . A A . 8 PRO C 1 1 11 4111 1 1 8 PRO CA C 1.728 -6.692 -17.143 1.00 . A A . 8 PRO CA 1 1 11 4112 1 1 8 PRO CB C 1.614 -5.433 -18.006 1.00 . A A . 8 PRO CB 1 1 11 4113 1 1 8 PRO CD C 3.484 -5.106 -16.552 1.00 . A A . 8 PRO CD 1 1 11 4114 1 1 8 PRO CG C 2.960 -4.798 -17.927 1.00 . A A . 8 PRO CG 1 1 11 4115 1 1 8 PRO HA H 0.792 -6.866 -16.632 1.00 . A A . 8 PRO HA 1 1 11 4116 1 1 8 PRO HB2 H 1.366 -5.710 -19.021 1.00 . A A . 8 PRO HB2 1 1 11 4117 1 1 8 PRO HB3 H 0.849 -4.785 -17.605 1.00 . A A . 8 PRO HB3 1 1 11 4118 1 1 8 PRO HD2 H 4.555 -5.243 -16.579 1.00 . A A . 8 PRO HD2 1 1 11 4119 1 1 8 PRO HD3 H 3.219 -4.319 -15.862 1.00 . A A . 8 PRO HD3 1 1 11 4120 1 1 8 PRO HG2 H 3.609 -5.219 -18.680 1.00 . A A . 8 PRO HG2 1 1 11 4121 1 1 8 PRO HG3 H 2.870 -3.730 -18.063 1.00 . A A . 8 PRO HG3 1 1 11 4122 1 1 8 PRO N N 2.802 -6.364 -16.202 1.00 . A A . 8 PRO N 1 1 11 4123 1 1 8 PRO O O 2.898 -7.818 -18.909 1.00 . A A . 8 PRO O 1 1 11 4124 1 1 9 . C C 2.181 -11.323 -17.565 1.00 . A A . 9 DBB C 1 1 11 4125 1 1 9 . CA C 1.644 -10.261 -18.488 1.00 . A A . 9 DBB CA 1 1 11 4126 1 1 9 . CB C 0.327 -10.736 -19.102 1.00 . A A . 9 DBB CB 1 1 11 4127 1 1 9 . CG C 0.363 -12.256 -19.276 1.00 . A A . 9 DBB CG 1 1 11 4128 1 1 9 . H H 0.759 -9.028 -16.997 1.00 . A A . 9 DBB H 1 1 11 4129 1 1 9 . HA H 2.367 -10.068 -19.280 1.00 . A A . 9 DBB HA 1 1 11 4130 1 1 9 . HB2 H 0.187 -10.263 -20.073 1.00 . A A . 9 DBB HB2 1 1 11 4131 1 1 9 . HG1 H -0.349 -12.551 -20.047 1.00 . A A . 9 DBB HG1 1 1 11 4132 1 1 9 . HG2 H 1.365 -12.565 -19.569 1.00 . A A . 9 DBB HG2 1 1 11 4133 1 1 9 . HG3 H 0.096 -12.735 -18.333 1.00 . A A . 9 DBB HG3 1 1 11 4134 1 1 9 . N N 1.412 -9.025 -17.728 1.00 . A A . 9 DBB N 1 1 11 4135 1 1 9 . O O 3.016 -12.138 -17.960 1.00 . A A . 9 DBB O 1 1 11 4136 1 1 10 VAL C C 1.003 -13.234 -14.947 1.00 . A A . 10 VAL C 1 1 11 4137 1 1 10 VAL CA C 2.141 -12.297 -15.335 1.00 . A A . 10 VAL CA 1 1 11 4138 1 1 10 VAL CB C 2.678 -11.608 -14.066 1.00 . A A . 10 VAL CB 1 1 11 4139 1 1 10 VAL CG1 C 3.824 -10.670 -14.413 1.00 . A A . 10 VAL CG1 1 1 11 4140 1 1 10 VAL CG2 C 1.562 -10.859 -13.354 1.00 . A A . 10 VAL CG2 1 1 11 4141 1 1 10 VAL H H 1.040 -10.646 -16.070 1.00 . A A . 10 VAL H 1 1 11 4142 1 1 10 VAL HA H 2.941 -12.878 -15.770 1.00 . A A . 10 VAL HA 1 1 11 4143 1 1 10 VAL HB H 3.054 -12.370 -13.399 1.00 . A A . 10 VAL HB 1 1 11 4144 1 1 10 VAL HG11 H 3.617 -10.181 -15.353 1.00 . A A . 10 VAL HG11 1 1 11 4145 1 1 10 VAL HG12 H 3.930 -9.928 -13.635 1.00 . A A . 10 VAL HG12 1 1 11 4146 1 1 10 VAL HG13 H 4.740 -11.237 -14.497 1.00 . A A . 10 VAL HG13 1 1 11 4147 1 1 10 VAL HG21 H 1.980 -10.029 -12.804 1.00 . A A . 10 VAL HG21 1 1 11 4148 1 1 10 VAL HG22 H 0.855 -10.488 -14.082 1.00 . A A . 10 VAL HG22 1 1 11 4149 1 1 10 VAL HG23 H 1.058 -11.527 -12.672 1.00 . A A . 10 VAL HG23 1 1 11 4150 1 1 10 VAL N N 1.703 -11.320 -16.325 1.00 . A A . 10 VAL N 1 1 11 4151 1 1 10 VAL O O 1.234 -14.372 -14.540 1.00 . A A . 10 VAL O 1 1 11 4152 1 1 11 DAL C C -1.428 -14.803 -15.578 1.00 . A A . 11 DAL C 1 1 11 4153 1 1 11 DAL CA C -1.412 -13.550 -14.740 1.00 . A A . 11 DAL CA 1 1 11 4154 1 1 11 DAL CB C -1.364 -13.927 -13.257 1.00 . A A . 11 DAL CB 1 1 11 4155 1 1 11 DAL H H -0.347 -11.834 -15.409 1.00 . A A . 11 DAL H 1 1 11 4156 1 1 11 DAL HA H -2.313 -12.968 -14.938 1.00 . A A . 11 DAL HA 1 1 11 4157 1 1 11 DAL HB1 H -2.113 -14.692 -13.053 1.00 . A A . 11 DAL HB1 1 1 11 4158 1 1 11 DAL HB2 H -0.375 -14.314 -13.014 1.00 . A A . 11 DAL HB2 1 1 11 4159 1 1 11 DAL N N -0.227 -12.748 -15.079 1.00 . A A . 11 DAL N 1 1 11 4160 1 1 11 DAL O O -0.477 -15.085 -16.308 1.00 . A A . 11 DAL O 1 1 11 4161 1 1 12 HIS C C -3.499 -16.580 -17.485 1.00 . A A . 12 HIS C 1 1 11 4162 1 1 12 HIS CA C -2.653 -16.801 -16.234 1.00 . A A . 12 HIS CA 1 1 11 4163 1 1 12 HIS CB C -3.282 -17.889 -15.364 1.00 . A A . 12 HIS CB 1 1 11 4164 1 1 12 HIS CD2 C -3.238 -19.950 -16.939 1.00 . A A . 12 HIS CD2 1 1 11 4165 1 1 12 HIS CE1 C -2.060 -21.296 -15.671 1.00 . A A . 12 HIS CE1 1 1 11 4166 1 1 12 HIS CG C -2.939 -19.280 -15.801 1.00 . A A . 12 HIS CG 1 1 11 4167 1 1 12 HIS H H -3.237 -15.285 -14.878 1.00 . A A . 12 HIS H 1 1 11 4168 1 1 12 HIS HA H -1.666 -17.119 -16.535 1.00 . A A . 12 HIS HA 1 1 11 4169 1 1 12 HIS HB2 H -2.942 -17.768 -14.346 1.00 . A A . 12 HIS HB2 1 1 11 4170 1 1 12 HIS HB3 H -4.358 -17.787 -15.393 1.00 . A A . 12 HIS HB3 1 1 11 4171 1 1 12 HIS HD1 H -1.834 -19.958 -14.140 1.00 . A A . 12 HIS HD1 1 1 11 4172 1 1 12 HIS HD2 H -3.809 -19.571 -17.775 1.00 . A A . 12 HIS HD2 1 1 11 4173 1 1 12 HIS HE1 H -1.528 -22.163 -15.310 1.00 . A A . 12 HIS HE1 1 1 11 4174 1 1 12 HIS N N -2.513 -15.563 -15.476 1.00 . A A . 12 HIS N 1 1 11 4175 1 1 12 HIS ND1 N -2.201 -20.151 -15.028 1.00 . A A . 12 HIS ND1 1 1 11 4176 1 1 12 HIS NE2 N -2.680 -21.200 -16.833 1.00 . A A . 12 HIS NE2 1 1 11 4177 1 1 12 HIS O O -3.401 -17.334 -18.453 1.00 . A A . 12 HIS O 1 1 11 4178 1 1 13 ASP C C -4.912 -13.815 -19.102 1.00 . A A . 13 ASP C 1 1 11 4179 1 1 13 ASP CA C -5.192 -15.223 -18.586 1.00 . A A . 13 ASP CA 1 1 11 4180 1 1 13 ASP CB C -6.662 -15.350 -18.185 1.00 . A A . 13 ASP CB 1 1 11 4181 1 1 13 ASP CG C -7.189 -16.762 -18.354 1.00 . A A . 13 ASP CG 1 1 11 4182 1 1 13 ASP H H -4.361 -14.980 -16.654 1.00 . A A . 13 ASP H 1 1 11 4183 1 1 13 ASP HA H -4.981 -15.930 -19.375 1.00 . A A . 13 ASP HA 1 1 11 4184 1 1 13 ASP HB2 H -6.772 -15.067 -17.148 1.00 . A A . 13 ASP HB2 1 1 11 4185 1 1 13 ASP HB3 H -7.255 -14.688 -18.799 1.00 . A A . 13 ASP HB3 1 1 11 4186 1 1 13 ASP N N -4.329 -15.544 -17.456 1.00 . A A . 13 ASP N 1 1 11 4187 1 1 13 ASP O O -5.512 -13.370 -20.081 1.00 . A A . 13 ASP O 1 1 11 4188 1 1 13 ASP OD1 O -8.015 -16.982 -19.265 1.00 . A A . 13 ASP OD1 1 1 11 4189 1 1 13 ASP OD2 O -6.774 -17.646 -17.576 1.00 . A A . 13 ASP OD2 1 1 11 4190 1 1 14 CYS C C -3.295 -11.691 -20.309 1.00 . A A . 14 CYS C 1 1 11 4191 1 1 14 CYS CA C -3.639 -11.759 -18.824 1.00 . A A . 14 CYS CA 1 1 11 4192 1 1 14 CYS CB C -2.455 -11.264 -17.991 1.00 . A A . 14 CYS CB 1 1 11 4193 1 1 14 CYS H H -3.554 -13.526 -17.662 1.00 . A A . 14 CYS H 1 1 11 4194 1 1 14 CYS HA H -4.491 -11.123 -18.635 1.00 . A A . 14 CYS HA 1 1 11 4195 1 1 14 CYS HB2 H -2.817 -10.922 -17.032 1.00 . A A . 14 CYS HB2 1 1 11 4196 1 1 14 CYS HB3 H -1.765 -12.081 -17.839 1.00 . A A . 14 CYS HB3 1 1 11 4197 1 1 14 CYS N N -3.998 -13.117 -18.435 1.00 . A A . 14 CYS N 1 1 11 4198 1 1 14 CYS O O -2.515 -12.499 -20.814 1.00 . A A . 14 CYS O 1 1 11 4199 1 1 14 CYS SG S -1.532 -9.891 -18.754 1.00 . A A . 14 CYS SG 1 1 11 4200 1 1 15 HIS C C -3.521 -9.066 -22.785 1.00 . A A . 15 HIS C 1 1 11 4201 1 1 15 HIS CA C -3.637 -10.546 -22.430 1.00 . A A . 15 HIS CA 1 1 11 4202 1 1 15 HIS CB C -4.758 -11.191 -23.245 1.00 . A A . 15 HIS CB 1 1 11 4203 1 1 15 HIS CD2 C -5.009 -10.891 -25.809 1.00 . A A . 15 HIS CD2 1 1 11 4204 1 1 15 HIS CE1 C -3.305 -12.116 -26.443 1.00 . A A . 15 HIS CE1 1 1 11 4205 1 1 15 HIS CG C -4.418 -11.376 -24.692 1.00 . A A . 15 HIS CG 1 1 11 4206 1 1 15 HIS H H -4.493 -10.108 -20.544 1.00 . A A . 15 HIS H 1 1 11 4207 1 1 15 HIS HA H -2.704 -11.034 -22.669 1.00 . A A . 15 HIS HA 1 1 11 4208 1 1 15 HIS HB2 H -4.981 -12.164 -22.830 1.00 . A A . 15 HIS HB2 1 1 11 4209 1 1 15 HIS HB3 H -5.640 -10.570 -23.187 1.00 . A A . 15 HIS HB3 1 1 11 4210 1 1 15 HIS HD1 H -2.729 -12.627 -24.548 1.00 . A A . 15 HIS HD1 1 1 11 4211 1 1 15 HIS HD2 H -5.878 -10.249 -25.848 1.00 . A A . 15 HIS HD2 1 1 11 4212 1 1 15 HIS HE1 H -2.577 -12.624 -27.058 1.00 . A A . 15 HIS HE1 1 1 11 4213 1 1 15 HIS N N -3.882 -10.721 -21.003 1.00 . A A . 15 HIS N 1 1 11 4214 1 1 15 HIS ND1 N -3.355 -12.140 -25.123 1.00 . A A . 15 HIS ND1 1 1 11 4215 1 1 15 HIS NE2 N -4.298 -11.365 -26.884 1.00 . A A . 15 HIS NE2 1 1 11 4216 1 1 15 HIS O O -4.381 -8.514 -23.471 1.00 . A A . 15 HIS O 1 1 11 4217 1 1 16 MET C C -3.370 -6.168 -22.029 1.00 . A A . 16 MET C 1 1 11 4218 1 1 16 MET CA C -2.227 -7.015 -22.579 1.00 . A A . 16 MET CA 1 1 11 4219 1 1 16 MET CB C -2.077 -6.776 -24.083 1.00 . A A . 16 MET CB 1 1 11 4220 1 1 16 MET CE C 0.754 -5.783 -25.442 1.00 . A A . 16 MET CE 1 1 11 4221 1 1 16 MET CG C -1.098 -7.726 -24.754 1.00 . A A . 16 MET CG 1 1 11 4222 1 1 16 MET H H -1.804 -8.925 -21.770 1.00 . A A . 16 MET H 1 1 11 4223 1 1 16 MET HA H -1.312 -6.728 -22.085 1.00 . A A . 16 MET HA 1 1 11 4224 1 1 16 MET HB2 H -3.042 -6.897 -24.552 1.00 . A A . 16 MET HB2 1 1 11 4225 1 1 16 MET HB3 H -1.732 -5.766 -24.242 1.00 . A A . 16 MET HB3 1 1 11 4226 1 1 16 MET HE1 H 1.522 -5.487 -26.142 1.00 . A A . 16 MET HE1 1 1 11 4227 1 1 16 MET HE2 H 0.170 -4.919 -25.162 1.00 . A A . 16 MET HE2 1 1 11 4228 1 1 16 MET HE3 H 1.213 -6.209 -24.562 1.00 . A A . 16 MET HE3 1 1 11 4229 1 1 16 MET HG2 H -0.330 -7.992 -24.044 1.00 . A A . 16 MET HG2 1 1 11 4230 1 1 16 MET HG3 H -1.631 -8.616 -25.055 1.00 . A A . 16 MET HG3 1 1 11 4231 1 1 16 MET N N -2.454 -8.431 -22.311 1.00 . A A . 16 MET N 1 1 11 4232 1 1 16 MET O O -4.409 -6.019 -22.671 1.00 . A A . 16 MET O 1 1 11 4233 1 1 16 MET SD S -0.313 -7.001 -26.207 1.00 . A A . 16 MET SD 1 1 11 4234 1 1 17 ASN C C -3.564 -3.886 -19.135 1.00 . A A . 17 ASN C 1 1 11 4235 1 1 17 ASN CA C -4.186 -4.783 -20.201 1.00 . A A . 17 ASN CA 1 1 11 4236 1 1 17 ASN CB C -5.274 -5.659 -19.576 1.00 . A A . 17 ASN CB 1 1 11 4237 1 1 17 ASN CG C -6.264 -6.172 -20.604 1.00 . A A . 17 ASN CG 1 1 11 4238 1 1 17 ASN H H -2.322 -5.770 -20.374 1.00 . A A . 17 ASN H 1 1 11 4239 1 1 17 ASN HA H -4.630 -4.162 -20.964 1.00 . A A . 17 ASN HA 1 1 11 4240 1 1 17 ASN HB2 H -4.812 -6.508 -19.094 1.00 . A A . 17 ASN HB2 1 1 11 4241 1 1 17 ASN HB3 H -5.814 -5.082 -18.840 1.00 . A A . 17 ASN HB3 1 1 11 4242 1 1 17 ASN HD21 H -7.363 -4.526 -20.405 1.00 . A A . 17 ASN HD21 1 1 11 4243 1 1 17 ASN HD22 H -7.953 -5.691 -21.536 1.00 . A A . 17 ASN HD22 1 1 11 4244 1 1 17 ASN N N -3.171 -5.615 -20.837 1.00 . A A . 17 ASN N 1 1 11 4245 1 1 17 ASN ND2 N -7.297 -5.384 -20.876 1.00 . A A . 17 ASN ND2 1 1 11 4246 1 1 17 ASN O O -3.369 -2.692 -19.352 1.00 . A A . 17 ASN O 1 1 11 4247 1 1 17 ASN OD1 O -6.101 -7.265 -21.147 1.00 . A A . 17 ASN OD1 1 1 11 4248 1 1 18 DAL C C -3.625 -2.681 -16.382 1.00 . A A . 18 DAL C 1 1 11 4249 1 1 18 DAL CA C -2.651 -3.721 -16.874 1.00 . A A . 18 DAL CA 1 1 11 4250 1 1 18 DAL CB C -2.311 -4.683 -15.733 1.00 . A A . 18 DAL CB 1 1 11 4251 1 1 18 DAL H H -3.436 -5.429 -17.870 1.00 . A A . 18 DAL H 1 1 11 4252 1 1 18 DAL HA H -1.741 -3.232 -17.221 1.00 . A A . 18 DAL HA 1 1 11 4253 1 1 18 DAL HB1 H -1.462 -4.296 -15.171 1.00 . A A . 18 DAL HB1 1 1 11 4254 1 1 18 DAL HB2 H -3.172 -4.778 -15.071 1.00 . A A . 18 DAL HB2 1 1 11 4255 1 1 18 DAL N N -3.256 -4.473 -17.983 1.00 . A A . 18 DAL N 1 1 11 4256 1 1 18 DAL O O -3.384 -1.481 -16.510 1.00 . A A . 18 DAL O 1 1 11 4257 1 1 19 PHE C C -5.783 -2.261 -13.771 1.00 . A A . 19 PHE C 1 1 11 4258 1 1 19 PHE CA C -5.758 -2.238 -15.296 1.00 . A A . 19 PHE CA 1 1 11 4259 1 1 19 PHE CB C -7.133 -2.623 -15.846 1.00 . A A . 19 PHE CB 1 1 11 4260 1 1 19 PHE CD1 C -6.522 -2.593 -18.280 1.00 . A A . 19 PHE CD1 1 1 11 4261 1 1 19 PHE CD2 C -8.413 -1.326 -17.571 1.00 . A A . 19 PHE CD2 1 1 11 4262 1 1 19 PHE CE1 C -6.729 -2.181 -19.583 1.00 . A A . 19 PHE CE1 1 1 11 4263 1 1 19 PHE CE2 C -8.625 -0.911 -18.872 1.00 . A A . 19 PHE CE2 1 1 11 4264 1 1 19 PHE CG C -7.361 -2.172 -17.261 1.00 . A A . 19 PHE CG 1 1 11 4265 1 1 19 PHE CZ C -7.782 -1.337 -19.879 1.00 . A A . 19 PHE CZ 1 1 11 4266 1 1 19 PHE H H -4.870 -4.108 -15.740 1.00 . A A . 19 PHE H 1 1 11 4267 1 1 19 PHE HA H -5.515 -1.239 -15.626 1.00 . A A . 19 PHE HA 1 1 11 4268 1 1 19 PHE HB2 H -7.235 -3.697 -15.821 1.00 . A A . 19 PHE HB2 1 1 11 4269 1 1 19 PHE HB3 H -7.897 -2.178 -15.228 1.00 . A A . 19 PHE HB3 1 1 11 4270 1 1 19 PHE HD1 H -5.697 -3.253 -18.049 1.00 . A A . 19 PHE HD1 1 1 11 4271 1 1 19 PHE HD2 H -9.073 -0.991 -16.785 1.00 . A A . 19 PHE HD2 1 1 11 4272 1 1 19 PHE HE1 H -6.067 -2.516 -20.367 1.00 . A A . 19 PHE HE1 1 1 11 4273 1 1 19 PHE HE2 H -9.449 -0.251 -19.101 1.00 . A A . 19 PHE HE2 1 1 11 4274 1 1 19 PHE HZ H -7.945 -1.014 -20.896 1.00 . A A . 19 PHE HZ 1 1 11 4275 1 1 19 PHE N N -4.735 -3.140 -15.813 1.00 . A A . 19 PHE N 1 1 11 4276 1 1 19 PHE O O -6.035 -1.241 -13.129 1.00 . A A . 19 PHE O 1 1 11 4277 1 1 20 GLN C C -5.180 -5.023 -11.358 1.00 . A A . 20 GLN C 1 1 11 4278 1 1 20 GLN CA C -5.515 -3.588 -11.749 1.00 . A A . 20 GLN CA 1 1 11 4279 1 1 20 GLN CB C -6.873 -3.192 -11.166 1.00 . A A . 20 GLN CB 1 1 11 4280 1 1 20 GLN CD C -7.268 -2.063 -8.941 1.00 . A A . 20 GLN CD 1 1 11 4281 1 1 20 GLN CG C -6.843 -1.888 -10.386 1.00 . A A . 20 GLN CG 1 1 11 4282 1 1 20 GLN H H -5.328 -4.207 -13.764 1.00 . A A . 20 GLN H 1 1 11 4283 1 1 20 GLN HA H -4.757 -2.932 -11.348 1.00 . A A . 20 GLN HA 1 1 11 4284 1 1 20 GLN HB2 H -7.581 -3.087 -11.974 1.00 . A A . 20 GLN HB2 1 1 11 4285 1 1 20 GLN HB3 H -7.209 -3.975 -10.503 1.00 . A A . 20 GLN HB3 1 1 11 4286 1 1 20 GLN HE21 H -5.497 -1.408 -8.316 1.00 . A A . 20 GLN HE21 1 1 11 4287 1 1 20 GLN HE22 H -6.618 -1.841 -7.075 1.00 . A A . 20 GLN HE22 1 1 11 4288 1 1 20 GLN HG2 H -5.838 -1.495 -10.404 1.00 . A A . 20 GLN HG2 1 1 11 4289 1 1 20 GLN HG3 H -7.512 -1.184 -10.860 1.00 . A A . 20 GLN HG3 1 1 11 4290 1 1 20 GLN N N -5.521 -3.431 -13.198 1.00 . A A . 20 GLN N 1 1 11 4291 1 1 20 GLN NE2 N -6.371 -1.739 -8.017 1.00 . A A . 20 GLN NE2 1 1 11 4292 1 1 20 GLN O O -5.729 -5.974 -11.915 1.00 . A A . 20 GLN O 1 1 11 4293 1 1 20 GLN OE1 O -8.389 -2.485 -8.658 1.00 . A A . 20 GLN OE1 1 1 11 4294 1 1 21 PHE C C -4.581 -6.860 -8.635 1.00 . A A . 21 PHE C 1 1 11 4295 1 1 21 PHE CA C -3.865 -6.493 -9.931 1.00 . A A . 21 PHE CA 1 1 11 4296 1 1 21 PHE CB C -2.350 -6.535 -9.719 1.00 . A A . 21 PHE CB 1 1 11 4297 1 1 21 PHE CD1 C -1.033 -6.827 -11.835 1.00 . A A . 21 PHE CD1 1 1 11 4298 1 1 21 PHE CD2 C -1.365 -4.617 -11.004 1.00 . A A . 21 PHE CD2 1 1 11 4299 1 1 21 PHE CE1 C -0.313 -6.321 -12.901 1.00 . A A . 21 PHE CE1 1 1 11 4300 1 1 21 PHE CE2 C -0.646 -4.106 -12.067 1.00 . A A . 21 PHE CE2 1 1 11 4301 1 1 21 PHE CG C -1.567 -5.982 -10.876 1.00 . A A . 21 PHE CG 1 1 11 4302 1 1 21 PHE CZ C -0.118 -4.959 -13.017 1.00 . A A . 21 PHE CZ 1 1 11 4303 1 1 21 PHE H H -3.872 -4.376 -9.990 1.00 . A A . 21 PHE H 1 1 11 4304 1 1 21 PHE HA H -4.133 -7.209 -10.692 1.00 . A A . 21 PHE HA 1 1 11 4305 1 1 21 PHE HB2 H -2.100 -5.955 -8.843 1.00 . A A . 21 PHE HB2 1 1 11 4306 1 1 21 PHE HB3 H -2.043 -7.558 -9.568 1.00 . A A . 21 PHE HB3 1 1 11 4307 1 1 21 PHE HD1 H -1.185 -7.893 -11.746 1.00 . A A . 21 PHE HD1 1 1 11 4308 1 1 21 PHE HD2 H -1.776 -3.948 -10.261 1.00 . A A . 21 PHE HD2 1 1 11 4309 1 1 21 PHE HE1 H 0.098 -6.992 -13.642 1.00 . A A . 21 PHE HE1 1 1 11 4310 1 1 21 PHE HE2 H -0.495 -3.040 -12.155 1.00 . A A . 21 PHE HE2 1 1 11 4311 1 1 21 PHE HZ H 0.443 -4.562 -13.849 1.00 . A A . 21 PHE HZ 1 1 11 4312 1 1 21 PHE N N -4.275 -5.173 -10.396 1.00 . A A . 21 PHE N 1 1 11 4313 1 1 21 PHE O O -4.359 -6.241 -7.593 1.00 . A A . 21 PHE O 1 1 11 4314 1 1 22 VAL C C -5.343 -9.231 -6.660 1.00 . A A . 22 VAL C 1 1 11 4315 1 1 22 VAL CA C -6.192 -8.320 -7.540 1.00 . A A . 22 VAL CA 1 1 11 4316 1 1 22 VAL CB C -7.473 -9.070 -7.951 1.00 . A A . 22 VAL CB 1 1 11 4317 1 1 22 VAL CG1 C -8.320 -9.388 -6.729 1.00 . A A . 22 VAL CG1 1 1 11 4318 1 1 22 VAL CG2 C -8.265 -8.255 -8.962 1.00 . A A . 22 VAL CG2 1 1 11 4319 1 1 22 VAL H H -5.576 -8.323 -9.565 1.00 . A A . 22 VAL H 1 1 11 4320 1 1 22 VAL HA H -6.477 -7.448 -6.969 1.00 . A A . 22 VAL HA 1 1 11 4321 1 1 22 VAL HB H -7.187 -10.002 -8.416 1.00 . A A . 22 VAL HB 1 1 11 4322 1 1 22 VAL HG11 H -8.427 -8.500 -6.123 1.00 . A A . 22 VAL HG11 1 1 11 4323 1 1 22 VAL HG12 H -9.295 -9.729 -7.045 1.00 . A A . 22 VAL HG12 1 1 11 4324 1 1 22 VAL HG13 H -7.839 -10.162 -6.149 1.00 . A A . 22 VAL HG13 1 1 11 4325 1 1 22 VAL HG21 H -8.158 -8.696 -9.942 1.00 . A A . 22 VAL HG21 1 1 11 4326 1 1 22 VAL HG22 H -9.309 -8.249 -8.682 1.00 . A A . 22 VAL HG22 1 1 11 4327 1 1 22 VAL HG23 H -7.893 -7.241 -8.980 1.00 . A A . 22 VAL HG23 1 1 11 4328 1 1 22 VAL N N -5.442 -7.870 -8.707 1.00 . A A . 22 VAL N 1 1 11 4329 1 1 22 VAL O O -5.666 -9.463 -5.495 1.00 . A A . 22 VAL O 1 1 11 4330 1 1 23 PHE C C -2.131 -10.976 -7.328 1.00 . A A . 23 PHE C 1 1 11 4331 1 1 23 PHE CA C -3.359 -10.631 -6.492 1.00 . A A . 23 PHE CA 1 1 11 4332 1 1 23 PHE CB C -4.092 -11.913 -6.089 1.00 . A A . 23 PHE CB 1 1 11 4333 1 1 23 PHE CD1 C -2.835 -13.956 -5.353 1.00 . A A . 23 PHE CD1 1 1 11 4334 1 1 23 PHE CD2 C -3.223 -12.227 -3.757 1.00 . A A . 23 PHE CD2 1 1 11 4335 1 1 23 PHE CE1 C -2.168 -14.696 -4.395 1.00 . A A . 23 PHE CE1 1 1 11 4336 1 1 23 PHE CE2 C -2.557 -12.963 -2.795 1.00 . A A . 23 PHE CE2 1 1 11 4337 1 1 23 PHE CG C -3.369 -12.715 -5.046 1.00 . A A . 23 PHE CG 1 1 11 4338 1 1 23 PHE CZ C -2.030 -14.199 -3.114 1.00 . A A . 23 PHE CZ 1 1 11 4339 1 1 23 PHE H H -4.051 -9.522 -8.157 1.00 . A A . 23 PHE H 1 1 11 4340 1 1 23 PHE HA H -3.040 -10.115 -5.600 1.00 . A A . 23 PHE HA 1 1 11 4341 1 1 23 PHE HB2 H -5.063 -11.655 -5.695 1.00 . A A . 23 PHE HB2 1 1 11 4342 1 1 23 PHE HB3 H -4.217 -12.536 -6.962 1.00 . A A . 23 PHE HB3 1 1 11 4343 1 1 23 PHE HD1 H -2.943 -14.346 -6.356 1.00 . A A . 23 PHE HD1 1 1 11 4344 1 1 23 PHE HD2 H -3.635 -11.261 -3.505 1.00 . A A . 23 PHE HD2 1 1 11 4345 1 1 23 PHE HE1 H -1.758 -15.662 -4.648 1.00 . A A . 23 PHE HE1 1 1 11 4346 1 1 23 PHE HE2 H -2.450 -12.573 -1.794 1.00 . A A . 23 PHE HE2 1 1 11 4347 1 1 23 PHE HZ H -1.509 -14.776 -2.364 1.00 . A A . 23 PHE HZ 1 1 11 4348 1 1 23 PHE N N -4.255 -9.745 -7.225 1.00 . A A . 23 PHE N 1 1 11 4349 1 1 23 PHE O O -1.577 -12.069 -7.216 1.00 . A A . 23 PHE O 1 1 11 4350 1 1 24 DBU C C -0.860 -10.311 -10.441 1.00 . A A . 24 DBU C 1 1 11 4351 1 1 24 DBU CA C -0.623 -10.225 -8.969 1.00 . A A . 24 DBU CA 1 1 11 4352 1 1 24 DBU CB C 0.658 -10.345 -8.575 1.00 . A A . 24 DBU CB 1 1 11 4353 1 1 24 DBU CG C 1.158 -10.295 -7.166 1.00 . A A . 24 DBU CG 1 1 11 4354 1 1 24 DBU HG1 H 0.361 -10.194 -6.425 1.00 . A A . 24 DBU HG1 1 1 11 4355 1 1 24 DBU HG2 H 1.838 -9.446 -7.047 1.00 . A A . 24 DBU HG2 1 1 11 4356 1 1 24 DBU HG3 H 1.713 -11.211 -6.939 1.00 . A A . 24 DBU HG3 1 1 11 4357 1 1 24 DBU N N -1.711 -10.035 -8.167 1.00 . A A . 24 DBU N 1 1 11 4358 1 1 24 DBU O O -0.085 -9.779 -11.237 1.00 . A A . 24 DBU O 1 1 11 4359 1 1 25 CYS C C -2.837 -9.841 -12.805 1.00 . A A . 25 CYS C 1 1 11 4360 1 1 25 CYS CA C -2.284 -11.142 -12.231 1.00 . A A . 25 CYS CA 1 1 11 4361 1 1 25 CYS CB C -3.309 -12.265 -12.404 1.00 . A A . 25 CYS CB 1 1 11 4362 1 1 25 CYS H H -2.519 -11.386 -10.142 1.00 . A A . 25 CYS H 1 1 11 4363 1 1 25 CYS HA H -1.383 -11.403 -12.767 1.00 . A A . 25 CYS HA 1 1 11 4364 1 1 25 CYS HB2 H -4.255 -11.944 -11.994 1.00 . A A . 25 CYS HB2 1 1 11 4365 1 1 25 CYS HB3 H -3.430 -12.472 -13.457 1.00 . A A . 25 CYS HB3 1 1 11 4366 1 1 25 CYS N N -1.939 -10.984 -10.824 1.00 . A A . 25 CYS N 1 1 11 4367 1 1 25 CYS O O -3.195 -8.925 -12.064 1.00 . A A . 25 CYS O 1 1 11 4368 1 1 25 CYS SG S -2.849 -13.824 -11.581 1.00 . A A . 25 CYS SG 1 1 11 4369 1 1 26 CYS C C -4.842 -8.802 -15.296 1.00 . A A . 26 CYS C 1 1 11 4370 1 1 26 CYS CA C -3.415 -8.579 -14.805 1.00 . A A . 26 CYS CA 1 1 11 4371 1 1 26 CYS CB C -2.511 -8.209 -15.983 1.00 . A A . 26 CYS CB 1 1 11 4372 1 1 26 CYS H H -2.605 -10.530 -14.668 1.00 . A A . 26 CYS H 1 1 11 4373 1 1 26 CYS HA H -3.414 -7.767 -14.094 1.00 . A A . 26 CYS HA 1 1 11 4374 1 1 26 CYS HB2 H -1.666 -8.883 -16.004 1.00 . A A . 26 CYS HB2 1 1 11 4375 1 1 26 CYS HB3 H -3.069 -8.311 -16.901 1.00 . A A . 26 CYS HB3 1 1 11 4376 1 1 26 CYS N N -2.905 -9.767 -14.130 1.00 . A A . 26 CYS N 1 1 11 4377 1 1 26 CYS O O -5.337 -9.929 -15.307 1.00 . A A . 26 CYS O 1 1 11 4378 1 1 26 CYS SG S -1.860 -6.509 -15.915 1.00 . A A . 26 CYS SG 1 1 11 4379 1 1 27 SER C C -6.990 -8.818 -17.316 1.00 . A A . 27 SER C 1 1 11 4380 1 1 27 SER CA C -6.871 -7.796 -16.189 1.00 . A A . 27 SER CA 1 1 11 4381 1 1 27 SER CB C -7.337 -6.424 -16.679 1.00 . A A . 27 SER CB 1 1 11 4382 1 1 27 SER H H -5.050 -6.849 -15.668 1.00 . A A . 27 SER H 1 1 11 4383 1 1 27 SER HA H -7.498 -8.108 -15.368 1.00 . A A . 27 SER HA 1 1 11 4384 1 1 27 SER HB2 H -6.988 -5.663 -15.997 1.00 . A A . 27 SER HB2 1 1 11 4385 1 1 27 SER HB3 H -6.931 -6.239 -17.663 1.00 . A A . 27 SER HB3 1 1 11 4386 1 1 27 SER HG H -9.103 -6.108 -15.891 1.00 . A A . 27 SER HG 1 1 11 4387 1 1 27 SER N N -5.499 -7.720 -15.701 1.00 . A A . 27 SER N 1 1 11 4388 1 1 27 SER O O -6.186 -8.827 -18.247 1.00 . A A . 27 SER O 1 1 11 4389 1 1 27 SER OG O -8.751 -6.361 -16.748 1.00 . A A . 27 SER OG 1 1 12 4390 1 1 1 LYS C C 4.573 -0.365 -3.515 1.00 . A A . 1 LYS C 1 1 12 4391 1 1 1 LYS CA C 5.974 -0.820 -3.912 1.00 . A A . 1 LYS CA 1 1 12 4392 1 1 1 LYS CB C 6.548 -1.742 -2.834 1.00 . A A . 1 LYS CB 1 1 12 4393 1 1 1 LYS CD C 7.833 -3.851 -3.292 1.00 . A A . 1 LYS CD 1 1 12 4394 1 1 1 LYS CE C 9.213 -4.477 -3.159 1.00 . A A . 1 LYS CE 1 1 12 4395 1 1 1 LYS CG C 7.898 -2.336 -3.197 1.00 . A A . 1 LYS CG 1 1 12 4396 1 1 1 LYS H1 H 7.181 0.519 -5.022 1.00 . A A . 1 LYS H1 1 1 12 4397 1 1 1 LYS HA H 5.913 -1.363 -4.843 1.00 . A A . 1 LYS HA 1 1 12 4398 1 1 1 LYS HB2 H 6.659 -1.180 -1.919 1.00 . A A . 1 LYS HB2 1 1 12 4399 1 1 1 LYS HB3 H 5.854 -2.554 -2.666 1.00 . A A . 1 LYS HB3 1 1 12 4400 1 1 1 LYS HD2 H 7.202 -4.226 -2.500 1.00 . A A . 1 LYS HD2 1 1 12 4401 1 1 1 LYS HD3 H 7.413 -4.126 -4.249 1.00 . A A . 1 LYS HD3 1 1 12 4402 1 1 1 LYS HE2 H 9.775 -3.924 -2.422 1.00 . A A . 1 LYS HE2 1 1 12 4403 1 1 1 LYS HE3 H 9.099 -5.500 -2.831 1.00 . A A . 1 LYS HE3 1 1 12 4404 1 1 1 LYS HG2 H 8.211 -1.940 -4.151 1.00 . A A . 1 LYS HG2 1 1 12 4405 1 1 1 LYS HG3 H 8.617 -2.062 -2.438 1.00 . A A . 1 LYS HG3 1 1 12 4406 1 1 1 LYS HZ1 H 10.362 -3.519 -4.616 1.00 . A A . 1 LYS HZ1 1 1 12 4407 1 1 1 LYS HZ2 H 9.314 -4.694 -5.234 1.00 . A A . 1 LYS HZ2 1 1 12 4408 1 1 1 LYS HZ3 H 10.726 -5.160 -4.427 1.00 . A A . 1 LYS HZ3 1 1 12 4409 1 1 1 LYS N N 6.854 0.325 -4.119 1.00 . A A . 1 LYS N 1 1 12 4410 1 1 1 LYS NZ N 9.956 -4.462 -4.449 1.00 . A A . 1 LYS NZ 1 1 12 4411 1 1 1 LYS O O 4.034 -0.800 -2.497 1.00 . A A . 1 LYS O 1 1 12 4412 1 1 2 LYS C C 1.835 1.108 -5.347 1.00 . A A . 2 LYS C 1 1 12 4413 1 1 2 LYS CA C 2.650 1.024 -4.060 1.00 . A A . 2 LYS CA 1 1 12 4414 1 1 2 LYS CB C 2.730 2.403 -3.403 1.00 . A A . 2 LYS CB 1 1 12 4415 1 1 2 LYS CD C 1.879 2.692 -1.057 1.00 . A A . 2 LYS CD 1 1 12 4416 1 1 2 LYS CE C 1.701 4.196 -0.913 1.00 . A A . 2 LYS CE 1 1 12 4417 1 1 2 LYS CG C 3.079 2.354 -1.925 1.00 . A A . 2 LYS CG 1 1 12 4418 1 1 2 LYS H H 4.470 0.821 -5.121 1.00 . A A . 2 LYS H 1 1 12 4419 1 1 2 LYS HA H 2.161 0.340 -3.383 1.00 . A A . 2 LYS HA 1 1 12 4420 1 1 2 LYS HB2 H 3.483 2.987 -3.910 1.00 . A A . 2 LYS HB2 1 1 12 4421 1 1 2 LYS HB3 H 1.774 2.895 -3.509 1.00 . A A . 2 LYS HB3 1 1 12 4422 1 1 2 LYS HD2 H 0.990 2.278 -1.509 1.00 . A A . 2 LYS HD2 1 1 12 4423 1 1 2 LYS HD3 H 2.021 2.260 -0.077 1.00 . A A . 2 LYS HD3 1 1 12 4424 1 1 2 LYS HE2 H 2.587 4.687 -1.285 1.00 . A A . 2 LYS HE2 1 1 12 4425 1 1 2 LYS HE3 H 0.847 4.502 -1.498 1.00 . A A . 2 LYS HE3 1 1 12 4426 1 1 2 LYS HG2 H 3.420 1.360 -1.678 1.00 . A A . 2 LYS HG2 1 1 12 4427 1 1 2 LYS HG3 H 3.868 3.066 -1.727 1.00 . A A . 2 LYS HG3 1 1 12 4428 1 1 2 LYS HZ1 H 0.481 4.497 0.755 1.00 . A A . 2 LYS HZ1 1 1 12 4429 1 1 2 LYS HZ2 H 1.770 5.586 0.645 1.00 . A A . 2 LYS HZ2 1 1 12 4430 1 1 2 LYS HZ3 H 2.050 3.992 1.137 1.00 . A A . 2 LYS HZ3 1 1 12 4431 1 1 2 LYS N N 3.989 0.511 -4.325 1.00 . A A . 2 LYS N 1 1 12 4432 1 1 2 LYS NZ N 1.486 4.596 0.506 1.00 . A A . 2 LYS NZ 1 1 12 4433 1 1 2 LYS O O 0.886 0.349 -5.544 1.00 . A A . 2 LYS O 1 1 12 4434 1 1 3 LYS C C 1.412 0.898 -8.246 1.00 . A A . 3 LYS C 1 1 12 4435 1 1 3 LYS CA C 1.519 2.218 -7.490 1.00 . A A . 3 LYS CA 1 1 12 4436 1 1 3 LYS CB C 2.250 3.253 -8.349 1.00 . A A . 3 LYS CB 1 1 12 4437 1 1 3 LYS CD C 1.732 5.072 -10.002 1.00 . A A . 3 LYS CD 1 1 12 4438 1 1 3 LYS CE C 0.514 5.760 -10.599 1.00 . A A . 3 LYS CE 1 1 12 4439 1 1 3 LYS CG C 1.431 4.501 -8.626 1.00 . A A . 3 LYS CG 1 1 12 4440 1 1 3 LYS H H 2.977 2.611 -6.006 1.00 . A A . 3 LYS H 1 1 12 4441 1 1 3 LYS HA H 0.525 2.579 -7.276 1.00 . A A . 3 LYS HA 1 1 12 4442 1 1 3 LYS HB2 H 3.157 3.548 -7.843 1.00 . A A . 3 LYS HB2 1 1 12 4443 1 1 3 LYS HB3 H 2.508 2.799 -9.296 1.00 . A A . 3 LYS HB3 1 1 12 4444 1 1 3 LYS HD2 H 2.532 5.792 -9.917 1.00 . A A . 3 LYS HD2 1 1 12 4445 1 1 3 LYS HD3 H 2.037 4.268 -10.657 1.00 . A A . 3 LYS HD3 1 1 12 4446 1 1 3 LYS HE2 H -0.147 6.052 -9.797 1.00 . A A . 3 LYS HE2 1 1 12 4447 1 1 3 LYS HE3 H 0.840 6.640 -11.134 1.00 . A A . 3 LYS HE3 1 1 12 4448 1 1 3 LYS HG2 H 0.382 4.252 -8.574 1.00 . A A . 3 LYS HG2 1 1 12 4449 1 1 3 LYS HG3 H 1.663 5.246 -7.879 1.00 . A A . 3 LYS HG3 1 1 12 4450 1 1 3 LYS HZ1 H -1.241 5.087 -11.510 1.00 . A A . 3 LYS HZ1 1 1 12 4451 1 1 3 LYS HZ2 H -0.089 3.874 -11.263 1.00 . A A . 3 LYS HZ2 1 1 12 4452 1 1 3 LYS HZ3 H 0.125 5.002 -12.506 1.00 . A A . 3 LYS HZ3 1 1 12 4453 1 1 3 LYS N N 2.212 2.036 -6.220 1.00 . A A . 3 LYS N 1 1 12 4454 1 1 3 LYS NZ N -0.224 4.868 -11.535 1.00 . A A . 3 LYS NZ 1 1 12 4455 1 1 3 LYS O O 0.368 0.581 -8.816 1.00 . A A . 3 LYS O 1 1 12 4456 1 1 4 SER C C 2.448 -2.306 -7.937 1.00 . A A . 4 SER C 1 1 12 4457 1 1 4 SER CA C 2.527 -1.154 -8.934 1.00 . A A . 4 SER CA 1 1 12 4458 1 1 4 SER CB C 3.799 -1.278 -9.775 1.00 . A A . 4 SER CB 1 1 12 4459 1 1 4 SER H H 3.300 0.439 -7.773 1.00 . A A . 4 SER H 1 1 12 4460 1 1 4 SER HA H 1.668 -1.199 -9.587 1.00 . A A . 4 SER HA 1 1 12 4461 1 1 4 SER HB2 H 4.661 -1.161 -9.137 1.00 . A A . 4 SER HB2 1 1 12 4462 1 1 4 SER HB3 H 3.825 -2.253 -10.241 1.00 . A A . 4 SER HB3 1 1 12 4463 1 1 4 SER HG H 3.854 -0.709 -11.648 1.00 . A A . 4 SER HG 1 1 12 4464 1 1 4 SER N N 2.498 0.131 -8.246 1.00 . A A . 4 SER N 1 1 12 4465 1 1 4 SER O O 3.229 -2.376 -6.989 1.00 . A A . 4 SER O 1 1 12 4466 1 1 4 SER OG O 3.841 -0.287 -10.786 1.00 . A A . 4 SER OG 1 1 12 4467 1 1 5 GLY C C 2.454 -5.356 -7.410 1.00 . A A . 5 GLY C 1 1 12 4468 1 1 5 GLY CA C 1.332 -4.346 -7.272 1.00 . A A . 5 GLY CA 1 1 12 4469 1 1 5 GLY H H 0.902 -3.101 -8.931 1.00 . A A . 5 GLY H 1 1 12 4470 1 1 5 GLY HA2 H 1.303 -3.992 -6.252 1.00 . A A . 5 GLY HA2 1 1 12 4471 1 1 5 GLY HA3 H 0.395 -4.833 -7.501 1.00 . A A . 5 GLY HA3 1 1 12 4472 1 1 5 GLY N N 1.497 -3.209 -8.159 1.00 . A A . 5 GLY N 1 1 12 4473 1 1 5 GLY O O 3.075 -5.744 -6.420 1.00 . A A . 5 GLY O 1 1 12 4474 1 1 6 VAL C C 4.365 -6.557 -10.294 1.00 . A A . 6 VAL C 1 1 12 4475 1 1 6 VAL CA C 3.769 -6.756 -8.905 1.00 . A A . 6 VAL CA 1 1 12 4476 1 1 6 VAL CB C 3.245 -8.199 -8.786 1.00 . A A . 6 VAL CB 1 1 12 4477 1 1 6 VAL CG1 C 4.318 -9.194 -9.202 1.00 . A A . 6 VAL CG1 1 1 12 4478 1 1 6 VAL CG2 C 2.769 -8.478 -7.368 1.00 . A A . 6 VAL CG2 1 1 12 4479 1 1 6 VAL H H 2.185 -5.438 -9.390 1.00 . A A . 6 VAL H 1 1 12 4480 1 1 6 VAL HA H 4.545 -6.615 -8.167 1.00 . A A . 6 VAL HA 1 1 12 4481 1 1 6 VAL HB H 2.403 -8.312 -9.453 1.00 . A A . 6 VAL HB 1 1 12 4482 1 1 6 VAL HG11 H 4.216 -10.098 -8.620 1.00 . A A . 6 VAL HG11 1 1 12 4483 1 1 6 VAL HG12 H 4.208 -9.425 -10.251 1.00 . A A . 6 VAL HG12 1 1 12 4484 1 1 6 VAL HG13 H 5.293 -8.764 -9.028 1.00 . A A . 6 VAL HG13 1 1 12 4485 1 1 6 VAL HG21 H 2.430 -9.500 -7.297 1.00 . A A . 6 VAL HG21 1 1 12 4486 1 1 6 VAL HG22 H 3.585 -8.321 -6.677 1.00 . A A . 6 VAL HG22 1 1 12 4487 1 1 6 VAL HG23 H 1.957 -7.810 -7.122 1.00 . A A . 6 VAL HG23 1 1 12 4488 1 1 6 VAL N N 2.714 -5.784 -8.641 1.00 . A A . 6 VAL N 1 1 12 4489 1 1 6 VAL O O 5.416 -5.933 -10.446 1.00 . A A . 6 VAL O 1 1 12 4490 1 1 7 ILE C C 2.974 -6.840 -13.646 1.00 . A A . 7 ILE C 1 1 12 4491 1 1 7 ILE CA C 4.148 -6.968 -12.682 1.00 . A A . 7 ILE CA 1 1 12 4492 1 1 7 ILE CB C 5.008 -8.177 -13.096 1.00 . A A . 7 ILE CB 1 1 12 4493 1 1 7 ILE CD1 C 7.123 -9.467 -12.510 1.00 . A A . 7 ILE CD1 1 1 12 4494 1 1 7 ILE CG1 C 6.285 -8.234 -12.255 1.00 . A A . 7 ILE CG1 1 1 12 4495 1 1 7 ILE CG2 C 5.346 -8.105 -14.577 1.00 . A A . 7 ILE CG2 1 1 12 4496 1 1 7 ILE H H 2.856 -7.575 -11.120 1.00 . A A . 7 ILE H 1 1 12 4497 1 1 7 ILE HA H 4.757 -6.078 -12.752 1.00 . A A . 7 ILE HA 1 1 12 4498 1 1 7 ILE HB H 4.434 -9.075 -12.926 1.00 . A A . 7 ILE HB 1 1 12 4499 1 1 7 ILE HD11 H 6.486 -10.340 -12.517 1.00 . A A . 7 ILE HD11 1 1 12 4500 1 1 7 ILE HD12 H 7.619 -9.375 -13.465 1.00 . A A . 7 ILE HD12 1 1 12 4501 1 1 7 ILE HD13 H 7.862 -9.568 -11.729 1.00 . A A . 7 ILE HD13 1 1 12 4502 1 1 7 ILE HG12 H 6.893 -7.370 -12.475 1.00 . A A . 7 ILE HG12 1 1 12 4503 1 1 7 ILE HG13 H 6.019 -8.224 -11.208 1.00 . A A . 7 ILE HG13 1 1 12 4504 1 1 7 ILE HG21 H 4.798 -8.869 -15.109 1.00 . A A . 7 ILE HG21 1 1 12 4505 1 1 7 ILE HG22 H 5.072 -7.133 -14.961 1.00 . A A . 7 ILE HG22 1 1 12 4506 1 1 7 ILE HG23 H 6.405 -8.261 -14.714 1.00 . A A . 7 ILE HG23 1 1 12 4507 1 1 7 ILE N N 3.687 -7.089 -11.305 1.00 . A A . 7 ILE N 1 1 12 4508 1 1 7 ILE O O 2.067 -7.672 -13.673 1.00 . A A . 7 ILE O 1 1 12 4509 1 1 8 PRO C C 1.954 -6.513 -16.594 1.00 . A A . 8 PRO C 1 1 12 4510 1 1 8 PRO CA C 1.935 -5.512 -15.443 1.00 . A A . 8 PRO CA 1 1 12 4511 1 1 8 PRO CB C 2.264 -4.107 -15.951 1.00 . A A . 8 PRO CB 1 1 12 4512 1 1 8 PRO CD C 4.040 -4.741 -14.482 1.00 . A A . 8 PRO CD 1 1 12 4513 1 1 8 PRO CG C 3.729 -3.956 -15.726 1.00 . A A . 8 PRO CG 1 1 12 4514 1 1 8 PRO HA H 0.956 -5.511 -14.984 1.00 . A A . 8 PRO HA 1 1 12 4515 1 1 8 PRO HB2 H 2.015 -4.033 -17.001 1.00 . A A . 8 PRO HB2 1 1 12 4516 1 1 8 PRO HB3 H 1.701 -3.376 -15.390 1.00 . A A . 8 PRO HB3 1 1 12 4517 1 1 8 PRO HD2 H 5.020 -5.189 -14.554 1.00 . A A . 8 PRO HD2 1 1 12 4518 1 1 8 PRO HD3 H 3.975 -4.108 -13.610 1.00 . A A . 8 PRO HD3 1 1 12 4519 1 1 8 PRO HG2 H 4.273 -4.356 -16.568 1.00 . A A . 8 PRO HG2 1 1 12 4520 1 1 8 PRO HG3 H 3.972 -2.914 -15.581 1.00 . A A . 8 PRO HG3 1 1 12 4521 1 1 8 PRO N N 2.990 -5.774 -14.460 1.00 . A A . 8 PRO N 1 1 12 4522 1 1 8 PRO O O 2.315 -6.172 -17.719 1.00 . A A . 8 PRO O 1 1 12 4523 1 1 9 . C C 2.262 -10.020 -16.808 1.00 . A A . 9 DBB C 1 1 12 4524 1 1 9 . CA C 1.533 -8.807 -17.323 1.00 . A A . 9 DBB CA 1 1 12 4525 1 1 9 . CB C 0.081 -9.177 -17.632 1.00 . A A . 9 DBB CB 1 1 12 4526 1 1 9 . CG C -0.833 -8.617 -16.540 1.00 . A A . 9 DBB CG 1 1 12 4527 1 1 9 . H H 1.284 -7.960 -15.387 1.00 . A A . 9 DBB H 1 1 12 4528 1 1 9 . HA H 2.018 -8.449 -18.230 1.00 . A A . 9 DBB HA 1 1 12 4529 1 1 9 . HB2 H -0.019 -10.261 -17.669 1.00 . A A . 9 DBB HB2 1 1 12 4530 1 1 9 . HG1 H -1.842 -9.005 -16.676 1.00 . A A . 9 DBB HG1 1 1 12 4531 1 1 9 . HG2 H -0.456 -8.916 -15.563 1.00 . A A . 9 DBB HG2 1 1 12 4532 1 1 9 . HG3 H -0.850 -7.528 -16.605 1.00 . A A . 9 DBB HG3 1 1 12 4533 1 1 9 . N N 1.561 -7.749 -16.303 1.00 . A A . 9 DBB N 1 1 12 4534 1 1 9 . O O 3.246 -10.464 -17.400 1.00 . A A . 9 DBB O 1 1 12 4535 1 1 10 VAL C C 1.384 -12.876 -14.949 1.00 . A A . 10 VAL C 1 1 12 4536 1 1 10 VAL CA C 2.394 -11.744 -15.095 1.00 . A A . 10 VAL CA 1 1 12 4537 1 1 10 VAL CB C 2.992 -11.423 -13.712 1.00 . A A . 10 VAL CB 1 1 12 4538 1 1 10 VAL CG1 C 1.920 -10.876 -12.781 1.00 . A A . 10 VAL CG1 1 1 12 4539 1 1 10 VAL CG2 C 3.648 -12.659 -13.115 1.00 . A A . 10 VAL CG2 1 1 12 4540 1 1 10 VAL H H 0.994 -10.168 -15.269 1.00 . A A . 10 VAL H 1 1 12 4541 1 1 10 VAL HA H 3.195 -12.071 -15.743 1.00 . A A . 10 VAL HA 1 1 12 4542 1 1 10 VAL HB H 3.750 -10.664 -13.838 1.00 . A A . 10 VAL HB 1 1 12 4543 1 1 10 VAL HG11 H 2.084 -9.819 -12.627 1.00 . A A . 10 VAL HG11 1 1 12 4544 1 1 10 VAL HG12 H 0.947 -11.030 -13.223 1.00 . A A . 10 VAL HG12 1 1 12 4545 1 1 10 VAL HG13 H 1.972 -11.389 -11.833 1.00 . A A . 10 VAL HG13 1 1 12 4546 1 1 10 VAL HG21 H 4.599 -12.386 -12.681 1.00 . A A . 10 VAL HG21 1 1 12 4547 1 1 10 VAL HG22 H 3.008 -13.072 -12.349 1.00 . A A . 10 VAL HG22 1 1 12 4548 1 1 10 VAL HG23 H 3.802 -13.395 -13.890 1.00 . A A . 10 VAL HG23 1 1 12 4549 1 1 10 VAL N N 1.781 -10.566 -15.696 1.00 . A A . 10 VAL N 1 1 12 4550 1 1 10 VAL O O 1.755 -14.028 -14.728 1.00 . A A . 10 VAL O 1 1 12 4551 1 1 11 DAL C C -0.822 -14.566 -16.045 1.00 . A A . 11 DAL C 1 1 12 4552 1 1 11 DAL CA C -0.970 -13.536 -14.954 1.00 . A A . 11 DAL CA 1 1 12 4553 1 1 11 DAL CB C -0.880 -14.221 -13.589 1.00 . A A . 11 DAL CB 1 1 12 4554 1 1 11 DAL H H -0.129 -11.604 -15.248 1.00 . A A . 11 DAL H 1 1 12 4555 1 1 11 DAL HA H -1.937 -13.041 -15.050 1.00 . A A . 11 DAL HA 1 1 12 4556 1 1 11 DAL HB1 H -1.256 -15.241 -13.668 1.00 . A A . 11 DAL HB1 1 1 12 4557 1 1 11 DAL HB2 H 0.160 -14.242 -13.262 1.00 . A A . 11 DAL HB2 1 1 12 4558 1 1 11 DAL N N 0.104 -12.539 -15.073 1.00 . A A . 11 DAL N 1 1 12 4559 1 1 11 DAL O O 0.186 -15.269 -16.116 1.00 . A A . 11 DAL O 1 1 12 4560 1 1 12 HIS C C -2.413 -15.005 -19.267 1.00 . A A . 12 HIS C 1 1 12 4561 1 1 12 HIS CA C -1.813 -15.617 -18.005 1.00 . A A . 12 HIS CA 1 1 12 4562 1 1 12 HIS CB C -2.581 -16.882 -17.622 1.00 . A A . 12 HIS CB 1 1 12 4563 1 1 12 HIS CD2 C -1.633 -19.188 -16.908 1.00 . A A . 12 HIS CD2 1 1 12 4564 1 1 12 HIS CE1 C -0.388 -19.582 -18.670 1.00 . A A . 12 HIS CE1 1 1 12 4565 1 1 12 HIS CG C -1.771 -18.136 -17.748 1.00 . A A . 12 HIS CG 1 1 12 4566 1 1 12 HIS H H -2.609 -14.072 -16.795 1.00 . A A . 12 HIS H 1 1 12 4567 1 1 12 HIS HA H -0.784 -15.876 -18.200 1.00 . A A . 12 HIS HA 1 1 12 4568 1 1 12 HIS HB2 H -2.908 -16.801 -16.596 1.00 . A A . 12 HIS HB2 1 1 12 4569 1 1 12 HIS HB3 H -3.445 -16.979 -18.264 1.00 . A A . 12 HIS HB3 1 1 12 4570 1 1 12 HIS HD1 H -0.865 -17.838 -19.627 1.00 . A A . 12 HIS HD1 1 1 12 4571 1 1 12 HIS HD2 H -2.114 -19.311 -15.948 1.00 . A A . 12 HIS HD2 1 1 12 4572 1 1 12 HIS HE1 H 0.290 -20.057 -19.363 1.00 . A A . 12 HIS HE1 1 1 12 4573 1 1 12 HIS N N -1.832 -14.660 -16.904 1.00 . A A . 12 HIS N 1 1 12 4574 1 1 12 HIS ND1 N -0.978 -18.413 -18.841 1.00 . A A . 12 HIS ND1 1 1 12 4575 1 1 12 HIS NE2 N -0.769 -20.074 -17.504 1.00 . A A . 12 HIS NE2 1 1 12 4576 1 1 12 HIS O O -3.571 -14.585 -19.275 1.00 . A A . 12 HIS O 1 1 12 4577 1 1 13 ASP C C -2.395 -12.912 -21.452 1.00 . A A . 13 ASP C 1 1 12 4578 1 1 13 ASP CA C -2.072 -14.396 -21.598 1.00 . A A . 13 ASP CA 1 1 12 4579 1 1 13 ASP CB C -3.302 -15.151 -22.104 1.00 . A A . 13 ASP CB 1 1 12 4580 1 1 13 ASP CG C -3.509 -14.988 -23.597 1.00 . A A . 13 ASP CG 1 1 12 4581 1 1 13 ASP H H -0.706 -15.307 -20.261 1.00 . A A . 13 ASP H 1 1 12 4582 1 1 13 ASP HA H -1.272 -14.508 -22.315 1.00 . A A . 13 ASP HA 1 1 12 4583 1 1 13 ASP HB2 H -3.184 -16.203 -21.888 1.00 . A A . 13 ASP HB2 1 1 12 4584 1 1 13 ASP HB3 H -4.179 -14.780 -21.594 1.00 . A A . 13 ASP HB3 1 1 12 4585 1 1 13 ASP N N -1.619 -14.956 -20.330 1.00 . A A . 13 ASP N 1 1 12 4586 1 1 13 ASP O O -3.473 -12.460 -21.839 1.00 . A A . 13 ASP O 1 1 12 4587 1 1 13 ASP OD1 O -3.776 -16.003 -24.273 1.00 . A A . 13 ASP OD1 1 1 12 4588 1 1 13 ASP OD2 O -3.404 -13.845 -24.088 1.00 . A A . 13 ASP OD2 1 1 12 4589 1 1 14 CYS C C -2.123 -10.057 -21.973 1.00 . A A . 14 CYS C 1 1 12 4590 1 1 14 CYS CA C -1.639 -10.727 -20.691 1.00 . A A . 14 CYS CA 1 1 12 4591 1 1 14 CYS CB C -0.330 -10.083 -20.228 1.00 . A A . 14 CYS CB 1 1 12 4592 1 1 14 CYS H H -0.616 -12.578 -20.602 1.00 . A A . 14 CYS H 1 1 12 4593 1 1 14 CYS HA H -2.387 -10.592 -19.924 1.00 . A A . 14 CYS HA 1 1 12 4594 1 1 14 CYS HB2 H 0.209 -10.786 -19.610 1.00 . A A . 14 CYS HB2 1 1 12 4595 1 1 14 CYS HB3 H 0.268 -9.841 -21.094 1.00 . A A . 14 CYS HB3 1 1 12 4596 1 1 14 CYS N N -1.455 -12.160 -20.890 1.00 . A A . 14 CYS N 1 1 12 4597 1 1 14 CYS O O -1.808 -10.504 -23.077 1.00 . A A . 14 CYS O 1 1 12 4598 1 1 14 CYS SG S -0.554 -8.555 -19.262 1.00 . A A . 14 CYS SG 1 1 12 4599 1 1 15 HIS C C -3.385 -6.747 -22.711 1.00 . A A . 15 HIS C 1 1 12 4600 1 1 15 HIS CA C -3.419 -8.251 -22.965 1.00 . A A . 15 HIS CA 1 1 12 4601 1 1 15 HIS CB C -4.850 -8.696 -23.267 1.00 . A A . 15 HIS CB 1 1 12 4602 1 1 15 HIS CD2 C -5.045 -8.955 -25.841 1.00 . A A . 15 HIS CD2 1 1 12 4603 1 1 15 HIS CE1 C -6.349 -7.237 -26.237 1.00 . A A . 15 HIS CE1 1 1 12 4604 1 1 15 HIS CG C -5.302 -8.357 -24.654 1.00 . A A . 15 HIS CG 1 1 12 4605 1 1 15 HIS H H -3.108 -8.676 -20.915 1.00 . A A . 15 HIS H 1 1 12 4606 1 1 15 HIS HA H -2.794 -8.473 -23.817 1.00 . A A . 15 HIS HA 1 1 12 4607 1 1 15 HIS HB2 H -4.918 -9.768 -23.149 1.00 . A A . 15 HIS HB2 1 1 12 4608 1 1 15 HIS HB3 H -5.523 -8.218 -22.571 1.00 . A A . 15 HIS HB3 1 1 12 4609 1 1 15 HIS HD1 H -6.482 -6.651 -24.282 1.00 . A A . 15 HIS HD1 1 1 12 4610 1 1 15 HIS HD2 H -4.433 -9.832 -25.998 1.00 . A A . 15 HIS HD2 1 1 12 4611 1 1 15 HIS HE1 H -6.955 -6.504 -26.747 1.00 . A A . 15 HIS HE1 1 1 12 4612 1 1 15 HIS N N -2.891 -8.983 -21.820 1.00 . A A . 15 HIS N 1 1 12 4613 1 1 15 HIS ND1 N -6.121 -7.283 -24.937 1.00 . A A . 15 HIS ND1 1 1 12 4614 1 1 15 HIS NE2 N -5.707 -8.240 -26.809 1.00 . A A . 15 HIS NE2 1 1 12 4615 1 1 15 HIS O O -4.367 -6.045 -22.948 1.00 . A A . 15 HIS O 1 1 12 4616 1 1 16 MET C C -2.996 -4.408 -20.793 1.00 . A A . 16 MET C 1 1 12 4617 1 1 16 MET CA C -2.086 -4.838 -21.939 1.00 . A A . 16 MET CA 1 1 12 4618 1 1 16 MET CB C -2.390 -4.007 -23.187 1.00 . A A . 16 MET CB 1 1 12 4619 1 1 16 MET CE C -0.872 -4.147 -26.265 1.00 . A A . 16 MET CE 1 1 12 4620 1 1 16 MET CG C -1.202 -3.198 -23.682 1.00 . A A . 16 MET CG 1 1 12 4621 1 1 16 MET H H -1.498 -6.868 -22.057 1.00 . A A . 16 MET H 1 1 12 4622 1 1 16 MET HA H -1.059 -4.674 -21.649 1.00 . A A . 16 MET HA 1 1 12 4623 1 1 16 MET HB2 H -2.702 -4.670 -23.980 1.00 . A A . 16 MET HB2 1 1 12 4624 1 1 16 MET HB3 H -3.195 -3.323 -22.963 1.00 . A A . 16 MET HB3 1 1 12 4625 1 1 16 MET HE1 H -1.224 -5.019 -25.734 1.00 . A A . 16 MET HE1 1 1 12 4626 1 1 16 MET HE2 H -1.287 -4.141 -27.262 1.00 . A A . 16 MET HE2 1 1 12 4627 1 1 16 MET HE3 H 0.207 -4.171 -26.324 1.00 . A A . 16 MET HE3 1 1 12 4628 1 1 16 MET HG2 H -1.095 -2.322 -23.060 1.00 . A A . 16 MET HG2 1 1 12 4629 1 1 16 MET HG3 H -0.312 -3.805 -23.602 1.00 . A A . 16 MET HG3 1 1 12 4630 1 1 16 MET N N -2.247 -6.259 -22.225 1.00 . A A . 16 MET N 1 1 12 4631 1 1 16 MET O O -4.188 -4.172 -20.990 1.00 . A A . 16 MET O 1 1 12 4632 1 1 16 MET SD S -1.388 -2.668 -25.396 1.00 . A A . 16 MET SD 1 1 12 4633 1 1 17 ASN C C -2.297 -3.873 -17.181 1.00 . A A . 17 ASN C 1 1 12 4634 1 1 17 ASN CA C -3.188 -3.906 -18.419 1.00 . A A . 17 ASN CA 1 1 12 4635 1 1 17 ASN CB C -4.359 -4.863 -18.193 1.00 . A A . 17 ASN CB 1 1 12 4636 1 1 17 ASN CG C -5.672 -4.132 -17.988 1.00 . A A . 17 ASN CG 1 1 12 4637 1 1 17 ASN H H -1.472 -4.508 -19.503 1.00 . A A . 17 ASN H 1 1 12 4638 1 1 17 ASN HA H -3.574 -2.914 -18.597 1.00 . A A . 17 ASN HA 1 1 12 4639 1 1 17 ASN HB2 H -4.460 -5.509 -19.053 1.00 . A A . 17 ASN HB2 1 1 12 4640 1 1 17 ASN HB3 H -4.162 -5.464 -17.318 1.00 . A A . 17 ASN HB3 1 1 12 4641 1 1 17 ASN HD21 H -6.156 -5.366 -16.505 1.00 . A A . 17 ASN HD21 1 1 12 4642 1 1 17 ASN HD22 H -7.316 -4.139 -16.870 1.00 . A A . 17 ASN HD22 1 1 12 4643 1 1 17 ASN N N -2.427 -4.307 -19.597 1.00 . A A . 17 ASN N 1 1 12 4644 1 1 17 ASN ND2 N -6.461 -4.592 -17.023 1.00 . A A . 17 ASN ND2 1 1 12 4645 1 1 17 ASN O O -1.078 -4.007 -17.278 1.00 . A A . 17 ASN O 1 1 12 4646 1 1 17 ASN OD1 O -5.973 -3.166 -18.688 1.00 . A A . 17 ASN OD1 1 1 12 4647 1 1 18 DAL C C -2.815 -2.634 -13.833 1.00 . A A . 18 DAL C 1 1 12 4648 1 1 18 DAL CA C -2.173 -3.642 -14.751 1.00 . A A . 18 DAL CA 1 1 12 4649 1 1 18 DAL CB C -2.198 -5.023 -14.091 1.00 . A A . 18 DAL CB 1 1 12 4650 1 1 18 DAL H H -3.890 -3.592 -16.006 1.00 . A A . 18 DAL H 1 1 12 4651 1 1 18 DAL HA H -1.141 -3.351 -14.946 1.00 . A A . 18 DAL HA 1 1 12 4652 1 1 18 DAL HB1 H -1.341 -5.604 -14.430 1.00 . A A . 18 DAL HB1 1 1 12 4653 1 1 18 DAL HB2 H -2.153 -4.907 -13.008 1.00 . A A . 18 DAL HB2 1 1 12 4654 1 1 18 DAL N N -2.915 -3.693 -16.019 1.00 . A A . 18 DAL N 1 1 12 4655 1 1 18 DAL O O -2.281 -1.546 -13.618 1.00 . A A . 18 DAL O 1 1 12 4656 1 1 19 PHE C C -4.579 -2.593 -10.936 1.00 . A A . 19 PHE C 1 1 12 4657 1 1 19 PHE CA C -4.695 -2.108 -12.379 1.00 . A A . 19 PHE CA 1 1 12 4658 1 1 19 PHE CB C -6.168 -2.023 -12.783 1.00 . A A . 19 PHE CB 1 1 12 4659 1 1 19 PHE CD1 C -7.833 -3.211 -11.329 1.00 . A A . 19 PHE CD1 1 1 12 4660 1 1 19 PHE CD2 C -6.842 -4.415 -13.133 1.00 . A A . 19 PHE CD2 1 1 12 4661 1 1 19 PHE CE1 C -8.566 -4.330 -10.981 1.00 . A A . 19 PHE CE1 1 1 12 4662 1 1 19 PHE CE2 C -7.573 -5.536 -12.790 1.00 . A A . 19 PHE CE2 1 1 12 4663 1 1 19 PHE CG C -6.964 -3.241 -12.408 1.00 . A A . 19 PHE CG 1 1 12 4664 1 1 19 PHE CZ C -8.436 -5.494 -11.712 1.00 . A A . 19 PHE CZ 1 1 12 4665 1 1 19 PHE H H -4.347 -3.873 -13.494 1.00 . A A . 19 PHE H 1 1 12 4666 1 1 19 PHE HA H -4.253 -1.126 -12.452 1.00 . A A . 19 PHE HA 1 1 12 4667 1 1 19 PHE HB2 H -6.619 -1.171 -12.298 1.00 . A A . 19 PHE HB2 1 1 12 4668 1 1 19 PHE HB3 H -6.233 -1.900 -13.854 1.00 . A A . 19 PHE HB3 1 1 12 4669 1 1 19 PHE HD1 H -7.935 -2.300 -10.756 1.00 . A A . 19 PHE HD1 1 1 12 4670 1 1 19 PHE HD2 H -6.167 -4.450 -13.976 1.00 . A A . 19 PHE HD2 1 1 12 4671 1 1 19 PHE HE1 H -9.240 -4.293 -10.137 1.00 . A A . 19 PHE HE1 1 1 12 4672 1 1 19 PHE HE2 H -7.469 -6.445 -13.364 1.00 . A A . 19 PHE HE2 1 1 12 4673 1 1 19 PHE HZ H -9.009 -6.369 -11.443 1.00 . A A . 19 PHE HZ 1 1 12 4674 1 1 19 PHE N N -3.971 -2.993 -13.284 1.00 . A A . 19 PHE N 1 1 12 4675 1 1 19 PHE O O -4.543 -1.792 -10.003 1.00 . A A . 19 PHE O 1 1 12 4676 1 1 20 GLN C C -4.359 -6.023 -9.521 1.00 . A A . 20 GLN C 1 1 12 4677 1 1 20 GLN CA C -4.410 -4.501 -9.436 1.00 . A A . 20 GLN CA 1 1 12 4678 1 1 20 GLN CB C -5.588 -4.067 -8.561 1.00 . A A . 20 GLN CB 1 1 12 4679 1 1 20 GLN CD C -5.788 -2.225 -6.844 1.00 . A A . 20 GLN CD 1 1 12 4680 1 1 20 GLN CG C -5.173 -3.567 -7.187 1.00 . A A . 20 GLN CG 1 1 12 4681 1 1 20 GLN H H -4.554 -4.496 -11.548 1.00 . A A . 20 GLN H 1 1 12 4682 1 1 20 GLN HA H -3.493 -4.147 -8.991 1.00 . A A . 20 GLN HA 1 1 12 4683 1 1 20 GLN HB2 H -6.121 -3.274 -9.064 1.00 . A A . 20 GLN HB2 1 1 12 4684 1 1 20 GLN HB3 H -6.252 -4.908 -8.429 1.00 . A A . 20 GLN HB3 1 1 12 4685 1 1 20 GLN HE21 H -6.566 -2.980 -5.178 1.00 . A A . 20 GLN HE21 1 1 12 4686 1 1 20 GLN HE22 H -6.897 -1.310 -5.471 1.00 . A A . 20 GLN HE22 1 1 12 4687 1 1 20 GLN HG2 H -5.485 -4.288 -6.446 1.00 . A A . 20 GLN HG2 1 1 12 4688 1 1 20 GLN HG3 H -4.097 -3.470 -7.163 1.00 . A A . 20 GLN HG3 1 1 12 4689 1 1 20 GLN N N -4.521 -3.909 -10.764 1.00 . A A . 20 GLN N 1 1 12 4690 1 1 20 GLN NE2 N -6.489 -2.165 -5.718 1.00 . A A . 20 GLN NE2 1 1 12 4691 1 1 20 GLN O O -4.738 -6.612 -10.533 1.00 . A A . 20 GLN O 1 1 12 4692 1 1 20 GLN OE1 O -5.636 -1.252 -7.583 1.00 . A A . 20 GLN OE1 1 1 12 4693 1 1 21 PHE C C -4.677 -8.682 -7.308 1.00 . A A . 21 PHE C 1 1 12 4694 1 1 21 PHE CA C -3.785 -8.109 -8.405 1.00 . A A . 21 PHE CA 1 1 12 4695 1 1 21 PHE CB C -2.333 -8.532 -8.171 1.00 . A A . 21 PHE CB 1 1 12 4696 1 1 21 PHE CD1 C -0.992 -6.676 -9.198 1.00 . A A . 21 PHE CD1 1 1 12 4697 1 1 21 PHE CD2 C -0.874 -8.841 -10.189 1.00 . A A . 21 PHE CD2 1 1 12 4698 1 1 21 PHE CE1 C -0.115 -6.189 -10.149 1.00 . A A . 21 PHE CE1 1 1 12 4699 1 1 21 PHE CE2 C 0.003 -8.360 -11.143 1.00 . A A . 21 PHE CE2 1 1 12 4700 1 1 21 PHE CG C -1.381 -8.006 -9.206 1.00 . A A . 21 PHE CG 1 1 12 4701 1 1 21 PHE CZ C 0.382 -7.032 -11.123 1.00 . A A . 21 PHE CZ 1 1 12 4702 1 1 21 PHE H H -3.600 -6.130 -7.674 1.00 . A A . 21 PHE H 1 1 12 4703 1 1 21 PHE HA H -4.113 -8.494 -9.358 1.00 . A A . 21 PHE HA 1 1 12 4704 1 1 21 PHE HB2 H -2.010 -8.166 -7.208 1.00 . A A . 21 PHE HB2 1 1 12 4705 1 1 21 PHE HB3 H -2.274 -9.610 -8.181 1.00 . A A . 21 PHE HB3 1 1 12 4706 1 1 21 PHE HD1 H -1.381 -6.015 -8.435 1.00 . A A . 21 PHE HD1 1 1 12 4707 1 1 21 PHE HD2 H -1.170 -9.880 -10.206 1.00 . A A . 21 PHE HD2 1 1 12 4708 1 1 21 PHE HE1 H 0.178 -5.150 -10.131 1.00 . A A . 21 PHE HE1 1 1 12 4709 1 1 21 PHE HE2 H 0.390 -9.021 -11.903 1.00 . A A . 21 PHE HE2 1 1 12 4710 1 1 21 PHE HZ H 1.067 -6.654 -11.867 1.00 . A A . 21 PHE HZ 1 1 12 4711 1 1 21 PHE N N -3.887 -6.655 -8.451 1.00 . A A . 21 PHE N 1 1 12 4712 1 1 21 PHE O O -5.017 -7.995 -6.346 1.00 . A A . 21 PHE O 1 1 12 4713 1 1 22 VAL C C -5.210 -11.836 -5.892 1.00 . A A . 22 VAL C 1 1 12 4714 1 1 22 VAL CA C -5.906 -10.616 -6.485 1.00 . A A . 22 VAL CA 1 1 12 4715 1 1 22 VAL CB C -7.242 -11.055 -7.113 1.00 . A A . 22 VAL CB 1 1 12 4716 1 1 22 VAL CG1 C -8.002 -9.851 -7.649 1.00 . A A . 22 VAL CG1 1 1 12 4717 1 1 22 VAL CG2 C -7.001 -12.077 -8.214 1.00 . A A . 22 VAL CG2 1 1 12 4718 1 1 22 VAL H H -4.750 -10.445 -8.250 1.00 . A A . 22 VAL H 1 1 12 4719 1 1 22 VAL HA H -6.118 -9.914 -5.692 1.00 . A A . 22 VAL HA 1 1 12 4720 1 1 22 VAL HB H -7.842 -11.519 -6.345 1.00 . A A . 22 VAL HB 1 1 12 4721 1 1 22 VAL HG11 H -7.350 -9.267 -8.282 1.00 . A A . 22 VAL HG11 1 1 12 4722 1 1 22 VAL HG12 H -8.854 -10.188 -8.220 1.00 . A A . 22 VAL HG12 1 1 12 4723 1 1 22 VAL HG13 H -8.339 -9.242 -6.823 1.00 . A A . 22 VAL HG13 1 1 12 4724 1 1 22 VAL HG21 H -6.748 -13.029 -7.772 1.00 . A A . 22 VAL HG21 1 1 12 4725 1 1 22 VAL HG22 H -7.897 -12.184 -8.809 1.00 . A A . 22 VAL HG22 1 1 12 4726 1 1 22 VAL HG23 H -6.190 -11.745 -8.844 1.00 . A A . 22 VAL HG23 1 1 12 4727 1 1 22 VAL N N -5.053 -9.948 -7.462 1.00 . A A . 22 VAL N 1 1 12 4728 1 1 22 VAL O O -5.592 -12.325 -4.829 1.00 . A A . 22 VAL O 1 1 12 4729 1 1 23 PHE C C -2.247 -13.761 -7.043 1.00 . A A . 23 PHE C 1 1 12 4730 1 1 23 PHE CA C -3.437 -13.486 -6.128 1.00 . A A . 23 PHE CA 1 1 12 4731 1 1 23 PHE CB C -4.346 -14.716 -6.073 1.00 . A A . 23 PHE CB 1 1 12 4732 1 1 23 PHE CD1 C -3.344 -15.680 -3.984 1.00 . A A . 23 PHE CD1 1 1 12 4733 1 1 23 PHE CD2 C -3.630 -17.112 -5.869 1.00 . A A . 23 PHE CD2 1 1 12 4734 1 1 23 PHE CE1 C -2.806 -16.730 -3.263 1.00 . A A . 23 PHE CE1 1 1 12 4735 1 1 23 PHE CE2 C -3.094 -18.165 -5.153 1.00 . A A . 23 PHE CE2 1 1 12 4736 1 1 23 PHE CG C -3.762 -15.859 -5.293 1.00 . A A . 23 PHE CG 1 1 12 4737 1 1 23 PHE CZ C -2.680 -17.974 -3.849 1.00 . A A . 23 PHE CZ 1 1 12 4738 1 1 23 PHE H H -3.930 -11.888 -7.427 1.00 . A A . 23 PHE H 1 1 12 4739 1 1 23 PHE HA H -3.071 -13.274 -5.135 1.00 . A A . 23 PHE HA 1 1 12 4740 1 1 23 PHE HB2 H -5.282 -14.442 -5.609 1.00 . A A . 23 PHE HB2 1 1 12 4741 1 1 23 PHE HB3 H -4.535 -15.060 -7.078 1.00 . A A . 23 PHE HB3 1 1 12 4742 1 1 23 PHE HD1 H -3.442 -14.706 -3.525 1.00 . A A . 23 PHE HD1 1 1 12 4743 1 1 23 PHE HD2 H -3.952 -17.263 -6.889 1.00 . A A . 23 PHE HD2 1 1 12 4744 1 1 23 PHE HE1 H -2.484 -16.576 -2.244 1.00 . A A . 23 PHE HE1 1 1 12 4745 1 1 23 PHE HE2 H -2.996 -19.137 -5.613 1.00 . A A . 23 PHE HE2 1 1 12 4746 1 1 23 PHE HZ H -2.261 -18.795 -3.288 1.00 . A A . 23 PHE HZ 1 1 12 4747 1 1 23 PHE N N -4.187 -12.322 -6.586 1.00 . A A . 23 PHE N 1 1 12 4748 1 1 23 PHE O O -1.850 -14.909 -7.234 1.00 . A A . 23 PHE O 1 1 12 4749 1 1 24 DBU C C -0.772 -12.309 -9.839 1.00 . A A . 24 DBU C 1 1 12 4750 1 1 24 DBU CA C -0.611 -12.814 -8.443 1.00 . A A . 24 DBU CA 1 1 12 4751 1 1 24 DBU CB C 0.590 -13.341 -8.146 1.00 . A A . 24 DBU CB 1 1 12 4752 1 1 24 DBU CG C 1.004 -13.912 -6.827 1.00 . A A . 24 DBU CG 1 1 12 4753 1 1 24 DBU HG1 H 2.034 -13.671 -6.552 1.00 . A A . 24 DBU HG1 1 1 12 4754 1 1 24 DBU HG2 H 0.910 -15.003 -6.851 1.00 . A A . 24 DBU HG2 1 1 12 4755 1 1 24 DBU HG3 H 0.348 -13.531 -6.038 1.00 . A A . 24 DBU HG3 1 1 12 4756 1 1 24 DBU N N -1.682 -12.697 -7.605 1.00 . A A . 24 DBU N 1 1 12 4757 1 1 24 DBU O O 0.136 -11.690 -10.395 1.00 . A A . 24 DBU O 1 1 12 4758 1 1 25 CYS C C -2.906 -10.769 -11.790 1.00 . A A . 25 CYS C 1 1 12 4759 1 1 25 CYS CA C -2.219 -12.132 -11.788 1.00 . A A . 25 CYS CA 1 1 12 4760 1 1 25 CYS CB C -3.097 -13.160 -12.504 1.00 . A A . 25 CYS CB 1 1 12 4761 1 1 25 CYS H H -2.620 -13.067 -9.933 1.00 . A A . 25 CYS H 1 1 12 4762 1 1 25 CYS HA H -1.279 -12.047 -12.313 1.00 . A A . 25 CYS HA 1 1 12 4763 1 1 25 CYS HB2 H -4.103 -13.097 -12.113 1.00 . A A . 25 CYS HB2 1 1 12 4764 1 1 25 CYS HB3 H -3.113 -12.936 -13.560 1.00 . A A . 25 CYS HB3 1 1 12 4765 1 1 25 CYS N N -1.935 -12.569 -10.427 1.00 . A A . 25 CYS N 1 1 12 4766 1 1 25 CYS O O -3.331 -10.274 -10.746 1.00 . A A . 25 CYS O 1 1 12 4767 1 1 25 CYS SG S -2.536 -14.882 -12.309 1.00 . A A . 25 CYS SG 1 1 12 4768 1 1 26 CYS C C -5.144 -9.012 -13.370 1.00 . A A . 26 CYS C 1 1 12 4769 1 1 26 CYS CA C -3.648 -8.863 -13.110 1.00 . A A . 26 CYS CA 1 1 12 4770 1 1 26 CYS CB C -2.997 -8.075 -14.248 1.00 . A A . 26 CYS CB 1 1 12 4771 1 1 26 CYS H H -2.655 -10.613 -13.768 1.00 . A A . 26 CYS H 1 1 12 4772 1 1 26 CYS HA H -3.508 -8.325 -12.185 1.00 . A A . 26 CYS HA 1 1 12 4773 1 1 26 CYS HB2 H -1.925 -8.081 -14.113 1.00 . A A . 26 CYS HB2 1 1 12 4774 1 1 26 CYS HB3 H -3.239 -8.549 -15.188 1.00 . A A . 26 CYS HB3 1 1 12 4775 1 1 26 CYS N N -3.013 -10.168 -12.970 1.00 . A A . 26 CYS N 1 1 12 4776 1 1 26 CYS O O -5.650 -8.588 -14.409 1.00 . A A . 26 CYS O 1 1 12 4777 1 1 26 CYS SG S -3.532 -6.337 -14.350 1.00 . A A . 26 CYS SG 1 1 12 4778 1 1 27 SER C C -8.052 -8.562 -12.166 1.00 . A A . 27 SER C 1 1 12 4779 1 1 27 SER CA C -7.285 -9.825 -12.544 1.00 . A A . 27 SER CA 1 1 12 4780 1 1 27 SER CB C -7.733 -10.991 -11.661 1.00 . A A . 27 SER CB 1 1 12 4781 1 1 27 SER H H -5.387 -9.933 -11.612 1.00 . A A . 27 SER H 1 1 12 4782 1 1 27 SER HA H -7.496 -10.064 -13.576 1.00 . A A . 27 SER HA 1 1 12 4783 1 1 27 SER HB2 H -6.875 -11.404 -11.152 1.00 . A A . 27 SER HB2 1 1 12 4784 1 1 27 SER HB3 H -8.446 -10.634 -10.932 1.00 . A A . 27 SER HB3 1 1 12 4785 1 1 27 SER HG H -8.952 -12.508 -11.884 1.00 . A A . 27 SER HG 1 1 12 4786 1 1 27 SER N N -5.847 -9.617 -12.417 1.00 . A A . 27 SER N 1 1 12 4787 1 1 27 SER O O -9.048 -8.215 -12.799 1.00 . A A . 27 SER O 1 1 12 4788 1 1 27 SER OG O -8.341 -12.012 -12.433 1.00 . A A . 27 SER OG 1 1 13 4789 1 1 1 LYS C C -2.054 -0.456 -3.042 1.00 . A A . 1 LYS C 1 1 13 4790 1 1 1 LYS CA C -3.486 -0.871 -2.719 1.00 . A A . 1 LYS CA 1 1 13 4791 1 1 1 LYS CB C -4.471 0.074 -3.412 1.00 . A A . 1 LYS CB 1 1 13 4792 1 1 1 LYS CD C -5.802 0.200 -5.538 1.00 . A A . 1 LYS CD 1 1 13 4793 1 1 1 LYS CE C -4.641 0.250 -6.520 1.00 . A A . 1 LYS CE 1 1 13 4794 1 1 1 LYS CG C -5.462 -0.637 -4.317 1.00 . A A . 1 LYS CG 1 1 13 4795 1 1 1 LYS H1 H -3.045 -1.278 -0.689 1.00 . A A . 1 LYS H1 1 1 13 4796 1 1 1 LYS HA H -3.648 -1.875 -3.082 1.00 . A A . 1 LYS HA 1 1 13 4797 1 1 1 LYS HB2 H -5.026 0.612 -2.658 1.00 . A A . 1 LYS HB2 1 1 13 4798 1 1 1 LYS HB3 H -3.913 0.781 -4.009 1.00 . A A . 1 LYS HB3 1 1 13 4799 1 1 1 LYS HD2 H -6.659 -0.232 -6.033 1.00 . A A . 1 LYS HD2 1 1 13 4800 1 1 1 LYS HD3 H -6.037 1.206 -5.220 1.00 . A A . 1 LYS HD3 1 1 13 4801 1 1 1 LYS HE2 H -3.875 0.895 -6.119 1.00 . A A . 1 LYS HE2 1 1 13 4802 1 1 1 LYS HE3 H -4.245 -0.748 -6.640 1.00 . A A . 1 LYS HE3 1 1 13 4803 1 1 1 LYS HG2 H -5.031 -1.572 -4.643 1.00 . A A . 1 LYS HG2 1 1 13 4804 1 1 1 LYS HG3 H -6.368 -0.831 -3.761 1.00 . A A . 1 LYS HG3 1 1 13 4805 1 1 1 LYS HZ1 H -5.149 1.803 -7.821 1.00 . A A . 1 LYS HZ1 1 1 13 4806 1 1 1 LYS HZ2 H -5.984 0.362 -8.117 1.00 . A A . 1 LYS HZ2 1 1 13 4807 1 1 1 LYS HZ3 H -4.361 0.509 -8.574 1.00 . A A . 1 LYS HZ3 1 1 13 4808 1 1 1 LYS N N -3.715 -0.873 -1.279 1.00 . A A . 1 LYS N 1 1 13 4809 1 1 1 LYS NZ N -5.063 0.767 -7.852 1.00 . A A . 1 LYS NZ 1 1 13 4810 1 1 1 LYS O O -1.644 0.670 -2.758 1.00 . A A . 1 LYS O 1 1 13 4811 1 1 2 LYS C C 0.247 -1.024 -5.518 1.00 . A A . 2 LYS C 1 1 13 4812 1 1 2 LYS CA C 0.088 -1.100 -4.003 1.00 . A A . 2 LYS CA 1 1 13 4813 1 1 2 LYS CB C 1.007 -2.185 -3.437 1.00 . A A . 2 LYS CB 1 1 13 4814 1 1 2 LYS CD C 2.302 -3.047 -1.465 1.00 . A A . 2 LYS CD 1 1 13 4815 1 1 2 LYS CE C 1.597 -3.628 -0.248 1.00 . A A . 2 LYS CE 1 1 13 4816 1 1 2 LYS CG C 1.532 -1.873 -2.047 1.00 . A A . 2 LYS CG 1 1 13 4817 1 1 2 LYS H H -1.682 -2.251 -3.839 1.00 . A A . 2 LYS H 1 1 13 4818 1 1 2 LYS HA H 0.363 -0.148 -3.575 1.00 . A A . 2 LYS HA 1 1 13 4819 1 1 2 LYS HB2 H 0.461 -3.116 -3.393 1.00 . A A . 2 LYS HB2 1 1 13 4820 1 1 2 LYS HB3 H 1.852 -2.305 -4.100 1.00 . A A . 2 LYS HB3 1 1 13 4821 1 1 2 LYS HD2 H 2.390 -3.817 -2.217 1.00 . A A . 2 LYS HD2 1 1 13 4822 1 1 2 LYS HD3 H 3.287 -2.711 -1.173 1.00 . A A . 2 LYS HD3 1 1 13 4823 1 1 2 LYS HE2 H 1.775 -2.981 0.597 1.00 . A A . 2 LYS HE2 1 1 13 4824 1 1 2 LYS HE3 H 0.536 -3.672 -0.450 1.00 . A A . 2 LYS HE3 1 1 13 4825 1 1 2 LYS HG2 H 2.190 -1.018 -2.103 1.00 . A A . 2 LYS HG2 1 1 13 4826 1 1 2 LYS HG3 H 0.697 -1.645 -1.399 1.00 . A A . 2 LYS HG3 1 1 13 4827 1 1 2 LYS HZ1 H 1.423 -5.468 0.724 1.00 . A A . 2 LYS HZ1 1 1 13 4828 1 1 2 LYS HZ2 H 3.019 -4.944 0.531 1.00 . A A . 2 LYS HZ2 1 1 13 4829 1 1 2 LYS HZ3 H 2.167 -5.562 -0.793 1.00 . A A . 2 LYS HZ3 1 1 13 4830 1 1 2 LYS N N -1.298 -1.371 -3.638 1.00 . A A . 2 LYS N 1 1 13 4831 1 1 2 LYS NZ N 2.086 -4.996 0.076 1.00 . A A . 2 LYS NZ 1 1 13 4832 1 1 2 LYS O O -0.302 -1.845 -6.253 1.00 . A A . 2 LYS O 1 1 13 4833 1 1 3 LYS C C 1.735 -1.141 -8.046 1.00 . A A . 3 LYS C 1 1 13 4834 1 1 3 LYS CA C 1.236 0.150 -7.407 1.00 . A A . 3 LYS CA 1 1 13 4835 1 1 3 LYS CB C 2.251 1.272 -7.638 1.00 . A A . 3 LYS CB 1 1 13 4836 1 1 3 LYS CD C 2.649 3.736 -7.923 1.00 . A A . 3 LYS CD 1 1 13 4837 1 1 3 LYS CE C 3.039 4.153 -6.514 1.00 . A A . 3 LYS CE 1 1 13 4838 1 1 3 LYS CG C 1.613 2.624 -7.908 1.00 . A A . 3 LYS CG 1 1 13 4839 1 1 3 LYS H H 1.413 0.591 -5.344 1.00 . A A . 3 LYS H 1 1 13 4840 1 1 3 LYS HA H 0.298 0.426 -7.865 1.00 . A A . 3 LYS HA 1 1 13 4841 1 1 3 LYS HB2 H 2.877 1.361 -6.763 1.00 . A A . 3 LYS HB2 1 1 13 4842 1 1 3 LYS HB3 H 2.868 1.013 -8.487 1.00 . A A . 3 LYS HB3 1 1 13 4843 1 1 3 LYS HD2 H 3.531 3.388 -8.440 1.00 . A A . 3 LYS HD2 1 1 13 4844 1 1 3 LYS HD3 H 2.238 4.591 -8.442 1.00 . A A . 3 LYS HD3 1 1 13 4845 1 1 3 LYS HE2 H 2.484 5.040 -6.248 1.00 . A A . 3 LYS HE2 1 1 13 4846 1 1 3 LYS HE3 H 2.786 3.354 -5.833 1.00 . A A . 3 LYS HE3 1 1 13 4847 1 1 3 LYS HG2 H 1.119 2.593 -8.868 1.00 . A A . 3 LYS HG2 1 1 13 4848 1 1 3 LYS HG3 H 0.888 2.830 -7.134 1.00 . A A . 3 LYS HG3 1 1 13 4849 1 1 3 LYS HZ1 H 5.026 3.865 -7.088 1.00 . A A . 3 LYS HZ1 1 1 13 4850 1 1 3 LYS HZ2 H 4.832 4.219 -5.445 1.00 . A A . 3 LYS HZ2 1 1 13 4851 1 1 3 LYS HZ3 H 4.677 5.447 -6.599 1.00 . A A . 3 LYS HZ3 1 1 13 4852 1 1 3 LYS N N 1.002 -0.033 -5.980 1.00 . A A . 3 LYS N 1 1 13 4853 1 1 3 LYS NZ N 4.495 4.441 -6.404 1.00 . A A . 3 LYS NZ 1 1 13 4854 1 1 3 LYS O O 1.247 -1.553 -9.099 1.00 . A A . 3 LYS O 1 1 13 4855 1 1 4 SER C C 3.861 -2.823 -9.305 1.00 . A A . 4 SER C 1 1 13 4856 1 1 4 SER CA C 3.275 -3.021 -7.911 1.00 . A A . 4 SER CA 1 1 13 4857 1 1 4 SER CB C 2.207 -4.116 -7.945 1.00 . A A . 4 SER CB 1 1 13 4858 1 1 4 SER H H 3.056 -1.399 -6.568 1.00 . A A . 4 SER H 1 1 13 4859 1 1 4 SER HA H 4.066 -3.323 -7.240 1.00 . A A . 4 SER HA 1 1 13 4860 1 1 4 SER HB2 H 1.647 -4.041 -8.865 1.00 . A A . 4 SER HB2 1 1 13 4861 1 1 4 SER HB3 H 2.685 -5.084 -7.893 1.00 . A A . 4 SER HB3 1 1 13 4862 1 1 4 SER HG H 0.831 -4.812 -6.737 1.00 . A A . 4 SER HG 1 1 13 4863 1 1 4 SER N N 2.709 -1.777 -7.403 1.00 . A A . 4 SER N 1 1 13 4864 1 1 4 SER O O 3.943 -1.700 -9.802 1.00 . A A . 4 SER O 1 1 13 4865 1 1 4 SER OG O 1.311 -3.989 -6.854 1.00 . A A . 4 SER OG 1 1 13 4866 1 1 5 GLY C C 5.880 -4.925 -11.507 1.00 . A A . 5 GLY C 1 1 13 4867 1 1 5 GLY CA C 4.840 -3.849 -11.263 1.00 . A A . 5 GLY CA 1 1 13 4868 1 1 5 GLY H H 4.177 -4.791 -9.487 1.00 . A A . 5 GLY H 1 1 13 4869 1 1 5 GLY HA2 H 4.049 -3.955 -11.991 1.00 . A A . 5 GLY HA2 1 1 13 4870 1 1 5 GLY HA3 H 5.304 -2.881 -11.390 1.00 . A A . 5 GLY HA3 1 1 13 4871 1 1 5 GLY N N 4.267 -3.923 -9.932 1.00 . A A . 5 GLY N 1 1 13 4872 1 1 5 GLY O O 7.034 -4.625 -11.812 1.00 . A A . 5 GLY O 1 1 13 4873 1 1 6 VAL C C 6.453 -7.685 -13.054 1.00 . A A . 6 VAL C 1 1 13 4874 1 1 6 VAL CA C 6.375 -7.307 -11.579 1.00 . A A . 6 VAL CA 1 1 13 4875 1 1 6 VAL CB C 5.933 -8.539 -10.768 1.00 . A A . 6 VAL CB 1 1 13 4876 1 1 6 VAL CG1 C 6.846 -9.722 -11.053 1.00 . A A . 6 VAL CG1 1 1 13 4877 1 1 6 VAL CG2 C 5.912 -8.218 -9.281 1.00 . A A . 6 VAL CG2 1 1 13 4878 1 1 6 VAL H H 4.538 -6.358 -11.128 1.00 . A A . 6 VAL H 1 1 13 4879 1 1 6 VAL HA H 7.358 -7.012 -11.241 1.00 . A A . 6 VAL HA 1 1 13 4880 1 1 6 VAL HB H 4.931 -8.805 -11.072 1.00 . A A . 6 VAL HB 1 1 13 4881 1 1 6 VAL HG11 H 6.367 -10.384 -11.759 1.00 . A A . 6 VAL HG11 1 1 13 4882 1 1 6 VAL HG12 H 7.778 -9.366 -11.467 1.00 . A A . 6 VAL HG12 1 1 13 4883 1 1 6 VAL HG13 H 7.040 -10.257 -10.135 1.00 . A A . 6 VAL HG13 1 1 13 4884 1 1 6 VAL HG21 H 5.486 -7.237 -9.132 1.00 . A A . 6 VAL HG21 1 1 13 4885 1 1 6 VAL HG22 H 5.314 -8.953 -8.762 1.00 . A A . 6 VAL HG22 1 1 13 4886 1 1 6 VAL HG23 H 6.920 -8.236 -8.894 1.00 . A A . 6 VAL HG23 1 1 13 4887 1 1 6 VAL N N 5.471 -6.182 -11.372 1.00 . A A . 6 VAL N 1 1 13 4888 1 1 6 VAL O O 7.405 -7.325 -13.748 1.00 . A A . 6 VAL O 1 1 13 4889 1 1 7 ILE C C 3.976 -8.790 -15.463 1.00 . A A . 7 ILE C 1 1 13 4890 1 1 7 ILE CA C 5.400 -8.836 -14.921 1.00 . A A . 7 ILE CA 1 1 13 4891 1 1 7 ILE CB C 5.957 -10.261 -15.093 1.00 . A A . 7 ILE CB 1 1 13 4892 1 1 7 ILE CD1 C 8.371 -9.510 -15.385 1.00 . A A . 7 ILE CD1 1 1 13 4893 1 1 7 ILE CG1 C 7.396 -10.336 -14.577 1.00 . A A . 7 ILE CG1 1 1 13 4894 1 1 7 ILE CG2 C 5.890 -10.683 -16.554 1.00 . A A . 7 ILE CG2 1 1 13 4895 1 1 7 ILE H H 4.716 -8.666 -12.926 1.00 . A A . 7 ILE H 1 1 13 4896 1 1 7 ILE HA H 6.015 -8.159 -15.496 1.00 . A A . 7 ILE HA 1 1 13 4897 1 1 7 ILE HB H 5.341 -10.937 -14.520 1.00 . A A . 7 ILE HB 1 1 13 4898 1 1 7 ILE HD11 H 7.826 -8.870 -16.063 1.00 . A A . 7 ILE HD11 1 1 13 4899 1 1 7 ILE HD12 H 8.969 -8.906 -14.720 1.00 . A A . 7 ILE HD12 1 1 13 4900 1 1 7 ILE HD13 H 9.016 -10.167 -15.952 1.00 . A A . 7 ILE HD13 1 1 13 4901 1 1 7 ILE HG12 H 7.425 -9.981 -13.559 1.00 . A A . 7 ILE HG12 1 1 13 4902 1 1 7 ILE HG13 H 7.727 -11.364 -14.606 1.00 . A A . 7 ILE HG13 1 1 13 4903 1 1 7 ILE HG21 H 4.866 -10.639 -16.894 1.00 . A A . 7 ILE HG21 1 1 13 4904 1 1 7 ILE HG22 H 6.495 -10.016 -17.149 1.00 . A A . 7 ILE HG22 1 1 13 4905 1 1 7 ILE HG23 H 6.260 -11.692 -16.655 1.00 . A A . 7 ILE HG23 1 1 13 4906 1 1 7 ILE N N 5.446 -8.411 -13.527 1.00 . A A . 7 ILE N 1 1 13 4907 1 1 7 ILE O O 3.145 -9.650 -15.170 1.00 . A A . 7 ILE O 1 1 13 4908 1 1 8 PRO C C 2.057 -8.633 -17.939 1.00 . A A . 8 PRO C 1 1 13 4909 1 1 8 PRO CA C 2.361 -7.581 -16.878 1.00 . A A . 8 PRO CA 1 1 13 4910 1 1 8 PRO CB C 2.448 -6.190 -17.512 1.00 . A A . 8 PRO CB 1 1 13 4911 1 1 8 PRO CD C 4.625 -6.700 -16.667 1.00 . A A . 8 PRO CD 1 1 13 4912 1 1 8 PRO CG C 3.900 -5.984 -17.773 1.00 . A A . 8 PRO CG 1 1 13 4913 1 1 8 PRO HA H 1.580 -7.589 -16.131 1.00 . A A . 8 PRO HA 1 1 13 4914 1 1 8 PRO HB2 H 1.875 -6.174 -18.429 1.00 . A A . 8 PRO HB2 1 1 13 4915 1 1 8 PRO HB3 H 2.061 -5.452 -16.826 1.00 . A A . 8 PRO HB3 1 1 13 4916 1 1 8 PRO HD2 H 5.550 -7.120 -17.033 1.00 . A A . 8 PRO HD2 1 1 13 4917 1 1 8 PRO HD3 H 4.813 -6.029 -15.842 1.00 . A A . 8 PRO HD3 1 1 13 4918 1 1 8 PRO HG2 H 4.165 -6.405 -18.730 1.00 . A A . 8 PRO HG2 1 1 13 4919 1 1 8 PRO HG3 H 4.130 -4.929 -17.749 1.00 . A A . 8 PRO HG3 1 1 13 4920 1 1 8 PRO N N 3.684 -7.763 -16.275 1.00 . A A . 8 PRO N 1 1 13 4921 1 1 8 PRO O O 2.330 -8.431 -19.121 1.00 . A A . 8 PRO O 1 1 13 4922 1 1 9 . C C 1.505 -12.167 -17.799 1.00 . A A . 9 DBB C 1 1 13 4923 1 1 9 . CA C 1.147 -10.847 -18.429 1.00 . A A . 9 DBB CA 1 1 13 4924 1 1 9 . CB C -0.354 -10.812 -18.723 1.00 . A A . 9 DBB CB 1 1 13 4925 1 1 9 . CG C -0.868 -9.377 -18.585 1.00 . A A . 9 DBB CG 1 1 13 4926 1 1 9 . H H 1.297 -9.857 -16.553 1.00 . A A . 9 DBB H 1 1 13 4927 1 1 9 . HA H 1.702 -10.725 -19.359 1.00 . A A . 9 DBB HA 1 1 13 4928 1 1 9 . HB2 H -0.878 -11.455 -18.018 1.00 . A A . 9 DBB HB2 1 1 13 4929 1 1 9 . HG1 H -0.235 -8.706 -19.165 1.00 . A A . 9 DBB HG1 1 1 13 4930 1 1 9 . HG2 H -1.892 -9.321 -18.953 1.00 . A A . 9 DBB HG2 1 1 13 4931 1 1 9 . HG3 H -0.843 -9.083 -17.535 1.00 . A A . 9 DBB HG3 1 1 13 4932 1 1 9 . N N 1.490 -9.755 -17.508 1.00 . A A . 9 DBB N 1 1 13 4933 1 1 9 . O O 2.041 -13.057 -18.460 1.00 . A A . 9 DBB O 1 1 13 4934 1 1 10 VAL C C 0.260 -14.065 -15.082 1.00 . A A . 10 VAL C 1 1 13 4935 1 1 10 VAL CA C 1.504 -13.530 -15.783 1.00 . A A . 10 VAL CA 1 1 13 4936 1 1 10 VAL CB C 2.614 -13.312 -14.738 1.00 . A A . 10 VAL CB 1 1 13 4937 1 1 10 VAL CG1 C 3.939 -13.008 -15.421 1.00 . A A . 10 VAL CG1 1 1 13 4938 1 1 10 VAL CG2 C 2.231 -12.194 -13.779 1.00 . A A . 10 VAL CG2 1 1 13 4939 1 1 10 VAL H H 0.784 -11.557 -16.037 1.00 . A A . 10 VAL H 1 1 13 4940 1 1 10 VAL HA H 1.849 -14.266 -16.495 1.00 . A A . 10 VAL HA 1 1 13 4941 1 1 10 VAL HB H 2.729 -14.222 -14.168 1.00 . A A . 10 VAL HB 1 1 13 4942 1 1 10 VAL HG11 H 4.692 -12.808 -14.673 1.00 . A A . 10 VAL HG11 1 1 13 4943 1 1 10 VAL HG12 H 4.239 -13.857 -16.018 1.00 . A A . 10 VAL HG12 1 1 13 4944 1 1 10 VAL HG13 H 3.825 -12.143 -16.057 1.00 . A A . 10 VAL HG13 1 1 13 4945 1 1 10 VAL HG21 H 1.848 -11.355 -14.341 1.00 . A A . 10 VAL HG21 1 1 13 4946 1 1 10 VAL HG22 H 1.471 -12.549 -13.098 1.00 . A A . 10 VAL HG22 1 1 13 4947 1 1 10 VAL HG23 H 3.101 -11.886 -13.219 1.00 . A A . 10 VAL HG23 1 1 13 4948 1 1 10 VAL N N 1.210 -12.301 -16.510 1.00 . A A . 10 VAL N 1 1 13 4949 1 1 10 VAL O O 0.227 -15.216 -14.648 1.00 . A A . 10 VAL O 1 1 13 4950 1 1 11 DAL C C -2.649 -14.750 -15.088 1.00 . A A . 11 DAL C 1 1 13 4951 1 1 11 DAL CA C -2.019 -13.614 -14.324 1.00 . A A . 11 DAL CA 1 1 13 4952 1 1 11 DAL CB C -1.730 -14.061 -12.889 1.00 . A A . 11 DAL CB 1 1 13 4953 1 1 11 DAL H H -0.674 -12.317 -15.343 1.00 . A A . 11 DAL H 1 1 13 4954 1 1 11 DAL HA H -2.701 -12.763 -14.310 1.00 . A A . 11 DAL HA 1 1 13 4955 1 1 11 DAL HB1 H -2.474 -14.794 -12.580 1.00 . A A . 11 DAL HB1 1 1 13 4956 1 1 11 DAL HB2 H -0.737 -14.508 -12.842 1.00 . A A . 11 DAL HB2 1 1 13 4957 1 1 11 DAL N N -0.761 -13.222 -14.977 1.00 . A A . 11 DAL N 1 1 13 4958 1 1 11 DAL O O -1.969 -15.477 -15.813 1.00 . A A . 11 DAL O 1 1 13 4959 1 1 12 HIS C C -5.364 -15.442 -16.873 1.00 . A A . 12 HIS C 1 1 13 4960 1 1 12 HIS CA C -4.688 -15.972 -15.612 1.00 . A A . 12 HIS CA 1 1 13 4961 1 1 12 HIS CB C -5.733 -16.584 -14.678 1.00 . A A . 12 HIS CB 1 1 13 4962 1 1 12 HIS CD2 C -4.919 -18.718 -13.448 1.00 . A A . 12 HIS CD2 1 1 13 4963 1 1 12 HIS CE1 C -5.706 -20.213 -14.845 1.00 . A A . 12 HIS CE1 1 1 13 4964 1 1 12 HIS CG C -5.543 -18.052 -14.448 1.00 . A A . 12 HIS CG 1 1 13 4965 1 1 12 HIS H H -4.446 -14.299 -14.337 1.00 . A A . 12 HIS H 1 1 13 4966 1 1 12 HIS HA H -3.978 -16.734 -15.892 1.00 . A A . 12 HIS HA 1 1 13 4967 1 1 12 HIS HB2 H -5.684 -16.089 -13.719 1.00 . A A . 12 HIS HB2 1 1 13 4968 1 1 12 HIS HB3 H -6.716 -16.439 -15.103 1.00 . A A . 12 HIS HB3 1 1 13 4969 1 1 12 HIS HD1 H -6.527 -18.850 -16.131 1.00 . A A . 12 HIS HD1 1 1 13 4970 1 1 12 HIS HD2 H -4.422 -18.276 -12.596 1.00 . A A . 12 HIS HD2 1 1 13 4971 1 1 12 HIS HE1 H -5.951 -21.156 -15.309 1.00 . A A . 12 HIS HE1 1 1 13 4972 1 1 12 HIS N N -3.959 -14.910 -14.928 1.00 . A A . 12 HIS N 1 1 13 4973 1 1 12 HIS ND1 N -6.024 -19.017 -15.307 1.00 . A A . 12 HIS ND1 1 1 13 4974 1 1 12 HIS NE2 N -5.034 -20.059 -13.718 1.00 . A A . 12 HIS NE2 1 1 13 4975 1 1 12 HIS O O -5.620 -16.193 -17.814 1.00 . A A . 12 HIS O 1 1 13 4976 1 1 13 ASP C C -5.447 -12.369 -18.569 1.00 . A A . 13 ASP C 1 1 13 4977 1 1 13 ASP CA C -6.297 -13.514 -18.029 1.00 . A A . 13 ASP CA 1 1 13 4978 1 1 13 ASP CB C -7.683 -12.998 -17.640 1.00 . A A . 13 ASP CB 1 1 13 4979 1 1 13 ASP CG C -7.704 -12.386 -16.253 1.00 . A A . 13 ASP CG 1 1 13 4980 1 1 13 ASP H H -5.422 -13.598 -16.103 1.00 . A A . 13 ASP H 1 1 13 4981 1 1 13 ASP HA H -6.405 -14.261 -18.801 1.00 . A A . 13 ASP HA 1 1 13 4982 1 1 13 ASP HB2 H -7.992 -12.245 -18.350 1.00 . A A . 13 ASP HB2 1 1 13 4983 1 1 13 ASP HB3 H -8.385 -13.818 -17.663 1.00 . A A . 13 ASP HB3 1 1 13 4984 1 1 13 ASP N N -5.651 -14.145 -16.884 1.00 . A A . 13 ASP N 1 1 13 4985 1 1 13 ASP O O -5.893 -11.222 -18.624 1.00 . A A . 13 ASP O 1 1 13 4986 1 1 13 ASP OD1 O -6.944 -11.424 -16.016 1.00 . A A . 13 ASP OD1 1 1 13 4987 1 1 13 ASP OD2 O -8.482 -12.869 -15.403 1.00 . A A . 13 ASP OD2 1 1 13 4988 1 1 14 CYS C C -4.025 -10.757 -20.478 1.00 . A A . 14 CYS C 1 1 13 4989 1 1 14 CYS CA C -3.306 -11.684 -19.502 1.00 . A A . 14 CYS CA 1 1 13 4990 1 1 14 CYS CB C -2.125 -12.361 -20.201 1.00 . A A . 14 CYS CB 1 1 13 4991 1 1 14 CYS H H -3.920 -13.617 -18.899 1.00 . A A . 14 CYS H 1 1 13 4992 1 1 14 CYS HA H -2.935 -11.098 -18.675 1.00 . A A . 14 CYS HA 1 1 13 4993 1 1 14 CYS HB2 H -1.748 -13.152 -19.569 1.00 . A A . 14 CYS HB2 1 1 13 4994 1 1 14 CYS HB3 H -2.464 -12.784 -21.135 1.00 . A A . 14 CYS HB3 1 1 13 4995 1 1 14 CYS N N -4.220 -12.686 -18.967 1.00 . A A . 14 CYS N 1 1 13 4996 1 1 14 CYS O O -4.446 -11.178 -21.556 1.00 . A A . 14 CYS O 1 1 13 4997 1 1 14 CYS SG S -0.737 -11.241 -20.570 1.00 . A A . 14 CYS SG 1 1 13 4998 1 1 15 HIS C C -4.019 -7.215 -21.004 1.00 . A A . 15 HIS C 1 1 13 4999 1 1 15 HIS CA C -4.830 -8.505 -20.933 1.00 . A A . 15 HIS CA 1 1 13 5000 1 1 15 HIS CB C -6.231 -8.211 -20.396 1.00 . A A . 15 HIS CB 1 1 13 5001 1 1 15 HIS CD2 C -7.575 -9.896 -21.840 1.00 . A A . 15 HIS CD2 1 1 13 5002 1 1 15 HIS CE1 C -9.153 -8.539 -22.530 1.00 . A A . 15 HIS CE1 1 1 13 5003 1 1 15 HIS CG C -7.329 -8.678 -21.301 1.00 . A A . 15 HIS CG 1 1 13 5004 1 1 15 HIS H H -3.806 -9.217 -19.222 1.00 . A A . 15 HIS H 1 1 13 5005 1 1 15 HIS HA H -4.914 -8.918 -21.927 1.00 . A A . 15 HIS HA 1 1 13 5006 1 1 15 HIS HB2 H -6.355 -8.704 -19.443 1.00 . A A . 15 HIS HB2 1 1 13 5007 1 1 15 HIS HB3 H -6.342 -7.145 -20.262 1.00 . A A . 15 HIS HB3 1 1 13 5008 1 1 15 HIS HD1 H -8.436 -6.901 -21.536 1.00 . A A . 15 HIS HD1 1 1 13 5009 1 1 15 HIS HD2 H -6.985 -10.791 -21.699 1.00 . A A . 15 HIS HD2 1 1 13 5010 1 1 15 HIS HE1 H -10.031 -8.152 -23.024 1.00 . A A . 15 HIS HE1 1 1 13 5011 1 1 15 HIS N N -4.162 -9.492 -20.092 1.00 . A A . 15 HIS N 1 1 13 5012 1 1 15 HIS ND1 N -8.335 -7.851 -21.754 1.00 . A A . 15 HIS ND1 1 1 13 5013 1 1 15 HIS NE2 N -8.714 -9.783 -22.599 1.00 . A A . 15 HIS NE2 1 1 13 5014 1 1 15 HIS O O -3.426 -6.899 -22.036 1.00 . A A . 15 HIS O 1 1 13 5015 1 1 16 MET C C -3.425 -4.555 -18.476 1.00 . A A . 16 MET C 1 1 13 5016 1 1 16 MET CA C -3.259 -5.217 -19.840 1.00 . A A . 16 MET CA 1 1 13 5017 1 1 16 MET CB C -3.732 -4.267 -20.942 1.00 . A A . 16 MET CB 1 1 13 5018 1 1 16 MET CE C -1.729 -2.077 -23.853 1.00 . A A . 16 MET CE 1 1 13 5019 1 1 16 MET CG C -2.602 -3.715 -21.795 1.00 . A A . 16 MET CG 1 1 13 5020 1 1 16 MET H H -4.490 -6.777 -19.110 1.00 . A A . 16 MET H 1 1 13 5021 1 1 16 MET HA H -2.214 -5.440 -19.994 1.00 . A A . 16 MET HA 1 1 13 5022 1 1 16 MET HB2 H -4.416 -4.797 -21.588 1.00 . A A . 16 MET HB2 1 1 13 5023 1 1 16 MET HB3 H -4.250 -3.436 -20.487 1.00 . A A . 16 MET HB3 1 1 13 5024 1 1 16 MET HE1 H -0.850 -2.673 -23.657 1.00 . A A . 16 MET HE1 1 1 13 5025 1 1 16 MET HE2 H -1.794 -1.869 -24.911 1.00 . A A . 16 MET HE2 1 1 13 5026 1 1 16 MET HE3 H -1.663 -1.148 -23.306 1.00 . A A . 16 MET HE3 1 1 13 5027 1 1 16 MET HG2 H -2.075 -2.962 -21.228 1.00 . A A . 16 MET HG2 1 1 13 5028 1 1 16 MET HG3 H -1.924 -4.521 -22.035 1.00 . A A . 16 MET HG3 1 1 13 5029 1 1 16 MET N N -3.998 -6.473 -19.902 1.00 . A A . 16 MET N 1 1 13 5030 1 1 16 MET O O -3.927 -5.168 -17.535 1.00 . A A . 16 MET O 1 1 13 5031 1 1 16 MET SD S -3.188 -2.975 -23.331 1.00 . A A . 16 MET SD 1 1 13 5032 1 1 17 ASN C C -2.194 -3.158 -16.059 1.00 . A A . 17 ASN C 1 1 13 5033 1 1 17 ASN CA C -3.101 -2.555 -17.127 1.00 . A A . 17 ASN CA 1 1 13 5034 1 1 17 ASN CB C -4.549 -2.541 -16.633 1.00 . A A . 17 ASN CB 1 1 13 5035 1 1 17 ASN CG C -4.879 -1.290 -15.843 1.00 . A A . 17 ASN CG 1 1 13 5036 1 1 17 ASN H H -2.608 -2.864 -19.162 1.00 . A A . 17 ASN H 1 1 13 5037 1 1 17 ASN HA H -2.786 -1.541 -17.319 1.00 . A A . 17 ASN HA 1 1 13 5038 1 1 17 ASN HB2 H -5.214 -2.592 -17.484 1.00 . A A . 17 ASN HB2 1 1 13 5039 1 1 17 ASN HB3 H -4.716 -3.400 -16.000 1.00 . A A . 17 ASN HB3 1 1 13 5040 1 1 17 ASN HD21 H -5.491 -0.375 -17.499 1.00 . A A . 17 ASN HD21 1 1 13 5041 1 1 17 ASN HD22 H -5.591 0.555 -16.047 1.00 . A A . 17 ASN HD22 1 1 13 5042 1 1 17 ASN N N -3.000 -3.300 -18.376 1.00 . A A . 17 ASN N 1 1 13 5043 1 1 17 ASN ND2 N -5.370 -0.267 -16.532 1.00 . A A . 17 ASN ND2 1 1 13 5044 1 1 17 ASN O O -2.658 -3.572 -14.997 1.00 . A A . 17 ASN O 1 1 13 5045 1 1 17 ASN OD1 O -4.694 -1.244 -14.626 1.00 . A A . 17 ASN OD1 1 1 13 5046 1 1 18 DAL C C 0.289 -2.795 -14.267 1.00 . A A . 18 DAL C 1 1 13 5047 1 1 18 DAL CA C 0.083 -3.761 -15.406 1.00 . A A . 18 DAL CA 1 1 13 5048 1 1 18 DAL CB C -0.436 -5.093 -14.859 1.00 . A A . 18 DAL CB 1 1 13 5049 1 1 18 DAL H H -0.588 -2.859 -17.212 1.00 . A A . 18 DAL H 1 1 13 5050 1 1 18 DAL HA H 1.030 -3.923 -15.920 1.00 . A A . 18 DAL HA 1 1 13 5051 1 1 18 DAL HB1 H 0.405 -5.755 -14.655 1.00 . A A . 18 DAL HB1 1 1 13 5052 1 1 18 DAL HB2 H -0.989 -4.915 -13.937 1.00 . A A . 18 DAL HB2 1 1 13 5053 1 1 18 DAL N N -0.898 -3.204 -16.348 1.00 . A A . 18 DAL N 1 1 13 5054 1 1 18 DAL O O 1.366 -2.218 -14.115 1.00 . A A . 18 DAL O 1 1 13 5055 1 1 19 PHE C C -1.541 -2.214 -11.164 1.00 . A A . 19 PHE C 1 1 13 5056 1 1 19 PHE CA C -0.680 -1.706 -12.317 1.00 . A A . 19 PHE CA 1 1 13 5057 1 1 19 PHE CB C -1.133 -0.304 -12.728 1.00 . A A . 19 PHE CB 1 1 13 5058 1 1 19 PHE CD1 C -0.996 -0.200 -15.232 1.00 . A A . 19 PHE CD1 1 1 13 5059 1 1 19 PHE CD2 C 0.604 1.025 -13.958 1.00 . A A . 19 PHE CD2 1 1 13 5060 1 1 19 PHE CE1 C -0.412 0.248 -16.402 1.00 . A A . 19 PHE CE1 1 1 13 5061 1 1 19 PHE CE2 C 1.192 1.476 -15.124 1.00 . A A . 19 PHE CE2 1 1 13 5062 1 1 19 PHE CG C -0.496 0.184 -13.998 1.00 . A A . 19 PHE CG 1 1 13 5063 1 1 19 PHE CZ C 0.684 1.086 -16.348 1.00 . A A . 19 PHE CZ 1 1 13 5064 1 1 19 PHE H H -1.581 -3.103 -13.629 1.00 . A A . 19 PHE H 1 1 13 5065 1 1 19 PHE HA H 0.348 -1.662 -11.991 1.00 . A A . 19 PHE HA 1 1 13 5066 1 1 19 PHE HB2 H -2.203 -0.307 -12.875 1.00 . A A . 19 PHE HB2 1 1 13 5067 1 1 19 PHE HB3 H -0.883 0.392 -11.941 1.00 . A A . 19 PHE HB3 1 1 13 5068 1 1 19 PHE HD1 H -1.854 -0.856 -15.275 1.00 . A A . 19 PHE HD1 1 1 13 5069 1 1 19 PHE HD2 H 1.004 1.331 -13.002 1.00 . A A . 19 PHE HD2 1 1 13 5070 1 1 19 PHE HE1 H -0.813 -0.059 -17.357 1.00 . A A . 19 PHE HE1 1 1 13 5071 1 1 19 PHE HE2 H 2.049 2.131 -15.080 1.00 . A A . 19 PHE HE2 1 1 13 5072 1 1 19 PHE HZ H 1.141 1.437 -17.261 1.00 . A A . 19 PHE HZ 1 1 13 5073 1 1 19 PHE N N -0.749 -2.615 -13.456 1.00 . A A . 19 PHE N 1 1 13 5074 1 1 19 PHE O O -2.293 -1.452 -10.557 1.00 . A A . 19 PHE O 1 1 13 5075 1 1 20 GLN C C -1.890 -5.605 -9.681 1.00 . A A . 20 GLN C 1 1 13 5076 1 1 20 GLN CA C -2.193 -4.114 -9.791 1.00 . A A . 20 GLN CA 1 1 13 5077 1 1 20 GLN CB C -3.691 -3.902 -10.021 1.00 . A A . 20 GLN CB 1 1 13 5078 1 1 20 GLN CD C -5.162 -4.547 -8.071 1.00 . A A . 20 GLN CD 1 1 13 5079 1 1 20 GLN CG C -4.434 -3.424 -8.784 1.00 . A A . 20 GLN CG 1 1 13 5080 1 1 20 GLN H H -0.808 -4.060 -11.391 1.00 . A A . 20 GLN H 1 1 13 5081 1 1 20 GLN HA H -1.909 -3.632 -8.868 1.00 . A A . 20 GLN HA 1 1 13 5082 1 1 20 GLN HB2 H -3.823 -3.167 -10.801 1.00 . A A . 20 GLN HB2 1 1 13 5083 1 1 20 GLN HB3 H -4.130 -4.836 -10.339 1.00 . A A . 20 GLN HB3 1 1 13 5084 1 1 20 GLN HE21 H -6.336 -4.823 -9.652 1.00 . A A . 20 GLN HE21 1 1 13 5085 1 1 20 GLN HE22 H -6.629 -5.868 -8.307 1.00 . A A . 20 GLN HE22 1 1 13 5086 1 1 20 GLN HG2 H -3.724 -2.985 -8.099 1.00 . A A . 20 GLN HG2 1 1 13 5087 1 1 20 GLN HG3 H -5.156 -2.677 -9.080 1.00 . A A . 20 GLN HG3 1 1 13 5088 1 1 20 GLN N N -1.425 -3.505 -10.870 1.00 . A A . 20 GLN N 1 1 13 5089 1 1 20 GLN NE2 N -6.142 -5.139 -8.744 1.00 . A A . 20 GLN NE2 1 1 13 5090 1 1 20 GLN O O -2.146 -6.371 -10.610 1.00 . A A . 20 GLN O 1 1 13 5091 1 1 20 GLN OE1 O -4.848 -4.878 -6.927 1.00 . A A . 20 GLN OE1 1 1 13 5092 1 1 21 PHE C C -1.604 -7.905 -6.999 1.00 . A A . 21 PHE C 1 1 13 5093 1 1 21 PHE CA C -1.001 -7.408 -8.309 1.00 . A A . 21 PHE CA 1 1 13 5094 1 1 21 PHE CB C 0.518 -7.588 -8.286 1.00 . A A . 21 PHE CB 1 1 13 5095 1 1 21 PHE CD1 C 1.803 -8.715 -10.123 1.00 . A A . 21 PHE CD1 1 1 13 5096 1 1 21 PHE CD2 C 1.071 -6.471 -10.464 1.00 . A A . 21 PHE CD2 1 1 13 5097 1 1 21 PHE CE1 C 2.379 -8.721 -11.380 1.00 . A A . 21 PHE CE1 1 1 13 5098 1 1 21 PHE CE2 C 1.644 -6.472 -11.721 1.00 . A A . 21 PHE CE2 1 1 13 5099 1 1 21 PHE CG C 1.143 -7.591 -9.652 1.00 . A A . 21 PHE CG 1 1 13 5100 1 1 21 PHE CZ C 2.300 -7.598 -12.180 1.00 . A A . 21 PHE CZ 1 1 13 5101 1 1 21 PHE H H -1.160 -5.350 -7.837 1.00 . A A . 21 PHE H 1 1 13 5102 1 1 21 PHE HA H -1.411 -7.987 -9.123 1.00 . A A . 21 PHE HA 1 1 13 5103 1 1 21 PHE HB2 H 0.961 -6.781 -7.721 1.00 . A A . 21 PHE HB2 1 1 13 5104 1 1 21 PHE HB3 H 0.755 -8.527 -7.809 1.00 . A A . 21 PHE HB3 1 1 13 5105 1 1 21 PHE HD1 H 1.866 -9.594 -9.498 1.00 . A A . 21 PHE HD1 1 1 13 5106 1 1 21 PHE HD2 H 0.559 -5.589 -10.106 1.00 . A A . 21 PHE HD2 1 1 13 5107 1 1 21 PHE HE1 H 2.891 -9.603 -11.735 1.00 . A A . 21 PHE HE1 1 1 13 5108 1 1 21 PHE HE2 H 1.581 -5.592 -12.344 1.00 . A A . 21 PHE HE2 1 1 13 5109 1 1 21 PHE HZ H 2.748 -7.601 -13.162 1.00 . A A . 21 PHE HZ 1 1 13 5110 1 1 21 PHE N N -1.341 -6.009 -8.540 1.00 . A A . 21 PHE N 1 1 13 5111 1 1 21 PHE O O -1.039 -7.698 -5.925 1.00 . A A . 21 PHE O 1 1 13 5112 1 1 22 VAL C C -2.797 -10.392 -5.453 1.00 . A A . 22 VAL C 1 1 13 5113 1 1 22 VAL CA C -3.436 -9.089 -5.919 1.00 . A A . 22 VAL CA 1 1 13 5114 1 1 22 VAL CB C -4.931 -9.334 -6.198 1.00 . A A . 22 VAL CB 1 1 13 5115 1 1 22 VAL CG1 C -5.653 -8.016 -6.434 1.00 . A A . 22 VAL CG1 1 1 13 5116 1 1 22 VAL CG2 C -5.105 -10.267 -7.386 1.00 . A A . 22 VAL CG2 1 1 13 5117 1 1 22 VAL H H -3.157 -8.695 -7.979 1.00 . A A . 22 VAL H 1 1 13 5118 1 1 22 VAL HA H -3.354 -8.356 -5.129 1.00 . A A . 22 VAL HA 1 1 13 5119 1 1 22 VAL HB H -5.366 -9.806 -5.329 1.00 . A A . 22 VAL HB 1 1 13 5120 1 1 22 VAL HG11 H -6.612 -8.208 -6.892 1.00 . A A . 22 VAL HG11 1 1 13 5121 1 1 22 VAL HG12 H -5.798 -7.511 -5.490 1.00 . A A . 22 VAL HG12 1 1 13 5122 1 1 22 VAL HG13 H -5.061 -7.393 -7.088 1.00 . A A . 22 VAL HG13 1 1 13 5123 1 1 22 VAL HG21 H -4.138 -10.626 -7.705 1.00 . A A . 22 VAL HG21 1 1 13 5124 1 1 22 VAL HG22 H -5.724 -11.105 -7.099 1.00 . A A . 22 VAL HG22 1 1 13 5125 1 1 22 VAL HG23 H -5.577 -9.733 -8.198 1.00 . A A . 22 VAL HG23 1 1 13 5126 1 1 22 VAL N N -2.756 -8.562 -7.095 1.00 . A A . 22 VAL N 1 1 13 5127 1 1 22 VAL O O -3.036 -10.848 -4.334 1.00 . A A . 22 VAL O 1 1 13 5128 1 1 23 PHE C C -0.348 -12.644 -7.109 1.00 . A A . 23 PHE C 1 1 13 5129 1 1 23 PHE CA C -1.309 -12.241 -5.995 1.00 . A A . 23 PHE CA 1 1 13 5130 1 1 23 PHE CB C -2.335 -13.352 -5.765 1.00 . A A . 23 PHE CB 1 1 13 5131 1 1 23 PHE CD1 C -0.974 -14.441 -3.960 1.00 . A A . 23 PHE CD1 1 1 13 5132 1 1 23 PHE CD2 C -2.013 -15.834 -5.592 1.00 . A A . 23 PHE CD2 1 1 13 5133 1 1 23 PHE CE1 C -0.445 -15.557 -3.339 1.00 . A A . 23 PHE CE1 1 1 13 5134 1 1 23 PHE CE2 C -1.488 -16.954 -4.975 1.00 . A A . 23 PHE CE2 1 1 13 5135 1 1 23 PHE CG C -1.762 -14.567 -5.092 1.00 . A A . 23 PHE CG 1 1 13 5136 1 1 23 PHE CZ C -0.702 -16.815 -3.847 1.00 . A A . 23 PHE CZ 1 1 13 5137 1 1 23 PHE H H -1.832 -10.576 -7.194 1.00 . A A . 23 PHE H 1 1 13 5138 1 1 23 PHE HA H -0.746 -12.089 -5.087 1.00 . A A . 23 PHE HA 1 1 13 5139 1 1 23 PHE HB2 H -3.132 -12.973 -5.142 1.00 . A A . 23 PHE HB2 1 1 13 5140 1 1 23 PHE HB3 H -2.742 -13.659 -6.716 1.00 . A A . 23 PHE HB3 1 1 13 5141 1 1 23 PHE HD1 H -0.772 -13.456 -3.561 1.00 . A A . 23 PHE HD1 1 1 13 5142 1 1 23 PHE HD2 H -2.626 -15.945 -6.475 1.00 . A A . 23 PHE HD2 1 1 13 5143 1 1 23 PHE HE1 H 0.169 -15.444 -2.457 1.00 . A A . 23 PHE HE1 1 1 13 5144 1 1 23 PHE HE2 H -1.689 -17.936 -5.375 1.00 . A A . 23 PHE HE2 1 1 13 5145 1 1 23 PHE HZ H -0.291 -17.688 -3.363 1.00 . A A . 23 PHE HZ 1 1 13 5146 1 1 23 PHE N N -1.983 -10.988 -6.318 1.00 . A A . 23 PHE N 1 1 13 5147 1 1 23 PHE O O -0.137 -13.829 -7.363 1.00 . A A . 23 PHE O 1 1 13 5148 1 1 24 DBU C C 0.642 -11.601 -10.180 1.00 . A A . 24 DBU C 1 1 13 5149 1 1 24 DBU CA C 1.110 -11.881 -8.790 1.00 . A A . 24 DBU CA 1 1 13 5150 1 1 24 DBU CB C 2.369 -12.342 -8.679 1.00 . A A . 24 DBU CB 1 1 13 5151 1 1 24 DBU CG C 3.072 -12.697 -7.407 1.00 . A A . 24 DBU CG 1 1 13 5152 1 1 24 DBU HG1 H 2.392 -12.869 -6.568 1.00 . A A . 24 DBU HG1 1 1 13 5153 1 1 24 DBU HG2 H 3.755 -11.889 -7.126 1.00 . A A . 24 DBU HG2 1 1 13 5154 1 1 24 DBU HG3 H 3.661 -13.607 -7.553 1.00 . A A . 24 DBU HG3 1 1 13 5155 1 1 24 DBU N N 0.232 -11.648 -7.772 1.00 . A A . 24 DBU N 1 1 13 5156 1 1 24 DBU O O 1.448 -11.431 -11.096 1.00 . A A . 24 DBU O 1 1 13 5157 1 1 25 CYS C C -1.246 -9.790 -11.975 1.00 . A A . 25 CYS C 1 1 13 5158 1 1 25 CYS CA C -1.261 -11.284 -11.665 1.00 . A A . 25 CYS CA 1 1 13 5159 1 1 25 CYS CB C -2.695 -11.814 -11.721 1.00 . A A . 25 CYS CB 1 1 13 5160 1 1 25 CYS H H -1.266 -11.694 -9.588 1.00 . A A . 25 CYS H 1 1 13 5161 1 1 25 CYS HA H -0.667 -11.798 -12.406 1.00 . A A . 25 CYS HA 1 1 13 5162 1 1 25 CYS HB2 H -3.324 -11.192 -11.100 1.00 . A A . 25 CYS HB2 1 1 13 5163 1 1 25 CYS HB3 H -3.048 -11.769 -12.741 1.00 . A A . 25 CYS HB3 1 1 13 5164 1 1 25 CYS N N -0.674 -11.549 -10.357 1.00 . A A . 25 CYS N 1 1 13 5165 1 1 25 CYS O O -0.897 -8.971 -11.123 1.00 . A A . 25 CYS O 1 1 13 5166 1 1 25 CYS SG S -2.876 -13.533 -11.146 1.00 . A A . 25 CYS SG 1 1 13 5167 1 1 26 CYS C C -3.091 -7.523 -13.665 1.00 . A A . 26 CYS C 1 1 13 5168 1 1 26 CYS CA C -1.658 -8.047 -13.623 1.00 . A A . 26 CYS CA 1 1 13 5169 1 1 26 CYS CB C -1.007 -7.896 -14.999 1.00 . A A . 26 CYS CB 1 1 13 5170 1 1 26 CYS H H -1.894 -10.140 -13.834 1.00 . A A . 26 CYS H 1 1 13 5171 1 1 26 CYS HA H -1.098 -7.469 -12.904 1.00 . A A . 26 CYS HA 1 1 13 5172 1 1 26 CYS HB2 H 0.067 -7.921 -14.886 1.00 . A A . 26 CYS HB2 1 1 13 5173 1 1 26 CYS HB3 H -1.317 -8.717 -15.628 1.00 . A A . 26 CYS HB3 1 1 13 5174 1 1 26 CYS N N -1.627 -9.441 -13.199 1.00 . A A . 26 CYS N 1 1 13 5175 1 1 26 CYS O O -4.002 -8.214 -14.121 1.00 . A A . 26 CYS O 1 1 13 5176 1 1 26 CYS SG S -1.435 -6.347 -15.858 1.00 . A A . 26 CYS SG 1 1 13 5177 1 1 27 SER C C -4.495 -4.170 -12.988 1.00 . A A . 27 SER C 1 1 13 5178 1 1 27 SER CA C -4.603 -5.681 -13.168 1.00 . A A . 27 SER CA 1 1 13 5179 1 1 27 SER CB C -5.451 -6.281 -12.044 1.00 . A A . 27 SER CB 1 1 13 5180 1 1 27 SER H H -2.514 -5.796 -12.839 1.00 . A A . 27 SER H 1 1 13 5181 1 1 27 SER HA H -5.079 -5.887 -14.115 1.00 . A A . 27 SER HA 1 1 13 5182 1 1 27 SER HB2 H -4.809 -6.803 -11.351 1.00 . A A . 27 SER HB2 1 1 13 5183 1 1 27 SER HB3 H -5.970 -5.487 -11.526 1.00 . A A . 27 SER HB3 1 1 13 5184 1 1 27 SER HG H -7.208 -7.146 -12.032 1.00 . A A . 27 SER HG 1 1 13 5185 1 1 27 SER N N -3.281 -6.297 -13.188 1.00 . A A . 27 SER N 1 1 13 5186 1 1 27 SER O O -5.466 -3.508 -12.625 1.00 . A A . 27 SER O 1 1 13 5187 1 1 27 SER OG O -6.406 -7.193 -12.557 1.00 . A A . 27 SER OG 1 1 14 5188 1 1 1 LYS C C 1.785 -0.278 -1.681 1.00 . A A . 1 LYS C 1 1 14 5189 1 1 1 LYS CA C 3.016 0.240 -0.943 1.00 . A A . 1 LYS CA 1 1 14 5190 1 1 1 LYS CB C 4.011 -0.902 -0.724 1.00 . A A . 1 LYS CB 1 1 14 5191 1 1 1 LYS CD C 5.545 -2.546 -1.843 1.00 . A A . 1 LYS CD 1 1 14 5192 1 1 1 LYS CE C 6.851 -2.502 -1.064 1.00 . A A . 1 LYS CE 1 1 14 5193 1 1 1 LYS CG C 4.900 -1.173 -1.925 1.00 . A A . 1 LYS CG 1 1 14 5194 1 1 1 LYS H1 H 2.787 0.329 1.160 1.00 . A A . 1 LYS H1 1 1 14 5195 1 1 1 LYS HA H 3.485 1.005 -1.543 1.00 . A A . 1 LYS HA 1 1 14 5196 1 1 1 LYS HB2 H 4.642 -0.656 0.117 1.00 . A A . 1 LYS HB2 1 1 14 5197 1 1 1 LYS HB3 H 3.461 -1.804 -0.499 1.00 . A A . 1 LYS HB3 1 1 14 5198 1 1 1 LYS HD2 H 4.866 -3.224 -1.348 1.00 . A A . 1 LYS HD2 1 1 14 5199 1 1 1 LYS HD3 H 5.745 -2.900 -2.844 1.00 . A A . 1 LYS HD3 1 1 14 5200 1 1 1 LYS HE2 H 7.602 -2.022 -1.672 1.00 . A A . 1 LYS HE2 1 1 14 5201 1 1 1 LYS HE3 H 6.697 -1.928 -0.162 1.00 . A A . 1 LYS HE3 1 1 14 5202 1 1 1 LYS HG2 H 4.302 -1.121 -2.823 1.00 . A A . 1 LYS HG2 1 1 14 5203 1 1 1 LYS HG3 H 5.676 -0.422 -1.964 1.00 . A A . 1 LYS HG3 1 1 14 5204 1 1 1 LYS HZ1 H 6.547 -4.407 -0.263 1.00 . A A . 1 LYS HZ1 1 1 14 5205 1 1 1 LYS HZ2 H 8.107 -3.801 -0.015 1.00 . A A . 1 LYS HZ2 1 1 14 5206 1 1 1 LYS HZ3 H 7.653 -4.370 -1.542 1.00 . A A . 1 LYS HZ3 1 1 14 5207 1 1 1 LYS N N 2.643 0.838 0.334 1.00 . A A . 1 LYS N 1 1 14 5208 1 1 1 LYS NZ N 7.323 -3.866 -0.696 1.00 . A A . 1 LYS NZ 1 1 14 5209 1 1 1 LYS O O 1.692 -1.464 -1.998 1.00 . A A . 1 LYS O 1 1 14 5210 1 1 2 LYS C C -0.111 0.037 -4.142 1.00 . A A . 2 LYS C 1 1 14 5211 1 1 2 LYS CA C -0.381 0.253 -2.657 1.00 . A A . 2 LYS CA 1 1 14 5212 1 1 2 LYS CB C -1.443 1.339 -2.473 1.00 . A A . 2 LYS CB 1 1 14 5213 1 1 2 LYS CD C -3.365 1.512 -0.865 1.00 . A A . 2 LYS CD 1 1 14 5214 1 1 2 LYS CE C -4.321 2.626 -1.261 1.00 . A A . 2 LYS CE 1 1 14 5215 1 1 2 LYS CG C -2.807 0.797 -2.084 1.00 . A A . 2 LYS CG 1 1 14 5216 1 1 2 LYS H H 0.975 1.549 -1.675 1.00 . A A . 2 LYS H 1 1 14 5217 1 1 2 LYS HA H -0.745 -0.670 -2.232 1.00 . A A . 2 LYS HA 1 1 14 5218 1 1 2 LYS HB2 H -1.115 2.019 -1.701 1.00 . A A . 2 LYS HB2 1 1 14 5219 1 1 2 LYS HB3 H -1.547 1.885 -3.400 1.00 . A A . 2 LYS HB3 1 1 14 5220 1 1 2 LYS HD2 H -3.895 0.799 -0.251 1.00 . A A . 2 LYS HD2 1 1 14 5221 1 1 2 LYS HD3 H -2.545 1.936 -0.301 1.00 . A A . 2 LYS HD3 1 1 14 5222 1 1 2 LYS HE2 H -3.986 3.056 -2.193 1.00 . A A . 2 LYS HE2 1 1 14 5223 1 1 2 LYS HE3 H -5.307 2.206 -1.392 1.00 . A A . 2 LYS HE3 1 1 14 5224 1 1 2 LYS HG2 H -3.488 0.933 -2.911 1.00 . A A . 2 LYS HG2 1 1 14 5225 1 1 2 LYS HG3 H -2.715 -0.257 -1.861 1.00 . A A . 2 LYS HG3 1 1 14 5226 1 1 2 LYS HZ1 H -5.304 3.675 0.254 1.00 . A A . 2 LYS HZ1 1 1 14 5227 1 1 2 LYS HZ2 H -4.261 4.630 -0.673 1.00 . A A . 2 LYS HZ2 1 1 14 5228 1 1 2 LYS HZ3 H -3.631 3.559 0.476 1.00 . A A . 2 LYS HZ3 1 1 14 5229 1 1 2 LYS N N 0.843 0.618 -1.953 1.00 . A A . 2 LYS N 1 1 14 5230 1 1 2 LYS NZ N -4.383 3.697 -0.229 1.00 . A A . 2 LYS NZ 1 1 14 5231 1 1 2 LYS O O -0.450 -1.007 -4.701 1.00 . A A . 2 LYS O 1 1 14 5232 1 1 3 LYS C C 1.579 -0.338 -6.513 1.00 . A A . 3 LYS C 1 1 14 5233 1 1 3 LYS CA C 0.822 0.948 -6.198 1.00 . A A . 3 LYS CA 1 1 14 5234 1 1 3 LYS CB C 1.653 2.160 -6.626 1.00 . A A . 3 LYS CB 1 1 14 5235 1 1 3 LYS CD C 1.665 4.422 -7.716 1.00 . A A . 3 LYS CD 1 1 14 5236 1 1 3 LYS CE C 0.900 5.394 -8.602 1.00 . A A . 3 LYS CE 1 1 14 5237 1 1 3 LYS CG C 0.909 3.115 -7.542 1.00 . A A . 3 LYS CG 1 1 14 5238 1 1 3 LYS H H 0.749 1.837 -4.278 1.00 . A A . 3 LYS H 1 1 14 5239 1 1 3 LYS HA H -0.108 0.948 -6.747 1.00 . A A . 3 LYS HA 1 1 14 5240 1 1 3 LYS HB2 H 1.957 2.703 -5.743 1.00 . A A . 3 LYS HB2 1 1 14 5241 1 1 3 LYS HB3 H 2.535 1.811 -7.144 1.00 . A A . 3 LYS HB3 1 1 14 5242 1 1 3 LYS HD2 H 1.811 4.876 -6.747 1.00 . A A . 3 LYS HD2 1 1 14 5243 1 1 3 LYS HD3 H 2.625 4.216 -8.168 1.00 . A A . 3 LYS HD3 1 1 14 5244 1 1 3 LYS HE2 H 1.122 5.171 -9.634 1.00 . A A . 3 LYS HE2 1 1 14 5245 1 1 3 LYS HE3 H -0.157 5.266 -8.425 1.00 . A A . 3 LYS HE3 1 1 14 5246 1 1 3 LYS HG2 H 0.787 2.651 -8.509 1.00 . A A . 3 LYS HG2 1 1 14 5247 1 1 3 LYS HG3 H -0.062 3.325 -7.116 1.00 . A A . 3 LYS HG3 1 1 14 5248 1 1 3 LYS HZ1 H 1.770 7.216 -9.139 1.00 . A A . 3 LYS HZ1 1 1 14 5249 1 1 3 LYS HZ2 H 1.894 6.858 -7.490 1.00 . A A . 3 LYS HZ2 1 1 14 5250 1 1 3 LYS HZ3 H 0.417 7.372 -8.135 1.00 . A A . 3 LYS HZ3 1 1 14 5251 1 1 3 LYS N N 0.503 1.030 -4.778 1.00 . A A . 3 LYS N 1 1 14 5252 1 1 3 LYS NZ N 1.271 6.809 -8.322 1.00 . A A . 3 LYS NZ 1 1 14 5253 1 1 3 LYS O O 2.351 -0.832 -5.692 1.00 . A A . 3 LYS O 1 1 14 5254 1 1 4 SER C C 2.173 -2.142 -9.647 1.00 . A A . 4 SER C 1 1 14 5255 1 1 4 SER CA C 2.012 -2.105 -8.130 1.00 . A A . 4 SER CA 1 1 14 5256 1 1 4 SER CB C 1.214 -3.323 -7.661 1.00 . A A . 4 SER CB 1 1 14 5257 1 1 4 SER H H 0.726 -0.434 -8.319 1.00 . A A . 4 SER H 1 1 14 5258 1 1 4 SER HA H 2.991 -2.130 -7.675 1.00 . A A . 4 SER HA 1 1 14 5259 1 1 4 SER HB2 H 1.592 -4.208 -8.150 1.00 . A A . 4 SER HB2 1 1 14 5260 1 1 4 SER HB3 H 1.321 -3.429 -6.591 1.00 . A A . 4 SER HB3 1 1 14 5261 1 1 4 SER HG H -0.345 -3.608 -8.812 1.00 . A A . 4 SER HG 1 1 14 5262 1 1 4 SER N N 1.353 -0.875 -7.708 1.00 . A A . 4 SER N 1 1 14 5263 1 1 4 SER O O 1.320 -1.653 -10.385 1.00 . A A . 4 SER O 1 1 14 5264 1 1 4 SER OG O -0.161 -3.182 -7.971 1.00 . A A . 4 SER OG 1 1 14 5265 1 1 5 GLY C C 4.608 -3.831 -11.864 1.00 . A A . 5 GLY C 1 1 14 5266 1 1 5 GLY CA C 3.531 -2.818 -11.530 1.00 . A A . 5 GLY CA 1 1 14 5267 1 1 5 GLY H H 3.922 -3.100 -9.469 1.00 . A A . 5 GLY H 1 1 14 5268 1 1 5 GLY HA2 H 2.617 -3.101 -12.031 1.00 . A A . 5 GLY HA2 1 1 14 5269 1 1 5 GLY HA3 H 3.841 -1.848 -11.891 1.00 . A A . 5 GLY HA3 1 1 14 5270 1 1 5 GLY N N 3.276 -2.727 -10.105 1.00 . A A . 5 GLY N 1 1 14 5271 1 1 5 GLY O O 5.567 -3.519 -12.569 1.00 . A A . 5 GLY O 1 1 14 5272 1 1 6 VAL C C 5.714 -6.250 -13.090 1.00 . A A . 6 VAL C 1 1 14 5273 1 1 6 VAL CA C 5.418 -6.112 -11.601 1.00 . A A . 6 VAL CA 1 1 14 5274 1 1 6 VAL CB C 4.916 -7.464 -11.061 1.00 . A A . 6 VAL CB 1 1 14 5275 1 1 6 VAL CG1 C 5.860 -8.585 -11.468 1.00 . A A . 6 VAL CG1 1 1 14 5276 1 1 6 VAL CG2 C 4.762 -7.409 -9.549 1.00 . A A . 6 VAL CG2 1 1 14 5277 1 1 6 VAL H H 3.665 -5.237 -10.799 1.00 . A A . 6 VAL H 1 1 14 5278 1 1 6 VAL HA H 6.332 -5.858 -11.084 1.00 . A A . 6 VAL HA 1 1 14 5279 1 1 6 VAL HB H 3.947 -7.664 -11.493 1.00 . A A . 6 VAL HB 1 1 14 5280 1 1 6 VAL HG11 H 5.683 -8.846 -12.501 1.00 . A A . 6 VAL HG11 1 1 14 5281 1 1 6 VAL HG12 H 6.882 -8.257 -11.348 1.00 . A A . 6 VAL HG12 1 1 14 5282 1 1 6 VAL HG13 H 5.683 -9.449 -10.844 1.00 . A A . 6 VAL HG13 1 1 14 5283 1 1 6 VAL HG21 H 3.981 -6.708 -9.292 1.00 . A A . 6 VAL HG21 1 1 14 5284 1 1 6 VAL HG22 H 4.502 -8.389 -9.177 1.00 . A A . 6 VAL HG22 1 1 14 5285 1 1 6 VAL HG23 H 5.693 -7.090 -9.103 1.00 . A A . 6 VAL HG23 1 1 14 5286 1 1 6 VAL N N 4.451 -5.049 -11.354 1.00 . A A . 6 VAL N 1 1 14 5287 1 1 6 VAL O O 6.719 -5.737 -13.584 1.00 . A A . 6 VAL O 1 1 14 5288 1 1 7 ILE C C 3.652 -7.155 -15.949 1.00 . A A . 7 ILE C 1 1 14 5289 1 1 7 ILE CA C 4.999 -7.150 -15.235 1.00 . A A . 7 ILE CA 1 1 14 5290 1 1 7 ILE CB C 5.732 -8.471 -15.534 1.00 . A A . 7 ILE CB 1 1 14 5291 1 1 7 ILE CD1 C 8.058 -7.438 -15.503 1.00 . A A . 7 ILE CD1 1 1 14 5292 1 1 7 ILE CG1 C 7.124 -8.463 -14.898 1.00 . A A . 7 ILE CG1 1 1 14 5293 1 1 7 ILE CG2 C 5.830 -8.694 -17.035 1.00 . A A . 7 ILE CG2 1 1 14 5294 1 1 7 ILE H H 4.052 -7.329 -13.351 1.00 . A A . 7 ILE H 1 1 14 5295 1 1 7 ILE HA H 5.595 -6.335 -15.620 1.00 . A A . 7 ILE HA 1 1 14 5296 1 1 7 ILE HB H 5.156 -9.280 -15.111 1.00 . A A . 7 ILE HB 1 1 14 5297 1 1 7 ILE HD11 H 8.830 -7.942 -16.066 1.00 . A A . 7 ILE HD11 1 1 14 5298 1 1 7 ILE HD12 H 7.501 -6.785 -16.159 1.00 . A A . 7 ILE HD12 1 1 14 5299 1 1 7 ILE HD13 H 8.511 -6.855 -14.715 1.00 . A A . 7 ILE HD13 1 1 14 5300 1 1 7 ILE HG12 H 7.031 -8.245 -13.846 1.00 . A A . 7 ILE HG12 1 1 14 5301 1 1 7 ILE HG13 H 7.573 -9.437 -15.023 1.00 . A A . 7 ILE HG13 1 1 14 5302 1 1 7 ILE HG21 H 6.384 -9.600 -17.229 1.00 . A A . 7 ILE HG21 1 1 14 5303 1 1 7 ILE HG22 H 4.838 -8.783 -17.451 1.00 . A A . 7 ILE HG22 1 1 14 5304 1 1 7 ILE HG23 H 6.338 -7.857 -17.491 1.00 . A A . 7 ILE HG23 1 1 14 5305 1 1 7 ILE N N 4.833 -6.945 -13.801 1.00 . A A . 7 ILE N 1 1 14 5306 1 1 7 ILE O O 2.796 -8.006 -15.705 1.00 . A A . 7 ILE O 1 1 14 5307 1 1 8 PRO C C 2.052 -7.178 -18.646 1.00 . A A . 8 PRO C 1 1 14 5308 1 1 8 PRO CA C 2.217 -6.057 -17.625 1.00 . A A . 8 PRO CA 1 1 14 5309 1 1 8 PRO CB C 2.375 -4.709 -18.331 1.00 . A A . 8 PRO CB 1 1 14 5310 1 1 8 PRO CD C 4.434 -5.137 -17.195 1.00 . A A . 8 PRO CD 1 1 14 5311 1 1 8 PRO CG C 3.847 -4.500 -18.424 1.00 . A A . 8 PRO CG 1 1 14 5312 1 1 8 PRO HA H 1.351 -6.029 -16.980 1.00 . A A . 8 PRO HA 1 1 14 5313 1 1 8 PRO HB2 H 1.919 -4.757 -19.310 1.00 . A A . 8 PRO HB2 1 1 14 5314 1 1 8 PRO HB3 H 1.903 -3.934 -17.746 1.00 . A A . 8 PRO HB3 1 1 14 5315 1 1 8 PRO HD2 H 5.400 -5.567 -17.417 1.00 . A A . 8 PRO HD2 1 1 14 5316 1 1 8 PRO HD3 H 4.517 -4.413 -16.398 1.00 . A A . 8 PRO HD3 1 1 14 5317 1 1 8 PRO HG2 H 4.230 -4.978 -19.313 1.00 . A A . 8 PRO HG2 1 1 14 5318 1 1 8 PRO HG3 H 4.068 -3.443 -18.440 1.00 . A A . 8 PRO HG3 1 1 14 5319 1 1 8 PRO N N 3.458 -6.185 -16.854 1.00 . A A . 8 PRO N 1 1 14 5320 1 1 8 PRO O O 2.301 -6.987 -19.835 1.00 . A A . 8 PRO O 1 1 14 5321 1 1 9 . C C 1.946 -10.746 -18.375 1.00 . A A . 9 DBB C 1 1 14 5322 1 1 9 . CA C 1.428 -9.505 -19.053 1.00 . A A . 9 DBB CA 1 1 14 5323 1 1 9 . CB C -0.064 -9.669 -19.347 1.00 . A A . 9 DBB CB 1 1 14 5324 1 1 9 . CG C -0.339 -11.100 -19.814 1.00 . A A . 9 DBB CG 1 1 14 5325 1 1 9 . H H 1.446 -8.436 -17.214 1.00 . A A . 9 DBB H 1 1 14 5326 1 1 9 . HA H 1.968 -9.349 -19.987 1.00 . A A . 9 DBB HA 1 1 14 5327 1 1 9 . HB2 H -0.360 -8.969 -20.128 1.00 . A A . 9 DBB HB2 1 1 14 5328 1 1 9 . HG1 H -1.277 -11.128 -20.369 1.00 . A A . 9 DBB HG1 1 1 14 5329 1 1 9 . HG2 H 0.474 -11.435 -20.456 1.00 . A A . 9 DBB HG2 1 1 14 5330 1 1 9 . HG3 H -0.411 -11.756 -18.946 1.00 . A A . 9 DBB HG3 1 1 14 5331 1 1 9 . N N 1.629 -8.346 -18.173 1.00 . A A . 9 DBB N 1 1 14 5332 1 1 9 . O O 2.752 -11.485 -18.940 1.00 . A A . 9 DBB O 1 1 14 5333 1 1 10 VAL C C 0.743 -12.735 -15.591 1.00 . A A . 10 VAL C 1 1 14 5334 1 1 10 VAL CA C 1.904 -12.151 -16.387 1.00 . A A . 10 VAL CA 1 1 14 5335 1 1 10 VAL CB C 3.052 -11.804 -15.420 1.00 . A A . 10 VAL CB 1 1 14 5336 1 1 10 VAL CG1 C 4.324 -11.490 -16.192 1.00 . A A . 10 VAL CG1 1 1 14 5337 1 1 10 VAL CG2 C 2.660 -10.639 -14.524 1.00 . A A . 10 VAL CG2 1 1 14 5338 1 1 10 VAL H H 0.842 -10.357 -16.753 1.00 . A A . 10 VAL H 1 1 14 5339 1 1 10 VAL HA H 2.261 -12.895 -17.084 1.00 . A A . 10 VAL HA 1 1 14 5340 1 1 10 VAL HB H 3.240 -12.665 -14.794 1.00 . A A . 10 VAL HB 1 1 14 5341 1 1 10 VAL HG11 H 4.145 -10.657 -16.856 1.00 . A A . 10 VAL HG11 1 1 14 5342 1 1 10 VAL HG12 H 5.113 -11.237 -15.499 1.00 . A A . 10 VAL HG12 1 1 14 5343 1 1 10 VAL HG13 H 4.616 -12.354 -16.771 1.00 . A A . 10 VAL HG13 1 1 14 5344 1 1 10 VAL HG21 H 1.941 -10.018 -15.037 1.00 . A A . 10 VAL HG21 1 1 14 5345 1 1 10 VAL HG22 H 2.223 -11.017 -13.611 1.00 . A A . 10 VAL HG22 1 1 14 5346 1 1 10 VAL HG23 H 3.537 -10.056 -14.287 1.00 . A A . 10 VAL HG23 1 1 14 5347 1 1 10 VAL N N 1.483 -10.983 -17.151 1.00 . A A . 10 VAL N 1 1 14 5348 1 1 10 VAL O O 0.434 -12.272 -14.494 1.00 . A A . 10 VAL O 1 1 14 5349 1 1 11 DAL C C -1.744 -15.303 -16.473 1.00 . A A . 11 DAL C 1 1 14 5350 1 1 11 DAL CA C -1.035 -14.409 -15.489 1.00 . A A . 11 DAL CA 1 1 14 5351 1 1 11 DAL CB C -0.526 -15.246 -14.313 1.00 . A A . 11 DAL CB 1 1 14 5352 1 1 11 DAL H H 0.395 -14.079 -17.029 1.00 . A A . 11 DAL H 1 1 14 5353 1 1 11 DAL HA H -1.727 -13.650 -15.123 1.00 . A A . 11 DAL HA 1 1 14 5354 1 1 11 DAL HB1 H -1.374 -15.655 -13.764 1.00 . A A . 11 DAL HB1 1 1 14 5355 1 1 11 DAL HB2 H 0.091 -16.062 -14.689 1.00 . A A . 11 DAL HB2 1 1 14 5356 1 1 11 DAL N N 0.102 -13.755 -16.152 1.00 . A A . 11 DAL N 1 1 14 5357 1 1 11 DAL O O -1.127 -16.163 -17.103 1.00 . A A . 11 DAL O 1 1 14 5358 1 1 12 HIS C C -4.888 -15.037 -18.242 1.00 . A A . 12 HIS C 1 1 14 5359 1 1 12 HIS CA C -3.853 -15.904 -17.531 1.00 . A A . 12 HIS CA 1 1 14 5360 1 1 12 HIS CB C -4.550 -17.039 -16.781 1.00 . A A . 12 HIS CB 1 1 14 5361 1 1 12 HIS CD2 C -6.607 -16.347 -15.360 1.00 . A A . 12 HIS CD2 1 1 14 5362 1 1 12 HIS CE1 C -5.571 -15.941 -13.472 1.00 . A A . 12 HIS CE1 1 1 14 5363 1 1 12 HIS CG C -5.290 -16.585 -15.560 1.00 . A A . 12 HIS CG 1 1 14 5364 1 1 12 HIS H H -3.487 -14.405 -16.081 1.00 . A A . 12 HIS H 1 1 14 5365 1 1 12 HIS HA H -3.188 -16.326 -18.269 1.00 . A A . 12 HIS HA 1 1 14 5366 1 1 12 HIS HB2 H -5.261 -17.515 -17.440 1.00 . A A . 12 HIS HB2 1 1 14 5367 1 1 12 HIS HB3 H -3.811 -17.764 -16.471 1.00 . A A . 12 HIS HB3 1 1 14 5368 1 1 12 HIS HD1 H -3.708 -16.400 -14.181 1.00 . A A . 12 HIS HD1 1 1 14 5369 1 1 12 HIS HD2 H -7.396 -16.452 -16.092 1.00 . A A . 12 HIS HD2 1 1 14 5370 1 1 12 HIS HE1 H -5.375 -15.670 -12.445 1.00 . A A . 12 HIS HE1 1 1 14 5371 1 1 12 HIS N N -3.051 -15.105 -16.610 1.00 . A A . 12 HIS N 1 1 14 5372 1 1 12 HIS ND1 N -4.668 -16.320 -14.358 1.00 . A A . 12 HIS ND1 1 1 14 5373 1 1 12 HIS NE2 N -6.756 -15.948 -14.055 1.00 . A A . 12 HIS NE2 1 1 14 5374 1 1 12 HIS O O -5.119 -15.187 -19.442 1.00 . A A . 12 HIS O 1 1 14 5375 1 1 13 ASP C C -5.985 -11.817 -18.167 1.00 . A A . 13 ASP C 1 1 14 5376 1 1 13 ASP CA C -6.520 -13.241 -18.052 1.00 . A A . 13 ASP CA 1 1 14 5377 1 1 13 ASP CB C -7.780 -13.258 -17.185 1.00 . A A . 13 ASP CB 1 1 14 5378 1 1 13 ASP CG C -8.995 -13.759 -17.940 1.00 . A A . 13 ASP CG 1 1 14 5379 1 1 13 ASP H H -5.282 -14.061 -16.543 1.00 . A A . 13 ASP H 1 1 14 5380 1 1 13 ASP HA H -6.769 -13.600 -19.039 1.00 . A A . 13 ASP HA 1 1 14 5381 1 1 13 ASP HB2 H -7.616 -13.904 -16.335 1.00 . A A . 13 ASP HB2 1 1 14 5382 1 1 13 ASP HB3 H -7.982 -12.256 -16.837 1.00 . A A . 13 ASP HB3 1 1 14 5383 1 1 13 ASP N N -5.509 -14.132 -17.493 1.00 . A A . 13 ASP N 1 1 14 5384 1 1 13 ASP O O -6.754 -10.859 -18.249 1.00 . A A . 13 ASP O 1 1 14 5385 1 1 13 ASP OD1 O -8.838 -14.667 -18.784 1.00 . A A . 13 ASP OD1 1 1 14 5386 1 1 13 ASP OD2 O -10.104 -13.244 -17.687 1.00 . A A . 13 ASP OD2 1 1 14 5387 1 1 14 CYS C C -3.976 -9.911 -19.727 1.00 . A A . 14 CYS C 1 1 14 5388 1 1 14 CYS CA C -4.024 -10.379 -18.275 1.00 . A A . 14 CYS CA 1 1 14 5389 1 1 14 CYS CB C -2.608 -10.433 -17.698 1.00 . A A . 14 CYS CB 1 1 14 5390 1 1 14 CYS H H -4.102 -12.488 -18.104 1.00 . A A . 14 CYS H 1 1 14 5391 1 1 14 CYS HA H -4.610 -9.677 -17.703 1.00 . A A . 14 CYS HA 1 1 14 5392 1 1 14 CYS HB2 H -2.668 -10.436 -16.619 1.00 . A A . 14 CYS HB2 1 1 14 5393 1 1 14 CYS HB3 H -2.127 -11.342 -18.029 1.00 . A A . 14 CYS HB3 1 1 14 5394 1 1 14 CYS N N -4.663 -11.686 -18.172 1.00 . A A . 14 CYS N 1 1 14 5395 1 1 14 CYS O O -3.501 -10.629 -20.607 1.00 . A A . 14 CYS O 1 1 14 5396 1 1 14 CYS SG S -1.551 -9.034 -18.190 1.00 . A A . 14 CYS SG 1 1 14 5397 1 1 15 HIS C C -3.489 -6.983 -21.428 1.00 . A A . 15 HIS C 1 1 14 5398 1 1 15 HIS CA C -4.483 -8.135 -21.314 1.00 . A A . 15 HIS CA 1 1 14 5399 1 1 15 HIS CB C -5.887 -7.650 -21.672 1.00 . A A . 15 HIS CB 1 1 14 5400 1 1 15 HIS CD2 C -7.821 -8.720 -23.030 1.00 . A A . 15 HIS CD2 1 1 14 5401 1 1 15 HIS CE1 C -7.629 -10.776 -22.296 1.00 . A A . 15 HIS CE1 1 1 14 5402 1 1 15 HIS CG C -6.795 -8.742 -22.147 1.00 . A A . 15 HIS CG 1 1 14 5403 1 1 15 HIS H H -4.834 -8.176 -19.226 1.00 . A A . 15 HIS H 1 1 14 5404 1 1 15 HIS HA H -4.193 -8.914 -22.003 1.00 . A A . 15 HIS HA 1 1 14 5405 1 1 15 HIS HB2 H -6.339 -7.199 -20.801 1.00 . A A . 15 HIS HB2 1 1 14 5406 1 1 15 HIS HB3 H -5.816 -6.911 -22.458 1.00 . A A . 15 HIS HB3 1 1 14 5407 1 1 15 HIS HD1 H -6.051 -10.383 -21.055 1.00 . A A . 15 HIS HD1 1 1 14 5408 1 1 15 HIS HD2 H -8.179 -7.858 -23.576 1.00 . A A . 15 HIS HD2 1 1 14 5409 1 1 15 HIS HE1 H -7.793 -11.832 -22.144 1.00 . A A . 15 HIS HE1 1 1 14 5410 1 1 15 HIS N N -4.470 -8.701 -19.969 1.00 . A A . 15 HIS N 1 1 14 5411 1 1 15 HIS ND1 N -6.702 -10.045 -21.704 1.00 . A A . 15 HIS ND1 1 1 14 5412 1 1 15 HIS NE2 N -8.322 -9.996 -23.105 1.00 . A A . 15 HIS NE2 1 1 14 5413 1 1 15 HIS O O -3.847 -5.880 -21.839 1.00 . A A . 15 HIS O 1 1 14 5414 1 1 16 MET C C -1.639 -4.951 -20.426 1.00 . A A . 16 MET C 1 1 14 5415 1 1 16 MET CA C -1.194 -6.233 -21.122 1.00 . A A . 16 MET CA 1 1 14 5416 1 1 16 MET CB C -0.828 -5.935 -22.577 1.00 . A A . 16 MET CB 1 1 14 5417 1 1 16 MET CE C 2.108 -3.512 -24.281 1.00 . A A . 16 MET CE 1 1 14 5418 1 1 16 MET CG C 0.314 -4.943 -22.726 1.00 . A A . 16 MET CG 1 1 14 5419 1 1 16 MET H H -2.014 -8.146 -20.741 1.00 . A A . 16 MET H 1 1 14 5420 1 1 16 MET HA H -0.324 -6.621 -20.614 1.00 . A A . 16 MET HA 1 1 14 5421 1 1 16 MET HB2 H -0.539 -6.857 -23.059 1.00 . A A . 16 MET HB2 1 1 14 5422 1 1 16 MET HB3 H -1.694 -5.532 -23.080 1.00 . A A . 16 MET HB3 1 1 14 5423 1 1 16 MET HE1 H 2.964 -3.681 -24.917 1.00 . A A . 16 MET HE1 1 1 14 5424 1 1 16 MET HE2 H 1.594 -2.617 -24.598 1.00 . A A . 16 MET HE2 1 1 14 5425 1 1 16 MET HE3 H 2.436 -3.397 -23.258 1.00 . A A . 16 MET HE3 1 1 14 5426 1 1 16 MET HG2 H -0.050 -3.956 -22.483 1.00 . A A . 16 MET HG2 1 1 14 5427 1 1 16 MET HG3 H 1.100 -5.214 -22.037 1.00 . A A . 16 MET HG3 1 1 14 5428 1 1 16 MET N N -2.239 -7.248 -21.060 1.00 . A A . 16 MET N 1 1 14 5429 1 1 16 MET O O -2.190 -4.050 -21.057 1.00 . A A . 16 MET O 1 1 14 5430 1 1 16 MET SD S 0.994 -4.911 -24.396 1.00 . A A . 16 MET SD 1 1 14 5431 1 1 17 ASN C C -1.125 -3.740 -16.958 1.00 . A A . 17 ASN C 1 1 14 5432 1 1 17 ASN CA C -1.774 -3.705 -18.339 1.00 . A A . 17 ASN CA 1 1 14 5433 1 1 17 ASN CB C -3.296 -3.628 -18.198 1.00 . A A . 17 ASN CB 1 1 14 5434 1 1 17 ASN CG C -3.934 -2.777 -19.279 1.00 . A A . 17 ASN CG 1 1 14 5435 1 1 17 ASN H H -0.954 -5.628 -18.673 1.00 . A A . 17 ASN H 1 1 14 5436 1 1 17 ASN HA H -1.425 -2.829 -18.865 1.00 . A A . 17 ASN HA 1 1 14 5437 1 1 17 ASN HB2 H -3.708 -4.625 -18.261 1.00 . A A . 17 ASN HB2 1 1 14 5438 1 1 17 ASN HB3 H -3.541 -3.202 -17.237 1.00 . A A . 17 ASN HB3 1 1 14 5439 1 1 17 ASN HD21 H -4.851 -4.375 -20.029 1.00 . A A . 17 ASN HD21 1 1 14 5440 1 1 17 ASN HD22 H -5.150 -2.883 -20.848 1.00 . A A . 17 ASN HD22 1 1 14 5441 1 1 17 ASN N N -1.397 -4.877 -19.121 1.00 . A A . 17 ASN N 1 1 14 5442 1 1 17 ASN ND2 N -4.725 -3.409 -20.138 1.00 . A A . 17 ASN ND2 1 1 14 5443 1 1 17 ASN O O -0.164 -3.019 -16.694 1.00 . A A . 17 ASN O 1 1 14 5444 1 1 17 ASN OD1 O -3.718 -1.567 -19.340 1.00 . A A . 17 ASN OD1 1 1 14 5445 1 1 18 DAL C C -1.804 -3.716 -13.816 1.00 . A A . 18 DAL C 1 1 14 5446 1 1 18 DAL CA C -1.127 -4.717 -14.718 1.00 . A A . 18 DAL CA 1 1 14 5447 1 1 18 DAL CB C -1.396 -6.132 -14.201 1.00 . A A . 18 DAL CB 1 1 14 5448 1 1 18 DAL H H -2.424 -5.134 -16.352 1.00 . A A . 18 DAL H 1 1 14 5449 1 1 18 DAL HA H -0.053 -4.531 -14.727 1.00 . A A . 18 DAL HA 1 1 14 5450 1 1 18 DAL HB1 H -0.451 -6.662 -14.085 1.00 . A A . 18 DAL HB1 1 1 14 5451 1 1 18 DAL HB2 H -1.902 -6.076 -13.238 1.00 . A A . 18 DAL HB2 1 1 14 5452 1 1 18 DAL N N -1.658 -4.585 -16.082 1.00 . A A . 18 DAL N 1 1 14 5453 1 1 18 DAL O O -1.186 -2.749 -13.371 1.00 . A A . 18 DAL O 1 1 14 5454 1 1 19 PHE C C -3.619 -3.377 -11.211 1.00 . A A . 19 PHE C 1 1 14 5455 1 1 19 PHE CA C -3.853 -3.051 -12.684 1.00 . A A . 19 PHE CA 1 1 14 5456 1 1 19 PHE CB C -5.344 -3.155 -13.010 1.00 . A A . 19 PHE CB 1 1 14 5457 1 1 19 PHE CD1 C -5.815 -1.777 -15.053 1.00 . A A . 19 PHE CD1 1 1 14 5458 1 1 19 PHE CD2 C -5.767 -4.151 -15.274 1.00 . A A . 19 PHE CD2 1 1 14 5459 1 1 19 PHE CE1 C -6.095 -1.654 -16.401 1.00 . A A . 19 PHE CE1 1 1 14 5460 1 1 19 PHE CE2 C -6.045 -4.034 -16.622 1.00 . A A . 19 PHE CE2 1 1 14 5461 1 1 19 PHE CG C -5.648 -3.025 -14.475 1.00 . A A . 19 PHE CG 1 1 14 5462 1 1 19 PHE CZ C -6.211 -2.784 -17.187 1.00 . A A . 19 PHE CZ 1 1 14 5463 1 1 19 PHE H H -3.522 -4.733 -13.927 1.00 . A A . 19 PHE H 1 1 14 5464 1 1 19 PHE HA H -3.521 -2.042 -12.874 1.00 . A A . 19 PHE HA 1 1 14 5465 1 1 19 PHE HB2 H -5.712 -4.115 -12.679 1.00 . A A . 19 PHE HB2 1 1 14 5466 1 1 19 PHE HB3 H -5.874 -2.372 -12.489 1.00 . A A . 19 PHE HB3 1 1 14 5467 1 1 19 PHE HD1 H -5.725 -0.892 -14.439 1.00 . A A . 19 PHE HD1 1 1 14 5468 1 1 19 PHE HD2 H -5.639 -5.129 -14.834 1.00 . A A . 19 PHE HD2 1 1 14 5469 1 1 19 PHE HE1 H -6.223 -0.675 -16.839 1.00 . A A . 19 PHE HE1 1 1 14 5470 1 1 19 PHE HE2 H -6.136 -4.919 -17.234 1.00 . A A . 19 PHE HE2 1 1 14 5471 1 1 19 PHE HZ H -6.428 -2.690 -18.240 1.00 . A A . 19 PHE HZ 1 1 14 5472 1 1 19 PHE N N -3.084 -3.945 -13.542 1.00 . A A . 19 PHE N 1 1 14 5473 1 1 19 PHE O O -3.653 -2.492 -10.357 1.00 . A A . 19 PHE O 1 1 14 5474 1 1 20 GLN C C -2.888 -6.598 -9.506 1.00 . A A . 20 GLN C 1 1 14 5475 1 1 20 GLN CA C -3.143 -5.095 -9.555 1.00 . A A . 20 GLN CA 1 1 14 5476 1 1 20 GLN CB C -4.336 -4.739 -8.666 1.00 . A A . 20 GLN CB 1 1 14 5477 1 1 20 GLN CD C -4.275 -4.300 -6.179 1.00 . A A . 20 GLN CD 1 1 14 5478 1 1 20 GLN CG C -3.999 -3.748 -7.564 1.00 . A A . 20 GLN CG 1 1 14 5479 1 1 20 GLN H H -3.367 -5.311 -11.649 1.00 . A A . 20 GLN H 1 1 14 5480 1 1 20 GLN HA H -2.267 -4.581 -9.189 1.00 . A A . 20 GLN HA 1 1 14 5481 1 1 20 GLN HB2 H -5.112 -4.309 -9.282 1.00 . A A . 20 GLN HB2 1 1 14 5482 1 1 20 GLN HB3 H -4.710 -5.642 -8.207 1.00 . A A . 20 GLN HB3 1 1 14 5483 1 1 20 GLN HE21 H -4.783 -2.490 -5.532 1.00 . A A . 20 GLN HE21 1 1 14 5484 1 1 20 GLN HE22 H -4.870 -3.758 -4.362 1.00 . A A . 20 GLN HE22 1 1 14 5485 1 1 20 GLN HG2 H -2.950 -3.497 -7.631 1.00 . A A . 20 GLN HG2 1 1 14 5486 1 1 20 GLN HG3 H -4.591 -2.857 -7.705 1.00 . A A . 20 GLN HG3 1 1 14 5487 1 1 20 GLN N N -3.381 -4.652 -10.924 1.00 . A A . 20 GLN N 1 1 14 5488 1 1 20 GLN NE2 N -4.683 -3.428 -5.264 1.00 . A A . 20 GLN NE2 1 1 14 5489 1 1 20 GLN O O -3.675 -7.389 -10.024 1.00 . A A . 20 GLN O 1 1 14 5490 1 1 20 GLN OE1 O -4.124 -5.497 -5.934 1.00 . A A . 20 GLN OE1 1 1 14 5491 1 1 21 PHE C C -1.813 -8.943 -7.395 1.00 . A A . 21 PHE C 1 1 14 5492 1 1 21 PHE CA C -1.421 -8.393 -8.763 1.00 . A A . 21 PHE CA 1 1 14 5493 1 1 21 PHE CB C 0.081 -8.578 -8.989 1.00 . A A . 21 PHE CB 1 1 14 5494 1 1 21 PHE CD1 C 0.902 -8.550 -11.360 1.00 . A A . 21 PHE CD1 1 1 14 5495 1 1 21 PHE CD2 C 0.781 -6.482 -10.179 1.00 . A A . 21 PHE CD2 1 1 14 5496 1 1 21 PHE CE1 C 1.378 -7.888 -12.476 1.00 . A A . 21 PHE CE1 1 1 14 5497 1 1 21 PHE CE2 C 1.255 -5.815 -11.292 1.00 . A A . 21 PHE CE2 1 1 14 5498 1 1 21 PHE CG C 0.598 -7.855 -10.200 1.00 . A A . 21 PHE CG 1 1 14 5499 1 1 21 PHE CZ C 1.556 -6.519 -12.442 1.00 . A A . 21 PHE CZ 1 1 14 5500 1 1 21 PHE H H -1.193 -6.306 -8.486 1.00 . A A . 21 PHE H 1 1 14 5501 1 1 21 PHE HA H -1.961 -8.936 -9.524 1.00 . A A . 21 PHE HA 1 1 14 5502 1 1 21 PHE HB2 H 0.615 -8.205 -8.128 1.00 . A A . 21 PHE HB2 1 1 14 5503 1 1 21 PHE HB3 H 0.292 -9.629 -9.112 1.00 . A A . 21 PHE HB3 1 1 14 5504 1 1 21 PHE HD1 H 0.763 -9.622 -11.388 1.00 . A A . 21 PHE HD1 1 1 14 5505 1 1 21 PHE HD2 H 0.547 -5.930 -9.280 1.00 . A A . 21 PHE HD2 1 1 14 5506 1 1 21 PHE HE1 H 1.611 -8.442 -13.374 1.00 . A A . 21 PHE HE1 1 1 14 5507 1 1 21 PHE HE2 H 1.394 -4.745 -11.263 1.00 . A A . 21 PHE HE2 1 1 14 5508 1 1 21 PHE HZ H 1.926 -6.001 -13.313 1.00 . A A . 21 PHE HZ 1 1 14 5509 1 1 21 PHE N N -1.781 -6.985 -8.879 1.00 . A A . 21 PHE N 1 1 14 5510 1 1 21 PHE O O -1.360 -8.450 -6.362 1.00 . A A . 21 PHE O 1 1 14 5511 1 1 22 VAL C C -2.060 -11.546 -5.604 1.00 . A A . 22 VAL C 1 1 14 5512 1 1 22 VAL CA C -3.110 -10.589 -6.156 1.00 . A A . 22 VAL CA 1 1 14 5513 1 1 22 VAL CB C -4.431 -11.355 -6.360 1.00 . A A . 22 VAL CB 1 1 14 5514 1 1 22 VAL CG1 C -4.858 -12.037 -5.070 1.00 . A A . 22 VAL CG1 1 1 14 5515 1 1 22 VAL CG2 C -5.518 -10.417 -6.862 1.00 . A A . 22 VAL CG2 1 1 14 5516 1 1 22 VAL H H -2.983 -10.319 -8.251 1.00 . A A . 22 VAL H 1 1 14 5517 1 1 22 VAL HA H -3.282 -9.803 -5.434 1.00 . A A . 22 VAL HA 1 1 14 5518 1 1 22 VAL HB H -4.269 -12.117 -7.108 1.00 . A A . 22 VAL HB 1 1 14 5519 1 1 22 VAL HG11 H -4.970 -11.296 -4.292 1.00 . A A . 22 VAL HG11 1 1 14 5520 1 1 22 VAL HG12 H -5.799 -12.544 -5.225 1.00 . A A . 22 VAL HG12 1 1 14 5521 1 1 22 VAL HG13 H -4.106 -12.755 -4.776 1.00 . A A . 22 VAL HG13 1 1 14 5522 1 1 22 VAL HG21 H -5.858 -9.793 -6.049 1.00 . A A . 22 VAL HG21 1 1 14 5523 1 1 22 VAL HG22 H -5.121 -9.794 -7.652 1.00 . A A . 22 VAL HG22 1 1 14 5524 1 1 22 VAL HG23 H -6.346 -10.996 -7.243 1.00 . A A . 22 VAL HG23 1 1 14 5525 1 1 22 VAL N N -2.658 -9.970 -7.396 1.00 . A A . 22 VAL N 1 1 14 5526 1 1 22 VAL O O -1.388 -11.246 -4.617 1.00 . A A . 22 VAL O 1 1 14 5527 1 1 23 PHE C C 0.259 -13.715 -6.747 1.00 . A A . 23 PHE C 1 1 14 5528 1 1 23 PHE CA C -0.954 -13.703 -5.822 1.00 . A A . 23 PHE CA 1 1 14 5529 1 1 23 PHE CB C -1.602 -15.089 -5.795 1.00 . A A . 23 PHE CB 1 1 14 5530 1 1 23 PHE CD1 C -4.092 -15.394 -5.719 1.00 . A A . 23 PHE CD1 1 1 14 5531 1 1 23 PHE CD2 C -2.949 -14.895 -3.687 1.00 . A A . 23 PHE CD2 1 1 14 5532 1 1 23 PHE CE1 C -5.294 -15.429 -5.039 1.00 . A A . 23 PHE CE1 1 1 14 5533 1 1 23 PHE CE2 C -4.148 -14.930 -3.001 1.00 . A A . 23 PHE CE2 1 1 14 5534 1 1 23 PHE CG C -2.907 -15.127 -5.052 1.00 . A A . 23 PHE CG 1 1 14 5535 1 1 23 PHE CZ C -5.323 -15.196 -3.678 1.00 . A A . 23 PHE CZ 1 1 14 5536 1 1 23 PHE H H -2.488 -12.882 -7.029 1.00 . A A . 23 PHE H 1 1 14 5537 1 1 23 PHE HA H -0.630 -13.447 -4.825 1.00 . A A . 23 PHE HA 1 1 14 5538 1 1 23 PHE HB2 H -1.788 -15.412 -6.808 1.00 . A A . 23 PHE HB2 1 1 14 5539 1 1 23 PHE HB3 H -0.927 -15.785 -5.319 1.00 . A A . 23 PHE HB3 1 1 14 5540 1 1 23 PHE HD1 H -4.070 -15.576 -6.785 1.00 . A A . 23 PHE HD1 1 1 14 5541 1 1 23 PHE HD2 H -2.032 -14.686 -3.156 1.00 . A A . 23 PHE HD2 1 1 14 5542 1 1 23 PHE HE1 H -6.210 -15.638 -5.571 1.00 . A A . 23 PHE HE1 1 1 14 5543 1 1 23 PHE HE2 H -4.168 -14.747 -1.937 1.00 . A A . 23 PHE HE2 1 1 14 5544 1 1 23 PHE HZ H -6.261 -15.224 -3.144 1.00 . A A . 23 PHE HZ 1 1 14 5545 1 1 23 PHE N N -1.923 -12.700 -6.248 1.00 . A A . 23 PHE N 1 1 14 5546 1 1 23 PHE O O 1.015 -14.684 -6.783 1.00 . A A . 23 PHE O 1 1 14 5547 1 1 24 DBU C C 1.173 -12.199 -9.782 1.00 . A A . 24 DBU C 1 1 14 5548 1 1 24 DBU CA C 1.487 -12.521 -8.358 1.00 . A A . 24 DBU CA 1 1 14 5549 1 1 24 DBU CB C 2.792 -12.674 -8.068 1.00 . A A . 24 DBU CB 1 1 14 5550 1 1 24 DBU CG C 3.367 -12.997 -6.725 1.00 . A A . 24 DBU CG 1 1 14 5551 1 1 24 DBU HG1 H 3.509 -14.069 -6.559 1.00 . A A . 24 DBU HG1 1 1 14 5552 1 1 24 DBU HG2 H 2.703 -12.621 -5.940 1.00 . A A . 24 DBU HG2 1 1 14 5553 1 1 24 DBU HG3 H 4.339 -12.508 -6.613 1.00 . A A . 24 DBU HG3 1 1 14 5554 1 1 24 DBU N N 0.438 -12.629 -7.492 1.00 . A A . 24 DBU N 1 1 14 5555 1 1 24 DBU O O 1.840 -11.371 -10.404 1.00 . A A . 24 DBU O 1 1 14 5556 1 1 25 CYS C C -1.017 -11.310 -11.838 1.00 . A A . 25 CYS C 1 1 14 5557 1 1 25 CYS CA C -0.262 -12.629 -11.700 1.00 . A A . 25 CYS CA 1 1 14 5558 1 1 25 CYS CB C -1.140 -13.784 -12.187 1.00 . A A . 25 CYS CB 1 1 14 5559 1 1 25 CYS H H -0.346 -13.499 -9.773 1.00 . A A . 25 CYS H 1 1 14 5560 1 1 25 CYS HA H 0.629 -12.584 -12.308 1.00 . A A . 25 CYS HA 1 1 14 5561 1 1 25 CYS HB2 H -1.922 -13.961 -11.463 1.00 . A A . 25 CYS HB2 1 1 14 5562 1 1 25 CYS HB3 H -1.586 -13.514 -13.132 1.00 . A A . 25 CYS HB3 1 1 14 5563 1 1 25 CYS N N 0.147 -12.851 -10.319 1.00 . A A . 25 CYS N 1 1 14 5564 1 1 25 CYS O O -1.194 -10.578 -10.864 1.00 . A A . 25 CYS O 1 1 14 5565 1 1 25 CYS SG S -0.241 -15.351 -12.424 1.00 . A A . 25 CYS SG 1 1 14 5566 1 1 26 CYS C C -3.645 -10.085 -13.697 1.00 . A A . 26 CYS C 1 1 14 5567 1 1 26 CYS CA C -2.197 -9.783 -13.322 1.00 . A A . 26 CYS CA 1 1 14 5568 1 1 26 CYS CB C -1.522 -8.993 -14.446 1.00 . A A . 26 CYS CB 1 1 14 5569 1 1 26 CYS H H -1.289 -11.636 -13.792 1.00 . A A . 26 CYS H 1 1 14 5570 1 1 26 CYS HA H -2.188 -9.188 -12.421 1.00 . A A . 26 CYS HA 1 1 14 5571 1 1 26 CYS HB2 H -0.551 -8.660 -14.108 1.00 . A A . 26 CYS HB2 1 1 14 5572 1 1 26 CYS HB3 H -1.396 -9.638 -15.303 1.00 . A A . 26 CYS HB3 1 1 14 5573 1 1 26 CYS N N -1.461 -11.012 -13.055 1.00 . A A . 26 CYS N 1 1 14 5574 1 1 26 CYS O O -3.915 -10.977 -14.502 1.00 . A A . 26 CYS O 1 1 14 5575 1 1 26 CYS SG S -2.454 -7.525 -14.986 1.00 . A A . 26 CYS SG 1 1 14 5576 1 1 27 SER C C -6.567 -8.331 -14.130 1.00 . A A . 27 SER C 1 1 14 5577 1 1 27 SER CA C -5.992 -9.527 -13.377 1.00 . A A . 27 SER CA 1 1 14 5578 1 1 27 SER CB C -6.757 -9.736 -12.069 1.00 . A A . 27 SER CB 1 1 14 5579 1 1 27 SER H H -4.293 -8.642 -12.475 1.00 . A A . 27 SER H 1 1 14 5580 1 1 27 SER HA H -6.098 -10.409 -13.991 1.00 . A A . 27 SER HA 1 1 14 5581 1 1 27 SER HB2 H -6.350 -9.087 -11.309 1.00 . A A . 27 SER HB2 1 1 14 5582 1 1 27 SER HB3 H -7.800 -9.499 -12.223 1.00 . A A . 27 SER HB3 1 1 14 5583 1 1 27 SER HG H -7.491 -11.356 -11.246 1.00 . A A . 27 SER HG 1 1 14 5584 1 1 27 SER N N -4.572 -9.337 -13.108 1.00 . A A . 27 SER N 1 1 14 5585 1 1 27 SER O O -6.700 -8.361 -15.353 1.00 . A A . 27 SER O 1 1 14 5586 1 1 27 SER OG O -6.654 -11.078 -11.627 1.00 . A A . 27 SER OG 1 1 15 5587 1 1 1 LYS C C 0.723 0.332 -0.642 1.00 . A A . 1 LYS C 1 1 15 5588 1 1 1 LYS CA C -0.727 0.124 -0.216 1.00 . A A . 1 LYS CA 1 1 15 5589 1 1 1 LYS CB C -1.642 0.175 -1.442 1.00 . A A . 1 LYS CB 1 1 15 5590 1 1 1 LYS CD C -2.555 1.569 -3.321 1.00 . A A . 1 LYS CD 1 1 15 5591 1 1 1 LYS CE C -2.821 3.033 -3.637 1.00 . A A . 1 LYS CE 1 1 15 5592 1 1 1 LYS CG C -1.442 1.413 -2.299 1.00 . A A . 1 LYS CG 1 1 15 5593 1 1 1 LYS H1 H -2.085 1.334 0.867 1.00 . A A . 1 LYS H1 1 1 15 5594 1 1 1 LYS HA H -0.818 -0.845 0.250 1.00 . A A . 1 LYS HA 1 1 15 5595 1 1 1 LYS HB2 H -1.453 -0.695 -2.053 1.00 . A A . 1 LYS HB2 1 1 15 5596 1 1 1 LYS HB3 H -2.670 0.155 -1.110 1.00 . A A . 1 LYS HB3 1 1 15 5597 1 1 1 LYS HD2 H -2.271 1.062 -4.232 1.00 . A A . 1 LYS HD2 1 1 15 5598 1 1 1 LYS HD3 H -3.459 1.125 -2.927 1.00 . A A . 1 LYS HD3 1 1 15 5599 1 1 1 LYS HE2 H -3.299 3.491 -2.785 1.00 . A A . 1 LYS HE2 1 1 15 5600 1 1 1 LYS HE3 H -1.877 3.524 -3.827 1.00 . A A . 1 LYS HE3 1 1 15 5601 1 1 1 LYS HG2 H -1.429 2.284 -1.661 1.00 . A A . 1 LYS HG2 1 1 15 5602 1 1 1 LYS HG3 H -0.498 1.331 -2.819 1.00 . A A . 1 LYS HG3 1 1 15 5603 1 1 1 LYS HZ1 H -3.452 4.066 -5.339 1.00 . A A . 1 LYS HZ1 1 1 15 5604 1 1 1 LYS HZ2 H -4.695 3.247 -4.535 1.00 . A A . 1 LYS HZ2 1 1 15 5605 1 1 1 LYS HZ3 H -3.581 2.384 -5.471 1.00 . A A . 1 LYS HZ3 1 1 15 5606 1 1 1 LYS N N -1.132 1.130 0.758 1.00 . A A . 1 LYS N 1 1 15 5607 1 1 1 LYS NZ N -3.699 3.193 -4.829 1.00 . A A . 1 LYS NZ 1 1 15 5608 1 1 1 LYS O O 1.202 1.463 -0.720 1.00 . A A . 1 LYS O 1 1 15 5609 1 1 2 LYS C C 2.934 -0.903 -2.847 1.00 . A A . 2 LYS C 1 1 15 5610 1 1 2 LYS CA C 2.811 -0.707 -1.339 1.00 . A A . 2 LYS CA 1 1 15 5611 1 1 2 LYS CB C 3.633 -1.770 -0.607 1.00 . A A . 2 LYS CB 1 1 15 5612 1 1 2 LYS CD C 5.202 -2.057 1.333 1.00 . A A . 2 LYS CD 1 1 15 5613 1 1 2 LYS CE C 6.237 -0.995 1.672 1.00 . A A . 2 LYS CE 1 1 15 5614 1 1 2 LYS CG C 3.903 -1.435 0.849 1.00 . A A . 2 LYS CG 1 1 15 5615 1 1 2 LYS H H 0.979 -1.641 -0.838 1.00 . A A . 2 LYS H 1 1 15 5616 1 1 2 LYS HA H 3.193 0.270 -1.083 1.00 . A A . 2 LYS HA 1 1 15 5617 1 1 2 LYS HB2 H 3.100 -2.709 -0.646 1.00 . A A . 2 LYS HB2 1 1 15 5618 1 1 2 LYS HB3 H 4.582 -1.884 -1.111 1.00 . A A . 2 LYS HB3 1 1 15 5619 1 1 2 LYS HD2 H 5.002 -2.644 2.218 1.00 . A A . 2 LYS HD2 1 1 15 5620 1 1 2 LYS HD3 H 5.596 -2.697 0.556 1.00 . A A . 2 LYS HD3 1 1 15 5621 1 1 2 LYS HE2 H 6.178 -0.207 0.937 1.00 . A A . 2 LYS HE2 1 1 15 5622 1 1 2 LYS HE3 H 6.013 -0.593 2.649 1.00 . A A . 2 LYS HE3 1 1 15 5623 1 1 2 LYS HG2 H 3.969 -0.362 0.956 1.00 . A A . 2 LYS HG2 1 1 15 5624 1 1 2 LYS HG3 H 3.088 -1.809 1.452 1.00 . A A . 2 LYS HG3 1 1 15 5625 1 1 2 LYS HZ1 H 8.022 -1.488 2.637 1.00 . A A . 2 LYS HZ1 1 1 15 5626 1 1 2 LYS HZ2 H 8.223 -1.013 1.026 1.00 . A A . 2 LYS HZ2 1 1 15 5627 1 1 2 LYS HZ3 H 7.606 -2.546 1.384 1.00 . A A . 2 LYS HZ3 1 1 15 5628 1 1 2 LYS N N 1.417 -0.767 -0.918 1.00 . A A . 2 LYS N 1 1 15 5629 1 1 2 LYS NZ N 7.619 -1.550 1.680 1.00 . A A . 2 LYS NZ 1 1 15 5630 1 1 2 LYS O O 3.794 -0.305 -3.494 1.00 . A A . 2 LYS O 1 1 15 5631 1 1 3 LYS C C 3.397 -2.647 -5.260 1.00 . A A . 3 LYS C 1 1 15 5632 1 1 3 LYS CA C 2.075 -2.017 -4.834 1.00 . A A . 3 LYS CA 1 1 15 5633 1 1 3 LYS CB C 1.836 -0.727 -5.622 1.00 . A A . 3 LYS CB 1 1 15 5634 1 1 3 LYS CD C 0.689 -0.003 -7.736 1.00 . A A . 3 LYS CD 1 1 15 5635 1 1 3 LYS CE C 0.173 1.426 -7.653 1.00 . A A . 3 LYS CE 1 1 15 5636 1 1 3 LYS CG C 0.537 -0.727 -6.409 1.00 . A A . 3 LYS CG 1 1 15 5637 1 1 3 LYS H H 1.404 -2.190 -2.834 1.00 . A A . 3 LYS H 1 1 15 5638 1 1 3 LYS HA H 1.275 -2.711 -5.044 1.00 . A A . 3 LYS HA 1 1 15 5639 1 1 3 LYS HB2 H 1.814 0.104 -4.932 1.00 . A A . 3 LYS HB2 1 1 15 5640 1 1 3 LYS HB3 H 2.653 -0.586 -6.315 1.00 . A A . 3 LYS HB3 1 1 15 5641 1 1 3 LYS HD2 H 1.734 0.020 -8.007 1.00 . A A . 3 LYS HD2 1 1 15 5642 1 1 3 LYS HD3 H 0.131 -0.535 -8.493 1.00 . A A . 3 LYS HD3 1 1 15 5643 1 1 3 LYS HE2 H -0.039 1.777 -8.652 1.00 . A A . 3 LYS HE2 1 1 15 5644 1 1 3 LYS HE3 H -0.736 1.433 -7.070 1.00 . A A . 3 LYS HE3 1 1 15 5645 1 1 3 LYS HG2 H 0.243 -1.749 -6.601 1.00 . A A . 3 LYS HG2 1 1 15 5646 1 1 3 LYS HG3 H -0.227 -0.234 -5.826 1.00 . A A . 3 LYS HG3 1 1 15 5647 1 1 3 LYS HZ1 H 0.678 3.013 -6.394 1.00 . A A . 3 LYS HZ1 1 1 15 5648 1 1 3 LYS HZ2 H 1.680 2.868 -7.748 1.00 . A A . 3 LYS HZ2 1 1 15 5649 1 1 3 LYS HZ3 H 1.845 1.790 -6.456 1.00 . A A . 3 LYS HZ3 1 1 15 5650 1 1 3 LYS N N 2.067 -1.743 -3.402 1.00 . A A . 3 LYS N 1 1 15 5651 1 1 3 LYS NZ N 1.164 2.338 -7.018 1.00 . A A . 3 LYS NZ 1 1 15 5652 1 1 3 LYS O O 4.307 -2.814 -4.447 1.00 . A A . 3 LYS O 1 1 15 5653 1 1 4 SER C C 4.717 -3.557 -8.597 1.00 . A A . 4 SER C 1 1 15 5654 1 1 4 SER CA C 4.708 -3.607 -7.072 1.00 . A A . 4 SER CA 1 1 15 5655 1 1 4 SER CB C 4.822 -5.057 -6.598 1.00 . A A . 4 SER CB 1 1 15 5656 1 1 4 SER H H 2.738 -2.835 -7.138 1.00 . A A . 4 SER H 1 1 15 5657 1 1 4 SER HA H 5.555 -3.049 -6.700 1.00 . A A . 4 SER HA 1 1 15 5658 1 1 4 SER HB2 H 5.224 -5.664 -7.395 1.00 . A A . 4 SER HB2 1 1 15 5659 1 1 4 SER HB3 H 5.481 -5.103 -5.743 1.00 . A A . 4 SER HB3 1 1 15 5660 1 1 4 SER HG H 3.632 -6.043 -5.393 1.00 . A A . 4 SER HG 1 1 15 5661 1 1 4 SER N N 3.498 -2.993 -6.539 1.00 . A A . 4 SER N 1 1 15 5662 1 1 4 SER O O 3.734 -3.162 -9.222 1.00 . A A . 4 SER O 1 1 15 5663 1 1 4 SER OG O 3.555 -5.573 -6.226 1.00 . A A . 4 SER OG 1 1 15 5664 1 1 5 GLY C C 6.603 -5.215 -11.171 1.00 . A A . 5 GLY C 1 1 15 5665 1 1 5 GLY CA C 5.954 -3.954 -10.636 1.00 . A A . 5 GLY CA 1 1 15 5666 1 1 5 GLY H H 6.589 -4.265 -8.641 1.00 . A A . 5 GLY H 1 1 15 5667 1 1 5 GLY HA2 H 4.968 -3.859 -11.066 1.00 . A A . 5 GLY HA2 1 1 15 5668 1 1 5 GLY HA3 H 6.549 -3.103 -10.934 1.00 . A A . 5 GLY HA3 1 1 15 5669 1 1 5 GLY N N 5.837 -3.961 -9.190 1.00 . A A . 5 GLY N 1 1 15 5670 1 1 5 GLY O O 7.543 -5.150 -11.964 1.00 . A A . 5 GLY O 1 1 15 5671 1 1 6 VAL C C 6.666 -7.741 -12.697 1.00 . A A . 6 VAL C 1 1 15 5672 1 1 6 VAL CA C 6.640 -7.649 -11.176 1.00 . A A . 6 VAL CA 1 1 15 5673 1 1 6 VAL CB C 5.818 -8.824 -10.614 1.00 . A A . 6 VAL CB 1 1 15 5674 1 1 6 VAL CG1 C 6.300 -10.142 -11.203 1.00 . A A . 6 VAL CG1 1 1 15 5675 1 1 6 VAL CG2 C 5.894 -8.850 -9.095 1.00 . A A . 6 VAL CG2 1 1 15 5676 1 1 6 VAL H H 5.353 -6.354 -10.105 1.00 . A A . 6 VAL H 1 1 15 5677 1 1 6 VAL HA H 7.651 -7.733 -10.803 1.00 . A A . 6 VAL HA 1 1 15 5678 1 1 6 VAL HB H 4.786 -8.684 -10.900 1.00 . A A . 6 VAL HB 1 1 15 5679 1 1 6 VAL HG11 H 6.472 -10.850 -10.406 1.00 . A A . 6 VAL HG11 1 1 15 5680 1 1 6 VAL HG12 H 5.550 -10.531 -11.876 1.00 . A A . 6 VAL HG12 1 1 15 5681 1 1 6 VAL HG13 H 7.221 -9.979 -11.744 1.00 . A A . 6 VAL HG13 1 1 15 5682 1 1 6 VAL HG21 H 6.891 -9.133 -8.790 1.00 . A A . 6 VAL HG21 1 1 15 5683 1 1 6 VAL HG22 H 5.664 -7.869 -8.706 1.00 . A A . 6 VAL HG22 1 1 15 5684 1 1 6 VAL HG23 H 5.183 -9.565 -8.711 1.00 . A A . 6 VAL HG23 1 1 15 5685 1 1 6 VAL N N 6.102 -6.367 -10.736 1.00 . A A . 6 VAL N 1 1 15 5686 1 1 6 VAL O O 7.685 -7.463 -13.329 1.00 . A A . 6 VAL O 1 1 15 5687 1 1 7 ILE C C 4.036 -7.877 -15.211 1.00 . A A . 7 ILE C 1 1 15 5688 1 1 7 ILE CA C 5.430 -8.261 -14.728 1.00 . A A . 7 ILE CA 1 1 15 5689 1 1 7 ILE CB C 5.745 -9.695 -15.191 1.00 . A A . 7 ILE CB 1 1 15 5690 1 1 7 ILE CD1 C 8.233 -9.272 -15.520 1.00 . A A . 7 ILE CD1 1 1 15 5691 1 1 7 ILE CG1 C 7.174 -10.079 -14.802 1.00 . A A . 7 ILE CG1 1 1 15 5692 1 1 7 ILE CG2 C 5.548 -9.821 -16.695 1.00 . A A . 7 ILE CG2 1 1 15 5693 1 1 7 ILE H H 4.759 -8.341 -12.722 1.00 . A A . 7 ILE H 1 1 15 5694 1 1 7 ILE HA H 6.152 -7.593 -15.175 1.00 . A A . 7 ILE HA 1 1 15 5695 1 1 7 ILE HB H 5.054 -10.367 -14.705 1.00 . A A . 7 ILE HB 1 1 15 5696 1 1 7 ILE HD11 H 8.923 -8.860 -14.798 1.00 . A A . 7 ILE HD11 1 1 15 5697 1 1 7 ILE HD12 H 8.767 -9.910 -16.208 1.00 . A A . 7 ILE HD12 1 1 15 5698 1 1 7 ILE HD13 H 7.763 -8.467 -16.066 1.00 . A A . 7 ILE HD13 1 1 15 5699 1 1 7 ILE HG12 H 7.304 -9.927 -13.742 1.00 . A A . 7 ILE HG12 1 1 15 5700 1 1 7 ILE HG13 H 7.335 -11.121 -15.035 1.00 . A A . 7 ILE HG13 1 1 15 5701 1 1 7 ILE HG21 H 4.494 -9.772 -16.925 1.00 . A A . 7 ILE HG21 1 1 15 5702 1 1 7 ILE HG22 H 6.063 -9.014 -17.193 1.00 . A A . 7 ILE HG22 1 1 15 5703 1 1 7 ILE HG23 H 5.946 -10.766 -17.032 1.00 . A A . 7 ILE HG23 1 1 15 5704 1 1 7 ILE N N 5.537 -8.133 -13.279 1.00 . A A . 7 ILE N 1 1 15 5705 1 1 7 ILE O O 3.048 -8.559 -14.940 1.00 . A A . 7 ILE O 1 1 15 5706 1 1 8 PRO C C 2.137 -7.148 -17.598 1.00 . A A . 8 PRO C 1 1 15 5707 1 1 8 PRO CA C 2.684 -6.259 -16.487 1.00 . A A . 8 PRO CA 1 1 15 5708 1 1 8 PRO CB C 3.053 -4.879 -17.038 1.00 . A A . 8 PRO CB 1 1 15 5709 1 1 8 PRO CD C 5.090 -5.896 -16.309 1.00 . A A . 8 PRO CD 1 1 15 5710 1 1 8 PRO CG C 4.509 -4.968 -17.341 1.00 . A A . 8 PRO CG 1 1 15 5711 1 1 8 PRO HA H 1.938 -6.151 -15.713 1.00 . A A . 8 PRO HA 1 1 15 5712 1 1 8 PRO HB2 H 2.475 -4.679 -17.930 1.00 . A A . 8 PRO HB2 1 1 15 5713 1 1 8 PRO HB3 H 2.850 -4.124 -16.294 1.00 . A A . 8 PRO HB3 1 1 15 5714 1 1 8 PRO HD2 H 5.894 -6.477 -16.735 1.00 . A A . 8 PRO HD2 1 1 15 5715 1 1 8 PRO HD3 H 5.437 -5.337 -15.453 1.00 . A A . 8 PRO HD3 1 1 15 5716 1 1 8 PRO HG2 H 4.654 -5.371 -18.331 1.00 . A A . 8 PRO HG2 1 1 15 5717 1 1 8 PRO HG3 H 4.960 -3.990 -17.261 1.00 . A A . 8 PRO HG3 1 1 15 5718 1 1 8 PRO N N 3.952 -6.758 -15.947 1.00 . A A . 8 PRO N 1 1 15 5719 1 1 8 PRO O O 2.230 -6.811 -18.778 1.00 . A A . 8 PRO O 1 1 15 5720 1 1 9 . C C 1.494 -10.618 -17.884 1.00 . A A . 9 DBB C 1 1 15 5721 1 1 9 . CA C 0.998 -9.229 -18.186 1.00 . A A . 9 DBB CA 1 1 15 5722 1 1 9 . CB C -0.529 -9.200 -18.092 1.00 . A A . 9 DBB CB 1 1 15 5723 1 1 9 . CG C -1.013 -7.748 -18.096 1.00 . A A . 9 DBB CG 1 1 15 5724 1 1 9 . H H 1.521 -8.497 -16.258 1.00 . A A . 9 DBB H 1 1 15 5725 1 1 9 . HA H 1.306 -8.942 -19.191 1.00 . A A . 9 DBB HA 1 1 15 5726 1 1 9 . HB2 H -0.846 -9.686 -17.171 1.00 . A A . 9 DBB HB2 1 1 15 5727 1 1 9 . HG1 H -0.643 -7.244 -18.988 1.00 . A A . 9 DBB HG1 1 1 15 5728 1 1 9 . HG2 H -2.102 -7.729 -18.093 1.00 . A A . 9 DBB HG2 1 1 15 5729 1 1 9 . HG3 H -0.638 -7.239 -17.208 1.00 . A A . 9 DBB HG3 1 1 15 5730 1 1 9 . N N 1.565 -8.284 -17.213 1.00 . A A . 9 DBB N 1 1 15 5731 1 1 9 . O O 2.311 -11.170 -18.622 1.00 . A A . 9 DBB O 1 1 15 5732 1 1 10 VAL C C 0.186 -13.449 -16.241 1.00 . A A . 10 VAL C 1 1 15 5733 1 1 10 VAL CA C 1.399 -12.538 -16.390 1.00 . A A . 10 VAL CA 1 1 15 5734 1 1 10 VAL CB C 2.179 -12.518 -15.063 1.00 . A A . 10 VAL CB 1 1 15 5735 1 1 10 VAL CG1 C 3.675 -12.420 -15.323 1.00 . A A . 10 VAL CG1 1 1 15 5736 1 1 10 VAL CG2 C 1.707 -11.369 -14.184 1.00 . A A . 10 VAL CG2 1 1 15 5737 1 1 10 VAL H H 0.353 -10.704 -16.245 1.00 . A A . 10 VAL H 1 1 15 5738 1 1 10 VAL HA H 2.045 -12.938 -17.158 1.00 . A A . 10 VAL HA 1 1 15 5739 1 1 10 VAL HB H 1.987 -13.444 -14.542 1.00 . A A . 10 VAL HB 1 1 15 5740 1 1 10 VAL HG11 H 4.046 -13.380 -15.651 1.00 . A A . 10 VAL HG11 1 1 15 5741 1 1 10 VAL HG12 H 3.859 -11.681 -16.089 1.00 . A A . 10 VAL HG12 1 1 15 5742 1 1 10 VAL HG13 H 4.180 -12.131 -14.414 1.00 . A A . 10 VAL HG13 1 1 15 5743 1 1 10 VAL HG21 H 0.666 -11.167 -14.387 1.00 . A A . 10 VAL HG21 1 1 15 5744 1 1 10 VAL HG22 H 1.825 -11.638 -13.144 1.00 . A A . 10 VAL HG22 1 1 15 5745 1 1 10 VAL HG23 H 2.293 -10.488 -14.397 1.00 . A A . 10 VAL HG23 1 1 15 5746 1 1 10 VAL N N 1.001 -11.194 -16.793 1.00 . A A . 10 VAL N 1 1 15 5747 1 1 10 VAL O O -0.285 -14.036 -17.213 1.00 . A A . 10 VAL O 1 1 15 5748 1 1 11 DAL C C -1.382 -15.683 -15.530 1.00 . A A . 11 DAL C 1 1 15 5749 1 1 11 DAL CA C -1.484 -14.407 -14.735 1.00 . A A . 11 DAL CA 1 1 15 5750 1 1 11 DAL CB C -1.527 -14.737 -13.241 1.00 . A A . 11 DAL CB 1 1 15 5751 1 1 11 DAL H H 0.104 -13.067 -14.280 1.00 . A A . 11 DAL H 1 1 15 5752 1 1 11 DAL HA H -2.393 -13.875 -15.016 1.00 . A A . 11 DAL HA 1 1 15 5753 1 1 11 DAL HB1 H -1.116 -13.904 -12.672 1.00 . A A . 11 DAL HB1 1 1 15 5754 1 1 11 DAL HB2 H -2.560 -14.909 -12.938 1.00 . A A . 11 DAL HB2 1 1 15 5755 1 1 11 DAL N N -0.316 -13.561 -15.015 1.00 . A A . 11 DAL N 1 1 15 5756 1 1 11 DAL O O -0.285 -16.174 -15.798 1.00 . A A . 11 DAL O 1 1 15 5757 1 1 12 HIS C C -2.782 -17.171 -18.168 1.00 . A A . 12 HIS C 1 1 15 5758 1 1 12 HIS CA C -2.570 -17.466 -16.686 1.00 . A A . 12 HIS CA 1 1 15 5759 1 1 12 HIS CB C -3.683 -18.380 -16.172 1.00 . A A . 12 HIS CB 1 1 15 5760 1 1 12 HIS CD2 C -5.729 -17.033 -15.322 1.00 . A A . 12 HIS CD2 1 1 15 5761 1 1 12 HIS CE1 C -6.996 -17.217 -17.102 1.00 . A A . 12 HIS CE1 1 1 15 5762 1 1 12 HIS CG C -5.045 -17.761 -16.235 1.00 . A A . 12 HIS CG 1 1 15 5763 1 1 12 HIS H H -3.374 -15.793 -15.667 1.00 . A A . 12 HIS H 1 1 15 5764 1 1 12 HIS HA H -1.621 -17.964 -16.563 1.00 . A A . 12 HIS HA 1 1 15 5765 1 1 12 HIS HB2 H -3.701 -19.282 -16.766 1.00 . A A . 12 HIS HB2 1 1 15 5766 1 1 12 HIS HB3 H -3.481 -18.637 -15.142 1.00 . A A . 12 HIS HB3 1 1 15 5767 1 1 12 HIS HD1 H -5.651 -18.328 -18.172 1.00 . A A . 12 HIS HD1 1 1 15 5768 1 1 12 HIS HD2 H -5.388 -16.759 -14.334 1.00 . A A . 12 HIS HD2 1 1 15 5769 1 1 12 HIS HE1 H -7.826 -17.125 -17.787 1.00 . A A . 12 HIS HE1 1 1 15 5770 1 1 12 HIS N N -2.532 -16.231 -15.912 1.00 . A A . 12 HIS N 1 1 15 5771 1 1 12 HIS ND1 N -5.866 -17.859 -17.339 1.00 . A A . 12 HIS ND1 1 1 15 5772 1 1 12 HIS NE2 N -6.939 -16.707 -15.885 1.00 . A A . 12 HIS NE2 1 1 15 5773 1 1 12 HIS O O -2.285 -17.895 -19.032 1.00 . A A . 12 HIS O 1 1 15 5774 1 1 13 ASP C C -3.302 -14.300 -20.107 1.00 . A A . 13 ASP C 1 1 15 5775 1 1 13 ASP CA C -3.800 -15.716 -19.833 1.00 . A A . 13 ASP CA 1 1 15 5776 1 1 13 ASP CB C -5.299 -15.808 -20.119 1.00 . A A . 13 ASP CB 1 1 15 5777 1 1 13 ASP CG C -5.657 -17.029 -20.943 1.00 . A A . 13 ASP CG 1 1 15 5778 1 1 13 ASP H H -3.891 -15.569 -17.722 1.00 . A A . 13 ASP H 1 1 15 5779 1 1 13 ASP HA H -3.276 -16.400 -20.483 1.00 . A A . 13 ASP HA 1 1 15 5780 1 1 13 ASP HB2 H -5.836 -15.859 -19.183 1.00 . A A . 13 ASP HB2 1 1 15 5781 1 1 13 ASP HB3 H -5.610 -14.926 -20.660 1.00 . A A . 13 ASP HB3 1 1 15 5782 1 1 13 ASP N N -3.522 -16.106 -18.455 1.00 . A A . 13 ASP N 1 1 15 5783 1 1 13 ASP O O -2.484 -14.081 -21.000 1.00 . A A . 13 ASP O 1 1 15 5784 1 1 13 ASP OD1 O -5.176 -17.133 -22.091 1.00 . A A . 13 ASP OD1 1 1 15 5785 1 1 13 ASP OD2 O -6.419 -17.881 -20.441 1.00 . A A . 13 ASP OD2 1 1 15 5786 1 1 14 CYS C C -3.835 -11.417 -20.860 1.00 . A A . 14 CYS C 1 1 15 5787 1 1 14 CYS CA C -3.412 -11.948 -19.493 1.00 . A A . 14 CYS CA 1 1 15 5788 1 1 14 CYS CB C -1.899 -11.798 -19.322 1.00 . A A . 14 CYS CB 1 1 15 5789 1 1 14 CYS H H -4.453 -13.580 -18.638 1.00 . A A . 14 CYS H 1 1 15 5790 1 1 14 CYS HA H -3.910 -11.373 -18.727 1.00 . A A . 14 CYS HA 1 1 15 5791 1 1 14 CYS HB2 H -1.619 -12.148 -18.339 1.00 . A A . 14 CYS HB2 1 1 15 5792 1 1 14 CYS HB3 H -1.399 -12.397 -20.068 1.00 . A A . 14 CYS HB3 1 1 15 5793 1 1 14 CYS N N -3.803 -13.343 -19.334 1.00 . A A . 14 CYS N 1 1 15 5794 1 1 14 CYS O O -3.851 -12.154 -21.846 1.00 . A A . 14 CYS O 1 1 15 5795 1 1 14 CYS SG S -1.297 -10.086 -19.490 1.00 . A A . 14 CYS SG 1 1 15 5796 1 1 15 HIS C C -3.861 -8.187 -22.377 1.00 . A A . 15 HIS C 1 1 15 5797 1 1 15 HIS CA C -4.601 -9.503 -22.155 1.00 . A A . 15 HIS CA 1 1 15 5798 1 1 15 HIS CB C -6.110 -9.257 -22.140 1.00 . A A . 15 HIS CB 1 1 15 5799 1 1 15 HIS CD2 C -6.670 -10.510 -24.341 1.00 . A A . 15 HIS CD2 1 1 15 5800 1 1 15 HIS CE1 C -8.456 -11.580 -23.655 1.00 . A A . 15 HIS CE1 1 1 15 5801 1 1 15 HIS CG C -6.875 -10.172 -23.047 1.00 . A A . 15 HIS CG 1 1 15 5802 1 1 15 HIS H H -4.145 -9.598 -20.090 1.00 . A A . 15 HIS H 1 1 15 5803 1 1 15 HIS HA H -4.363 -10.176 -22.965 1.00 . A A . 15 HIS HA 1 1 15 5804 1 1 15 HIS HB2 H -6.481 -9.399 -21.136 1.00 . A A . 15 HIS HB2 1 1 15 5805 1 1 15 HIS HB3 H -6.306 -8.241 -22.451 1.00 . A A . 15 HIS HB3 1 1 15 5806 1 1 15 HIS HD1 H -8.407 -10.822 -21.756 1.00 . A A . 15 HIS HD1 1 1 15 5807 1 1 15 HIS HD2 H -5.871 -10.157 -24.978 1.00 . A A . 15 HIS HD2 1 1 15 5808 1 1 15 HIS HE1 H -9.326 -12.220 -23.634 1.00 . A A . 15 HIS HE1 1 1 15 5809 1 1 15 HIS N N -4.178 -10.133 -20.910 1.00 . A A . 15 HIS N 1 1 15 5810 1 1 15 HIS ND1 N -8.002 -10.858 -22.647 1.00 . A A . 15 HIS ND1 1 1 15 5811 1 1 15 HIS NE2 N -7.666 -11.387 -24.696 1.00 . A A . 15 HIS NE2 1 1 15 5812 1 1 15 HIS O O -3.368 -7.918 -23.472 1.00 . A A . 15 HIS O 1 1 15 5813 1 1 16 MET C C -3.023 -5.427 -20.037 1.00 . A A . 16 MET C 1 1 15 5814 1 1 16 MET CA C -3.108 -6.084 -21.411 1.00 . A A . 16 MET CA 1 1 15 5815 1 1 16 MET CB C -3.837 -5.158 -22.387 1.00 . A A . 16 MET CB 1 1 15 5816 1 1 16 MET CE C -2.803 -1.854 -24.259 1.00 . A A . 16 MET CE 1 1 15 5817 1 1 16 MET CG C -2.914 -4.483 -23.388 1.00 . A A . 16 MET CG 1 1 15 5818 1 1 16 MET H H -4.201 -7.641 -20.483 1.00 . A A . 16 MET H 1 1 15 5819 1 1 16 MET HA H -2.108 -6.260 -21.775 1.00 . A A . 16 MET HA 1 1 15 5820 1 1 16 MET HB2 H -4.567 -5.736 -22.935 1.00 . A A . 16 MET HB2 1 1 15 5821 1 1 16 MET HB3 H -4.346 -4.390 -21.825 1.00 . A A . 16 MET HB3 1 1 15 5822 1 1 16 MET HE1 H -2.467 -1.503 -25.223 1.00 . A A . 16 MET HE1 1 1 15 5823 1 1 16 MET HE2 H -3.402 -1.090 -23.786 1.00 . A A . 16 MET HE2 1 1 15 5824 1 1 16 MET HE3 H -1.947 -2.077 -23.639 1.00 . A A . 16 MET HE3 1 1 15 5825 1 1 16 MET HG2 H -2.155 -3.937 -22.847 1.00 . A A . 16 MET HG2 1 1 15 5826 1 1 16 MET HG3 H -2.444 -5.244 -23.994 1.00 . A A . 16 MET HG3 1 1 15 5827 1 1 16 MET N N -3.788 -7.371 -21.330 1.00 . A A . 16 MET N 1 1 15 5828 1 1 16 MET O O -3.338 -6.047 -19.022 1.00 . A A . 16 MET O 1 1 15 5829 1 1 16 MET SD S -3.786 -3.336 -24.473 1.00 . A A . 16 MET SD 1 1 15 5830 1 1 17 ASN C C -1.398 -4.050 -17.869 1.00 . A A . 17 ASN C 1 1 15 5831 1 1 17 ASN CA C -2.467 -3.429 -18.763 1.00 . A A . 17 ASN CA 1 1 15 5832 1 1 17 ASN CB C -3.807 -3.397 -18.026 1.00 . A A . 17 ASN CB 1 1 15 5833 1 1 17 ASN CG C -4.982 -3.225 -18.970 1.00 . A A . 17 ASN CG 1 1 15 5834 1 1 17 ASN H H -2.358 -3.728 -20.855 1.00 . A A . 17 ASN H 1 1 15 5835 1 1 17 ASN HA H -2.175 -2.418 -19.005 1.00 . A A . 17 ASN HA 1 1 15 5836 1 1 17 ASN HB2 H -3.937 -4.323 -17.486 1.00 . A A . 17 ASN HB2 1 1 15 5837 1 1 17 ASN HB3 H -3.808 -2.574 -17.326 1.00 . A A . 17 ASN HB3 1 1 15 5838 1 1 17 ASN HD21 H -5.561 -5.097 -18.628 1.00 . A A . 17 ASN HD21 1 1 15 5839 1 1 17 ASN HD22 H -6.542 -4.196 -19.729 1.00 . A A . 17 ASN HD22 1 1 15 5840 1 1 17 ASN N N -2.594 -4.169 -20.013 1.00 . A A . 17 ASN N 1 1 15 5841 1 1 17 ASN ND2 N -5.775 -4.279 -19.124 1.00 . A A . 17 ASN ND2 1 1 15 5842 1 1 17 ASN O O -0.614 -4.888 -18.313 1.00 . A A . 17 ASN O 1 1 15 5843 1 1 17 ASN OD1 O -5.174 -2.158 -19.552 1.00 . A A . 17 ASN OD1 1 1 15 5844 1 1 18 DAL C C 0.003 -3.056 -14.688 1.00 . A A . 18 DAL C 1 1 15 5845 1 1 18 DAL CA C -0.392 -4.153 -15.644 1.00 . A A . 18 DAL CA 1 1 15 5846 1 1 18 DAL CB C -1.014 -5.312 -14.862 1.00 . A A . 18 DAL CB 1 1 15 5847 1 1 18 DAL H H -2.024 -2.962 -16.313 1.00 . A A . 18 DAL H 1 1 15 5848 1 1 18 DAL HA H 0.490 -4.505 -16.178 1.00 . A A . 18 DAL HA 1 1 15 5849 1 1 18 DAL HB1 H -0.623 -6.257 -15.240 1.00 . A A . 18 DAL HB1 1 1 15 5850 1 1 18 DAL HB2 H -0.763 -5.212 -13.806 1.00 . A A . 18 DAL HB2 1 1 15 5851 1 1 18 DAL N N -1.373 -3.633 -16.608 1.00 . A A . 18 DAL N 1 1 15 5852 1 1 18 DAL O O 1.119 -2.540 -14.747 1.00 . A A . 18 DAL O 1 1 15 5853 1 1 19 PHE C C -1.264 -2.003 -11.466 1.00 . A A . 19 PHE C 1 1 15 5854 1 1 19 PHE CA C -0.660 -1.643 -12.820 1.00 . A A . 19 PHE CA 1 1 15 5855 1 1 19 PHE CB C -1.231 -0.310 -13.308 1.00 . A A . 19 PHE CB 1 1 15 5856 1 1 19 PHE CD1 C -3.501 -1.097 -14.033 1.00 . A A . 19 PHE CD1 1 1 15 5857 1 1 19 PHE CD2 C -3.371 0.665 -12.432 1.00 . A A . 19 PHE CD2 1 1 15 5858 1 1 19 PHE CE1 C -4.881 -1.041 -13.988 1.00 . A A . 19 PHE CE1 1 1 15 5859 1 1 19 PHE CE2 C -4.751 0.725 -12.382 1.00 . A A . 19 PHE CE2 1 1 15 5860 1 1 19 PHE CG C -2.731 -0.246 -13.257 1.00 . A A . 19 PHE CG 1 1 15 5861 1 1 19 PHE CZ C -5.507 -0.128 -13.162 1.00 . A A . 19 PHE CZ 1 1 15 5862 1 1 19 PHE H H -1.788 -3.141 -13.803 1.00 . A A . 19 PHE H 1 1 15 5863 1 1 19 PHE HA H 0.409 -1.548 -12.710 1.00 . A A . 19 PHE HA 1 1 15 5864 1 1 19 PHE HB2 H -0.844 0.487 -12.691 1.00 . A A . 19 PHE HB2 1 1 15 5865 1 1 19 PHE HB3 H -0.926 -0.149 -14.331 1.00 . A A . 19 PHE HB3 1 1 15 5866 1 1 19 PHE HD1 H -3.012 -1.812 -14.680 1.00 . A A . 19 PHE HD1 1 1 15 5867 1 1 19 PHE HD2 H -2.781 1.334 -11.823 1.00 . A A . 19 PHE HD2 1 1 15 5868 1 1 19 PHE HE1 H -5.469 -1.710 -14.599 1.00 . A A . 19 PHE HE1 1 1 15 5869 1 1 19 PHE HE2 H -5.237 1.440 -11.736 1.00 . A A . 19 PHE HE2 1 1 15 5870 1 1 19 PHE HZ H -6.585 -0.083 -13.124 1.00 . A A . 19 PHE HZ 1 1 15 5871 1 1 19 PHE N N -0.916 -2.693 -13.800 1.00 . A A . 19 PHE N 1 1 15 5872 1 1 19 PHE O O -1.679 -1.127 -10.708 1.00 . A A . 19 PHE O 1 1 15 5873 1 1 20 GLN C C -1.780 -5.295 -9.817 1.00 . A A . 20 GLN C 1 1 15 5874 1 1 20 GLN CA C -1.864 -3.775 -9.909 1.00 . A A . 20 GLN CA 1 1 15 5875 1 1 20 GLN CB C -3.317 -3.322 -9.764 1.00 . A A . 20 GLN CB 1 1 15 5876 1 1 20 GLN CD C -5.062 -2.533 -8.115 1.00 . A A . 20 GLN CD 1 1 15 5877 1 1 20 GLN CG C -3.590 -2.556 -8.479 1.00 . A A . 20 GLN CG 1 1 15 5878 1 1 20 GLN H H -0.962 -3.948 -11.816 1.00 . A A . 20 GLN H 1 1 15 5879 1 1 20 GLN HA H -1.281 -3.346 -9.108 1.00 . A A . 20 GLN HA 1 1 15 5880 1 1 20 GLN HB2 H -3.569 -2.685 -10.598 1.00 . A A . 20 GLN HB2 1 1 15 5881 1 1 20 GLN HB3 H -3.956 -4.193 -9.780 1.00 . A A . 20 GLN HB3 1 1 15 5882 1 1 20 GLN HE21 H -4.610 -2.661 -6.183 1.00 . A A . 20 GLN HE21 1 1 15 5883 1 1 20 GLN HE22 H -6.295 -2.588 -6.557 1.00 . A A . 20 GLN HE22 1 1 15 5884 1 1 20 GLN HG2 H -3.043 -3.022 -7.673 1.00 . A A . 20 GLN HG2 1 1 15 5885 1 1 20 GLN HG3 H -3.249 -1.539 -8.603 1.00 . A A . 20 GLN HG3 1 1 15 5886 1 1 20 GLN N N -1.309 -3.298 -11.171 1.00 . A A . 20 GLN N 1 1 15 5887 1 1 20 GLN NE2 N -5.353 -2.602 -6.821 1.00 . A A . 20 GLN NE2 1 1 15 5888 1 1 20 GLN O O -2.254 -6.007 -10.702 1.00 . A A . 20 GLN O 1 1 15 5889 1 1 20 GLN OE1 O -5.928 -2.455 -8.986 1.00 . A A . 20 GLN OE1 1 1 15 5890 1 1 21 PHE C C -1.764 -7.667 -7.274 1.00 . A A . 21 PHE C 1 1 15 5891 1 1 21 PHE CA C -1.027 -7.221 -8.534 1.00 . A A . 21 PHE CA 1 1 15 5892 1 1 21 PHE CB C 0.453 -7.594 -8.432 1.00 . A A . 21 PHE CB 1 1 15 5893 1 1 21 PHE CD1 C 0.833 -8.217 -10.833 1.00 . A A . 21 PHE CD1 1 1 15 5894 1 1 21 PHE CD2 C 2.258 -6.579 -9.848 1.00 . A A . 21 PHE CD2 1 1 15 5895 1 1 21 PHE CE1 C 1.514 -8.097 -12.029 1.00 . A A . 21 PHE CE1 1 1 15 5896 1 1 21 PHE CE2 C 2.943 -6.453 -11.042 1.00 . A A . 21 PHE CE2 1 1 15 5897 1 1 21 PHE CG C 1.196 -7.461 -9.730 1.00 . A A . 21 PHE CG 1 1 15 5898 1 1 21 PHE CZ C 2.571 -7.214 -12.134 1.00 . A A . 21 PHE CZ 1 1 15 5899 1 1 21 PHE H H -0.816 -5.166 -8.070 1.00 . A A . 21 PHE H 1 1 15 5900 1 1 21 PHE HA H -1.458 -7.724 -9.386 1.00 . A A . 21 PHE HA 1 1 15 5901 1 1 21 PHE HB2 H 0.930 -6.950 -7.709 1.00 . A A . 21 PHE HB2 1 1 15 5902 1 1 21 PHE HB3 H 0.536 -8.620 -8.104 1.00 . A A . 21 PHE HB3 1 1 15 5903 1 1 21 PHE HD1 H 0.006 -8.909 -10.752 1.00 . A A . 21 PHE HD1 1 1 15 5904 1 1 21 PHE HD2 H 2.551 -5.984 -8.996 1.00 . A A . 21 PHE HD2 1 1 15 5905 1 1 21 PHE HE1 H 1.221 -8.693 -12.880 1.00 . A A . 21 PHE HE1 1 1 15 5906 1 1 21 PHE HE2 H 3.769 -5.762 -11.121 1.00 . A A . 21 PHE HE2 1 1 15 5907 1 1 21 PHE HZ H 3.105 -7.118 -13.067 1.00 . A A . 21 PHE HZ 1 1 15 5908 1 1 21 PHE N N -1.174 -5.785 -8.741 1.00 . A A . 21 PHE N 1 1 15 5909 1 1 21 PHE O O -1.205 -7.656 -6.178 1.00 . A A . 21 PHE O 1 1 15 5910 1 1 22 VAL C C -3.507 -9.949 -5.941 1.00 . A A . 22 VAL C 1 1 15 5911 1 1 22 VAL CA C -3.838 -8.509 -6.318 1.00 . A A . 22 VAL CA 1 1 15 5912 1 1 22 VAL CB C -5.341 -8.407 -6.639 1.00 . A A . 22 VAL CB 1 1 15 5913 1 1 22 VAL CG1 C -5.766 -6.951 -6.747 1.00 . A A . 22 VAL CG1 1 1 15 5914 1 1 22 VAL CG2 C -5.665 -9.162 -7.919 1.00 . A A . 22 VAL CG2 1 1 15 5915 1 1 22 VAL H H -3.414 -8.045 -8.339 1.00 . A A . 22 VAL H 1 1 15 5916 1 1 22 VAL HA H -3.627 -7.869 -5.474 1.00 . A A . 22 VAL HA 1 1 15 5917 1 1 22 VAL HB H -5.893 -8.861 -5.829 1.00 . A A . 22 VAL HB 1 1 15 5918 1 1 22 VAL HG11 H -4.999 -6.389 -7.260 1.00 . A A . 22 VAL HG11 1 1 15 5919 1 1 22 VAL HG12 H -6.692 -6.886 -7.299 1.00 . A A . 22 VAL HG12 1 1 15 5920 1 1 22 VAL HG13 H -5.908 -6.543 -5.757 1.00 . A A . 22 VAL HG13 1 1 15 5921 1 1 22 VAL HG21 H -5.227 -10.148 -7.875 1.00 . A A . 22 VAL HG21 1 1 15 5922 1 1 22 VAL HG22 H -6.737 -9.249 -8.025 1.00 . A A . 22 VAL HG22 1 1 15 5923 1 1 22 VAL HG23 H -5.262 -8.626 -8.765 1.00 . A A . 22 VAL HG23 1 1 15 5924 1 1 22 VAL N N -3.023 -8.059 -7.440 1.00 . A A . 22 VAL N 1 1 15 5925 1 1 22 VAL O O -3.664 -10.353 -4.789 1.00 . A A . 22 VAL O 1 1 15 5926 1 1 23 PHE C C -1.621 -12.574 -7.678 1.00 . A A . 23 PHE C 1 1 15 5927 1 1 23 PHE CA C -2.693 -12.116 -6.693 1.00 . A A . 23 PHE CA 1 1 15 5928 1 1 23 PHE CB C -3.931 -13.006 -6.820 1.00 . A A . 23 PHE CB 1 1 15 5929 1 1 23 PHE CD1 C -4.910 -12.954 -4.510 1.00 . A A . 23 PHE CD1 1 1 15 5930 1 1 23 PHE CD2 C -6.174 -12.008 -6.297 1.00 . A A . 23 PHE CD2 1 1 15 5931 1 1 23 PHE CE1 C -5.916 -12.627 -3.621 1.00 . A A . 23 PHE CE1 1 1 15 5932 1 1 23 PHE CE2 C -7.183 -11.678 -5.413 1.00 . A A . 23 PHE CE2 1 1 15 5933 1 1 23 PHE CG C -5.027 -12.649 -5.856 1.00 . A A . 23 PHE CG 1 1 15 5934 1 1 23 PHE CZ C -7.055 -11.989 -4.073 1.00 . A A . 23 PHE CZ 1 1 15 5935 1 1 23 PHE H H -2.943 -10.341 -7.819 1.00 . A A . 23 PHE H 1 1 15 5936 1 1 23 PHE HA H -2.302 -12.199 -5.691 1.00 . A A . 23 PHE HA 1 1 15 5937 1 1 23 PHE HB2 H -4.328 -12.917 -7.820 1.00 . A A . 23 PHE HB2 1 1 15 5938 1 1 23 PHE HB3 H -3.649 -14.032 -6.638 1.00 . A A . 23 PHE HB3 1 1 15 5939 1 1 23 PHE HD1 H -4.020 -13.454 -4.155 1.00 . A A . 23 PHE HD1 1 1 15 5940 1 1 23 PHE HD2 H -6.276 -11.765 -7.345 1.00 . A A . 23 PHE HD2 1 1 15 5941 1 1 23 PHE HE1 H -5.813 -12.872 -2.574 1.00 . A A . 23 PHE HE1 1 1 15 5942 1 1 23 PHE HE2 H -8.072 -11.179 -5.769 1.00 . A A . 23 PHE HE2 1 1 15 5943 1 1 23 PHE HZ H -7.841 -11.731 -3.380 1.00 . A A . 23 PHE HZ 1 1 15 5944 1 1 23 PHE N N -3.046 -10.720 -6.921 1.00 . A A . 23 PHE N 1 1 15 5945 1 1 23 PHE O O -1.448 -13.769 -7.912 1.00 . A A . 23 PHE O 1 1 15 5946 1 1 24 DBU C C -0.281 -11.878 -10.601 1.00 . A A . 24 DBU C 1 1 15 5947 1 1 24 DBU CA C 0.082 -11.897 -9.152 1.00 . A A . 24 DBU CA 1 1 15 5948 1 1 24 DBU CB C 1.364 -12.195 -8.875 1.00 . A A . 24 DBU CB 1 1 15 5949 1 1 24 DBU CG C 1.978 -12.278 -7.513 1.00 . A A . 24 DBU CG 1 1 15 5950 1 1 24 DBU HG1 H 1.295 -12.662 -6.750 1.00 . A A . 24 DBU HG1 1 1 15 5951 1 1 24 DBU HG2 H 2.309 -11.284 -7.197 1.00 . A A . 24 DBU HG2 1 1 15 5952 1 1 24 DBU HG3 H 2.852 -12.936 -7.542 1.00 . A A . 24 DBU HG3 1 1 15 5953 1 1 24 DBU N N -0.905 -11.613 -8.253 1.00 . A A . 24 DBU N 1 1 15 5954 1 1 24 DBU O O 0.470 -12.364 -11.446 1.00 . A A . 24 DBU O 1 1 15 5955 1 1 25 CYS C C -2.463 -9.840 -12.589 1.00 . A A . 25 CYS C 1 1 15 5956 1 1 25 CYS CA C -1.917 -11.232 -12.284 1.00 . A A . 25 CYS CA 1 1 15 5957 1 1 25 CYS CB C -2.999 -12.283 -12.538 1.00 . A A . 25 CYS CB 1 1 15 5958 1 1 25 CYS H H -2.001 -10.945 -10.188 1.00 . A A . 25 CYS H 1 1 15 5959 1 1 25 CYS HA H -1.078 -11.427 -12.934 1.00 . A A . 25 CYS HA 1 1 15 5960 1 1 25 CYS HB2 H -3.969 -11.839 -12.365 1.00 . A A . 25 CYS HB2 1 1 15 5961 1 1 25 CYS HB3 H -2.938 -12.611 -13.565 1.00 . A A . 25 CYS HB3 1 1 15 5962 1 1 25 CYS N N -1.445 -11.314 -10.907 1.00 . A A . 25 CYS N 1 1 15 5963 1 1 25 CYS O O -2.255 -8.898 -11.824 1.00 . A A . 25 CYS O 1 1 15 5964 1 1 25 CYS SG S -2.869 -13.757 -11.475 1.00 . A A . 25 CYS SG 1 1 15 5965 1 1 26 CYS C C -5.057 -8.653 -14.859 1.00 . A A . 26 CYS C 1 1 15 5966 1 1 26 CYS CA C -3.738 -8.443 -14.121 1.00 . A A . 26 CYS CA 1 1 15 5967 1 1 26 CYS CB C -2.758 -7.679 -15.013 1.00 . A A . 26 CYS CB 1 1 15 5968 1 1 26 CYS H H -3.294 -10.506 -14.282 1.00 . A A . 26 CYS H 1 1 15 5969 1 1 26 CYS HA H -3.927 -7.864 -13.230 1.00 . A A . 26 CYS HA 1 1 15 5970 1 1 26 CYS HB2 H -1.751 -7.993 -14.779 1.00 . A A . 26 CYS HB2 1 1 15 5971 1 1 26 CYS HB3 H -2.970 -7.909 -16.047 1.00 . A A . 26 CYS HB3 1 1 15 5972 1 1 26 CYS N N -3.162 -9.718 -13.712 1.00 . A A . 26 CYS N 1 1 15 5973 1 1 26 CYS O O -5.167 -9.529 -15.717 1.00 . A A . 26 CYS O 1 1 15 5974 1 1 26 CYS SG S -2.832 -5.869 -14.819 1.00 . A A . 26 CYS SG 1 1 15 5975 1 1 27 SER C C -8.070 -6.588 -15.154 1.00 . A A . 27 SER C 1 1 15 5976 1 1 27 SER CA C -7.368 -7.943 -15.146 1.00 . A A . 27 SER CA 1 1 15 5977 1 1 27 SER CB C -8.230 -8.973 -14.414 1.00 . A A . 27 SER CB 1 1 15 5978 1 1 27 SER H H -5.905 -7.165 -13.827 1.00 . A A . 27 SER H 1 1 15 5979 1 1 27 SER HA H -7.224 -8.267 -16.166 1.00 . A A . 27 SER HA 1 1 15 5980 1 1 27 SER HB2 H -7.938 -9.966 -14.720 1.00 . A A . 27 SER HB2 1 1 15 5981 1 1 27 SER HB3 H -8.085 -8.867 -13.348 1.00 . A A . 27 SER HB3 1 1 15 5982 1 1 27 SER HG H -10.063 -8.488 -13.920 1.00 . A A . 27 SER HG 1 1 15 5983 1 1 27 SER N N -6.055 -7.844 -14.519 1.00 . A A . 27 SER N 1 1 15 5984 1 1 27 SER O O -7.686 -5.684 -15.894 1.00 . A A . 27 SER O 1 1 15 5985 1 1 27 SER OG O -9.604 -8.789 -14.708 1.00 . A A . 27 SER OG 1 1 16 5986 1 1 1 LYS C C 1.810 4.390 -5.637 1.00 . A A . 1 LYS C 1 1 16 5987 1 1 1 LYS CA C 2.567 5.706 -5.789 1.00 . A A . 1 LYS CA 1 1 16 5988 1 1 1 LYS CB C 1.580 6.850 -6.027 1.00 . A A . 1 LYS CB 1 1 16 5989 1 1 1 LYS CD C -0.365 7.665 -7.392 1.00 . A A . 1 LYS CD 1 1 16 5990 1 1 1 LYS CE C -1.646 6.874 -7.178 1.00 . A A . 1 LYS CE 1 1 16 5991 1 1 1 LYS CG C 0.858 6.764 -7.361 1.00 . A A . 1 LYS CG 1 1 16 5992 1 1 1 LYS H1 H 4.444 5.339 -6.697 1.00 . A A . 1 LYS H1 1 1 16 5993 1 1 1 LYS HA H 3.117 5.898 -4.880 1.00 . A A . 1 LYS HA 1 1 16 5994 1 1 1 LYS HB2 H 0.840 6.841 -5.240 1.00 . A A . 1 LYS HB2 1 1 16 5995 1 1 1 LYS HB3 H 2.118 7.787 -5.993 1.00 . A A . 1 LYS HB3 1 1 16 5996 1 1 1 LYS HD2 H -0.277 8.405 -6.611 1.00 . A A . 1 LYS HD2 1 1 16 5997 1 1 1 LYS HD3 H -0.413 8.158 -8.353 1.00 . A A . 1 LYS HD3 1 1 16 5998 1 1 1 LYS HE2 H -1.928 6.411 -8.111 1.00 . A A . 1 LYS HE2 1 1 16 5999 1 1 1 LYS HE3 H -1.461 6.109 -6.438 1.00 . A A . 1 LYS HE3 1 1 16 6000 1 1 1 LYS HG2 H 1.535 7.066 -8.146 1.00 . A A . 1 LYS HG2 1 1 16 6001 1 1 1 LYS HG3 H 0.546 5.742 -7.525 1.00 . A A . 1 LYS HG3 1 1 16 6002 1 1 1 LYS HZ1 H -3.182 7.347 -5.845 1.00 . A A . 1 LYS HZ1 1 1 16 6003 1 1 1 LYS HZ2 H -3.498 7.802 -7.442 1.00 . A A . 1 LYS HZ2 1 1 16 6004 1 1 1 LYS HZ3 H -2.410 8.698 -6.507 1.00 . A A . 1 LYS HZ3 1 1 16 6005 1 1 1 LYS N N 3.527 5.630 -6.885 1.00 . A A . 1 LYS N 1 1 16 6006 1 1 1 LYS NZ N -2.762 7.741 -6.710 1.00 . A A . 1 LYS NZ 1 1 16 6007 1 1 1 LYS O O 0.669 4.368 -5.175 1.00 . A A . 1 LYS O 1 1 16 6008 1 1 2 LYS C C 2.855 0.881 -6.256 1.00 . A A . 2 LYS C 1 1 16 6009 1 1 2 LYS CA C 1.842 1.974 -5.932 1.00 . A A . 2 LYS CA 1 1 16 6010 1 1 2 LYS CB C 0.646 1.873 -6.881 1.00 . A A . 2 LYS CB 1 1 16 6011 1 1 2 LYS CD C -1.859 1.829 -7.067 1.00 . A A . 2 LYS CD 1 1 16 6012 1 1 2 LYS CE C -2.198 3.312 -7.079 1.00 . A A . 2 LYS CE 1 1 16 6013 1 1 2 LYS CG C -0.660 1.539 -6.180 1.00 . A A . 2 LYS CG 1 1 16 6014 1 1 2 LYS H H 3.361 3.376 -6.387 1.00 . A A . 2 LYS H 1 1 16 6015 1 1 2 LYS HA H 1.498 1.840 -4.917 1.00 . A A . 2 LYS HA 1 1 16 6016 1 1 2 LYS HB2 H 0.525 2.818 -7.390 1.00 . A A . 2 LYS HB2 1 1 16 6017 1 1 2 LYS HB3 H 0.845 1.103 -7.611 1.00 . A A . 2 LYS HB3 1 1 16 6018 1 1 2 LYS HD2 H -1.634 1.515 -8.076 1.00 . A A . 2 LYS HD2 1 1 16 6019 1 1 2 LYS HD3 H -2.711 1.277 -6.698 1.00 . A A . 2 LYS HD3 1 1 16 6020 1 1 2 LYS HE2 H -2.135 3.690 -6.070 1.00 . A A . 2 LYS HE2 1 1 16 6021 1 1 2 LYS HE3 H -1.482 3.827 -7.702 1.00 . A A . 2 LYS HE3 1 1 16 6022 1 1 2 LYS HG2 H -0.662 0.491 -5.922 1.00 . A A . 2 LYS HG2 1 1 16 6023 1 1 2 LYS HG3 H -0.737 2.134 -5.280 1.00 . A A . 2 LYS HG3 1 1 16 6024 1 1 2 LYS HZ1 H -3.634 4.531 -7.983 1.00 . A A . 2 LYS HZ1 1 1 16 6025 1 1 2 LYS HZ2 H -4.269 3.451 -6.847 1.00 . A A . 2 LYS HZ2 1 1 16 6026 1 1 2 LYS HZ3 H -3.787 2.890 -8.368 1.00 . A A . 2 LYS HZ3 1 1 16 6027 1 1 2 LYS N N 2.453 3.295 -6.027 1.00 . A A . 2 LYS N 1 1 16 6028 1 1 2 LYS NZ N -3.568 3.563 -7.606 1.00 . A A . 2 LYS NZ 1 1 16 6029 1 1 2 LYS O O 2.946 -0.125 -5.552 1.00 . A A . 2 LYS O 1 1 16 6030 1 1 3 LYS C C 3.986 -1.220 -8.092 1.00 . A A . 3 LYS C 1 1 16 6031 1 1 3 LYS CA C 4.627 0.120 -7.742 1.00 . A A . 3 LYS CA 1 1 16 6032 1 1 3 LYS CB C 5.665 -0.074 -6.635 1.00 . A A . 3 LYS CB 1 1 16 6033 1 1 3 LYS CD C 7.618 1.348 -5.945 1.00 . A A . 3 LYS CD 1 1 16 6034 1 1 3 LYS CE C 8.411 0.578 -4.900 1.00 . A A . 3 LYS CE 1 1 16 6035 1 1 3 LYS CG C 7.052 0.422 -7.008 1.00 . A A . 3 LYS CG 1 1 16 6036 1 1 3 LYS H H 3.498 1.908 -7.847 1.00 . A A . 3 LYS H 1 1 16 6037 1 1 3 LYS HA H 5.118 0.511 -8.620 1.00 . A A . 3 LYS HA 1 1 16 6038 1 1 3 LYS HB2 H 5.339 0.461 -5.755 1.00 . A A . 3 LYS HB2 1 1 16 6039 1 1 3 LYS HB3 H 5.733 -1.126 -6.402 1.00 . A A . 3 LYS HB3 1 1 16 6040 1 1 3 LYS HD2 H 8.270 2.068 -6.416 1.00 . A A . 3 LYS HD2 1 1 16 6041 1 1 3 LYS HD3 H 6.802 1.863 -5.457 1.00 . A A . 3 LYS HD3 1 1 16 6042 1 1 3 LYS HE2 H 8.418 -0.467 -5.171 1.00 . A A . 3 LYS HE2 1 1 16 6043 1 1 3 LYS HE3 H 9.423 0.953 -4.887 1.00 . A A . 3 LYS HE3 1 1 16 6044 1 1 3 LYS HG2 H 7.710 -0.426 -7.119 1.00 . A A . 3 LYS HG2 1 1 16 6045 1 1 3 LYS HG3 H 6.992 0.959 -7.945 1.00 . A A . 3 LYS HG3 1 1 16 6046 1 1 3 LYS HZ1 H 7.071 1.441 -3.550 1.00 . A A . 3 LYS HZ1 1 1 16 6047 1 1 3 LYS HZ2 H 8.556 1.012 -2.862 1.00 . A A . 3 LYS HZ2 1 1 16 6048 1 1 3 LYS HZ3 H 7.416 -0.184 -3.228 1.00 . A A . 3 LYS HZ3 1 1 16 6049 1 1 3 LYS N N 3.617 1.086 -7.325 1.00 . A A . 3 LYS N 1 1 16 6050 1 1 3 LYS NZ N 7.822 0.722 -3.540 1.00 . A A . 3 LYS NZ 1 1 16 6051 1 1 3 LYS O O 2.782 -1.406 -7.920 1.00 . A A . 3 LYS O 1 1 16 6052 1 1 4 SER C C 4.718 -4.515 -7.925 1.00 . A A . 4 SER C 1 1 16 6053 1 1 4 SER CA C 4.311 -3.470 -8.960 1.00 . A A . 4 SER CA 1 1 16 6054 1 1 4 SER CB C 4.851 -3.864 -10.337 1.00 . A A . 4 SER CB 1 1 16 6055 1 1 4 SER H H 5.750 -1.940 -8.698 1.00 . A A . 4 SER H 1 1 16 6056 1 1 4 SER HA H 3.233 -3.425 -9.005 1.00 . A A . 4 SER HA 1 1 16 6057 1 1 4 SER HB2 H 4.567 -4.882 -10.554 1.00 . A A . 4 SER HB2 1 1 16 6058 1 1 4 SER HB3 H 4.434 -3.205 -11.085 1.00 . A A . 4 SER HB3 1 1 16 6059 1 1 4 SER HG H 6.651 -4.589 -10.074 1.00 . A A . 4 SER HG 1 1 16 6060 1 1 4 SER N N 4.800 -2.149 -8.584 1.00 . A A . 4 SER N 1 1 16 6061 1 1 4 SER O O 5.761 -4.397 -7.284 1.00 . A A . 4 SER O 1 1 16 6062 1 1 4 SER OG O 6.264 -3.765 -10.378 1.00 . A A . 4 SER OG 1 1 16 6063 1 1 5 GLY C C 5.088 -7.656 -7.377 1.00 . A A . 5 GLY C 1 1 16 6064 1 1 5 GLY CA C 4.173 -6.590 -6.809 1.00 . A A . 5 GLY CA 1 1 16 6065 1 1 5 GLY H H 3.067 -5.581 -8.307 1.00 . A A . 5 GLY H 1 1 16 6066 1 1 5 GLY HA2 H 4.642 -6.152 -5.941 1.00 . A A . 5 GLY HA2 1 1 16 6067 1 1 5 GLY HA3 H 3.244 -7.052 -6.509 1.00 . A A . 5 GLY HA3 1 1 16 6068 1 1 5 GLY N N 3.884 -5.539 -7.768 1.00 . A A . 5 GLY N 1 1 16 6069 1 1 5 GLY O O 5.930 -8.205 -6.665 1.00 . A A . 5 GLY O 1 1 16 6070 1 1 6 VAL C C 6.024 -8.576 -10.773 1.00 . A A . 6 VAL C 1 1 16 6071 1 1 6 VAL CA C 5.742 -8.961 -9.325 1.00 . A A . 6 VAL CA 1 1 16 6072 1 1 6 VAL CB C 5.062 -10.343 -9.296 1.00 . A A . 6 VAL CB 1 1 16 6073 1 1 6 VAL CG1 C 5.851 -11.344 -10.126 1.00 . A A . 6 VAL CG1 1 1 16 6074 1 1 6 VAL CG2 C 4.906 -10.830 -7.864 1.00 . A A . 6 VAL CG2 1 1 16 6075 1 1 6 VAL H H 4.237 -7.481 -9.177 1.00 . A A . 6 VAL H 1 1 16 6076 1 1 6 VAL HA H 6.679 -9.034 -8.793 1.00 . A A . 6 VAL HA 1 1 16 6077 1 1 6 VAL HB H 4.077 -10.246 -9.730 1.00 . A A . 6 VAL HB 1 1 16 6078 1 1 6 VAL HG11 H 6.842 -10.956 -10.310 1.00 . A A . 6 VAL HG11 1 1 16 6079 1 1 6 VAL HG12 H 5.922 -12.279 -9.590 1.00 . A A . 6 VAL HG12 1 1 16 6080 1 1 6 VAL HG13 H 5.348 -11.506 -11.068 1.00 . A A . 6 VAL HG13 1 1 16 6081 1 1 6 VAL HG21 H 5.880 -11.045 -7.450 1.00 . A A . 6 VAL HG21 1 1 16 6082 1 1 6 VAL HG22 H 4.425 -10.064 -7.272 1.00 . A A . 6 VAL HG22 1 1 16 6083 1 1 6 VAL HG23 H 4.304 -11.726 -7.851 1.00 . A A . 6 VAL HG23 1 1 16 6084 1 1 6 VAL N N 4.924 -7.953 -8.662 1.00 . A A . 6 VAL N 1 1 16 6085 1 1 6 VAL O O 7.072 -8.008 -11.081 1.00 . A A . 6 VAL O 1 1 16 6086 1 1 7 ILE C C 3.887 -8.194 -13.692 1.00 . A A . 7 ILE C 1 1 16 6087 1 1 7 ILE CA C 5.228 -8.571 -13.072 1.00 . A A . 7 ILE CA 1 1 16 6088 1 1 7 ILE CB C 5.828 -9.755 -13.853 1.00 . A A . 7 ILE CB 1 1 16 6089 1 1 7 ILE CD1 C 7.774 -11.395 -13.889 1.00 . A A . 7 ILE CD1 1 1 16 6090 1 1 7 ILE CG1 C 7.179 -10.156 -13.257 1.00 . A A . 7 ILE CG1 1 1 16 6091 1 1 7 ILE CG2 C 5.977 -9.397 -15.324 1.00 . A A . 7 ILE CG2 1 1 16 6092 1 1 7 ILE H H 4.268 -9.339 -11.349 1.00 . A A . 7 ILE H 1 1 16 6093 1 1 7 ILE HA H 5.902 -7.731 -13.157 1.00 . A A . 7 ILE HA 1 1 16 6094 1 1 7 ILE HB H 5.147 -10.589 -13.778 1.00 . A A . 7 ILE HB 1 1 16 6095 1 1 7 ILE HD11 H 8.283 -11.124 -14.802 1.00 . A A . 7 ILE HD11 1 1 16 6096 1 1 7 ILE HD12 H 8.476 -11.847 -13.205 1.00 . A A . 7 ILE HD12 1 1 16 6097 1 1 7 ILE HD13 H 6.986 -12.099 -14.113 1.00 . A A . 7 ILE HD13 1 1 16 6098 1 1 7 ILE HG12 H 7.879 -9.347 -13.391 1.00 . A A . 7 ILE HG12 1 1 16 6099 1 1 7 ILE HG13 H 7.055 -10.348 -12.201 1.00 . A A . 7 ILE HG13 1 1 16 6100 1 1 7 ILE HG21 H 6.668 -8.573 -15.426 1.00 . A A . 7 ILE HG21 1 1 16 6101 1 1 7 ILE HG22 H 6.355 -10.252 -15.866 1.00 . A A . 7 ILE HG22 1 1 16 6102 1 1 7 ILE HG23 H 5.016 -9.113 -15.725 1.00 . A A . 7 ILE HG23 1 1 16 6103 1 1 7 ILE N N 5.081 -8.887 -11.656 1.00 . A A . 7 ILE N 1 1 16 6104 1 1 7 ILE O O 3.003 -9.030 -13.877 1.00 . A A . 7 ILE O 1 1 16 6105 1 1 8 PRO C C 2.310 -6.879 -16.063 1.00 . A A . 8 PRO C 1 1 16 6106 1 1 8 PRO CA C 2.502 -6.386 -14.633 1.00 . A A . 8 PRO CA 1 1 16 6107 1 1 8 PRO CB C 2.708 -4.869 -14.614 1.00 . A A . 8 PRO CB 1 1 16 6108 1 1 8 PRO CD C 4.744 -5.852 -13.834 1.00 . A A . 8 PRO CD 1 1 16 6109 1 1 8 PRO CG C 4.187 -4.688 -14.608 1.00 . A A . 8 PRO CG 1 1 16 6110 1 1 8 PRO HA H 1.632 -6.640 -14.046 1.00 . A A . 8 PRO HA 1 1 16 6111 1 1 8 PRO HB2 H 2.260 -4.431 -15.494 1.00 . A A . 8 PRO HB2 1 1 16 6112 1 1 8 PRO HB3 H 2.256 -4.452 -13.726 1.00 . A A . 8 PRO HB3 1 1 16 6113 1 1 8 PRO HD2 H 5.697 -6.155 -14.241 1.00 . A A . 8 PRO HD2 1 1 16 6114 1 1 8 PRO HD3 H 4.842 -5.597 -12.789 1.00 . A A . 8 PRO HD3 1 1 16 6115 1 1 8 PRO HG2 H 4.562 -4.697 -15.619 1.00 . A A . 8 PRO HG2 1 1 16 6116 1 1 8 PRO HG3 H 4.441 -3.759 -14.120 1.00 . A A . 8 PRO HG3 1 1 16 6117 1 1 8 PRO N N 3.731 -6.904 -14.025 1.00 . A A . 8 PRO N 1 1 16 6118 1 1 8 PRO O O 2.938 -6.375 -16.992 1.00 . A A . 8 PRO O 1 1 16 6119 1 1 9 . C C 1.731 -9.824 -17.641 1.00 . A A . 9 DBB C 1 1 16 6120 1 1 9 . CA C 1.161 -8.433 -17.559 1.00 . A A . 9 DBB CA 1 1 16 6121 1 1 9 . CB C -0.352 -8.487 -17.784 1.00 . A A . 9 DBB CB 1 1 16 6122 1 1 9 . CG C -0.999 -7.224 -17.210 1.00 . A A . 9 DBB CG 1 1 16 6123 1 1 9 . H H 0.968 -8.229 -15.450 1.00 . A A . 9 DBB H 1 1 16 6124 1 1 9 . HA H 1.620 -7.805 -18.322 1.00 . A A . 9 DBB HA 1 1 16 6125 1 1 9 . HB2 H -0.763 -9.364 -17.286 1.00 . A A . 9 DBB HB2 1 1 16 6126 1 1 9 . HG1 H -0.271 -6.413 -17.206 1.00 . A A . 9 DBB HG1 1 1 16 6127 1 1 9 . HG2 H -1.854 -6.944 -17.823 1.00 . A A . 9 DBB HG2 1 1 16 6128 1 1 9 . HG3 H -1.331 -7.419 -16.189 1.00 . A A . 9 DBB HG3 1 1 16 6129 1 1 9 . N N 1.438 -7.868 -16.231 1.00 . A A . 9 DBB N 1 1 16 6130 1 1 9 . O O 2.676 -10.076 -18.389 1.00 . A A . 9 DBB O 1 1 16 6131 1 1 10 VAL C C 0.437 -13.093 -16.895 1.00 . A A . 10 VAL C 1 1 16 6132 1 1 10 VAL CA C 1.614 -12.125 -16.856 1.00 . A A . 10 VAL CA 1 1 16 6133 1 1 10 VAL CB C 2.468 -12.423 -15.609 1.00 . A A . 10 VAL CB 1 1 16 6134 1 1 10 VAL CG1 C 2.739 -13.915 -15.491 1.00 . A A . 10 VAL CG1 1 1 16 6135 1 1 10 VAL CG2 C 3.771 -11.639 -15.657 1.00 . A A . 10 VAL CG2 1 1 16 6136 1 1 10 VAL H H 0.408 -10.480 -16.293 1.00 . A A . 10 VAL H 1 1 16 6137 1 1 10 VAL HA H 2.227 -12.283 -17.732 1.00 . A A . 10 VAL HA 1 1 16 6138 1 1 10 VAL HB H 1.916 -12.110 -14.736 1.00 . A A . 10 VAL HB 1 1 16 6139 1 1 10 VAL HG11 H 2.133 -14.329 -14.698 1.00 . A A . 10 VAL HG11 1 1 16 6140 1 1 10 VAL HG12 H 2.493 -14.401 -16.424 1.00 . A A . 10 VAL HG12 1 1 16 6141 1 1 10 VAL HG13 H 3.783 -14.075 -15.265 1.00 . A A . 10 VAL HG13 1 1 16 6142 1 1 10 VAL HG21 H 3.577 -10.605 -15.414 1.00 . A A . 10 VAL HG21 1 1 16 6143 1 1 10 VAL HG22 H 4.467 -12.052 -14.940 1.00 . A A . 10 VAL HG22 1 1 16 6144 1 1 10 VAL HG23 H 4.195 -11.704 -16.647 1.00 . A A . 10 VAL HG23 1 1 16 6145 1 1 10 VAL N N 1.157 -10.741 -16.868 1.00 . A A . 10 VAL N 1 1 16 6146 1 1 10 VAL O O 0.014 -13.528 -17.965 1.00 . A A . 10 VAL O 1 1 16 6147 1 1 11 DAL C C -1.174 -15.338 -16.755 1.00 . A A . 11 DAL C 1 1 16 6148 1 1 11 DAL CA C -1.227 -14.349 -15.619 1.00 . A A . 11 DAL CA 1 1 16 6149 1 1 11 DAL CB C -1.157 -15.099 -14.286 1.00 . A A . 11 DAL CB 1 1 16 6150 1 1 11 DAL H H 0.293 -13.045 -14.901 1.00 . A A . 11 DAL H 1 1 16 6151 1 1 11 DAL HA H -2.158 -13.785 -15.670 1.00 . A A . 11 DAL HA 1 1 16 6152 1 1 11 DAL HB1 H -0.880 -14.405 -13.493 1.00 . A A . 11 DAL HB1 1 1 16 6153 1 1 11 DAL HB2 H -2.131 -15.534 -14.064 1.00 . A A . 11 DAL HB2 1 1 16 6154 1 1 11 DAL N N -0.088 -13.425 -15.720 1.00 . A A . 11 DAL N 1 1 16 6155 1 1 11 DAL O O -0.119 -15.896 -17.057 1.00 . A A . 11 DAL O 1 1 16 6156 1 1 12 HIS C C -2.683 -15.754 -19.816 1.00 . A A . 12 HIS C 1 1 16 6157 1 1 12 HIS CA C -2.402 -16.493 -18.511 1.00 . A A . 12 HIS CA 1 1 16 6158 1 1 12 HIS CB C -3.494 -17.533 -18.255 1.00 . A A . 12 HIS CB 1 1 16 6159 1 1 12 HIS CD2 C -2.428 -19.720 -17.356 1.00 . A A . 12 HIS CD2 1 1 16 6160 1 1 12 HIS CE1 C -2.980 -19.501 -15.245 1.00 . A A . 12 HIS CE1 1 1 16 6161 1 1 12 HIS CG C -3.114 -18.560 -17.233 1.00 . A A . 12 HIS CG 1 1 16 6162 1 1 12 HIS H H -3.126 -15.085 -17.106 1.00 . A A . 12 HIS H 1 1 16 6163 1 1 12 HIS HA H -1.451 -16.996 -18.595 1.00 . A A . 12 HIS HA 1 1 16 6164 1 1 12 HIS HB2 H -4.384 -17.031 -17.906 1.00 . A A . 12 HIS HB2 1 1 16 6165 1 1 12 HIS HB3 H -3.715 -18.048 -19.178 1.00 . A A . 12 HIS HB3 1 1 16 6166 1 1 12 HIS HD1 H -3.948 -17.716 -15.491 1.00 . A A . 12 HIS HD1 1 1 16 6167 1 1 12 HIS HD2 H -2.012 -20.126 -18.267 1.00 . A A . 12 HIS HD2 1 1 16 6168 1 1 12 HIS HE1 H -3.088 -19.687 -14.187 1.00 . A A . 12 HIS HE1 1 1 16 6169 1 1 12 HIS N N -2.319 -15.560 -17.393 1.00 . A A . 12 HIS N 1 1 16 6170 1 1 12 HIS ND1 N -3.446 -18.452 -15.899 1.00 . A A . 12 HIS ND1 1 1 16 6171 1 1 12 HIS NE2 N -2.358 -20.286 -16.107 1.00 . A A . 12 HIS NE2 1 1 16 6172 1 1 12 HIS O O -2.209 -16.152 -20.880 1.00 . A A . 12 HIS O 1 1 16 6173 1 1 13 ASP C C -3.194 -12.488 -20.807 1.00 . A A . 13 ASP C 1 1 16 6174 1 1 13 ASP CA C -3.802 -13.884 -20.899 1.00 . A A . 13 ASP CA 1 1 16 6175 1 1 13 ASP CB C -5.321 -13.783 -21.045 1.00 . A A . 13 ASP CB 1 1 16 6176 1 1 13 ASP CG C -5.784 -14.037 -22.466 1.00 . A A . 13 ASP CG 1 1 16 6177 1 1 13 ASP H H -3.805 -14.412 -18.849 1.00 . A A . 13 ASP H 1 1 16 6178 1 1 13 ASP HA H -3.398 -14.382 -21.767 1.00 . A A . 13 ASP HA 1 1 16 6179 1 1 13 ASP HB2 H -5.788 -14.512 -20.399 1.00 . A A . 13 ASP HB2 1 1 16 6180 1 1 13 ASP HB3 H -5.639 -12.793 -20.753 1.00 . A A . 13 ASP HB3 1 1 16 6181 1 1 13 ASP N N -3.458 -14.679 -19.726 1.00 . A A . 13 ASP N 1 1 16 6182 1 1 13 ASP O O -2.473 -12.053 -21.706 1.00 . A A . 13 ASP O 1 1 16 6183 1 1 13 ASP OD1 O -6.083 -13.055 -23.178 1.00 . A A . 13 ASP OD1 1 1 16 6184 1 1 13 ASP OD2 O -5.847 -15.218 -22.868 1.00 . A A . 13 ASP OD2 1 1 16 6185 1 1 14 CYS C C -3.500 -9.486 -20.573 1.00 . A A . 14 CYS C 1 1 16 6186 1 1 14 CYS CA C -2.973 -10.442 -19.506 1.00 . A A . 14 CYS CA 1 1 16 6187 1 1 14 CYS CB C -1.443 -10.451 -19.525 1.00 . A A . 14 CYS CB 1 1 16 6188 1 1 14 CYS H H -4.069 -12.191 -19.034 1.00 . A A . 14 CYS H 1 1 16 6189 1 1 14 CYS HA H -3.311 -10.104 -18.539 1.00 . A A . 14 CYS HA 1 1 16 6190 1 1 14 CYS HB2 H -1.083 -10.950 -18.637 1.00 . A A . 14 CYS HB2 1 1 16 6191 1 1 14 CYS HB3 H -1.104 -10.990 -20.397 1.00 . A A . 14 CYS HB3 1 1 16 6192 1 1 14 CYS N N -3.489 -11.790 -19.716 1.00 . A A . 14 CYS N 1 1 16 6193 1 1 14 CYS O O -3.625 -9.851 -21.742 1.00 . A A . 14 CYS O 1 1 16 6194 1 1 14 CYS SG S -0.691 -8.792 -19.570 1.00 . A A . 14 CYS SG 1 1 16 6195 1 1 15 HIS C C -3.404 -6.033 -21.116 1.00 . A A . 15 HIS C 1 1 16 6196 1 1 15 HIS CA C -4.322 -7.251 -21.079 1.00 . A A . 15 HIS CA 1 1 16 6197 1 1 15 HIS CB C -5.733 -6.829 -20.671 1.00 . A A . 15 HIS CB 1 1 16 6198 1 1 15 HIS CD2 C -7.501 -8.692 -21.035 1.00 . A A . 15 HIS CD2 1 1 16 6199 1 1 15 HIS CE1 C -8.241 -8.052 -22.997 1.00 . A A . 15 HIS CE1 1 1 16 6200 1 1 15 HIS CG C -6.814 -7.580 -21.386 1.00 . A A . 15 HIS CG 1 1 16 6201 1 1 15 HIS H H -3.688 -8.030 -19.216 1.00 . A A . 15 HIS H 1 1 16 6202 1 1 15 HIS HA H -4.357 -7.688 -22.066 1.00 . A A . 15 HIS HA 1 1 16 6203 1 1 15 HIS HB2 H -5.859 -6.997 -19.611 1.00 . A A . 15 HIS HB2 1 1 16 6204 1 1 15 HIS HB3 H -5.863 -5.778 -20.882 1.00 . A A . 15 HIS HB3 1 1 16 6205 1 1 15 HIS HD1 H -7.001 -6.431 -23.142 1.00 . A A . 15 HIS HD1 1 1 16 6206 1 1 15 HIS HD2 H -7.380 -9.260 -20.123 1.00 . A A . 15 HIS HD2 1 1 16 6207 1 1 15 HIS HE1 H -8.800 -8.007 -23.920 1.00 . A A . 15 HIS HE1 1 1 16 6208 1 1 15 HIS N N -3.808 -8.261 -20.160 1.00 . A A . 15 HIS N 1 1 16 6209 1 1 15 HIS ND1 N -7.300 -7.205 -22.621 1.00 . A A . 15 HIS ND1 1 1 16 6210 1 1 15 HIS NE2 N -8.382 -8.964 -22.053 1.00 . A A . 15 HIS NE2 1 1 16 6211 1 1 15 HIS O O -2.699 -5.804 -22.098 1.00 . A A . 15 HIS O 1 1 16 6212 1 1 16 MET C C -2.786 -3.361 -18.606 1.00 . A A . 16 MET C 1 1 16 6213 1 1 16 MET CA C -2.589 -4.059 -19.948 1.00 . A A . 16 MET CA 1 1 16 6214 1 1 16 MET CB C -2.916 -3.096 -21.091 1.00 . A A . 16 MET CB 1 1 16 6215 1 1 16 MET CE C -5.732 -1.031 -22.886 1.00 . A A . 16 MET CE 1 1 16 6216 1 1 16 MET CG C -4.405 -2.851 -21.271 1.00 . A A . 16 MET CG 1 1 16 6217 1 1 16 MET H H -4.003 -5.488 -19.287 1.00 . A A . 16 MET H 1 1 16 6218 1 1 16 MET HA H -1.557 -4.367 -20.032 1.00 . A A . 16 MET HA 1 1 16 6219 1 1 16 MET HB2 H -2.438 -2.148 -20.894 1.00 . A A . 16 MET HB2 1 1 16 6220 1 1 16 MET HB3 H -2.526 -3.503 -22.012 1.00 . A A . 16 MET HB3 1 1 16 6221 1 1 16 MET HE1 H -6.036 -0.014 -23.081 1.00 . A A . 16 MET HE1 1 1 16 6222 1 1 16 MET HE2 H -5.105 -1.381 -23.693 1.00 . A A . 16 MET HE2 1 1 16 6223 1 1 16 MET HE3 H -6.607 -1.661 -22.811 1.00 . A A . 16 MET HE3 1 1 16 6224 1 1 16 MET HG2 H -4.726 -3.322 -22.189 1.00 . A A . 16 MET HG2 1 1 16 6225 1 1 16 MET HG3 H -4.932 -3.295 -20.439 1.00 . A A . 16 MET HG3 1 1 16 6226 1 1 16 MET N N -3.420 -5.254 -20.039 1.00 . A A . 16 MET N 1 1 16 6227 1 1 16 MET O O -3.294 -2.242 -18.547 1.00 . A A . 16 MET O 1 1 16 6228 1 1 16 MET SD S -4.817 -1.098 -21.348 1.00 . A A . 16 MET SD 1 1 16 6229 1 1 17 ASN C C -1.466 -4.061 -15.249 1.00 . A A . 17 ASN C 1 1 16 6230 1 1 17 ASN CA C -2.512 -3.471 -16.190 1.00 . A A . 17 ASN CA 1 1 16 6231 1 1 17 ASN CB C -3.916 -3.738 -15.641 1.00 . A A . 17 ASN CB 1 1 16 6232 1 1 17 ASN CG C -5.005 -3.308 -16.605 1.00 . A A . 17 ASN CG 1 1 16 6233 1 1 17 ASN H H -1.981 -4.917 -17.642 1.00 . A A . 17 ASN H 1 1 16 6234 1 1 17 ASN HA H -2.359 -2.405 -16.257 1.00 . A A . 17 ASN HA 1 1 16 6235 1 1 17 ASN HB2 H -4.026 -4.796 -15.452 1.00 . A A . 17 ASN HB2 1 1 16 6236 1 1 17 ASN HB3 H -4.044 -3.195 -14.717 1.00 . A A . 17 ASN HB3 1 1 16 6237 1 1 17 ASN HD21 H -5.266 -5.192 -17.187 1.00 . A A . 17 ASN HD21 1 1 16 6238 1 1 17 ASN HD22 H -6.282 -4.021 -17.952 1.00 . A A . 17 ASN HD22 1 1 16 6239 1 1 17 ASN N N -2.379 -4.028 -17.531 1.00 . A A . 17 ASN N 1 1 16 6240 1 1 17 ASN ND2 N -5.575 -4.271 -17.320 1.00 . A A . 17 ASN ND2 1 1 16 6241 1 1 17 ASN O O -0.522 -4.717 -15.688 1.00 . A A . 17 ASN O 1 1 16 6242 1 1 17 ASN OD1 O -5.329 -2.125 -16.706 1.00 . A A . 17 ASN OD1 1 1 16 6243 1 1 18 DAL C C -0.700 -3.413 -11.751 1.00 . A A . 18 DAL C 1 1 16 6244 1 1 18 DAL CA C -0.705 -4.335 -12.943 1.00 . A A . 18 DAL CA 1 1 16 6245 1 1 18 DAL CB C -1.145 -5.734 -12.505 1.00 . A A . 18 DAL CB 1 1 16 6246 1 1 18 DAL H H -2.414 -3.293 -13.665 1.00 . A A . 18 DAL H 1 1 16 6247 1 1 18 DAL HA H 0.297 -4.385 -13.369 1.00 . A A . 18 DAL HA 1 1 16 6248 1 1 18 DAL HB1 H -0.659 -6.481 -13.131 1.00 . A A . 18 DAL HB1 1 1 16 6249 1 1 18 DAL HB2 H -0.863 -5.893 -11.464 1.00 . A A . 18 DAL HB2 1 1 16 6250 1 1 18 DAL N N -1.641 -3.823 -13.954 1.00 . A A . 18 DAL N 1 1 16 6251 1 1 18 DAL O O 0.263 -2.680 -11.524 1.00 . A A . 18 DAL O 1 1 16 6252 1 1 19 PHE C C -1.853 -3.441 -8.522 1.00 . A A . 19 PHE C 1 1 16 6253 1 1 19 PHE CA C -1.901 -2.601 -9.796 1.00 . A A . 19 PHE CA 1 1 16 6254 1 1 19 PHE CB C -3.205 -1.802 -9.843 1.00 . A A . 19 PHE CB 1 1 16 6255 1 1 19 PHE CD1 C -4.905 -3.529 -10.493 1.00 . A A . 19 PHE CD1 1 1 16 6256 1 1 19 PHE CD2 C -5.094 -2.503 -8.349 1.00 . A A . 19 PHE CD2 1 1 16 6257 1 1 19 PHE CE1 C -6.028 -4.292 -10.231 1.00 . A A . 19 PHE CE1 1 1 16 6258 1 1 19 PHE CE2 C -6.217 -3.263 -8.081 1.00 . A A . 19 PHE CE2 1 1 16 6259 1 1 19 PHE CG C -4.426 -2.628 -9.556 1.00 . A A . 19 PHE CG 1 1 16 6260 1 1 19 PHE CZ C -6.686 -4.157 -9.024 1.00 . A A . 19 PHE CZ 1 1 16 6261 1 1 19 PHE H H -2.516 -4.051 -11.211 1.00 . A A . 19 PHE H 1 1 16 6262 1 1 19 PHE HA H -1.068 -1.916 -9.793 1.00 . A A . 19 PHE HA 1 1 16 6263 1 1 19 PHE HB2 H -3.160 -1.010 -9.111 1.00 . A A . 19 PHE HB2 1 1 16 6264 1 1 19 PHE HB3 H -3.318 -1.371 -10.827 1.00 . A A . 19 PHE HB3 1 1 16 6265 1 1 19 PHE HD1 H -4.391 -3.635 -11.438 1.00 . A A . 19 PHE HD1 1 1 16 6266 1 1 19 PHE HD2 H -4.730 -1.803 -7.611 1.00 . A A . 19 PHE HD2 1 1 16 6267 1 1 19 PHE HE1 H -6.391 -4.990 -10.970 1.00 . A A . 19 PHE HE1 1 1 16 6268 1 1 19 PHE HE2 H -6.730 -3.156 -7.137 1.00 . A A . 19 PHE HE2 1 1 16 6269 1 1 19 PHE HZ H -7.563 -4.752 -8.817 1.00 . A A . 19 PHE HZ 1 1 16 6270 1 1 19 PHE N N -1.781 -3.445 -10.979 1.00 . A A . 19 PHE N 1 1 16 6271 1 1 19 PHE O O -1.473 -2.951 -7.459 1.00 . A A . 19 PHE O 1 1 16 6272 1 1 20 GLN C C -2.406 -7.060 -7.952 1.00 . A A . 20 GLN C 1 1 16 6273 1 1 20 GLN CA C -2.242 -5.614 -7.498 1.00 . A A . 20 GLN CA 1 1 16 6274 1 1 20 GLN CB C -3.363 -5.241 -6.526 1.00 . A A . 20 GLN CB 1 1 16 6275 1 1 20 GLN CD C -3.460 -5.032 -4.010 1.00 . A A . 20 GLN CD 1 1 16 6276 1 1 20 GLN CG C -2.878 -4.486 -5.299 1.00 . A A . 20 GLN CG 1 1 16 6277 1 1 20 GLN H H -2.532 -5.038 -9.514 1.00 . A A . 20 GLN H 1 1 16 6278 1 1 20 GLN HA H -1.293 -5.513 -6.994 1.00 . A A . 20 GLN HA 1 1 16 6279 1 1 20 GLN HB2 H -4.081 -4.623 -7.043 1.00 . A A . 20 GLN HB2 1 1 16 6280 1 1 20 GLN HB3 H -3.851 -6.146 -6.195 1.00 . A A . 20 GLN HB3 1 1 16 6281 1 1 20 GLN HE21 H -4.597 -3.414 -3.809 1.00 . A A . 20 GLN HE21 1 1 16 6282 1 1 20 GLN HE22 H -4.754 -4.601 -2.564 1.00 . A A . 20 GLN HE22 1 1 16 6283 1 1 20 GLN HG2 H -1.802 -4.559 -5.249 1.00 . A A . 20 GLN HG2 1 1 16 6284 1 1 20 GLN HG3 H -3.163 -3.449 -5.395 1.00 . A A . 20 GLN HG3 1 1 16 6285 1 1 20 GLN N N -2.240 -4.707 -8.640 1.00 . A A . 20 GLN N 1 1 16 6286 1 1 20 GLN NE2 N -4.361 -4.272 -3.398 1.00 . A A . 20 GLN NE2 1 1 16 6287 1 1 20 GLN O O -3.056 -7.335 -8.961 1.00 . A A . 20 GLN O 1 1 16 6288 1 1 20 GLN OE1 O -3.104 -6.125 -3.569 1.00 . A A . 20 GLN OE1 1 1 16 6289 1 1 21 PHE C C -2.766 -10.143 -6.520 1.00 . A A . 21 PHE C 1 1 16 6290 1 1 21 PHE CA C -1.892 -9.401 -7.527 1.00 . A A . 21 PHE CA 1 1 16 6291 1 1 21 PHE CB C -0.492 -10.018 -7.557 1.00 . A A . 21 PHE CB 1 1 16 6292 1 1 21 PHE CD1 C 0.419 -10.341 -9.872 1.00 . A A . 21 PHE CD1 1 1 16 6293 1 1 21 PHE CD2 C 1.035 -8.372 -8.676 1.00 . A A . 21 PHE CD2 1 1 16 6294 1 1 21 PHE CE1 C 1.181 -9.929 -10.950 1.00 . A A . 21 PHE CE1 1 1 16 6295 1 1 21 PHE CE2 C 1.798 -7.955 -9.750 1.00 . A A . 21 PHE CE2 1 1 16 6296 1 1 21 PHE CG C 0.337 -9.568 -8.725 1.00 . A A . 21 PHE CG 1 1 16 6297 1 1 21 PHE CZ C 1.872 -8.735 -10.888 1.00 . A A . 21 PHE CZ 1 1 16 6298 1 1 21 PHE H H -1.309 -7.701 -6.408 1.00 . A A . 21 PHE H 1 1 16 6299 1 1 21 PHE HA H -2.337 -9.491 -8.506 1.00 . A A . 21 PHE HA 1 1 16 6300 1 1 21 PHE HB2 H 0.032 -9.746 -6.653 1.00 . A A . 21 PHE HB2 1 1 16 6301 1 1 21 PHE HB3 H -0.582 -11.093 -7.606 1.00 . A A . 21 PHE HB3 1 1 16 6302 1 1 21 PHE HD1 H -0.122 -11.276 -9.921 1.00 . A A . 21 PHE HD1 1 1 16 6303 1 1 21 PHE HD2 H 0.979 -7.762 -7.787 1.00 . A A . 21 PHE HD2 1 1 16 6304 1 1 21 PHE HE1 H 1.236 -10.541 -11.837 1.00 . A A . 21 PHE HE1 1 1 16 6305 1 1 21 PHE HE2 H 2.338 -7.021 -9.699 1.00 . A A . 21 PHE HE2 1 1 16 6306 1 1 21 PHE HZ H 2.467 -8.411 -11.729 1.00 . A A . 21 PHE HZ 1 1 16 6307 1 1 21 PHE N N -1.813 -7.982 -7.201 1.00 . A A . 21 PHE N 1 1 16 6308 1 1 21 PHE O O -2.682 -9.906 -5.315 1.00 . A A . 21 PHE O 1 1 16 6309 1 1 22 VAL C C -4.035 -13.268 -6.069 1.00 . A A . 22 VAL C 1 1 16 6310 1 1 22 VAL CA C -4.497 -11.818 -6.169 1.00 . A A . 22 VAL CA 1 1 16 6311 1 1 22 VAL CB C -5.945 -11.787 -6.691 1.00 . A A . 22 VAL CB 1 1 16 6312 1 1 22 VAL CG1 C -6.885 -12.456 -5.700 1.00 . A A . 22 VAL CG1 1 1 16 6313 1 1 22 VAL CG2 C -6.380 -10.356 -6.969 1.00 . A A . 22 VAL CG2 1 1 16 6314 1 1 22 VAL H H -3.628 -11.185 -7.992 1.00 . A A . 22 VAL H 1 1 16 6315 1 1 22 VAL HA H -4.482 -11.377 -5.183 1.00 . A A . 22 VAL HA 1 1 16 6316 1 1 22 VAL HB H -5.984 -12.339 -7.619 1.00 . A A . 22 VAL HB 1 1 16 6317 1 1 22 VAL HG11 H -7.673 -11.768 -5.432 1.00 . A A . 22 VAL HG11 1 1 16 6318 1 1 22 VAL HG12 H -7.314 -13.339 -6.150 1.00 . A A . 22 VAL HG12 1 1 16 6319 1 1 22 VAL HG13 H -6.334 -12.734 -4.814 1.00 . A A . 22 VAL HG13 1 1 16 6320 1 1 22 VAL HG21 H -7.428 -10.247 -6.733 1.00 . A A . 22 VAL HG21 1 1 16 6321 1 1 22 VAL HG22 H -5.801 -9.678 -6.358 1.00 . A A . 22 VAL HG22 1 1 16 6322 1 1 22 VAL HG23 H -6.219 -10.126 -8.012 1.00 . A A . 22 VAL HG23 1 1 16 6323 1 1 22 VAL N N -3.607 -11.041 -7.023 1.00 . A A . 22 VAL N 1 1 16 6324 1 1 22 VAL O O -4.350 -13.966 -5.106 1.00 . A A . 22 VAL O 1 1 16 6325 1 1 23 PHE C C -1.692 -15.240 -8.155 1.00 . A A . 23 PHE C 1 1 16 6326 1 1 23 PHE CA C -2.780 -15.082 -7.098 1.00 . A A . 23 PHE CA 1 1 16 6327 1 1 23 PHE CB C -3.921 -16.065 -7.374 1.00 . A A . 23 PHE CB 1 1 16 6328 1 1 23 PHE CD1 C -4.594 -14.955 -9.521 1.00 . A A . 23 PHE CD1 1 1 16 6329 1 1 23 PHE CD2 C -6.307 -15.592 -7.989 1.00 . A A . 23 PHE CD2 1 1 16 6330 1 1 23 PHE CE1 C -5.549 -14.459 -10.388 1.00 . A A . 23 PHE CE1 1 1 16 6331 1 1 23 PHE CE2 C -7.266 -15.098 -8.853 1.00 . A A . 23 PHE CE2 1 1 16 6332 1 1 23 PHE CG C -4.961 -15.527 -8.313 1.00 . A A . 23 PHE CG 1 1 16 6333 1 1 23 PHE CZ C -6.887 -14.530 -10.053 1.00 . A A . 23 PHE CZ 1 1 16 6334 1 1 23 PHE H H -3.068 -13.110 -7.812 1.00 . A A . 23 PHE H 1 1 16 6335 1 1 23 PHE HA H -2.358 -15.297 -6.128 1.00 . A A . 23 PHE HA 1 1 16 6336 1 1 23 PHE HB2 H -3.514 -16.964 -7.810 1.00 . A A . 23 PHE HB2 1 1 16 6337 1 1 23 PHE HB3 H -4.408 -16.310 -6.442 1.00 . A A . 23 PHE HB3 1 1 16 6338 1 1 23 PHE HD1 H -3.547 -14.899 -9.784 1.00 . A A . 23 PHE HD1 1 1 16 6339 1 1 23 PHE HD2 H -6.605 -16.035 -7.050 1.00 . A A . 23 PHE HD2 1 1 16 6340 1 1 23 PHE HE1 H -5.249 -14.015 -11.326 1.00 . A A . 23 PHE HE1 1 1 16 6341 1 1 23 PHE HE2 H -8.312 -15.155 -8.588 1.00 . A A . 23 PHE HE2 1 1 16 6342 1 1 23 PHE HZ H -7.635 -14.144 -10.729 1.00 . A A . 23 PHE HZ 1 1 16 6343 1 1 23 PHE N N -3.286 -13.715 -7.072 1.00 . A A . 23 PHE N 1 1 16 6344 1 1 23 PHE O O -1.495 -16.324 -8.701 1.00 . A A . 23 PHE O 1 1 16 6345 1 1 24 DBU C C -0.292 -13.599 -10.715 1.00 . A A . 24 DBU C 1 1 16 6346 1 1 24 DBU CA C 0.012 -14.164 -9.367 1.00 . A A . 24 DBU CA 1 1 16 6347 1 1 24 DBU CB C 1.261 -14.636 -9.200 1.00 . A A . 24 DBU CB 1 1 16 6348 1 1 24 DBU CG C 1.815 -15.249 -7.952 1.00 . A A . 24 DBU CG 1 1 16 6349 1 1 24 DBU HG1 H 1.299 -16.165 -7.651 1.00 . A A . 24 DBU HG1 1 1 16 6350 1 1 24 DBU HG2 H 1.739 -14.534 -7.126 1.00 . A A . 24 DBU HG2 1 1 16 6351 1 1 24 DBU HG3 H 2.872 -15.491 -8.098 1.00 . A A . 24 DBU HG3 1 1 16 6352 1 1 24 DBU N N -0.988 -14.149 -8.438 1.00 . A A . 24 DBU N 1 1 16 6353 1 1 24 DBU O O 0.527 -13.675 -11.632 1.00 . A A . 24 DBU O 1 1 16 6354 1 1 25 CYS C C -2.454 -11.025 -11.907 1.00 . A A . 25 CYS C 1 1 16 6355 1 1 25 CYS CA C -1.902 -12.432 -12.120 1.00 . A A . 25 CYS CA 1 1 16 6356 1 1 25 CYS CB C -2.960 -13.311 -12.789 1.00 . A A . 25 CYS CB 1 1 16 6357 1 1 25 CYS H H -2.091 -12.991 -10.087 1.00 . A A . 25 CYS H 1 1 16 6358 1 1 25 CYS HA H -1.037 -12.372 -12.762 1.00 . A A . 25 CYS HA 1 1 16 6359 1 1 25 CYS HB2 H -3.938 -13.013 -12.441 1.00 . A A . 25 CYS HB2 1 1 16 6360 1 1 25 CYS HB3 H -2.907 -13.172 -13.859 1.00 . A A . 25 CYS HB3 1 1 16 6361 1 1 25 CYS N N -1.481 -13.021 -10.854 1.00 . A A . 25 CYS N 1 1 16 6362 1 1 25 CYS O O -2.317 -10.449 -10.827 1.00 . A A . 25 CYS O 1 1 16 6363 1 1 25 CYS SG S -2.771 -15.091 -12.450 1.00 . A A . 25 CYS SG 1 1 16 6364 1 1 26 CYS C C -4.908 -9.039 -13.734 1.00 . A A . 26 CYS C 1 1 16 6365 1 1 26 CYS CA C -3.653 -9.139 -12.873 1.00 . A A . 26 CYS CA 1 1 16 6366 1 1 26 CYS CB C -2.627 -8.098 -13.323 1.00 . A A . 26 CYS CB 1 1 16 6367 1 1 26 CYS H H -3.157 -10.987 -13.779 1.00 . A A . 26 CYS H 1 1 16 6368 1 1 26 CYS HA H -3.920 -8.947 -11.845 1.00 . A A . 26 CYS HA 1 1 16 6369 1 1 26 CYS HB2 H -1.639 -8.432 -13.041 1.00 . A A . 26 CYS HB2 1 1 16 6370 1 1 26 CYS HB3 H -2.674 -7.998 -14.397 1.00 . A A . 26 CYS HB3 1 1 16 6371 1 1 26 CYS N N -3.079 -10.478 -12.944 1.00 . A A . 26 CYS N 1 1 16 6372 1 1 26 CYS O O -5.031 -9.721 -14.752 1.00 . A A . 26 CYS O 1 1 16 6373 1 1 26 CYS SG S -2.879 -6.445 -12.600 1.00 . A A . 26 CYS SG 1 1 16 6374 1 1 27 SER C C -7.878 -9.297 -14.114 1.00 . A A . 27 SER C 1 1 16 6375 1 1 27 SER CA C -7.084 -7.995 -14.051 1.00 . A A . 27 SER CA 1 1 16 6376 1 1 27 SER CB C -6.799 -7.489 -15.466 1.00 . A A . 27 SER CB 1 1 16 6377 1 1 27 SER H H -5.680 -7.668 -12.500 1.00 . A A . 27 SER H 1 1 16 6378 1 1 27 SER HA H -7.669 -7.256 -13.525 1.00 . A A . 27 SER HA 1 1 16 6379 1 1 27 SER HB2 H -5.733 -7.396 -15.604 1.00 . A A . 27 SER HB2 1 1 16 6380 1 1 27 SER HB3 H -7.194 -8.194 -16.184 1.00 . A A . 27 SER HB3 1 1 16 6381 1 1 27 SER HG H -7.847 -6.228 -16.538 1.00 . A A . 27 SER HG 1 1 16 6382 1 1 27 SER N N -5.837 -8.183 -13.320 1.00 . A A . 27 SER N 1 1 16 6383 1 1 27 SER O O -8.832 -9.416 -14.881 1.00 . A A . 27 SER O 1 1 16 6384 1 1 27 SER OG O -7.401 -6.226 -15.688 1.00 . A A . 27 SER OG 1 1 17 6385 1 1 1 LYS C C 1.780 1.380 -1.587 1.00 . A A . 1 LYS C 1 1 17 6386 1 1 1 LYS CA C 0.592 0.706 -0.907 1.00 . A A . 1 LYS CA 1 1 17 6387 1 1 1 LYS CB C -0.279 1.759 -0.218 1.00 . A A . 1 LYS CB 1 1 17 6388 1 1 1 LYS CD C -2.270 1.978 1.297 1.00 . A A . 1 LYS CD 1 1 17 6389 1 1 1 LYS CE C -3.004 0.999 2.202 1.00 . A A . 1 LYS CE 1 1 17 6390 1 1 1 LYS CG C -1.690 1.282 0.078 1.00 . A A . 1 LYS CG 1 1 17 6391 1 1 1 LYS H1 H 0.589 -1.157 0.098 1.00 . A A . 1 LYS H1 1 1 17 6392 1 1 1 LYS HA H 0.004 0.198 -1.656 1.00 . A A . 1 LYS HA 1 1 17 6393 1 1 1 LYS HB2 H 0.187 2.041 0.714 1.00 . A A . 1 LYS HB2 1 1 17 6394 1 1 1 LYS HB3 H -0.343 2.629 -0.856 1.00 . A A . 1 LYS HB3 1 1 17 6395 1 1 1 LYS HD2 H -1.467 2.434 1.857 1.00 . A A . 1 LYS HD2 1 1 17 6396 1 1 1 LYS HD3 H -2.963 2.741 0.970 1.00 . A A . 1 LYS HD3 1 1 17 6397 1 1 1 LYS HE2 H -3.799 1.524 2.708 1.00 . A A . 1 LYS HE2 1 1 17 6398 1 1 1 LYS HE3 H -3.423 0.212 1.593 1.00 . A A . 1 LYS HE3 1 1 17 6399 1 1 1 LYS HG2 H -2.318 1.491 -0.776 1.00 . A A . 1 LYS HG2 1 1 17 6400 1 1 1 LYS HG3 H -1.669 0.216 0.258 1.00 . A A . 1 LYS HG3 1 1 17 6401 1 1 1 LYS HZ1 H -1.213 0.941 3.275 1.00 . A A . 1 LYS HZ1 1 1 17 6402 1 1 1 LYS HZ2 H -1.870 -0.584 2.956 1.00 . A A . 1 LYS HZ2 1 1 17 6403 1 1 1 LYS HZ3 H -2.555 0.398 4.151 1.00 . A A . 1 LYS HZ3 1 1 17 6404 1 1 1 LYS N N 1.042 -0.288 0.060 1.00 . A A . 1 LYS N 1 1 17 6405 1 1 1 LYS NZ N -2.097 0.396 3.217 1.00 . A A . 1 LYS NZ 1 1 17 6406 1 1 1 LYS O O 2.023 2.572 -1.399 1.00 . A A . 1 LYS O 1 1 17 6407 1 1 2 LYS C C 3.509 0.972 -4.599 1.00 . A A . 2 LYS C 1 1 17 6408 1 1 2 LYS CA C 3.678 1.131 -3.091 1.00 . A A . 2 LYS CA 1 1 17 6409 1 1 2 LYS CB C 4.949 0.414 -2.631 1.00 . A A . 2 LYS CB 1 1 17 6410 1 1 2 LYS CD C 5.772 -1.902 -2.110 1.00 . A A . 2 LYS CD 1 1 17 6411 1 1 2 LYS CE C 4.848 -2.346 -0.987 1.00 . A A . 2 LYS CE 1 1 17 6412 1 1 2 LYS CG C 5.045 -1.023 -3.115 1.00 . A A . 2 LYS CG 1 1 17 6413 1 1 2 LYS H H 2.273 -0.334 -2.490 1.00 . A A . 2 LYS H 1 1 17 6414 1 1 2 LYS HA H 3.764 2.182 -2.859 1.00 . A A . 2 LYS HA 1 1 17 6415 1 1 2 LYS HB2 H 5.807 0.955 -3.001 1.00 . A A . 2 LYS HB2 1 1 17 6416 1 1 2 LYS HB3 H 4.975 0.410 -1.551 1.00 . A A . 2 LYS HB3 1 1 17 6417 1 1 2 LYS HD2 H 6.149 -2.777 -2.618 1.00 . A A . 2 LYS HD2 1 1 17 6418 1 1 2 LYS HD3 H 6.596 -1.345 -1.688 1.00 . A A . 2 LYS HD3 1 1 17 6419 1 1 2 LYS HE2 H 4.013 -1.664 -0.934 1.00 . A A . 2 LYS HE2 1 1 17 6420 1 1 2 LYS HE3 H 4.487 -3.340 -1.207 1.00 . A A . 2 LYS HE3 1 1 17 6421 1 1 2 LYS HG2 H 4.049 -1.411 -3.262 1.00 . A A . 2 LYS HG2 1 1 17 6422 1 1 2 LYS HG3 H 5.583 -1.042 -4.052 1.00 . A A . 2 LYS HG3 1 1 17 6423 1 1 2 LYS HZ1 H 4.934 -1.946 1.061 1.00 . A A . 2 LYS HZ1 1 1 17 6424 1 1 2 LYS HZ2 H 6.425 -1.814 0.275 1.00 . A A . 2 LYS HZ2 1 1 17 6425 1 1 2 LYS HZ3 H 5.773 -3.341 0.600 1.00 . A A . 2 LYS HZ3 1 1 17 6426 1 1 2 LYS N N 2.517 0.609 -2.380 1.00 . A A . 2 LYS N 1 1 17 6427 1 1 2 LYS NZ N 5.544 -2.363 0.329 1.00 . A A . 2 LYS NZ 1 1 17 6428 1 1 2 LYS O O 2.550 0.357 -5.065 1.00 . A A . 2 LYS O 1 1 17 6429 1 1 3 LYS C C 4.244 0.002 -7.271 1.00 . A A . 3 LYS C 1 1 17 6430 1 1 3 LYS CA C 4.405 1.447 -6.812 1.00 . A A . 3 LYS CA 1 1 17 6431 1 1 3 LYS CB C 5.679 2.046 -7.414 1.00 . A A . 3 LYS CB 1 1 17 6432 1 1 3 LYS CD C 7.042 1.533 -9.460 1.00 . A A . 3 LYS CD 1 1 17 6433 1 1 3 LYS CE C 8.024 2.681 -9.633 1.00 . A A . 3 LYS CE 1 1 17 6434 1 1 3 LYS CG C 5.703 2.020 -8.932 1.00 . A A . 3 LYS CG 1 1 17 6435 1 1 3 LYS H H 5.188 2.007 -4.926 1.00 . A A . 3 LYS H 1 1 17 6436 1 1 3 LYS HA H 3.554 2.018 -7.151 1.00 . A A . 3 LYS HA 1 1 17 6437 1 1 3 LYS HB2 H 5.768 3.072 -7.090 1.00 . A A . 3 LYS HB2 1 1 17 6438 1 1 3 LYS HB3 H 6.530 1.488 -7.052 1.00 . A A . 3 LYS HB3 1 1 17 6439 1 1 3 LYS HD2 H 7.457 0.821 -8.763 1.00 . A A . 3 LYS HD2 1 1 17 6440 1 1 3 LYS HD3 H 6.889 1.054 -10.418 1.00 . A A . 3 LYS HD3 1 1 17 6441 1 1 3 LYS HE2 H 7.691 3.516 -9.035 1.00 . A A . 3 LYS HE2 1 1 17 6442 1 1 3 LYS HE3 H 8.997 2.360 -9.291 1.00 . A A . 3 LYS HE3 1 1 17 6443 1 1 3 LYS HG2 H 4.927 1.358 -9.285 1.00 . A A . 3 LYS HG2 1 1 17 6444 1 1 3 LYS HG3 H 5.522 3.019 -9.303 1.00 . A A . 3 LYS HG3 1 1 17 6445 1 1 3 LYS HZ1 H 7.331 2.732 -11.602 1.00 . A A . 3 LYS HZ1 1 1 17 6446 1 1 3 LYS HZ2 H 9.017 2.768 -11.469 1.00 . A A . 3 LYS HZ2 1 1 17 6447 1 1 3 LYS HZ3 H 8.111 4.152 -11.114 1.00 . A A . 3 LYS HZ3 1 1 17 6448 1 1 3 LYS N N 4.448 1.529 -5.356 1.00 . A A . 3 LYS N 1 1 17 6449 1 1 3 LYS NZ N 8.128 3.114 -11.054 1.00 . A A . 3 LYS NZ 1 1 17 6450 1 1 3 LYS O O 5.164 -0.806 -7.145 1.00 . A A . 3 LYS O 1 1 17 6451 1 1 4 SER C C 3.361 -1.881 -9.678 1.00 . A A . 4 SER C 1 1 17 6452 1 1 4 SER CA C 2.786 -1.666 -8.280 1.00 . A A . 4 SER CA 1 1 17 6453 1 1 4 SER CB C 1.278 -1.920 -8.292 1.00 . A A . 4 SER CB 1 1 17 6454 1 1 4 SER H H 2.375 0.371 -7.878 1.00 . A A . 4 SER H 1 1 17 6455 1 1 4 SER HA H 3.255 -2.362 -7.601 1.00 . A A . 4 SER HA 1 1 17 6456 1 1 4 SER HB2 H 1.091 -2.953 -8.544 1.00 . A A . 4 SER HB2 1 1 17 6457 1 1 4 SER HB3 H 0.873 -1.709 -7.313 1.00 . A A . 4 SER HB3 1 1 17 6458 1 1 4 SER HG H 0.619 -0.188 -8.926 1.00 . A A . 4 SER HG 1 1 17 6459 1 1 4 SER N N 3.069 -0.317 -7.805 1.00 . A A . 4 SER N 1 1 17 6460 1 1 4 SER O O 4.083 -1.034 -10.201 1.00 . A A . 4 SER O 1 1 17 6461 1 1 4 SER OG O 0.629 -1.094 -9.243 1.00 . A A . 4 SER OG 1 1 17 6462 1 1 5 GLY C C 4.596 -4.401 -11.596 1.00 . A A . 5 GLY C 1 1 17 6463 1 1 5 GLY CA C 3.525 -3.329 -11.607 1.00 . A A . 5 GLY CA 1 1 17 6464 1 1 5 GLY H H 2.454 -3.661 -9.810 1.00 . A A . 5 GLY H 1 1 17 6465 1 1 5 GLY HA2 H 2.698 -3.667 -12.215 1.00 . A A . 5 GLY HA2 1 1 17 6466 1 1 5 GLY HA3 H 3.935 -2.430 -12.043 1.00 . A A . 5 GLY HA3 1 1 17 6467 1 1 5 GLY N N 3.033 -3.022 -10.276 1.00 . A A . 5 GLY N 1 1 17 6468 1 1 5 GLY O O 5.626 -4.266 -12.258 1.00 . A A . 5 GLY O 1 1 17 6469 1 1 6 VAL C C 5.749 -7.035 -12.130 1.00 . A A . 6 VAL C 1 1 17 6470 1 1 6 VAL CA C 5.309 -6.568 -10.747 1.00 . A A . 6 VAL CA 1 1 17 6471 1 1 6 VAL CB C 4.714 -7.763 -9.979 1.00 . A A . 6 VAL CB 1 1 17 6472 1 1 6 VAL CG1 C 5.668 -8.947 -10.010 1.00 . A A . 6 VAL CG1 1 1 17 6473 1 1 6 VAL CG2 C 4.390 -7.366 -8.546 1.00 . A A . 6 VAL CG2 1 1 17 6474 1 1 6 VAL H H 3.518 -5.519 -10.337 1.00 . A A . 6 VAL H 1 1 17 6475 1 1 6 VAL HA H 6.175 -6.214 -10.205 1.00 . A A . 6 VAL HA 1 1 17 6476 1 1 6 VAL HB H 3.795 -8.056 -10.466 1.00 . A A . 6 VAL HB 1 1 17 6477 1 1 6 VAL HG11 H 6.624 -8.629 -10.400 1.00 . A A . 6 VAL HG11 1 1 17 6478 1 1 6 VAL HG12 H 5.795 -9.333 -9.010 1.00 . A A . 6 VAL HG12 1 1 17 6479 1 1 6 VAL HG13 H 5.261 -9.720 -10.646 1.00 . A A . 6 VAL HG13 1 1 17 6480 1 1 6 VAL HG21 H 3.790 -6.468 -8.549 1.00 . A A . 6 VAL HG21 1 1 17 6481 1 1 6 VAL HG22 H 3.841 -8.164 -8.067 1.00 . A A . 6 VAL HG22 1 1 17 6482 1 1 6 VAL HG23 H 5.307 -7.186 -8.006 1.00 . A A . 6 VAL HG23 1 1 17 6483 1 1 6 VAL N N 4.356 -5.469 -10.842 1.00 . A A . 6 VAL N 1 1 17 6484 1 1 6 VAL O O 6.832 -6.684 -12.600 1.00 . A A . 6 VAL O 1 1 17 6485 1 1 7 ILE C C 3.945 -8.409 -14.968 1.00 . A A . 7 ILE C 1 1 17 6486 1 1 7 ILE CA C 5.202 -8.342 -14.108 1.00 . A A . 7 ILE CA 1 1 17 6487 1 1 7 ILE CB C 5.839 -9.743 -14.040 1.00 . A A . 7 ILE CB 1 1 17 6488 1 1 7 ILE CD1 C 8.225 -8.869 -13.890 1.00 . A A . 7 ILE CD1 1 1 17 6489 1 1 7 ILE CG1 C 7.140 -9.697 -13.236 1.00 . A A . 7 ILE CG1 1 1 17 6490 1 1 7 ILE CG2 C 6.093 -10.278 -15.441 1.00 . A A . 7 ILE CG2 1 1 17 6491 1 1 7 ILE H H 4.055 -8.073 -12.350 1.00 . A A . 7 ILE H 1 1 17 6492 1 1 7 ILE HA H 5.909 -7.670 -14.573 1.00 . A A . 7 ILE HA 1 1 17 6493 1 1 7 ILE HB H 5.144 -10.406 -13.548 1.00 . A A . 7 ILE HB 1 1 17 6494 1 1 7 ILE HD11 H 8.596 -8.140 -13.185 1.00 . A A . 7 ILE HD11 1 1 17 6495 1 1 7 ILE HD12 H 9.033 -9.514 -14.201 1.00 . A A . 7 ILE HD12 1 1 17 6496 1 1 7 ILE HD13 H 7.818 -8.360 -14.752 1.00 . A A . 7 ILE HD13 1 1 17 6497 1 1 7 ILE HG12 H 6.942 -9.274 -12.264 1.00 . A A . 7 ILE HG12 1 1 17 6498 1 1 7 ILE HG13 H 7.516 -10.703 -13.117 1.00 . A A . 7 ILE HG13 1 1 17 6499 1 1 7 ILE HG21 H 6.650 -9.548 -16.009 1.00 . A A . 7 ILE HG21 1 1 17 6500 1 1 7 ILE HG22 H 6.662 -11.194 -15.378 1.00 . A A . 7 ILE HG22 1 1 17 6501 1 1 7 ILE HG23 H 5.150 -10.471 -15.930 1.00 . A A . 7 ILE HG23 1 1 17 6502 1 1 7 ILE N N 4.902 -7.828 -12.777 1.00 . A A . 7 ILE N 1 1 17 6503 1 1 7 ILE O O 3.055 -9.231 -14.749 1.00 . A A . 7 ILE O 1 1 17 6504 1 1 8 PRO C C 2.663 -8.672 -17.818 1.00 . A A . 8 PRO C 1 1 17 6505 1 1 8 PRO CA C 2.726 -7.464 -16.890 1.00 . A A . 8 PRO CA 1 1 17 6506 1 1 8 PRO CB C 2.983 -6.186 -17.693 1.00 . A A . 8 PRO CB 1 1 17 6507 1 1 8 PRO CD C 4.893 -6.516 -16.294 1.00 . A A . 8 PRO CD 1 1 17 6508 1 1 8 PRO CG C 4.459 -5.992 -17.635 1.00 . A A . 8 PRO CG 1 1 17 6509 1 1 8 PRO HA H 1.793 -7.373 -16.354 1.00 . A A . 8 PRO HA 1 1 17 6510 1 1 8 PRO HB2 H 2.641 -6.322 -18.709 1.00 . A A . 8 PRO HB2 1 1 17 6511 1 1 8 PRO HB3 H 2.458 -5.359 -17.238 1.00 . A A . 8 PRO HB3 1 1 17 6512 1 1 8 PRO HD2 H 5.871 -6.968 -16.364 1.00 . A A . 8 PRO HD2 1 1 17 6513 1 1 8 PRO HD3 H 4.894 -5.722 -15.561 1.00 . A A . 8 PRO HD3 1 1 17 6514 1 1 8 PRO HG2 H 4.934 -6.550 -18.427 1.00 . A A . 8 PRO HG2 1 1 17 6515 1 1 8 PRO HG3 H 4.694 -4.941 -17.721 1.00 . A A . 8 PRO HG3 1 1 17 6516 1 1 8 PRO N N 3.869 -7.524 -15.974 1.00 . A A . 8 PRO N 1 1 17 6517 1 1 8 PRO O O 3.417 -8.764 -18.785 1.00 . A A . 8 PRO O 1 1 17 6518 1 1 9 . C C 2.004 -12.013 -17.527 1.00 . A A . 9 DBB C 1 1 17 6519 1 1 9 . CA C 1.593 -10.808 -18.331 1.00 . A A . 9 DBB CA 1 1 17 6520 1 1 9 . CB C 0.127 -10.948 -18.748 1.00 . A A . 9 DBB CB 1 1 17 6521 1 1 9 . CG C -0.759 -10.969 -17.500 1.00 . A A . 9 DBB CG 1 1 17 6522 1 1 9 . H H 1.183 -9.466 -16.732 1.00 . A A . 9 DBB H 1 1 17 6523 1 1 9 . HA H 2.218 -10.734 -19.221 1.00 . A A . 9 DBB HA 1 1 17 6524 1 1 9 . HB2 H -0.006 -11.875 -19.304 1.00 . A A . 9 DBB HB2 1 1 17 6525 1 1 9 . HG1 H -1.310 -11.908 -17.462 1.00 . A A . 9 DBB HG1 1 1 17 6526 1 1 9 . HG2 H -0.137 -10.875 -16.611 1.00 . A A . 9 DBB HG2 1 1 17 6527 1 1 9 . HG3 H -1.462 -10.136 -17.541 1.00 . A A . 9 DBB HG3 1 1 17 6528 1 1 9 . N N 1.756 -9.596 -17.517 1.00 . A A . 9 DBB N 1 1 17 6529 1 1 9 . O O 2.380 -13.045 -18.083 1.00 . A A . 9 DBB O 1 1 17 6530 1 1 10 VAL C C 1.105 -13.879 -15.020 1.00 . A A . 10 VAL C 1 1 17 6531 1 1 10 VAL CA C 2.302 -12.981 -15.314 1.00 . A A . 10 VAL CA 1 1 17 6532 1 1 10 VAL CB C 2.872 -12.453 -13.984 1.00 . A A . 10 VAL CB 1 1 17 6533 1 1 10 VAL CG1 C 1.850 -11.577 -13.275 1.00 . A A . 10 VAL CG1 1 1 17 6534 1 1 10 VAL CG2 C 3.305 -13.608 -13.093 1.00 . A A . 10 VAL CG2 1 1 17 6535 1 1 10 VAL H H 1.626 -11.041 -15.821 1.00 . A A . 10 VAL H 1 1 17 6536 1 1 10 VAL HA H 3.068 -13.567 -15.802 1.00 . A A . 10 VAL HA 1 1 17 6537 1 1 10 VAL HB H 3.741 -11.849 -14.202 1.00 . A A . 10 VAL HB 1 1 17 6538 1 1 10 VAL HG11 H 1.576 -10.753 -13.917 1.00 . A A . 10 VAL HG11 1 1 17 6539 1 1 10 VAL HG12 H 0.972 -12.163 -13.045 1.00 . A A . 10 VAL HG12 1 1 17 6540 1 1 10 VAL HG13 H 2.277 -11.193 -12.361 1.00 . A A . 10 VAL HG13 1 1 17 6541 1 1 10 VAL HG21 H 2.665 -13.651 -12.225 1.00 . A A . 10 VAL HG21 1 1 17 6542 1 1 10 VAL HG22 H 3.228 -14.535 -13.643 1.00 . A A . 10 VAL HG22 1 1 17 6543 1 1 10 VAL HG23 H 4.328 -13.459 -12.781 1.00 . A A . 10 VAL HG23 1 1 17 6544 1 1 10 VAL N N 1.934 -11.888 -16.205 1.00 . A A . 10 VAL N 1 1 17 6545 1 1 10 VAL O O 1.263 -15.059 -14.710 1.00 . A A . 10 VAL O 1 1 17 6546 1 1 11 DAL C C -1.470 -15.158 -15.894 1.00 . A A . 11 DAL C 1 1 17 6547 1 1 11 DAL CA C -1.327 -14.066 -14.865 1.00 . A A . 11 DAL CA 1 1 17 6548 1 1 11 DAL CB C -1.263 -14.686 -13.468 1.00 . A A . 11 DAL CB 1 1 17 6549 1 1 11 DAL H H -0.153 -12.366 -15.373 1.00 . A A . 11 DAL H 1 1 17 6550 1 1 11 DAL HA H -2.183 -13.393 -14.926 1.00 . A A . 11 DAL HA 1 1 17 6551 1 1 11 DAL HB1 H -0.832 -13.968 -12.770 1.00 . A A . 11 DAL HB1 1 1 17 6552 1 1 11 DAL HB2 H -2.269 -14.949 -13.142 1.00 . A A . 11 DAL HB2 1 1 17 6553 1 1 11 DAL N N -0.092 -13.311 -15.121 1.00 . A A . 11 DAL N 1 1 17 6554 1 1 11 DAL O O -0.501 -15.536 -16.553 1.00 . A A . 11 DAL O 1 1 17 6555 1 1 12 HIS C C -3.827 -16.220 -18.146 1.00 . A A . 12 HIS C 1 1 17 6556 1 1 12 HIS CA C -2.960 -16.734 -17.000 1.00 . A A . 12 HIS CA 1 1 17 6557 1 1 12 HIS CB C -3.651 -17.911 -16.311 1.00 . A A . 12 HIS CB 1 1 17 6558 1 1 12 HIS CD2 C -2.442 -20.098 -15.614 1.00 . A A . 12 HIS CD2 1 1 17 6559 1 1 12 HIS CE1 C -2.067 -20.908 -17.617 1.00 . A A . 12 HIS CE1 1 1 17 6560 1 1 12 HIS CG C -2.949 -19.218 -16.510 1.00 . A A . 12 HIS CG 1 1 17 6561 1 1 12 HIS H H -3.420 -15.329 -15.484 1.00 . A A . 12 HIS H 1 1 17 6562 1 1 12 HIS HA H -2.016 -17.068 -17.402 1.00 . A A . 12 HIS HA 1 1 17 6563 1 1 12 HIS HB2 H -3.699 -17.720 -15.249 1.00 . A A . 12 HIS HB2 1 1 17 6564 1 1 12 HIS HB3 H -4.654 -18.009 -16.700 1.00 . A A . 12 HIS HB3 1 1 17 6565 1 1 12 HIS HD1 H -2.943 -19.351 -18.613 1.00 . A A . 12 HIS HD1 1 1 17 6566 1 1 12 HIS HD2 H -2.461 -19.999 -14.538 1.00 . A A . 12 HIS HD2 1 1 17 6567 1 1 12 HIS HE1 H -1.743 -21.552 -18.420 1.00 . A A . 12 HIS HE1 1 1 17 6568 1 1 12 HIS N N -2.688 -15.672 -16.038 1.00 . A A . 12 HIS N 1 1 17 6569 1 1 12 HIS ND1 N -2.696 -19.755 -17.756 1.00 . A A . 12 HIS ND1 1 1 17 6570 1 1 12 HIS NE2 N -1.900 -21.139 -16.327 1.00 . A A . 12 HIS NE2 1 1 17 6571 1 1 12 HIS O O -3.833 -16.790 -19.236 1.00 . A A . 12 HIS O 1 1 17 6572 1 1 13 ASP C C -4.707 -13.437 -19.654 1.00 . A A . 13 ASP C 1 1 17 6573 1 1 13 ASP CA C -5.428 -14.549 -18.899 1.00 . A A . 13 ASP CA 1 1 17 6574 1 1 13 ASP CB C -6.699 -14.001 -18.249 1.00 . A A . 13 ASP CB 1 1 17 6575 1 1 13 ASP CG C -7.454 -15.060 -17.470 1.00 . A A . 13 ASP CG 1 1 17 6576 1 1 13 ASP H H -4.510 -14.731 -17.000 1.00 . A A . 13 ASP H 1 1 17 6577 1 1 13 ASP HA H -5.699 -15.325 -19.599 1.00 . A A . 13 ASP HA 1 1 17 6578 1 1 13 ASP HB2 H -6.434 -13.203 -17.571 1.00 . A A . 13 ASP HB2 1 1 17 6579 1 1 13 ASP HB3 H -7.351 -13.613 -19.019 1.00 . A A . 13 ASP HB3 1 1 17 6580 1 1 13 ASP N N -4.558 -15.140 -17.890 1.00 . A A . 13 ASP N 1 1 17 6581 1 1 13 ASP O O -4.403 -13.572 -20.840 1.00 . A A . 13 ASP O 1 1 17 6582 1 1 13 ASP OD1 O -8.251 -15.797 -18.088 1.00 . A A . 13 ASP OD1 1 1 17 6583 1 1 13 ASP OD2 O -7.248 -15.152 -16.242 1.00 . A A . 13 ASP OD2 1 1 17 6584 1 1 14 CYS C C -4.598 -10.586 -20.679 1.00 . A A . 14 CYS C 1 1 17 6585 1 1 14 CYS CA C -3.754 -11.199 -19.564 1.00 . A A . 14 CYS CA 1 1 17 6586 1 1 14 CYS CB C -2.394 -11.629 -20.117 1.00 . A A . 14 CYS CB 1 1 17 6587 1 1 14 CYS H H -4.705 -12.287 -18.018 1.00 . A A . 14 CYS H 1 1 17 6588 1 1 14 CYS HA H -3.602 -10.457 -18.796 1.00 . A A . 14 CYS HA 1 1 17 6589 1 1 14 CYS HB2 H -1.969 -12.377 -19.464 1.00 . A A . 14 CYS HB2 1 1 17 6590 1 1 14 CYS HB3 H -2.532 -12.054 -21.100 1.00 . A A . 14 CYS HB3 1 1 17 6591 1 1 14 CYS N N -4.438 -12.336 -18.960 1.00 . A A . 14 CYS N 1 1 17 6592 1 1 14 CYS O O -4.739 -11.166 -21.756 1.00 . A A . 14 CYS O 1 1 17 6593 1 1 14 CYS SG S -1.188 -10.272 -20.263 1.00 . A A . 14 CYS SG 1 1 17 6594 1 1 15 HIS C C -5.625 -7.238 -21.461 1.00 . A A . 15 HIS C 1 1 17 6595 1 1 15 HIS CA C -5.987 -8.718 -21.392 1.00 . A A . 15 HIS CA 1 1 17 6596 1 1 15 HIS CB C -7.467 -8.878 -21.043 1.00 . A A . 15 HIS CB 1 1 17 6597 1 1 15 HIS CD2 C -9.689 -8.246 -22.221 1.00 . A A . 15 HIS CD2 1 1 17 6598 1 1 15 HIS CE1 C -9.011 -8.421 -24.299 1.00 . A A . 15 HIS CE1 1 1 17 6599 1 1 15 HIS CG C -8.386 -8.611 -22.194 1.00 . A A . 15 HIS CG 1 1 17 6600 1 1 15 HIS H H -5.008 -8.998 -19.535 1.00 . A A . 15 HIS H 1 1 17 6601 1 1 15 HIS HA H -5.803 -9.166 -22.357 1.00 . A A . 15 HIS HA 1 1 17 6602 1 1 15 HIS HB2 H -7.643 -9.888 -20.705 1.00 . A A . 15 HIS HB2 1 1 17 6603 1 1 15 HIS HB3 H -7.719 -8.189 -20.249 1.00 . A A . 15 HIS HB3 1 1 17 6604 1 1 15 HIS HD1 H -7.096 -8.961 -23.823 1.00 . A A . 15 HIS HD1 1 1 17 6605 1 1 15 HIS HD2 H -10.325 -8.075 -21.364 1.00 . A A . 15 HIS HD2 1 1 17 6606 1 1 15 HIS HE1 H -8.996 -8.417 -25.378 1.00 . A A . 15 HIS HE1 1 1 17 6607 1 1 15 HIS N N -5.157 -9.410 -20.412 1.00 . A A . 15 HIS N 1 1 17 6608 1 1 15 HIS ND1 N -7.991 -8.713 -23.512 1.00 . A A . 15 HIS ND1 1 1 17 6609 1 1 15 HIS NE2 N -10.054 -8.135 -23.540 1.00 . A A . 15 HIS NE2 1 1 17 6610 1 1 15 HIS O O -6.462 -6.399 -21.793 1.00 . A A . 15 HIS O 1 1 17 6611 1 1 16 MET C C -4.614 -4.705 -20.116 1.00 . A A . 16 MET C 1 1 17 6612 1 1 16 MET CA C -3.900 -5.545 -21.171 1.00 . A A . 16 MET CA 1 1 17 6613 1 1 16 MET CB C -4.119 -4.935 -22.557 1.00 . A A . 16 MET CB 1 1 17 6614 1 1 16 MET CE C -3.595 -4.990 -25.768 1.00 . A A . 16 MET CE 1 1 17 6615 1 1 16 MET CG C -2.854 -4.358 -23.173 1.00 . A A . 16 MET CG 1 1 17 6616 1 1 16 MET H H -3.751 -7.637 -20.887 1.00 . A A . 16 MET H 1 1 17 6617 1 1 16 MET HA H -2.843 -5.552 -20.954 1.00 . A A . 16 MET HA 1 1 17 6618 1 1 16 MET HB2 H -4.498 -5.700 -23.218 1.00 . A A . 16 MET HB2 1 1 17 6619 1 1 16 MET HB3 H -4.849 -4.143 -22.479 1.00 . A A . 16 MET HB3 1 1 17 6620 1 1 16 MET HE1 H -4.549 -5.066 -25.268 1.00 . A A . 16 MET HE1 1 1 17 6621 1 1 16 MET HE2 H -3.481 -3.997 -26.177 1.00 . A A . 16 MET HE2 1 1 17 6622 1 1 16 MET HE3 H -3.547 -5.716 -26.566 1.00 . A A . 16 MET HE3 1 1 17 6623 1 1 16 MET HG2 H -3.054 -3.346 -23.492 1.00 . A A . 16 MET HG2 1 1 17 6624 1 1 16 MET HG3 H -2.077 -4.350 -22.424 1.00 . A A . 16 MET HG3 1 1 17 6625 1 1 16 MET N N -4.373 -6.924 -21.144 1.00 . A A . 16 MET N 1 1 17 6626 1 1 16 MET O O -5.818 -4.470 -20.207 1.00 . A A . 16 MET O 1 1 17 6627 1 1 16 MET SD S -2.279 -5.306 -24.595 1.00 . A A . 16 MET SD 1 1 17 6628 1 1 17 ASN C C -3.343 -3.035 -17.047 1.00 . A A . 17 ASN C 1 1 17 6629 1 1 17 ASN CA C -4.424 -3.444 -18.043 1.00 . A A . 17 ASN CA 1 1 17 6630 1 1 17 ASN CB C -5.533 -4.212 -17.321 1.00 . A A . 17 ASN CB 1 1 17 6631 1 1 17 ASN CG C -6.917 -3.724 -17.703 1.00 . A A . 17 ASN CG 1 1 17 6632 1 1 17 ASN H H -2.908 -4.478 -19.098 1.00 . A A . 17 ASN H 1 1 17 6633 1 1 17 ASN HA H -4.844 -2.554 -18.486 1.00 . A A . 17 ASN HA 1 1 17 6634 1 1 17 ASN HB2 H -5.460 -5.260 -17.572 1.00 . A A . 17 ASN HB2 1 1 17 6635 1 1 17 ASN HB3 H -5.411 -4.092 -16.255 1.00 . A A . 17 ASN HB3 1 1 17 6636 1 1 17 ASN HD21 H -6.523 -1.930 -16.941 1.00 . A A . 17 ASN HD21 1 1 17 6637 1 1 17 ASN HD22 H -8.096 -2.125 -17.628 1.00 . A A . 17 ASN HD22 1 1 17 6638 1 1 17 ASN N N -3.862 -4.257 -19.116 1.00 . A A . 17 ASN N 1 1 17 6639 1 1 17 ASN ND2 N -7.208 -2.466 -17.393 1.00 . A A . 17 ASN ND2 1 1 17 6640 1 1 17 ASN O O -2.903 -1.886 -17.031 1.00 . A A . 17 ASN O 1 1 17 6641 1 1 17 ASN OD1 O -7.715 -4.469 -18.272 1.00 . A A . 17 ASN OD1 1 1 17 6642 1 1 18 DAL C C -2.283 -2.536 -14.374 1.00 . A A . 18 DAL C 1 1 17 6643 1 1 18 DAL CA C -1.880 -3.721 -15.213 1.00 . A A . 18 DAL CA 1 1 17 6644 1 1 18 DAL CB C -1.716 -4.950 -14.317 1.00 . A A . 18 DAL CB 1 1 17 6645 1 1 18 DAL H H -3.307 -4.881 -16.282 1.00 . A A . 18 DAL H 1 1 17 6646 1 1 18 DAL HA H -0.935 -3.507 -15.714 1.00 . A A . 18 DAL HA 1 1 17 6647 1 1 18 DAL HB1 H -1.008 -5.642 -14.773 1.00 . A A . 18 DAL HB1 1 1 17 6648 1 1 18 DAL HB2 H -1.343 -4.640 -13.341 1.00 . A A . 18 DAL HB2 1 1 17 6649 1 1 18 DAL N N -2.918 -3.984 -16.220 1.00 . A A . 18 DAL N 1 1 17 6650 1 1 18 DAL O O -1.709 -1.453 -14.493 1.00 . A A . 18 DAL O 1 1 17 6651 1 1 19 PHE C C -3.631 -2.064 -11.178 1.00 . A A . 19 PHE C 1 1 17 6652 1 1 19 PHE CA C -3.763 -1.671 -12.646 1.00 . A A . 19 PHE CA 1 1 17 6653 1 1 19 PHE CB C -5.223 -1.345 -12.969 1.00 . A A . 19 PHE CB 1 1 17 6654 1 1 19 PHE CD1 C -7.078 -2.111 -11.463 1.00 . A A . 19 PHE CD1 1 1 17 6655 1 1 19 PHE CD2 C -6.210 -3.650 -13.064 1.00 . A A . 19 PHE CD2 1 1 17 6656 1 1 19 PHE CE1 C -7.969 -3.069 -11.019 1.00 . A A . 19 PHE CE1 1 1 17 6657 1 1 19 PHE CE2 C -7.100 -4.612 -12.625 1.00 . A A . 19 PHE CE2 1 1 17 6658 1 1 19 PHE CG C -6.190 -2.390 -12.489 1.00 . A A . 19 PHE CG 1 1 17 6659 1 1 19 PHE CZ C -7.980 -4.322 -11.600 1.00 . A A . 19 PHE CZ 1 1 17 6660 1 1 19 PHE H H -3.695 -3.621 -13.466 1.00 . A A . 19 PHE H 1 1 17 6661 1 1 19 PHE HA H -3.159 -0.795 -12.827 1.00 . A A . 19 PHE HA 1 1 17 6662 1 1 19 PHE HB2 H -5.487 -0.409 -12.502 1.00 . A A . 19 PHE HB2 1 1 17 6663 1 1 19 PHE HB3 H -5.335 -1.254 -14.039 1.00 . A A . 19 PHE HB3 1 1 17 6664 1 1 19 PHE HD1 H -7.070 -1.131 -11.007 1.00 . A A . 19 PHE HD1 1 1 17 6665 1 1 19 PHE HD2 H -5.523 -3.879 -13.865 1.00 . A A . 19 PHE HD2 1 1 17 6666 1 1 19 PHE HE1 H -8.656 -2.839 -10.217 1.00 . A A . 19 PHE HE1 1 1 17 6667 1 1 19 PHE HE2 H -7.106 -5.591 -13.080 1.00 . A A . 19 PHE HE2 1 1 17 6668 1 1 19 PHE HZ H -8.676 -5.072 -11.255 1.00 . A A . 19 PHE HZ 1 1 17 6669 1 1 19 PHE N N -3.277 -2.736 -13.515 1.00 . A A . 19 PHE N 1 1 17 6670 1 1 19 PHE O O -3.599 -1.207 -10.296 1.00 . A A . 19 PHE O 1 1 17 6671 1 1 20 GLN C C -3.355 -5.398 -9.556 1.00 . A A . 20 GLN C 1 1 17 6672 1 1 20 GLN CA C -3.427 -3.874 -9.564 1.00 . A A . 20 GLN CA 1 1 17 6673 1 1 20 GLN CB C -4.604 -3.403 -8.709 1.00 . A A . 20 GLN CB 1 1 17 6674 1 1 20 GLN CD C -4.790 -2.797 -6.263 1.00 . A A . 20 GLN CD 1 1 17 6675 1 1 20 GLN CG C -4.208 -2.427 -7.613 1.00 . A A . 20 GLN CG 1 1 17 6676 1 1 20 GLN H H -3.585 -4.001 -11.671 1.00 . A A . 20 GLN H 1 1 17 6677 1 1 20 GLN HA H -2.512 -3.481 -9.148 1.00 . A A . 20 GLN HA 1 1 17 6678 1 1 20 GLN HB2 H -5.327 -2.919 -9.349 1.00 . A A . 20 GLN HB2 1 1 17 6679 1 1 20 GLN HB3 H -5.065 -4.263 -8.246 1.00 . A A . 20 GLN HB3 1 1 17 6680 1 1 20 GLN HE21 H -2.970 -2.854 -5.466 1.00 . A A . 20 GLN HE21 1 1 17 6681 1 1 20 GLN HE22 H -4.272 -3.212 -4.389 1.00 . A A . 20 GLN HE22 1 1 17 6682 1 1 20 GLN HG2 H -3.131 -2.414 -7.532 1.00 . A A . 20 GLN HG2 1 1 17 6683 1 1 20 GLN HG3 H -4.559 -1.442 -7.882 1.00 . A A . 20 GLN HG3 1 1 17 6684 1 1 20 GLN N N -3.554 -3.367 -10.925 1.00 . A A . 20 GLN N 1 1 17 6685 1 1 20 GLN NE2 N -3.923 -2.973 -5.273 1.00 . A A . 20 GLN NE2 1 1 17 6686 1 1 20 GLN O O -4.054 -6.067 -10.318 1.00 . A A . 20 GLN O 1 1 17 6687 1 1 20 GLN OE1 O -6.005 -2.924 -6.112 1.00 . A A . 20 GLN OE1 1 1 17 6688 1 1 21 PHE C C -3.152 -7.940 -7.414 1.00 . A A . 21 PHE C 1 1 17 6689 1 1 21 PHE CA C -2.342 -7.386 -8.583 1.00 . A A . 21 PHE CA 1 1 17 6690 1 1 21 PHE CB C -0.864 -7.741 -8.408 1.00 . A A . 21 PHE CB 1 1 17 6691 1 1 21 PHE CD1 C 0.413 -6.233 -9.954 1.00 . A A . 21 PHE CD1 1 1 17 6692 1 1 21 PHE CD2 C 0.279 -8.553 -10.488 1.00 . A A . 21 PHE CD2 1 1 17 6693 1 1 21 PHE CE1 C 1.171 -6.012 -11.088 1.00 . A A . 21 PHE CE1 1 1 17 6694 1 1 21 PHE CE2 C 1.038 -8.338 -11.624 1.00 . A A . 21 PHE CE2 1 1 17 6695 1 1 21 PHE CG C -0.041 -7.504 -9.641 1.00 . A A . 21 PHE CG 1 1 17 6696 1 1 21 PHE CZ C 1.483 -7.066 -11.925 1.00 . A A . 21 PHE CZ 1 1 17 6697 1 1 21 PHE H H -1.977 -5.355 -8.108 1.00 . A A . 21 PHE H 1 1 17 6698 1 1 21 PHE HA H -2.704 -7.828 -9.498 1.00 . A A . 21 PHE HA 1 1 17 6699 1 1 21 PHE HB2 H -0.449 -7.141 -7.612 1.00 . A A . 21 PHE HB2 1 1 17 6700 1 1 21 PHE HB3 H -0.781 -8.785 -8.147 1.00 . A A . 21 PHE HB3 1 1 17 6701 1 1 21 PHE HD1 H 0.169 -5.407 -9.300 1.00 . A A . 21 PHE HD1 1 1 17 6702 1 1 21 PHE HD2 H -0.069 -9.548 -10.255 1.00 . A A . 21 PHE HD2 1 1 17 6703 1 1 21 PHE HE1 H 1.518 -5.016 -11.321 1.00 . A A . 21 PHE HE1 1 1 17 6704 1 1 21 PHE HE2 H 1.280 -9.164 -12.276 1.00 . A A . 21 PHE HE2 1 1 17 6705 1 1 21 PHE HZ H 2.076 -6.895 -12.811 1.00 . A A . 21 PHE HZ 1 1 17 6706 1 1 21 PHE N N -2.506 -5.941 -8.689 1.00 . A A . 21 PHE N 1 1 17 6707 1 1 21 PHE O O -2.863 -7.653 -6.252 1.00 . A A . 21 PHE O 1 1 17 6708 1 1 22 VAL C C -4.353 -10.548 -6.078 1.00 . A A . 22 VAL C 1 1 17 6709 1 1 22 VAL CA C -5.020 -9.332 -6.709 1.00 . A A . 22 VAL CA 1 1 17 6710 1 1 22 VAL CB C -6.384 -9.751 -7.290 1.00 . A A . 22 VAL CB 1 1 17 6711 1 1 22 VAL CG1 C -7.248 -8.529 -7.562 1.00 . A A . 22 VAL CG1 1 1 17 6712 1 1 22 VAL CG2 C -6.193 -10.572 -8.556 1.00 . A A . 22 VAL CG2 1 1 17 6713 1 1 22 VAL H H -4.349 -8.927 -8.675 1.00 . A A . 22 VAL H 1 1 17 6714 1 1 22 VAL HA H -5.192 -8.589 -5.943 1.00 . A A . 22 VAL HA 1 1 17 6715 1 1 22 VAL HB H -6.889 -10.367 -6.560 1.00 . A A . 22 VAL HB 1 1 17 6716 1 1 22 VAL HG11 H -8.227 -8.847 -7.890 1.00 . A A . 22 VAL HG11 1 1 17 6717 1 1 22 VAL HG12 H -7.341 -7.946 -6.657 1.00 . A A . 22 VAL HG12 1 1 17 6718 1 1 22 VAL HG13 H -6.788 -7.928 -8.332 1.00 . A A . 22 VAL HG13 1 1 17 6719 1 1 22 VAL HG21 H -5.364 -11.251 -8.423 1.00 . A A . 22 VAL HG21 1 1 17 6720 1 1 22 VAL HG22 H -7.092 -11.137 -8.758 1.00 . A A . 22 VAL HG22 1 1 17 6721 1 1 22 VAL HG23 H -5.989 -9.912 -9.386 1.00 . A A . 22 VAL HG23 1 1 17 6722 1 1 22 VAL N N -4.168 -8.736 -7.731 1.00 . A A . 22 VAL N 1 1 17 6723 1 1 22 VAL O O -4.679 -10.937 -4.956 1.00 . A A . 22 VAL O 1 1 17 6724 1 1 23 PHE C C -1.549 -12.683 -7.250 1.00 . A A . 23 PHE C 1 1 17 6725 1 1 23 PHE CA C -2.701 -12.320 -6.317 1.00 . A A . 23 PHE CA 1 1 17 6726 1 1 23 PHE CB C -3.658 -13.507 -6.184 1.00 . A A . 23 PHE CB 1 1 17 6727 1 1 23 PHE CD1 C -4.343 -13.609 -8.596 1.00 . A A . 23 PHE CD1 1 1 17 6728 1 1 23 PHE CD2 C -6.052 -13.547 -6.934 1.00 . A A . 23 PHE CD2 1 1 17 6729 1 1 23 PHE CE1 C -5.305 -13.655 -9.588 1.00 . A A . 23 PHE CE1 1 1 17 6730 1 1 23 PHE CE2 C -7.018 -13.593 -7.921 1.00 . A A . 23 PHE CE2 1 1 17 6731 1 1 23 PHE CG C -4.705 -13.555 -7.259 1.00 . A A . 23 PHE CG 1 1 17 6732 1 1 23 PHE CZ C -6.644 -13.645 -9.250 1.00 . A A . 23 PHE CZ 1 1 17 6733 1 1 23 PHE H H -3.199 -10.789 -7.693 1.00 . A A . 23 PHE H 1 1 17 6734 1 1 23 PHE HA H -2.299 -12.081 -5.344 1.00 . A A . 23 PHE HA 1 1 17 6735 1 1 23 PHE HB2 H -3.091 -14.424 -6.232 1.00 . A A . 23 PHE HB2 1 1 17 6736 1 1 23 PHE HB3 H -4.161 -13.449 -5.231 1.00 . A A . 23 PHE HB3 1 1 17 6737 1 1 23 PHE HD1 H -3.295 -13.616 -8.861 1.00 . A A . 23 PHE HD1 1 1 17 6738 1 1 23 PHE HD2 H -6.346 -13.505 -5.895 1.00 . A A . 23 PHE HD2 1 1 17 6739 1 1 23 PHE HE1 H -5.009 -13.696 -10.625 1.00 . A A . 23 PHE HE1 1 1 17 6740 1 1 23 PHE HE2 H -8.064 -13.585 -7.654 1.00 . A A . 23 PHE HE2 1 1 17 6741 1 1 23 PHE HZ H -7.397 -13.681 -10.023 1.00 . A A . 23 PHE HZ 1 1 17 6742 1 1 23 PHE N N -3.415 -11.146 -6.805 1.00 . A A . 23 PHE N 1 1 17 6743 1 1 23 PHE O O -1.311 -13.856 -7.530 1.00 . A A . 23 PHE O 1 1 17 6744 1 1 24 DBU C C -0.089 -12.029 -10.024 1.00 . A A . 24 DBU C 1 1 17 6745 1 1 24 DBU CA C 0.215 -11.863 -8.571 1.00 . A A . 24 DBU CA 1 1 17 6746 1 1 24 DBU CB C 1.516 -11.924 -8.235 1.00 . A A . 24 DBU CB 1 1 17 6747 1 1 24 DBU CG C 2.081 -11.788 -6.856 1.00 . A A . 24 DBU CG 1 1 17 6748 1 1 24 DBU HG1 H 1.355 -11.430 -6.122 1.00 . A A . 24 DBU HG1 1 1 17 6749 1 1 24 DBU HG2 H 2.920 -11.086 -6.869 1.00 . A A . 24 DBU HG2 1 1 17 6750 1 1 24 DBU HG3 H 2.454 -12.758 -6.514 1.00 . A A . 24 DBU HG3 1 1 17 6751 1 1 24 DBU N N -0.839 -11.666 -7.727 1.00 . A A . 24 DBU N 1 1 17 6752 1 1 24 DBU O O 0.744 -12.513 -10.791 1.00 . A A . 24 DBU O 1 1 17 6753 1 1 25 CYS C C -2.152 -10.379 -12.355 1.00 . A A . 25 CYS C 1 1 17 6754 1 1 25 CYS CA C -1.713 -11.736 -11.813 1.00 . A A . 25 CYS CA 1 1 17 6755 1 1 25 CYS CB C -2.856 -12.745 -11.945 1.00 . A A . 25 CYS CB 1 1 17 6756 1 1 25 CYS H H -1.912 -11.251 -9.762 1.00 . A A . 25 CYS H 1 1 17 6757 1 1 25 CYS HA H -0.869 -12.084 -12.389 1.00 . A A . 25 CYS HA 1 1 17 6758 1 1 25 CYS HB2 H -3.700 -12.399 -11.366 1.00 . A A . 25 CYS HB2 1 1 17 6759 1 1 25 CYS HB3 H -3.143 -12.818 -12.983 1.00 . A A . 25 CYS HB3 1 1 17 6760 1 1 25 CYS N N -1.292 -11.629 -10.421 1.00 . A A . 25 CYS N 1 1 17 6761 1 1 25 CYS O O -3.003 -9.709 -11.768 1.00 . A A . 25 CYS O 1 1 17 6762 1 1 25 CYS SG S -2.439 -14.421 -11.365 1.00 . A A . 25 CYS SG 1 1 17 6763 1 1 26 CYS C C -1.096 -8.501 -15.385 1.00 . A A . 26 CYS C 1 1 17 6764 1 1 26 CYS CA C -1.897 -8.703 -14.101 1.00 . A A . 26 CYS CA 1 1 17 6765 1 1 26 CYS CB C -1.624 -7.553 -13.130 1.00 . A A . 26 CYS CB 1 1 17 6766 1 1 26 CYS H H -0.896 -10.558 -13.901 1.00 . A A . 26 CYS H 1 1 17 6767 1 1 26 CYS HA H -2.948 -8.715 -14.346 1.00 . A A . 26 CYS HA 1 1 17 6768 1 1 26 CYS HB2 H -1.600 -7.941 -12.122 1.00 . A A . 26 CYS HB2 1 1 17 6769 1 1 26 CYS HB3 H -0.665 -7.114 -13.364 1.00 . A A . 26 CYS HB3 1 1 17 6770 1 1 26 CYS N N -1.567 -9.980 -13.479 1.00 . A A . 26 CYS N 1 1 17 6771 1 1 26 CYS O O 0.052 -8.932 -15.487 1.00 . A A . 26 CYS O 1 1 17 6772 1 1 26 CYS SG S -2.870 -6.225 -13.182 1.00 . A A . 26 CYS SG 1 1 17 6773 1 1 27 SER C C -0.155 -6.357 -17.551 1.00 . A A . 27 SER C 1 1 17 6774 1 1 27 SER CA C -1.057 -7.584 -17.639 1.00 . A A . 27 SER CA 1 1 17 6775 1 1 27 SER CB C -2.101 -7.386 -18.739 1.00 . A A . 27 SER CB 1 1 17 6776 1 1 27 SER H H -2.626 -7.522 -16.219 1.00 . A A . 27 SER H 1 1 17 6777 1 1 27 SER HA H -0.451 -8.445 -17.881 1.00 . A A . 27 SER HA 1 1 17 6778 1 1 27 SER HB2 H -2.707 -8.275 -18.821 1.00 . A A . 27 SER HB2 1 1 17 6779 1 1 27 SER HB3 H -2.730 -6.544 -18.488 1.00 . A A . 27 SER HB3 1 1 17 6780 1 1 27 SER HG H -0.608 -7.531 -19.999 1.00 . A A . 27 SER HG 1 1 17 6781 1 1 27 SER N N -1.711 -7.841 -16.361 1.00 . A A . 27 SER N 1 1 17 6782 1 1 27 SER O O 0.239 -5.790 -18.569 1.00 . A A . 27 SER O 1 1 17 6783 1 1 27 SER OG O -1.484 -7.137 -19.990 1.00 . A A . 27 SER OG 1 1 18 6784 1 1 1 LYS C C 5.412 3.097 -8.644 1.00 . A A . 1 LYS C 1 1 18 6785 1 1 1 LYS CA C 4.392 3.525 -9.693 1.00 . A A . 1 LYS CA 1 1 18 6786 1 1 1 LYS CB C 4.131 5.029 -9.582 1.00 . A A . 1 LYS CB 1 1 18 6787 1 1 1 LYS CD C 3.193 6.893 -8.183 1.00 . A A . 1 LYS CD 1 1 18 6788 1 1 1 LYS CE C 2.887 7.372 -6.772 1.00 . A A . 1 LYS CE 1 1 18 6789 1 1 1 LYS CG C 3.746 5.478 -8.183 1.00 . A A . 1 LYS CG 1 1 18 6790 1 1 1 LYS H1 H 3.077 2.106 -8.836 1.00 . A A . 1 LYS H1 1 1 18 6791 1 1 1 LYS HA H 4.790 3.309 -10.673 1.00 . A A . 1 LYS HA 1 1 18 6792 1 1 1 LYS HB2 H 5.024 5.560 -9.875 1.00 . A A . 1 LYS HB2 1 1 18 6793 1 1 1 LYS HB3 H 3.328 5.294 -10.255 1.00 . A A . 1 LYS HB3 1 1 18 6794 1 1 1 LYS HD2 H 3.922 7.555 -8.625 1.00 . A A . 1 LYS HD2 1 1 18 6795 1 1 1 LYS HD3 H 2.284 6.915 -8.767 1.00 . A A . 1 LYS HD3 1 1 18 6796 1 1 1 LYS HE2 H 2.351 6.594 -6.250 1.00 . A A . 1 LYS HE2 1 1 18 6797 1 1 1 LYS HE3 H 3.819 7.570 -6.263 1.00 . A A . 1 LYS HE3 1 1 18 6798 1 1 1 LYS HG2 H 2.993 4.809 -7.794 1.00 . A A . 1 LYS HG2 1 1 18 6799 1 1 1 LYS HG3 H 4.622 5.443 -7.550 1.00 . A A . 1 LYS HG3 1 1 18 6800 1 1 1 LYS HZ1 H 2.584 9.389 -6.320 1.00 . A A . 1 LYS HZ1 1 1 18 6801 1 1 1 LYS HZ2 H 1.177 8.453 -6.252 1.00 . A A . 1 LYS HZ2 1 1 18 6802 1 1 1 LYS HZ3 H 1.832 8.887 -7.750 1.00 . A A . 1 LYS HZ3 1 1 18 6803 1 1 1 LYS N N 3.146 2.783 -9.541 1.00 . A A . 1 LYS N 1 1 18 6804 1 1 1 LYS NZ N 2.062 8.612 -6.774 1.00 . A A . 1 LYS NZ 1 1 18 6805 1 1 1 LYS O O 5.060 2.491 -7.631 1.00 . A A . 1 LYS O 1 1 18 6806 1 1 2 LYS C C 7.982 1.559 -7.946 1.00 . A A . 2 LYS C 1 1 18 6807 1 1 2 LYS CA C 7.750 3.067 -7.966 1.00 . A A . 2 LYS CA 1 1 18 6808 1 1 2 LYS CB C 7.417 3.561 -6.557 1.00 . A A . 2 LYS CB 1 1 18 6809 1 1 2 LYS CD C 7.617 5.851 -5.544 1.00 . A A . 2 LYS CD 1 1 18 6810 1 1 2 LYS CE C 7.631 6.975 -6.568 1.00 . A A . 2 LYS CE 1 1 18 6811 1 1 2 LYS CG C 8.368 4.630 -6.046 1.00 . A A . 2 LYS CG 1 1 18 6812 1 1 2 LYS H H 6.897 3.899 -9.716 1.00 . A A . 2 LYS H 1 1 18 6813 1 1 2 LYS HA H 8.652 3.553 -8.305 1.00 . A A . 2 LYS HA 1 1 18 6814 1 1 2 LYS HB2 H 6.417 3.969 -6.558 1.00 . A A . 2 LYS HB2 1 1 18 6815 1 1 2 LYS HB3 H 7.453 2.722 -5.876 1.00 . A A . 2 LYS HB3 1 1 18 6816 1 1 2 LYS HD2 H 6.592 5.575 -5.343 1.00 . A A . 2 LYS HD2 1 1 18 6817 1 1 2 LYS HD3 H 8.082 6.200 -4.632 1.00 . A A . 2 LYS HD3 1 1 18 6818 1 1 2 LYS HE2 H 7.466 6.554 -7.548 1.00 . A A . 2 LYS HE2 1 1 18 6819 1 1 2 LYS HE3 H 6.835 7.667 -6.335 1.00 . A A . 2 LYS HE3 1 1 18 6820 1 1 2 LYS HG2 H 8.953 4.222 -5.235 1.00 . A A . 2 LYS HG2 1 1 18 6821 1 1 2 LYS HG3 H 9.025 4.929 -6.851 1.00 . A A . 2 LYS HG3 1 1 18 6822 1 1 2 LYS HZ1 H 8.954 8.385 -5.778 1.00 . A A . 2 LYS HZ1 1 1 18 6823 1 1 2 LYS HZ2 H 9.043 8.231 -7.460 1.00 . A A . 2 LYS HZ2 1 1 18 6824 1 1 2 LYS HZ3 H 9.717 7.040 -6.465 1.00 . A A . 2 LYS HZ3 1 1 18 6825 1 1 2 LYS N N 6.678 3.416 -8.891 1.00 . A A . 2 LYS N 1 1 18 6826 1 1 2 LYS NZ N 8.927 7.709 -6.568 1.00 . A A . 2 LYS NZ 1 1 18 6827 1 1 2 LYS O O 8.955 1.063 -8.514 1.00 . A A . 2 LYS O 1 1 18 6828 1 1 3 LYS C C 6.018 -1.196 -6.406 1.00 . A A . 3 LYS C 1 1 18 6829 1 1 3 LYS CA C 7.186 -0.616 -7.197 1.00 . A A . 3 LYS CA 1 1 18 6830 1 1 3 LYS CB C 8.509 -1.012 -6.539 1.00 . A A . 3 LYS CB 1 1 18 6831 1 1 3 LYS CD C 9.632 -3.102 -7.364 1.00 . A A . 3 LYS CD 1 1 18 6832 1 1 3 LYS CE C 10.858 -3.495 -6.553 1.00 . A A . 3 LYS CE 1 1 18 6833 1 1 3 LYS CG C 9.522 -1.593 -7.510 1.00 . A A . 3 LYS CG 1 1 18 6834 1 1 3 LYS H H 6.328 1.289 -6.857 1.00 . A A . 3 LYS H 1 1 18 6835 1 1 3 LYS HA H 7.159 -1.015 -8.200 1.00 . A A . 3 LYS HA 1 1 18 6836 1 1 3 LYS HB2 H 8.944 -0.137 -6.078 1.00 . A A . 3 LYS HB2 1 1 18 6837 1 1 3 LYS HB3 H 8.310 -1.750 -5.774 1.00 . A A . 3 LYS HB3 1 1 18 6838 1 1 3 LYS HD2 H 8.750 -3.472 -6.864 1.00 . A A . 3 LYS HD2 1 1 18 6839 1 1 3 LYS HD3 H 9.704 -3.545 -8.347 1.00 . A A . 3 LYS HD3 1 1 18 6840 1 1 3 LYS HE2 H 11.721 -3.482 -7.200 1.00 . A A . 3 LYS HE2 1 1 18 6841 1 1 3 LYS HE3 H 10.993 -2.777 -5.758 1.00 . A A . 3 LYS HE3 1 1 18 6842 1 1 3 LYS HG2 H 9.214 -1.362 -8.519 1.00 . A A . 3 LYS HG2 1 1 18 6843 1 1 3 LYS HG3 H 10.489 -1.150 -7.315 1.00 . A A . 3 LYS HG3 1 1 18 6844 1 1 3 LYS HZ1 H 10.995 -4.837 -4.958 1.00 . A A . 3 LYS HZ1 1 1 18 6845 1 1 3 LYS HZ2 H 11.326 -5.529 -6.465 1.00 . A A . 3 LYS HZ2 1 1 18 6846 1 1 3 LYS HZ3 H 9.730 -5.174 -6.030 1.00 . A A . 3 LYS HZ3 1 1 18 6847 1 1 3 LYS N N 7.082 0.836 -7.289 1.00 . A A . 3 LYS N 1 1 18 6848 1 1 3 LYS NZ N 10.717 -4.854 -5.960 1.00 . A A . 3 LYS NZ 1 1 18 6849 1 1 3 LYS O O 5.166 -0.460 -5.909 1.00 . A A . 3 LYS O 1 1 18 6850 1 1 4 SER C C 5.258 -4.673 -5.357 1.00 . A A . 4 SER C 1 1 18 6851 1 1 4 SER CA C 4.922 -3.198 -5.562 1.00 . A A . 4 SER CA 1 1 18 6852 1 1 4 SER CB C 3.595 -3.066 -6.312 1.00 . A A . 4 SER CB 1 1 18 6853 1 1 4 SER H H 6.695 -3.053 -6.710 1.00 . A A . 4 SER H 1 1 18 6854 1 1 4 SER HA H 4.828 -2.725 -4.596 1.00 . A A . 4 SER HA 1 1 18 6855 1 1 4 SER HB2 H 2.791 -2.957 -5.601 1.00 . A A . 4 SER HB2 1 1 18 6856 1 1 4 SER HB3 H 3.632 -2.195 -6.951 1.00 . A A . 4 SER HB3 1 1 18 6857 1 1 4 SER HG H 2.417 -4.445 -7.051 1.00 . A A . 4 SER HG 1 1 18 6858 1 1 4 SER N N 5.986 -2.520 -6.291 1.00 . A A . 4 SER N 1 1 18 6859 1 1 4 SER O O 6.335 -5.133 -5.731 1.00 . A A . 4 SER O 1 1 18 6860 1 1 4 SER OG O 3.345 -4.208 -7.112 1.00 . A A . 4 SER OG 1 1 18 6861 1 1 5 GLY C C 4.420 -7.654 -5.774 1.00 . A A . 5 GLY C 1 1 18 6862 1 1 5 GLY CA C 4.541 -6.822 -4.513 1.00 . A A . 5 GLY CA 1 1 18 6863 1 1 5 GLY H H 3.485 -4.987 -4.481 1.00 . A A . 5 GLY H 1 1 18 6864 1 1 5 GLY HA2 H 5.528 -6.958 -4.097 1.00 . A A . 5 GLY HA2 1 1 18 6865 1 1 5 GLY HA3 H 3.809 -7.167 -3.797 1.00 . A A . 5 GLY HA3 1 1 18 6866 1 1 5 GLY N N 4.326 -5.408 -4.758 1.00 . A A . 5 GLY N 1 1 18 6867 1 1 5 GLY O O 5.292 -8.471 -6.074 1.00 . A A . 5 GLY O 1 1 18 6868 1 1 6 VAL C C 3.330 -7.301 -8.971 1.00 . A A . 6 VAL C 1 1 18 6869 1 1 6 VAL CA C 3.104 -8.187 -7.751 1.00 . A A . 6 VAL CA 1 1 18 6870 1 1 6 VAL CB C 1.675 -8.759 -7.804 1.00 . A A . 6 VAL CB 1 1 18 6871 1 1 6 VAL CG1 C 1.682 -10.162 -8.390 1.00 . A A . 6 VAL CG1 1 1 18 6872 1 1 6 VAL CG2 C 1.049 -8.755 -6.417 1.00 . A A . 6 VAL CG2 1 1 18 6873 1 1 6 VAL H H 2.677 -6.785 -6.225 1.00 . A A . 6 VAL H 1 1 18 6874 1 1 6 VAL HA H 3.801 -9.012 -7.783 1.00 . A A . 6 VAL HA 1 1 18 6875 1 1 6 VAL HB H 1.079 -8.127 -8.446 1.00 . A A . 6 VAL HB 1 1 18 6876 1 1 6 VAL HG11 H 1.195 -10.841 -7.705 1.00 . A A . 6 VAL HG11 1 1 18 6877 1 1 6 VAL HG12 H 1.156 -10.162 -9.333 1.00 . A A . 6 VAL HG12 1 1 18 6878 1 1 6 VAL HG13 H 2.702 -10.481 -8.547 1.00 . A A . 6 VAL HG13 1 1 18 6879 1 1 6 VAL HG21 H 1.763 -9.128 -5.699 1.00 . A A . 6 VAL HG21 1 1 18 6880 1 1 6 VAL HG22 H 0.766 -7.746 -6.152 1.00 . A A . 6 VAL HG22 1 1 18 6881 1 1 6 VAL HG23 H 0.172 -9.385 -6.415 1.00 . A A . 6 VAL HG23 1 1 18 6882 1 1 6 VAL N N 3.336 -7.449 -6.515 1.00 . A A . 6 VAL N 1 1 18 6883 1 1 6 VAL O O 3.841 -6.187 -8.855 1.00 . A A . 6 VAL O 1 1 18 6884 1 1 7 ILE C C 1.900 -7.246 -12.295 1.00 . A A . 7 ILE C 1 1 18 6885 1 1 7 ILE CA C 3.105 -7.057 -11.381 1.00 . A A . 7 ILE CA 1 1 18 6886 1 1 7 ILE CB C 4.379 -7.483 -12.135 1.00 . A A . 7 ILE CB 1 1 18 6887 1 1 7 ILE CD1 C 6.878 -7.856 -11.826 1.00 . A A . 7 ILE CD1 1 1 18 6888 1 1 7 ILE CG1 C 5.617 -7.228 -11.274 1.00 . A A . 7 ILE CG1 1 1 18 6889 1 1 7 ILE CG2 C 4.485 -6.740 -13.458 1.00 . A A . 7 ILE CG2 1 1 18 6890 1 1 7 ILE H H 2.546 -8.697 -10.167 1.00 . A A . 7 ILE H 1 1 18 6891 1 1 7 ILE HA H 3.193 -6.009 -11.131 1.00 . A A . 7 ILE HA 1 1 18 6892 1 1 7 ILE HB H 4.308 -8.539 -12.348 1.00 . A A . 7 ILE HB 1 1 18 6893 1 1 7 ILE HD11 H 7.292 -8.534 -11.094 1.00 . A A . 7 ILE HD11 1 1 18 6894 1 1 7 ILE HD12 H 6.644 -8.399 -12.729 1.00 . A A . 7 ILE HD12 1 1 18 6895 1 1 7 ILE HD13 H 7.599 -7.082 -12.047 1.00 . A A . 7 ILE HD13 1 1 18 6896 1 1 7 ILE HG12 H 5.783 -6.165 -11.199 1.00 . A A . 7 ILE HG12 1 1 18 6897 1 1 7 ILE HG13 H 5.449 -7.632 -10.286 1.00 . A A . 7 ILE HG13 1 1 18 6898 1 1 7 ILE HG21 H 4.376 -5.679 -13.285 1.00 . A A . 7 ILE HG21 1 1 18 6899 1 1 7 ILE HG22 H 5.450 -6.933 -13.903 1.00 . A A . 7 ILE HG22 1 1 18 6900 1 1 7 ILE HG23 H 3.706 -7.078 -14.125 1.00 . A A . 7 ILE HG23 1 1 18 6901 1 1 7 ILE N N 2.946 -7.804 -10.140 1.00 . A A . 7 ILE N 1 1 18 6902 1 1 7 ILE O O 1.603 -8.350 -12.752 1.00 . A A . 7 ILE O 1 1 18 6903 1 1 8 PRO C C 0.357 -6.419 -14.897 1.00 . A A . 8 PRO C 1 1 18 6904 1 1 8 PRO CA C 0.004 -6.162 -13.436 1.00 . A A . 8 PRO CA 1 1 18 6905 1 1 8 PRO CB C -0.580 -4.757 -13.267 1.00 . A A . 8 PRO CB 1 1 18 6906 1 1 8 PRO CD C 1.484 -4.794 -12.063 1.00 . A A . 8 PRO CD 1 1 18 6907 1 1 8 PRO CG C 0.580 -3.909 -12.875 1.00 . A A . 8 PRO CG 1 1 18 6908 1 1 8 PRO HA H -0.717 -6.895 -13.106 1.00 . A A . 8 PRO HA 1 1 18 6909 1 1 8 PRO HB2 H -1.013 -4.429 -14.202 1.00 . A A . 8 PRO HB2 1 1 18 6910 1 1 8 PRO HB3 H -1.338 -4.769 -12.498 1.00 . A A . 8 PRO HB3 1 1 18 6911 1 1 8 PRO HD2 H 2.519 -4.536 -12.234 1.00 . A A . 8 PRO HD2 1 1 18 6912 1 1 8 PRO HD3 H 1.244 -4.717 -11.013 1.00 . A A . 8 PRO HD3 1 1 18 6913 1 1 8 PRO HG2 H 1.092 -3.557 -13.757 1.00 . A A . 8 PRO HG2 1 1 18 6914 1 1 8 PRO HG3 H 0.239 -3.074 -12.279 1.00 . A A . 8 PRO HG3 1 1 18 6915 1 1 8 PRO N N 1.188 -6.143 -12.572 1.00 . A A . 8 PRO N 1 1 18 6916 1 1 8 PRO O O 0.864 -5.536 -15.587 1.00 . A A . 8 PRO O 1 1 18 6917 1 1 9 . C C 1.348 -9.159 -16.769 1.00 . A A . 9 DBB C 1 1 18 6918 1 1 9 . CA C 0.375 -8.010 -16.752 1.00 . A A . 9 DBB CA 1 1 18 6919 1 1 9 . CB C -0.922 -8.428 -17.448 1.00 . A A . 9 DBB CB 1 1 18 6920 1 1 9 . CG C -2.065 -7.520 -16.988 1.00 . A A . 9 DBB CG 1 1 18 6921 1 1 9 . H H -0.321 -8.295 -14.762 1.00 . A A . 9 DBB H 1 1 18 6922 1 1 9 . HA H 0.809 -7.157 -17.274 1.00 . A A . 9 DBB HA 1 1 18 6923 1 1 9 . HB2 H -1.154 -9.461 -17.194 1.00 . A A . 9 DBB HB2 1 1 18 6924 1 1 9 . HG1 H -2.874 -7.557 -17.717 1.00 . A A . 9 DBB HG1 1 1 18 6925 1 1 9 . HG2 H -2.430 -7.859 -16.020 1.00 . A A . 9 DBB HG2 1 1 18 6926 1 1 9 . HG3 H -1.701 -6.496 -16.900 1.00 . A A . 9 DBB HG3 1 1 18 6927 1 1 9 . N N 0.084 -7.634 -15.362 1.00 . A A . 9 DBB N 1 1 18 6928 1 1 9 . O O 2.230 -9.227 -17.625 1.00 . A A . 9 DBB O 1 1 18 6929 1 1 10 VAL C C 1.268 -12.533 -15.788 1.00 . A A . 10 VAL C 1 1 18 6930 1 1 10 VAL CA C 2.067 -11.236 -15.724 1.00 . A A . 10 VAL CA 1 1 18 6931 1 1 10 VAL CB C 2.889 -11.216 -14.421 1.00 . A A . 10 VAL CB 1 1 18 6932 1 1 10 VAL CG1 C 3.842 -10.031 -14.409 1.00 . A A . 10 VAL CG1 1 1 18 6933 1 1 10 VAL CG2 C 1.967 -11.182 -13.211 1.00 . A A . 10 VAL CG2 1 1 18 6934 1 1 10 VAL H H 0.470 -9.965 -15.163 1.00 . A A . 10 VAL H 1 1 18 6935 1 1 10 VAL HA H 2.753 -11.206 -16.558 1.00 . A A . 10 VAL HA 1 1 18 6936 1 1 10 VAL HB H 3.475 -12.122 -14.375 1.00 . A A . 10 VAL HB 1 1 18 6937 1 1 10 VAL HG11 H 4.146 -9.804 -15.420 1.00 . A A . 10 VAL HG11 1 1 18 6938 1 1 10 VAL HG12 H 3.346 -9.174 -13.979 1.00 . A A . 10 VAL HG12 1 1 18 6939 1 1 10 VAL HG13 H 4.713 -10.276 -13.819 1.00 . A A . 10 VAL HG13 1 1 18 6940 1 1 10 VAL HG21 H 1.138 -10.519 -13.409 1.00 . A A . 10 VAL HG21 1 1 18 6941 1 1 10 VAL HG22 H 1.593 -12.177 -13.015 1.00 . A A . 10 VAL HG22 1 1 18 6942 1 1 10 VAL HG23 H 2.515 -10.828 -12.351 1.00 . A A . 10 VAL HG23 1 1 18 6943 1 1 10 VAL N N 1.192 -10.074 -15.817 1.00 . A A . 10 VAL N 1 1 18 6944 1 1 10 VAL O O 1.837 -13.623 -15.818 1.00 . A A . 10 VAL O 1 1 18 6945 1 1 11 DAL C C -0.744 -14.286 -17.187 1.00 . A A . 11 DAL C 1 1 18 6946 1 1 11 DAL CA C -0.940 -13.577 -15.871 1.00 . A A . 11 DAL CA 1 1 18 6947 1 1 11 DAL CB C -0.604 -14.530 -14.722 1.00 . A A . 11 DAL CB 1 1 18 6948 1 1 11 DAL H H -0.449 -11.509 -15.784 1.00 . A A . 11 DAL H 1 1 18 6949 1 1 11 DAL HA H -1.977 -13.253 -15.784 1.00 . A A . 11 DAL HA 1 1 18 6950 1 1 11 DAL HB1 H -1.399 -15.267 -14.616 1.00 . A A . 11 DAL HB1 1 1 18 6951 1 1 11 DAL HB2 H 0.336 -15.039 -14.936 1.00 . A A . 11 DAL HB2 1 1 18 6952 1 1 11 DAL N N -0.055 -12.406 -15.810 1.00 . A A . 11 DAL N 1 1 18 6953 1 1 11 DAL O O 0.384 -14.446 -17.656 1.00 . A A . 11 DAL O 1 1 18 6954 1 1 12 HIS C C -2.116 -14.471 -20.222 1.00 . A A . 12 HIS C 1 1 18 6955 1 1 12 HIS CA C -1.793 -15.417 -19.070 1.00 . A A . 12 HIS CA 1 1 18 6956 1 1 12 HIS CB C -2.770 -16.594 -19.072 1.00 . A A . 12 HIS CB 1 1 18 6957 1 1 12 HIS CD2 C -3.486 -17.914 -16.958 1.00 . A A . 12 HIS CD2 1 1 18 6958 1 1 12 HIS CE1 C -1.567 -18.879 -16.517 1.00 . A A . 12 HIS CE1 1 1 18 6959 1 1 12 HIS CG C -2.603 -17.513 -17.901 1.00 . A A . 12 HIS CG 1 1 18 6960 1 1 12 HIS H H -2.716 -14.560 -17.368 1.00 . A A . 12 HIS H 1 1 18 6961 1 1 12 HIS HA H -0.790 -15.794 -19.200 1.00 . A A . 12 HIS HA 1 1 18 6962 1 1 12 HIS HB2 H -3.781 -16.214 -19.053 1.00 . A A . 12 HIS HB2 1 1 18 6963 1 1 12 HIS HB3 H -2.625 -17.172 -19.973 1.00 . A A . 12 HIS HB3 1 1 18 6964 1 1 12 HIS HD1 H -0.573 -18.044 -18.098 1.00 . A A . 12 HIS HD1 1 1 18 6965 1 1 12 HIS HD2 H -4.525 -17.622 -16.885 1.00 . A A . 12 HIS HD2 1 1 18 6966 1 1 12 HIS HE1 H -0.804 -19.480 -16.046 1.00 . A A . 12 HIS HE1 1 1 18 6967 1 1 12 HIS N N -1.846 -14.717 -17.792 1.00 . A A . 12 HIS N 1 1 18 6968 1 1 12 HIS ND1 N -1.410 -18.134 -17.596 1.00 . A A . 12 HIS ND1 1 1 18 6969 1 1 12 HIS NE2 N -2.818 -18.762 -16.109 1.00 . A A . 12 HIS NE2 1 1 18 6970 1 1 12 HIS O O -3.262 -14.382 -20.663 1.00 . A A . 12 HIS O 1 1 18 6971 1 1 13 ASP C C -2.138 -11.643 -21.378 1.00 . A A . 13 ASP C 1 1 18 6972 1 1 13 ASP CA C -1.274 -12.826 -21.806 1.00 . A A . 13 ASP CA 1 1 18 6973 1 1 13 ASP CB C -1.909 -13.527 -23.007 1.00 . A A . 13 ASP CB 1 1 18 6974 1 1 13 ASP CG C -1.607 -12.823 -24.315 1.00 . A A . 13 ASP CG 1 1 18 6975 1 1 13 ASP H H -0.208 -13.881 -20.311 1.00 . A A . 13 ASP H 1 1 18 6976 1 1 13 ASP HA H -0.299 -12.460 -22.088 1.00 . A A . 13 ASP HA 1 1 18 6977 1 1 13 ASP HB2 H -1.529 -14.537 -23.068 1.00 . A A . 13 ASP HB2 1 1 18 6978 1 1 13 ASP HB3 H -2.980 -13.558 -22.874 1.00 . A A . 13 ASP HB3 1 1 18 6979 1 1 13 ASP N N -1.099 -13.766 -20.705 1.00 . A A . 13 ASP N 1 1 18 6980 1 1 13 ASP O O -3.190 -11.818 -20.762 1.00 . A A . 13 ASP O 1 1 18 6981 1 1 13 ASP OD1 O -2.523 -12.715 -25.157 1.00 . A A . 13 ASP OD1 1 1 18 6982 1 1 13 ASP OD2 O -0.454 -12.378 -24.496 1.00 . A A . 13 ASP OD2 1 1 18 6983 1 1 14 CYS C C -1.862 -8.020 -22.112 1.00 . A A . 14 CYS C 1 1 18 6984 1 1 14 CYS CA C -2.414 -9.224 -21.356 1.00 . A A . 14 CYS CA 1 1 18 6985 1 1 14 CYS CB C -2.335 -8.975 -19.849 1.00 . A A . 14 CYS CB 1 1 18 6986 1 1 14 CYS H H -0.840 -10.361 -22.198 1.00 . A A . 14 CYS H 1 1 18 6987 1 1 14 CYS HA H -3.447 -9.366 -21.635 1.00 . A A . 14 CYS HA 1 1 18 6988 1 1 14 CYS HB2 H -3.064 -8.225 -19.577 1.00 . A A . 14 CYS HB2 1 1 18 6989 1 1 14 CYS HB3 H -2.559 -9.893 -19.327 1.00 . A A . 14 CYS HB3 1 1 18 6990 1 1 14 CYS N N -1.685 -10.437 -21.707 1.00 . A A . 14 CYS N 1 1 18 6991 1 1 14 CYS O O -0.687 -7.989 -22.479 1.00 . A A . 14 CYS O 1 1 18 6992 1 1 14 CYS SG S -0.706 -8.393 -19.276 1.00 . A A . 14 CYS SG 1 1 18 6993 1 1 15 HIS C C -2.120 -4.659 -22.084 1.00 . A A . 15 HIS C 1 1 18 6994 1 1 15 HIS CA C -2.315 -5.821 -23.054 1.00 . A A . 15 HIS CA 1 1 18 6995 1 1 15 HIS CB C -3.361 -5.452 -24.106 1.00 . A A . 15 HIS CB 1 1 18 6996 1 1 15 HIS CD2 C -3.378 -4.078 -26.307 1.00 . A A . 15 HIS CD2 1 1 18 6997 1 1 15 HIS CE1 C -1.573 -2.885 -25.953 1.00 . A A . 15 HIS CE1 1 1 18 6998 1 1 15 HIS CG C -2.877 -4.444 -25.103 1.00 . A A . 15 HIS CG 1 1 18 6999 1 1 15 HIS H H -3.641 -7.112 -22.025 1.00 . A A . 15 HIS H 1 1 18 7000 1 1 15 HIS HA H -1.377 -6.023 -23.547 1.00 . A A . 15 HIS HA 1 1 18 7001 1 1 15 HIS HB2 H -3.647 -6.342 -24.648 1.00 . A A . 15 HIS HB2 1 1 18 7002 1 1 15 HIS HB3 H -4.230 -5.041 -23.613 1.00 . A A . 15 HIS HB3 1 1 18 7003 1 1 15 HIS HD1 H -1.159 -3.712 -24.128 1.00 . A A . 15 HIS HD1 1 1 18 7004 1 1 15 HIS HD2 H -4.265 -4.475 -26.780 1.00 . A A . 15 HIS HD2 1 1 18 7005 1 1 15 HIS HE1 H -0.769 -2.175 -26.081 1.00 . A A . 15 HIS HE1 1 1 18 7006 1 1 15 HIS N N -2.717 -7.029 -22.342 1.00 . A A . 15 HIS N 1 1 18 7007 1 1 15 HIS ND1 N -1.746 -3.679 -24.912 1.00 . A A . 15 HIS ND1 1 1 18 7008 1 1 15 HIS NE2 N -2.549 -3.108 -26.815 1.00 . A A . 15 HIS NE2 1 1 18 7009 1 1 15 HIS O O -0.997 -4.208 -21.859 1.00 . A A . 15 HIS O 1 1 18 7010 1 1 16 MET C C -4.219 -3.237 -19.476 1.00 . A A . 16 MET C 1 1 18 7011 1 1 16 MET CA C -3.169 -3.069 -20.570 1.00 . A A . 16 MET CA 1 1 18 7012 1 1 16 MET CB C -3.383 -1.740 -21.298 1.00 . A A . 16 MET CB 1 1 18 7013 1 1 16 MET CE C -0.067 0.260 -20.360 1.00 . A A . 16 MET CE 1 1 18 7014 1 1 16 MET CG C -2.089 -1.062 -21.718 1.00 . A A . 16 MET CG 1 1 18 7015 1 1 16 MET H H -4.087 -4.579 -21.735 1.00 . A A . 16 MET H 1 1 18 7016 1 1 16 MET HA H -2.190 -3.066 -20.115 1.00 . A A . 16 MET HA 1 1 18 7017 1 1 16 MET HB2 H -3.974 -1.920 -22.184 1.00 . A A . 16 MET HB2 1 1 18 7018 1 1 16 MET HB3 H -3.921 -1.068 -20.646 1.00 . A A . 16 MET HB3 1 1 18 7019 1 1 16 MET HE1 H 0.011 0.178 -19.286 1.00 . A A . 16 MET HE1 1 1 18 7020 1 1 16 MET HE2 H 0.320 -0.638 -20.819 1.00 . A A . 16 MET HE2 1 1 18 7021 1 1 16 MET HE3 H 0.504 1.112 -20.699 1.00 . A A . 16 MET HE3 1 1 18 7022 1 1 16 MET HG2 H -1.267 -1.738 -21.535 1.00 . A A . 16 MET HG2 1 1 18 7023 1 1 16 MET HG3 H -2.142 -0.841 -22.774 1.00 . A A . 16 MET HG3 1 1 18 7024 1 1 16 MET N N -3.220 -4.178 -21.515 1.00 . A A . 16 MET N 1 1 18 7025 1 1 16 MET O O -5.383 -2.886 -19.661 1.00 . A A . 16 MET O 1 1 18 7026 1 1 16 MET SD S -1.785 0.471 -20.820 1.00 . A A . 16 MET SD 1 1 18 7027 1 1 17 ASN C C -3.940 -4.003 -15.894 1.00 . A A . 17 ASN C 1 1 18 7028 1 1 17 ASN CA C -4.704 -3.994 -17.214 1.00 . A A . 17 ASN CA 1 1 18 7029 1 1 17 ASN CB C -5.461 -5.312 -17.388 1.00 . A A . 17 ASN CB 1 1 18 7030 1 1 17 ASN CG C -6.138 -5.416 -18.741 1.00 . A A . 17 ASN CG 1 1 18 7031 1 1 17 ASN H H -2.858 -4.038 -18.249 1.00 . A A . 17 ASN H 1 1 18 7032 1 1 17 ASN HA H -5.414 -3.181 -17.200 1.00 . A A . 17 ASN HA 1 1 18 7033 1 1 17 ASN HB2 H -4.766 -6.134 -17.291 1.00 . A A . 17 ASN HB2 1 1 18 7034 1 1 17 ASN HB3 H -6.216 -5.391 -16.621 1.00 . A A . 17 ASN HB3 1 1 18 7035 1 1 17 ASN HD21 H -7.747 -4.486 -18.034 1.00 . A A . 17 ASN HD21 1 1 18 7036 1 1 17 ASN HD22 H -7.819 -4.953 -19.696 1.00 . A A . 17 ASN HD22 1 1 18 7037 1 1 17 ASN N N -3.799 -3.778 -18.337 1.00 . A A . 17 ASN N 1 1 18 7038 1 1 17 ASN ND2 N -7.357 -4.899 -18.833 1.00 . A A . 17 ASN ND2 1 1 18 7039 1 1 17 ASN O O -2.764 -3.646 -15.843 1.00 . A A . 17 ASN O 1 1 18 7040 1 1 17 ASN OD1 O -5.570 -5.954 -19.692 1.00 . A A . 17 ASN OD1 1 1 18 7041 1 1 18 DAL C C -4.901 -3.805 -12.492 1.00 . A A . 18 DAL C 1 1 18 7042 1 1 18 DAL CA C -3.997 -4.473 -13.496 1.00 . A A . 18 DAL CA 1 1 18 7043 1 1 18 DAL CB C -3.783 -5.935 -13.097 1.00 . A A . 18 DAL CB 1 1 18 7044 1 1 18 DAL H H -5.553 -4.688 -14.931 1.00 . A A . 18 DAL H 1 1 18 7045 1 1 18 DAL HA H -3.037 -3.958 -13.520 1.00 . A A . 18 DAL HA 1 1 18 7046 1 1 18 DAL HB1 H -2.731 -6.194 -13.215 1.00 . A A . 18 DAL HB1 1 1 18 7047 1 1 18 DAL HB2 H -4.077 -6.074 -12.057 1.00 . A A . 18 DAL HB2 1 1 18 7048 1 1 18 DAL N N -4.617 -4.416 -14.827 1.00 . A A . 18 DAL N 1 1 18 7049 1 1 18 DAL O O -4.602 -2.717 -11.999 1.00 . A A . 18 DAL O 1 1 18 7050 1 1 19 PHE C C -6.771 -4.535 -9.844 1.00 . A A . 19 PHE C 1 1 18 7051 1 1 19 PHE CA C -6.976 -3.919 -11.224 1.00 . A A . 19 PHE CA 1 1 18 7052 1 1 19 PHE CB C -8.406 -4.177 -11.703 1.00 . A A . 19 PHE CB 1 1 18 7053 1 1 19 PHE CD1 C -8.479 -6.437 -12.790 1.00 . A A . 19 PHE CD1 1 1 18 7054 1 1 19 PHE CD2 C -9.446 -6.190 -10.625 1.00 . A A . 19 PHE CD2 1 1 18 7055 1 1 19 PHE CE1 C -8.825 -7.776 -12.796 1.00 . A A . 19 PHE CE1 1 1 18 7056 1 1 19 PHE CE2 C -9.794 -7.528 -10.625 1.00 . A A . 19 PHE CE2 1 1 18 7057 1 1 19 PHE CG C -8.784 -5.631 -11.706 1.00 . A A . 19 PHE CG 1 1 18 7058 1 1 19 PHE CZ C -9.484 -8.321 -11.712 1.00 . A A . 19 PHE CZ 1 1 18 7059 1 1 19 PHE H H -6.200 -5.321 -12.608 1.00 . A A . 19 PHE H 1 1 18 7060 1 1 19 PHE HA H -6.814 -2.854 -11.158 1.00 . A A . 19 PHE HA 1 1 18 7061 1 1 19 PHE HB2 H -9.095 -3.657 -11.055 1.00 . A A . 19 PHE HB2 1 1 18 7062 1 1 19 PHE HB3 H -8.514 -3.803 -12.710 1.00 . A A . 19 PHE HB3 1 1 18 7063 1 1 19 PHE HD1 H -7.963 -6.011 -13.640 1.00 . A A . 19 PHE HD1 1 1 18 7064 1 1 19 PHE HD2 H -9.689 -5.571 -9.774 1.00 . A A . 19 PHE HD2 1 1 18 7065 1 1 19 PHE HE1 H -8.581 -8.393 -13.648 1.00 . A A . 19 PHE HE1 1 1 18 7066 1 1 19 PHE HE2 H -10.309 -7.952 -9.776 1.00 . A A . 19 PHE HE2 1 1 18 7067 1 1 19 PHE HZ H -9.755 -9.366 -11.714 1.00 . A A . 19 PHE HZ 1 1 18 7068 1 1 19 PHE N N -6.017 -4.457 -12.182 1.00 . A A . 19 PHE N 1 1 18 7069 1 1 19 PHE O O -6.936 -3.866 -8.824 1.00 . A A . 19 PHE O 1 1 18 7070 1 1 20 GLN C C -5.782 -7.970 -8.822 1.00 . A A . 20 GLN C 1 1 18 7071 1 1 20 GLN CA C -6.185 -6.522 -8.566 1.00 . A A . 20 GLN CA 1 1 18 7072 1 1 20 GLN CB C -7.443 -6.476 -7.697 1.00 . A A . 20 GLN CB 1 1 18 7073 1 1 20 GLN CD C -8.345 -5.471 -5.561 1.00 . A A . 20 GLN CD 1 1 18 7074 1 1 20 GLN CG C -7.165 -6.137 -6.241 1.00 . A A . 20 GLN CG 1 1 18 7075 1 1 20 GLN H H -6.296 -6.294 -10.667 1.00 . A A . 20 GLN H 1 1 18 7076 1 1 20 GLN HA H -5.381 -6.024 -8.046 1.00 . A A . 20 GLN HA 1 1 18 7077 1 1 20 GLN HB2 H -8.115 -5.732 -8.096 1.00 . A A . 20 GLN HB2 1 1 18 7078 1 1 20 GLN HB3 H -7.926 -7.442 -7.732 1.00 . A A . 20 GLN HB3 1 1 18 7079 1 1 20 GLN HE21 H -7.256 -3.844 -5.212 1.00 . A A . 20 GLN HE21 1 1 18 7080 1 1 20 GLN HE22 H -8.889 -3.791 -4.650 1.00 . A A . 20 GLN HE22 1 1 18 7081 1 1 20 GLN HG2 H -6.931 -7.048 -5.711 1.00 . A A . 20 GLN HG2 1 1 18 7082 1 1 20 GLN HG3 H -6.318 -5.469 -6.197 1.00 . A A . 20 GLN HG3 1 1 18 7083 1 1 20 GLN N N -6.411 -5.815 -9.821 1.00 . A A . 20 GLN N 1 1 18 7084 1 1 20 GLN NE2 N -8.143 -4.245 -5.093 1.00 . A A . 20 GLN NE2 1 1 18 7085 1 1 20 GLN O O -6.277 -8.608 -9.751 1.00 . A A . 20 GLN O 1 1 18 7086 1 1 20 GLN OE1 O -9.425 -6.052 -5.458 1.00 . A A . 20 GLN OE1 1 1 18 7087 1 1 21 PHE C C -5.116 -10.776 -7.141 1.00 . A A . 21 PHE C 1 1 18 7088 1 1 21 PHE CA C -4.408 -9.856 -8.131 1.00 . A A . 21 PHE CA 1 1 18 7089 1 1 21 PHE CB C -2.894 -9.923 -7.914 1.00 . A A . 21 PHE CB 1 1 18 7090 1 1 21 PHE CD1 C -2.049 -7.571 -8.144 1.00 . A A . 21 PHE CD1 1 1 18 7091 1 1 21 PHE CD2 C -1.509 -9.142 -9.855 1.00 . A A . 21 PHE CD2 1 1 18 7092 1 1 21 PHE CE1 C -1.351 -6.589 -8.820 1.00 . A A . 21 PHE CE1 1 1 18 7093 1 1 21 PHE CE2 C -0.810 -8.163 -10.536 1.00 . A A . 21 PHE CE2 1 1 18 7094 1 1 21 PHE CG C -2.136 -8.857 -8.652 1.00 . A A . 21 PHE CG 1 1 18 7095 1 1 21 PHE CZ C -0.732 -6.885 -10.019 1.00 . A A . 21 PHE CZ 1 1 18 7096 1 1 21 PHE H H -4.520 -7.925 -7.271 1.00 . A A . 21 PHE H 1 1 18 7097 1 1 21 PHE HA H -4.634 -10.184 -9.134 1.00 . A A . 21 PHE HA 1 1 18 7098 1 1 21 PHE HB2 H -2.683 -9.810 -6.861 1.00 . A A . 21 PHE HB2 1 1 18 7099 1 1 21 PHE HB3 H -2.532 -10.883 -8.249 1.00 . A A . 21 PHE HB3 1 1 18 7100 1 1 21 PHE HD1 H -2.534 -7.339 -7.206 1.00 . A A . 21 PHE HD1 1 1 18 7101 1 1 21 PHE HD2 H -1.570 -10.140 -10.262 1.00 . A A . 21 PHE HD2 1 1 18 7102 1 1 21 PHE HE1 H -1.293 -5.590 -8.413 1.00 . A A . 21 PHE HE1 1 1 18 7103 1 1 21 PHE HE2 H -0.327 -8.397 -11.473 1.00 . A A . 21 PHE HE2 1 1 18 7104 1 1 21 PHE HZ H -0.186 -6.119 -10.548 1.00 . A A . 21 PHE HZ 1 1 18 7105 1 1 21 PHE N N -4.879 -8.483 -7.993 1.00 . A A . 21 PHE N 1 1 18 7106 1 1 21 PHE O O -5.097 -10.538 -5.933 1.00 . A A . 21 PHE O 1 1 18 7107 1 1 22 VAL C C -5.495 -13.797 -6.206 1.00 . A A . 22 VAL C 1 1 18 7108 1 1 22 VAL CA C -6.454 -12.785 -6.824 1.00 . A A . 22 VAL CA 1 1 18 7109 1 1 22 VAL CB C -7.531 -13.538 -7.626 1.00 . A A . 22 VAL CB 1 1 18 7110 1 1 22 VAL CG1 C -8.391 -14.386 -6.701 1.00 . A A . 22 VAL CG1 1 1 18 7111 1 1 22 VAL CG2 C -8.387 -12.560 -8.416 1.00 . A A . 22 VAL CG2 1 1 18 7112 1 1 22 VAL H H -5.719 -11.965 -8.631 1.00 . A A . 22 VAL H 1 1 18 7113 1 1 22 VAL HA H -6.942 -12.236 -6.032 1.00 . A A . 22 VAL HA 1 1 18 7114 1 1 22 VAL HB H -7.036 -14.197 -8.325 1.00 . A A . 22 VAL HB 1 1 18 7115 1 1 22 VAL HG11 H -8.119 -14.187 -5.675 1.00 . A A . 22 VAL HG11 1 1 18 7116 1 1 22 VAL HG12 H -9.432 -14.141 -6.852 1.00 . A A . 22 VAL HG12 1 1 18 7117 1 1 22 VAL HG13 H -8.232 -15.431 -6.920 1.00 . A A . 22 VAL HG13 1 1 18 7118 1 1 22 VAL HG21 H -8.869 -11.874 -7.736 1.00 . A A . 22 VAL HG21 1 1 18 7119 1 1 22 VAL HG22 H -7.763 -12.007 -9.103 1.00 . A A . 22 VAL HG22 1 1 18 7120 1 1 22 VAL HG23 H -9.137 -13.104 -8.971 1.00 . A A . 22 VAL HG23 1 1 18 7121 1 1 22 VAL N N -5.740 -11.828 -7.661 1.00 . A A . 22 VAL N 1 1 18 7122 1 1 22 VAL O O -5.401 -13.914 -4.984 1.00 . A A . 22 VAL O 1 1 18 7123 1 1 23 PHE C C -2.441 -15.261 -7.162 1.00 . A A . 23 PHE C 1 1 18 7124 1 1 23 PHE CA C -3.833 -15.531 -6.597 1.00 . A A . 23 PHE CA 1 1 18 7125 1 1 23 PHE CB C -4.297 -16.931 -7.004 1.00 . A A . 23 PHE CB 1 1 18 7126 1 1 23 PHE CD1 C -6.137 -17.013 -5.299 1.00 . A A . 23 PHE CD1 1 1 18 7127 1 1 23 PHE CD2 C -6.616 -17.742 -7.519 1.00 . A A . 23 PHE CD2 1 1 18 7128 1 1 23 PHE CE1 C -7.437 -17.291 -4.923 1.00 . A A . 23 PHE CE1 1 1 18 7129 1 1 23 PHE CE2 C -7.918 -18.021 -7.148 1.00 . A A . 23 PHE CE2 1 1 18 7130 1 1 23 PHE CG C -5.712 -17.234 -6.599 1.00 . A A . 23 PHE CG 1 1 18 7131 1 1 23 PHE CZ C -8.329 -17.797 -5.849 1.00 . A A . 23 PHE CZ 1 1 18 7132 1 1 23 PHE H H -4.903 -14.388 -8.022 1.00 . A A . 23 PHE H 1 1 18 7133 1 1 23 PHE HA H -3.789 -15.475 -5.521 1.00 . A A . 23 PHE HA 1 1 18 7134 1 1 23 PHE HB2 H -4.233 -17.026 -8.078 1.00 . A A . 23 PHE HB2 1 1 18 7135 1 1 23 PHE HB3 H -3.654 -17.664 -6.543 1.00 . A A . 23 PHE HB3 1 1 18 7136 1 1 23 PHE HD1 H -5.439 -16.617 -4.574 1.00 . A A . 23 PHE HD1 1 1 18 7137 1 1 23 PHE HD2 H -6.296 -17.919 -8.535 1.00 . A A . 23 PHE HD2 1 1 18 7138 1 1 23 PHE HE1 H -7.755 -17.114 -3.906 1.00 . A A . 23 PHE HE1 1 1 18 7139 1 1 23 PHE HE2 H -8.613 -18.417 -7.874 1.00 . A A . 23 PHE HE2 1 1 18 7140 1 1 23 PHE HZ H -9.345 -18.014 -5.557 1.00 . A A . 23 PHE HZ 1 1 18 7141 1 1 23 PHE N N -4.784 -14.528 -7.059 1.00 . A A . 23 PHE N 1 1 18 7142 1 1 23 PHE O O -1.616 -16.167 -7.266 1.00 . A A . 23 PHE O 1 1 18 7143 1 1 24 DBU C C -0.983 -12.936 -9.360 1.00 . A A . 24 DBU C 1 1 18 7144 1 1 24 DBU CA C -0.981 -13.642 -8.044 1.00 . A A . 24 DBU CA 1 1 18 7145 1 1 24 DBU CB C 0.229 -13.850 -7.494 1.00 . A A . 24 DBU CB 1 1 18 7146 1 1 24 DBU CG C 0.502 -14.530 -6.189 1.00 . A A . 24 DBU CG 1 1 18 7147 1 1 24 DBU HG1 H -0.370 -14.577 -5.532 1.00 . A A . 24 DBU HG1 1 1 18 7148 1 1 24 DBU HG2 H 1.297 -13.998 -5.656 1.00 . A A . 24 DBU HG2 1 1 18 7149 1 1 24 DBU HG3 H 0.840 -15.555 -6.371 1.00 . A A . 24 DBU HG3 1 1 18 7150 1 1 24 DBU N N -2.189 -14.008 -7.525 1.00 . A A . 24 DBU N 1 1 18 7151 1 1 24 DBU O O -0.322 -11.911 -9.527 1.00 . A A . 24 DBU O 1 1 18 7152 1 1 25 CYS C C -2.846 -11.761 -11.673 1.00 . A A . 25 CYS C 1 1 18 7153 1 1 25 CYS CA C -1.817 -12.888 -11.646 1.00 . A A . 25 CYS CA 1 1 18 7154 1 1 25 CYS CB C -2.187 -13.955 -12.677 1.00 . A A . 25 CYS CB 1 1 18 7155 1 1 25 CYS H H -2.234 -14.297 -10.122 1.00 . A A . 25 CYS H 1 1 18 7156 1 1 25 CYS HA H -0.849 -12.480 -11.893 1.00 . A A . 25 CYS HA 1 1 18 7157 1 1 25 CYS HB2 H -3.082 -14.465 -12.352 1.00 . A A . 25 CYS HB2 1 1 18 7158 1 1 25 CYS HB3 H -2.377 -13.477 -13.627 1.00 . A A . 25 CYS HB3 1 1 18 7159 1 1 25 CYS N N -1.729 -13.478 -10.316 1.00 . A A . 25 CYS N 1 1 18 7160 1 1 25 CYS O O -3.411 -11.396 -10.642 1.00 . A A . 25 CYS O 1 1 18 7161 1 1 25 CYS SG S -0.897 -15.215 -12.938 1.00 . A A . 25 CYS SG 1 1 18 7162 1 1 26 CYS C C -5.280 -10.605 -13.781 1.00 . A A . 26 CYS C 1 1 18 7163 1 1 26 CYS CA C -4.044 -10.128 -13.024 1.00 . A A . 26 CYS CA 1 1 18 7164 1 1 26 CYS CB C -3.398 -8.956 -13.766 1.00 . A A . 26 CYS CB 1 1 18 7165 1 1 26 CYS H H -2.602 -11.547 -13.647 1.00 . A A . 26 CYS H 1 1 18 7166 1 1 26 CYS HA H -4.344 -9.799 -12.041 1.00 . A A . 26 CYS HA 1 1 18 7167 1 1 26 CYS HB2 H -2.512 -8.645 -13.231 1.00 . A A . 26 CYS HB2 1 1 18 7168 1 1 26 CYS HB3 H -3.118 -9.278 -14.758 1.00 . A A . 26 CYS HB3 1 1 18 7169 1 1 26 CYS N N -3.084 -11.213 -12.860 1.00 . A A . 26 CYS N 1 1 18 7170 1 1 26 CYS O O -5.366 -10.464 -15.001 1.00 . A A . 26 CYS O 1 1 18 7171 1 1 26 CYS SG S -4.478 -7.499 -13.938 1.00 . A A . 26 CYS SG 1 1 18 7172 1 1 27 SER C C -8.594 -11.708 -12.626 1.00 . A A . 27 SER C 1 1 18 7173 1 1 27 SER CA C -7.464 -11.670 -13.651 1.00 . A A . 27 SER CA 1 1 18 7174 1 1 27 SER CB C -7.241 -13.068 -14.232 1.00 . A A . 27 SER CB 1 1 18 7175 1 1 27 SER H H -6.107 -11.253 -12.080 1.00 . A A . 27 SER H 1 1 18 7176 1 1 27 SER HA H -7.740 -10.998 -14.449 1.00 . A A . 27 SER HA 1 1 18 7177 1 1 27 SER HB2 H -8.178 -13.456 -14.601 1.00 . A A . 27 SER HB2 1 1 18 7178 1 1 27 SER HB3 H -6.531 -13.007 -15.044 1.00 . A A . 27 SER HB3 1 1 18 7179 1 1 27 SER HG H -7.158 -14.811 -13.342 1.00 . A A . 27 SER HG 1 1 18 7180 1 1 27 SER N N -6.234 -11.169 -13.049 1.00 . A A . 27 SER N 1 1 18 7181 1 1 27 SER O O -8.448 -12.280 -11.547 1.00 . A A . 27 SER O 1 1 18 7182 1 1 27 SER OG O -6.735 -13.954 -13.248 1.00 . A A . 27 SER OG 1 1 19 7183 1 1 1 LYS C C 5.444 0.792 -4.044 1.00 . A A . 1 LYS C 1 1 19 7184 1 1 1 LYS CA C 5.148 0.463 -2.584 1.00 . A A . 1 LYS CA 1 1 19 7185 1 1 1 LYS CB C 5.400 1.695 -1.712 1.00 . A A . 1 LYS CB 1 1 19 7186 1 1 1 LYS CD C 4.917 2.894 0.442 1.00 . A A . 1 LYS CD 1 1 19 7187 1 1 1 LYS CE C 4.413 2.659 1.857 1.00 . A A . 1 LYS CE 1 1 19 7188 1 1 1 LYS CG C 4.498 1.771 -0.492 1.00 . A A . 1 LYS CG 1 1 19 7189 1 1 1 LYS H1 H 6.424 -1.214 -2.790 1.00 . A A . 1 LYS H1 1 1 19 7190 1 1 1 LYS HA H 4.112 0.175 -2.495 1.00 . A A . 1 LYS HA 1 1 19 7191 1 1 1 LYS HB2 H 6.426 1.679 -1.374 1.00 . A A . 1 LYS HB2 1 1 19 7192 1 1 1 LYS HB3 H 5.240 2.582 -2.308 1.00 . A A . 1 LYS HB3 1 1 19 7193 1 1 1 LYS HD2 H 5.995 2.952 0.461 1.00 . A A . 1 LYS HD2 1 1 19 7194 1 1 1 LYS HD3 H 4.511 3.826 0.075 1.00 . A A . 1 LYS HD3 1 1 19 7195 1 1 1 LYS HE2 H 3.965 1.679 1.908 1.00 . A A . 1 LYS HE2 1 1 19 7196 1 1 1 LYS HE3 H 5.251 2.706 2.536 1.00 . A A . 1 LYS HE3 1 1 19 7197 1 1 1 LYS HG2 H 3.483 1.947 -0.817 1.00 . A A . 1 LYS HG2 1 1 19 7198 1 1 1 LYS HG3 H 4.550 0.833 0.042 1.00 . A A . 1 LYS HG3 1 1 19 7199 1 1 1 LYS HZ1 H 2.472 3.431 1.869 1.00 . A A . 1 LYS HZ1 1 1 19 7200 1 1 1 LYS HZ2 H 3.679 4.614 1.910 1.00 . A A . 1 LYS HZ2 1 1 19 7201 1 1 1 LYS HZ3 H 3.330 3.714 3.299 1.00 . A A . 1 LYS HZ3 1 1 19 7202 1 1 1 LYS N N 5.965 -0.655 -2.127 1.00 . A A . 1 LYS N 1 1 19 7203 1 1 1 LYS NZ N 3.403 3.676 2.263 1.00 . A A . 1 LYS NZ 1 1 19 7204 1 1 1 LYS O O 6.223 1.697 -4.342 1.00 . A A . 1 LYS O 1 1 19 7205 1 1 2 LYS C C 3.676 0.539 -7.074 1.00 . A A . 2 LYS C 1 1 19 7206 1 1 2 LYS CA C 5.007 0.266 -6.380 1.00 . A A . 2 LYS CA 1 1 19 7207 1 1 2 LYS CB C 5.683 -0.952 -7.013 1.00 . A A . 2 LYS CB 1 1 19 7208 1 1 2 LYS CD C 7.495 -2.614 -6.497 1.00 . A A . 2 LYS CD 1 1 19 7209 1 1 2 LYS CE C 8.988 -2.825 -6.694 1.00 . A A . 2 LYS CE 1 1 19 7210 1 1 2 LYS CG C 7.126 -1.142 -6.577 1.00 . A A . 2 LYS CG 1 1 19 7211 1 1 2 LYS H H 4.205 -0.656 -4.652 1.00 . A A . 2 LYS H 1 1 19 7212 1 1 2 LYS HA H 5.647 1.127 -6.504 1.00 . A A . 2 LYS HA 1 1 19 7213 1 1 2 LYS HB2 H 5.128 -1.838 -6.743 1.00 . A A . 2 LYS HB2 1 1 19 7214 1 1 2 LYS HB3 H 5.666 -0.841 -8.088 1.00 . A A . 2 LYS HB3 1 1 19 7215 1 1 2 LYS HD2 H 7.215 -2.994 -5.525 1.00 . A A . 2 LYS HD2 1 1 19 7216 1 1 2 LYS HD3 H 6.959 -3.153 -7.265 1.00 . A A . 2 LYS HD3 1 1 19 7217 1 1 2 LYS HE2 H 9.189 -2.915 -7.751 1.00 . A A . 2 LYS HE2 1 1 19 7218 1 1 2 LYS HE3 H 9.515 -1.969 -6.299 1.00 . A A . 2 LYS HE3 1 1 19 7219 1 1 2 LYS HG2 H 7.775 -0.658 -7.292 1.00 . A A . 2 LYS HG2 1 1 19 7220 1 1 2 LYS HG3 H 7.260 -0.692 -5.604 1.00 . A A . 2 LYS HG3 1 1 19 7221 1 1 2 LYS HZ1 H 10.175 -4.541 -6.593 1.00 . A A . 2 LYS HZ1 1 1 19 7222 1 1 2 LYS HZ2 H 8.676 -4.699 -5.826 1.00 . A A . 2 LYS HZ2 1 1 19 7223 1 1 2 LYS HZ3 H 9.909 -3.803 -5.094 1.00 . A A . 2 LYS HZ3 1 1 19 7224 1 1 2 LYS N N 4.815 0.052 -4.951 1.00 . A A . 2 LYS N 1 1 19 7225 1 1 2 LYS NZ N 9.471 -4.053 -6.003 1.00 . A A . 2 LYS NZ 1 1 19 7226 1 1 2 LYS O O 2.616 0.154 -6.579 1.00 . A A . 2 LYS O 1 1 19 7227 1 1 3 LYS C C 1.692 0.280 -9.221 1.00 . A A . 3 LYS C 1 1 19 7228 1 1 3 LYS CA C 2.538 1.526 -8.986 1.00 . A A . 3 LYS CA 1 1 19 7229 1 1 3 LYS CB C 2.917 2.159 -10.327 1.00 . A A . 3 LYS CB 1 1 19 7230 1 1 3 LYS CD C 1.387 4.150 -10.394 1.00 . A A . 3 LYS CD 1 1 19 7231 1 1 3 LYS CE C 1.283 5.650 -10.165 1.00 . A A . 3 LYS CE 1 1 19 7232 1 1 3 LYS CG C 2.829 3.675 -10.331 1.00 . A A . 3 LYS CG 1 1 19 7233 1 1 3 LYS H H 4.613 1.484 -8.566 1.00 . A A . 3 LYS H 1 1 19 7234 1 1 3 LYS HA H 1.961 2.236 -8.413 1.00 . A A . 3 LYS HA 1 1 19 7235 1 1 3 LYS HB2 H 3.931 1.878 -10.570 1.00 . A A . 3 LYS HB2 1 1 19 7236 1 1 3 LYS HB3 H 2.254 1.779 -11.091 1.00 . A A . 3 LYS HB3 1 1 19 7237 1 1 3 LYS HD2 H 0.982 3.917 -11.368 1.00 . A A . 3 LYS HD2 1 1 19 7238 1 1 3 LYS HD3 H 0.815 3.638 -9.633 1.00 . A A . 3 LYS HD3 1 1 19 7239 1 1 3 LYS HE2 H 0.305 5.873 -9.767 1.00 . A A . 3 LYS HE2 1 1 19 7240 1 1 3 LYS HE3 H 2.038 5.945 -9.451 1.00 . A A . 3 LYS HE3 1 1 19 7241 1 1 3 LYS HG2 H 3.282 4.056 -9.427 1.00 . A A . 3 LYS HG2 1 1 19 7242 1 1 3 LYS HG3 H 3.362 4.056 -11.191 1.00 . A A . 3 LYS HG3 1 1 19 7243 1 1 3 LYS HZ1 H 0.762 7.166 -11.504 1.00 . A A . 3 LYS HZ1 1 1 19 7244 1 1 3 LYS HZ2 H 1.397 5.786 -12.246 1.00 . A A . 3 LYS HZ2 1 1 19 7245 1 1 3 LYS HZ3 H 2.423 6.856 -11.433 1.00 . A A . 3 LYS HZ3 1 1 19 7246 1 1 3 LYS N N 3.738 1.204 -8.222 1.00 . A A . 3 LYS N 1 1 19 7247 1 1 3 LYS NZ N 1.480 6.418 -11.425 1.00 . A A . 3 LYS NZ 1 1 19 7248 1 1 3 LYS O O 0.488 0.277 -8.962 1.00 . A A . 3 LYS O 1 1 19 7249 1 1 4 SER C C 1.694 -2.960 -8.775 1.00 . A A . 4 SER C 1 1 19 7250 1 1 4 SER CA C 1.633 -2.031 -9.984 1.00 . A A . 4 SER CA 1 1 19 7251 1 1 4 SER CB C 2.243 -2.723 -11.205 1.00 . A A . 4 SER CB 1 1 19 7252 1 1 4 SER H H 3.289 -0.714 -9.898 1.00 . A A . 4 SER H 1 1 19 7253 1 1 4 SER HA H 0.600 -1.798 -10.193 1.00 . A A . 4 SER HA 1 1 19 7254 1 1 4 SER HB2 H 3.183 -3.175 -10.927 1.00 . A A . 4 SER HB2 1 1 19 7255 1 1 4 SER HB3 H 1.566 -3.488 -11.557 1.00 . A A . 4 SER HB3 1 1 19 7256 1 1 4 SER HG H 2.956 -1.042 -11.913 1.00 . A A . 4 SER HG 1 1 19 7257 1 1 4 SER N N 2.329 -0.779 -9.712 1.00 . A A . 4 SER N 1 1 19 7258 1 1 4 SER O O 0.670 -3.285 -8.176 1.00 . A A . 4 SER O 1 1 19 7259 1 1 4 SER OG O 2.473 -1.798 -12.254 1.00 . A A . 4 SER OG 1 1 19 7260 1 1 5 GLY C C 4.117 -5.345 -7.545 1.00 . A A . 5 GLY C 1 1 19 7261 1 1 5 GLY CA C 3.077 -4.272 -7.288 1.00 . A A . 5 GLY CA 1 1 19 7262 1 1 5 GLY H H 3.685 -3.093 -8.939 1.00 . A A . 5 GLY H 1 1 19 7263 1 1 5 GLY HA2 H 3.380 -3.689 -6.432 1.00 . A A . 5 GLY HA2 1 1 19 7264 1 1 5 GLY HA3 H 2.132 -4.748 -7.071 1.00 . A A . 5 GLY HA3 1 1 19 7265 1 1 5 GLY N N 2.904 -3.385 -8.423 1.00 . A A . 5 GLY N 1 1 19 7266 1 1 5 GLY O O 5.099 -5.456 -6.810 1.00 . A A . 5 GLY O 1 1 19 7267 1 1 6 VAL C C 5.287 -7.084 -10.389 1.00 . A A . 6 VAL C 1 1 19 7268 1 1 6 VAL CA C 4.828 -7.208 -8.940 1.00 . A A . 6 VAL CA 1 1 19 7269 1 1 6 VAL CB C 4.189 -8.594 -8.733 1.00 . A A . 6 VAL CB 1 1 19 7270 1 1 6 VAL CG1 C 5.125 -9.692 -9.216 1.00 . A A . 6 VAL CG1 1 1 19 7271 1 1 6 VAL CG2 C 3.825 -8.799 -7.270 1.00 . A A . 6 VAL CG2 1 1 19 7272 1 1 6 VAL H H 3.101 -6.000 -9.137 1.00 . A A . 6 VAL H 1 1 19 7273 1 1 6 VAL HA H 5.689 -7.131 -8.292 1.00 . A A . 6 VAL HA 1 1 19 7274 1 1 6 VAL HB H 3.282 -8.642 -9.318 1.00 . A A . 6 VAL HB 1 1 19 7275 1 1 6 VAL HG11 H 4.977 -9.850 -10.274 1.00 . A A . 6 VAL HG11 1 1 19 7276 1 1 6 VAL HG12 H 6.148 -9.398 -9.035 1.00 . A A . 6 VAL HG12 1 1 19 7277 1 1 6 VAL HG13 H 4.912 -10.606 -8.682 1.00 . A A . 6 VAL HG13 1 1 19 7278 1 1 6 VAL HG21 H 3.241 -7.959 -6.924 1.00 . A A . 6 VAL HG21 1 1 19 7279 1 1 6 VAL HG22 H 3.247 -9.706 -7.166 1.00 . A A . 6 VAL HG22 1 1 19 7280 1 1 6 VAL HG23 H 4.727 -8.877 -6.681 1.00 . A A . 6 VAL HG23 1 1 19 7281 1 1 6 VAL N N 3.902 -6.138 -8.589 1.00 . A A . 6 VAL N 1 1 19 7282 1 1 6 VAL O O 6.350 -6.529 -10.668 1.00 . A A . 6 VAL O 1 1 19 7283 1 1 7 ILE C C 3.545 -7.353 -13.569 1.00 . A A . 7 ILE C 1 1 19 7284 1 1 7 ILE CA C 4.801 -7.550 -12.727 1.00 . A A . 7 ILE CA 1 1 19 7285 1 1 7 ILE CB C 5.521 -8.831 -13.190 1.00 . A A . 7 ILE CB 1 1 19 7286 1 1 7 ILE CD1 C 7.434 -10.407 -12.614 1.00 . A A . 7 ILE CD1 1 1 19 7287 1 1 7 ILE CG1 C 6.768 -9.077 -12.338 1.00 . A A . 7 ILE CG1 1 1 19 7288 1 1 7 ILE CG2 C 5.890 -8.728 -14.662 1.00 . A A . 7 ILE CG2 1 1 19 7289 1 1 7 ILE H H 3.645 -8.034 -11.021 1.00 . A A . 7 ILE H 1 1 19 7290 1 1 7 ILE HA H 5.464 -6.711 -12.886 1.00 . A A . 7 ILE HA 1 1 19 7291 1 1 7 ILE HB H 4.842 -9.661 -13.071 1.00 . A A . 7 ILE HB 1 1 19 7292 1 1 7 ILE HD11 H 6.735 -11.207 -12.423 1.00 . A A . 7 ILE HD11 1 1 19 7293 1 1 7 ILE HD12 H 7.753 -10.444 -13.645 1.00 . A A . 7 ILE HD12 1 1 19 7294 1 1 7 ILE HD13 H 8.293 -10.520 -11.968 1.00 . A A . 7 ILE HD13 1 1 19 7295 1 1 7 ILE HG12 H 7.489 -8.299 -12.533 1.00 . A A . 7 ILE HG12 1 1 19 7296 1 1 7 ILE HG13 H 6.492 -9.054 -11.294 1.00 . A A . 7 ILE HG13 1 1 19 7297 1 1 7 ILE HG21 H 4.993 -8.603 -15.250 1.00 . A A . 7 ILE HG21 1 1 19 7298 1 1 7 ILE HG22 H 6.538 -7.878 -14.812 1.00 . A A . 7 ILE HG22 1 1 19 7299 1 1 7 ILE HG23 H 6.400 -9.628 -14.969 1.00 . A A . 7 ILE HG23 1 1 19 7300 1 1 7 ILE N N 4.479 -7.604 -11.306 1.00 . A A . 7 ILE N 1 1 19 7301 1 1 7 ILE O O 2.735 -8.264 -13.742 1.00 . A A . 7 ILE O 1 1 19 7302 1 1 8 PRO C C 2.258 -6.494 -16.296 1.00 . A A . 8 PRO C 1 1 19 7303 1 1 8 PRO CA C 2.225 -5.792 -14.943 1.00 . A A . 8 PRO CA 1 1 19 7304 1 1 8 PRO CB C 2.357 -4.278 -15.124 1.00 . A A . 8 PRO CB 1 1 19 7305 1 1 8 PRO CD C 4.305 -5.003 -13.944 1.00 . A A . 8 PRO CD 1 1 19 7306 1 1 8 PRO CG C 3.810 -4.001 -14.949 1.00 . A A . 8 PRO CG 1 1 19 7307 1 1 8 PRO HA H 1.293 -6.017 -14.445 1.00 . A A . 8 PRO HA 1 1 19 7308 1 1 8 PRO HB2 H 2.016 -3.999 -16.111 1.00 . A A . 8 PRO HB2 1 1 19 7309 1 1 8 PRO HB3 H 1.766 -3.770 -14.376 1.00 . A A . 8 PRO HB3 1 1 19 7310 1 1 8 PRO HD2 H 5.319 -5.298 -14.172 1.00 . A A . 8 PRO HD2 1 1 19 7311 1 1 8 PRO HD3 H 4.243 -4.598 -12.945 1.00 . A A . 8 PRO HD3 1 1 19 7312 1 1 8 PRO HG2 H 4.324 -4.128 -15.890 1.00 . A A . 8 PRO HG2 1 1 19 7313 1 1 8 PRO HG3 H 3.950 -2.997 -14.576 1.00 . A A . 8 PRO HG3 1 1 19 7314 1 1 8 PRO N N 3.379 -6.137 -14.108 1.00 . A A . 8 PRO N 1 1 19 7315 1 1 8 PRO O O 2.938 -6.049 -17.220 1.00 . A A . 8 PRO O 1 1 19 7316 1 1 9 . C C 2.062 -9.728 -17.434 1.00 . A A . 9 DBB C 1 1 19 7317 1 1 9 . CA C 1.465 -8.363 -17.656 1.00 . A A . 9 DBB CA 1 1 19 7318 1 1 9 . CB C 0.008 -8.510 -18.100 1.00 . A A . 9 DBB CB 1 1 19 7319 1 1 9 . CG C -0.692 -7.151 -18.013 1.00 . A A . 9 DBB CG 1 1 19 7320 1 1 9 . H H 0.999 -7.899 -15.633 1.00 . A A . 9 DBB H 1 1 19 7321 1 1 9 . HA H 2.029 -7.840 -18.428 1.00 . A A . 9 DBB HA 1 1 19 7322 1 1 9 . HB2 H -0.500 -9.222 -17.452 1.00 . A A . 9 DBB HB2 1 1 19 7323 1 1 9 . HG1 H -0.663 -6.793 -16.984 1.00 . A A . 9 DBB HG1 1 1 19 7324 1 1 9 . HG2 H -0.183 -6.439 -18.661 1.00 . A A . 9 DBB HG2 1 1 19 7325 1 1 9 . HG3 H -1.729 -7.257 -18.332 1.00 . A A . 9 DBB HG3 1 1 19 7326 1 1 9 . N N 1.520 -7.594 -16.406 1.00 . A A . 9 DBB N 1 1 19 7327 1 1 9 . O O 3.117 -10.051 -17.979 1.00 . A A . 9 DBB O 1 1 19 7328 1 1 10 VAL C C 0.703 -12.882 -16.317 1.00 . A A . 10 VAL C 1 1 19 7329 1 1 10 VAL CA C 1.858 -11.887 -16.329 1.00 . A A . 10 VAL CA 1 1 19 7330 1 1 10 VAL CB C 2.582 -11.942 -14.970 1.00 . A A . 10 VAL CB 1 1 19 7331 1 1 10 VAL CG1 C 2.928 -13.378 -14.607 1.00 . A A . 10 VAL CG1 1 1 19 7332 1 1 10 VAL CG2 C 3.831 -11.074 -14.998 1.00 . A A . 10 VAL CG2 1 1 19 7333 1 1 10 VAL H H 0.553 -10.224 -16.220 1.00 . A A . 10 VAL H 1 1 19 7334 1 1 10 VAL HA H 2.559 -12.173 -17.099 1.00 . A A . 10 VAL HA 1 1 19 7335 1 1 10 VAL HB H 1.916 -11.553 -14.214 1.00 . A A . 10 VAL HB 1 1 19 7336 1 1 10 VAL HG11 H 2.321 -13.693 -13.771 1.00 . A A . 10 VAL HG11 1 1 19 7337 1 1 10 VAL HG12 H 2.738 -14.020 -15.455 1.00 . A A . 10 VAL HG12 1 1 19 7338 1 1 10 VAL HG13 H 3.972 -13.439 -14.336 1.00 . A A . 10 VAL HG13 1 1 19 7339 1 1 10 VAL HG21 H 4.449 -11.307 -14.143 1.00 . A A . 10 VAL HG21 1 1 19 7340 1 1 10 VAL HG22 H 4.385 -11.268 -15.905 1.00 . A A . 10 VAL HG22 1 1 19 7341 1 1 10 VAL HG23 H 3.548 -10.033 -14.965 1.00 . A A . 10 VAL HG23 1 1 19 7342 1 1 10 VAL N N 1.387 -10.539 -16.626 1.00 . A A . 10 VAL N 1 1 19 7343 1 1 10 VAL O O 0.371 -13.474 -17.343 1.00 . A A . 10 VAL O 1 1 19 7344 1 1 11 DAL C C -0.880 -15.125 -15.983 1.00 . A A . 11 DAL C 1 1 19 7345 1 1 11 DAL CA C -1.034 -13.991 -15.002 1.00 . A A . 11 DAL CA 1 1 19 7346 1 1 11 DAL CB C -1.052 -14.548 -13.577 1.00 . A A . 11 DAL CB 1 1 19 7347 1 1 11 DAL H H 0.405 -12.559 -14.367 1.00 . A A . 11 DAL H 1 1 19 7348 1 1 11 DAL HA H -1.967 -13.464 -15.199 1.00 . A A . 11 DAL HA 1 1 19 7349 1 1 11 DAL HB1 H -0.910 -13.733 -12.867 1.00 . A A . 11 DAL HB1 1 1 19 7350 1 1 11 DAL HB2 H -2.011 -15.030 -13.389 1.00 . A A . 11 DAL HB2 1 1 19 7351 1 1 11 DAL N N 0.094 -13.060 -15.149 1.00 . A A . 11 DAL N 1 1 19 7352 1 1 11 DAL O O 0.202 -15.696 -16.123 1.00 . A A . 11 DAL O 1 1 19 7353 1 1 12 HIS C C -2.148 -15.993 -19.062 1.00 . A A . 12 HIS C 1 1 19 7354 1 1 12 HIS CA C -1.952 -16.538 -17.651 1.00 . A A . 12 HIS CA 1 1 19 7355 1 1 12 HIS CB C -3.041 -17.562 -17.331 1.00 . A A . 12 HIS CB 1 1 19 7356 1 1 12 HIS CD2 C -3.192 -19.150 -15.285 1.00 . A A . 12 HIS CD2 1 1 19 7357 1 1 12 HIS CE1 C -1.281 -20.192 -15.547 1.00 . A A . 12 HIS CE1 1 1 19 7358 1 1 12 HIS CG C -2.595 -18.636 -16.386 1.00 . A A . 12 HIS CG 1 1 19 7359 1 1 12 HIS H H -2.801 -14.967 -16.514 1.00 . A A . 12 HIS H 1 1 19 7360 1 1 12 HIS HA H -0.988 -17.022 -17.596 1.00 . A A . 12 HIS HA 1 1 19 7361 1 1 12 HIS HB2 H -3.882 -17.055 -16.882 1.00 . A A . 12 HIS HB2 1 1 19 7362 1 1 12 HIS HB3 H -3.360 -18.038 -18.247 1.00 . A A . 12 HIS HB3 1 1 19 7363 1 1 12 HIS HD1 H -0.737 -19.162 -17.229 1.00 . A A . 12 HIS HD1 1 1 19 7364 1 1 12 HIS HD2 H -4.149 -18.857 -14.878 1.00 . A A . 12 HIS HD2 1 1 19 7365 1 1 12 HIS HE1 H -0.447 -20.863 -15.399 1.00 . A A . 12 HIS HE1 1 1 19 7366 1 1 12 HIS N N -1.968 -15.459 -16.670 1.00 . A A . 12 HIS N 1 1 19 7367 1 1 12 HIS ND1 N -1.399 -19.309 -16.522 1.00 . A A . 12 HIS ND1 1 1 19 7368 1 1 12 HIS NE2 N -2.355 -20.116 -14.782 1.00 . A A . 12 HIS NE2 1 1 19 7369 1 1 12 HIS O O -1.547 -16.485 -20.017 1.00 . A A . 12 HIS O 1 1 19 7370 1 1 13 ASP C C -2.695 -12.953 -20.548 1.00 . A A . 13 ASP C 1 1 19 7371 1 1 13 ASP CA C -3.269 -14.364 -20.481 1.00 . A A . 13 ASP CA 1 1 19 7372 1 1 13 ASP CB C -4.776 -14.328 -20.741 1.00 . A A . 13 ASP CB 1 1 19 7373 1 1 13 ASP CG C -5.408 -15.704 -20.675 1.00 . A A . 13 ASP CG 1 1 19 7374 1 1 13 ASP H H -3.443 -14.628 -18.387 1.00 . A A . 13 ASP H 1 1 19 7375 1 1 13 ASP HA H -2.797 -14.968 -21.240 1.00 . A A . 13 ASP HA 1 1 19 7376 1 1 13 ASP HB2 H -5.248 -13.700 -19.999 1.00 . A A . 13 ASP HB2 1 1 19 7377 1 1 13 ASP HB3 H -4.955 -13.915 -21.723 1.00 . A A . 13 ASP HB3 1 1 19 7378 1 1 13 ASP N N -2.994 -14.976 -19.186 1.00 . A A . 13 ASP N 1 1 19 7379 1 1 13 ASP O O -2.096 -12.562 -21.551 1.00 . A A . 13 ASP O 1 1 19 7380 1 1 13 ASP OD1 O -6.214 -15.944 -19.751 1.00 . A A . 13 ASP OD1 1 1 19 7381 1 1 13 ASP OD2 O -5.099 -16.541 -21.548 1.00 . A A . 13 ASP OD2 1 1 19 7382 1 1 14 CYS C C -2.960 -9.981 -20.546 1.00 . A A . 14 CYS C 1 1 19 7383 1 1 14 CYS CA C -2.383 -10.823 -19.411 1.00 . A A . 14 CYS CA 1 1 19 7384 1 1 14 CYS CB C -0.854 -10.811 -19.478 1.00 . A A . 14 CYS CB 1 1 19 7385 1 1 14 CYS H H -3.366 -12.560 -18.705 1.00 . A A . 14 CYS H 1 1 19 7386 1 1 14 CYS HA H -2.696 -10.399 -18.469 1.00 . A A . 14 CYS HA 1 1 19 7387 1 1 14 CYS HB2 H -0.458 -11.160 -18.536 1.00 . A A . 14 CYS HB2 1 1 19 7388 1 1 14 CYS HB3 H -0.531 -11.474 -20.267 1.00 . A A . 14 CYS HB3 1 1 19 7389 1 1 14 CYS N N -2.881 -12.192 -19.475 1.00 . A A . 14 CYS N 1 1 19 7390 1 1 14 CYS O O -2.458 -10.007 -21.670 1.00 . A A . 14 CYS O 1 1 19 7391 1 1 14 CYS SG S -0.138 -9.168 -19.804 1.00 . A A . 14 CYS SG 1 1 19 7392 1 1 15 HIS C C -4.388 -6.911 -20.951 1.00 . A A . 15 HIS C 1 1 19 7393 1 1 15 HIS CA C -4.662 -8.384 -21.236 1.00 . A A . 15 HIS CA 1 1 19 7394 1 1 15 HIS CB C -6.170 -8.640 -21.256 1.00 . A A . 15 HIS CB 1 1 19 7395 1 1 15 HIS CD2 C -6.734 -11.050 -20.482 1.00 . A A . 15 HIS CD2 1 1 19 7396 1 1 15 HIS CE1 C -7.026 -11.961 -22.455 1.00 . A A . 15 HIS CE1 1 1 19 7397 1 1 15 HIS CG C -6.530 -10.086 -21.409 1.00 . A A . 15 HIS CG 1 1 19 7398 1 1 15 HIS H H -4.371 -9.257 -19.330 1.00 . A A . 15 HIS H 1 1 19 7399 1 1 15 HIS HA H -4.251 -8.633 -22.203 1.00 . A A . 15 HIS HA 1 1 19 7400 1 1 15 HIS HB2 H -6.600 -8.288 -20.330 1.00 . A A . 15 HIS HB2 1 1 19 7401 1 1 15 HIS HB3 H -6.610 -8.098 -22.081 1.00 . A A . 15 HIS HB3 1 1 19 7402 1 1 15 HIS HD1 H -6.642 -10.249 -23.507 1.00 . A A . 15 HIS HD1 1 1 19 7403 1 1 15 HIS HD2 H -6.668 -10.933 -19.409 1.00 . A A . 15 HIS HD2 1 1 19 7404 1 1 15 HIS HE1 H -7.229 -12.679 -23.235 1.00 . A A . 15 HIS HE1 1 1 19 7405 1 1 15 HIS N N -4.017 -9.235 -20.243 1.00 . A A . 15 HIS N 1 1 19 7406 1 1 15 HIS ND1 N -6.719 -10.689 -22.635 1.00 . A A . 15 HIS ND1 1 1 19 7407 1 1 15 HIS NE2 N -7.041 -12.206 -21.157 1.00 . A A . 15 HIS NE2 1 1 19 7408 1 1 15 HIS O O -5.170 -6.040 -21.330 1.00 . A A . 15 HIS O 1 1 19 7409 1 1 16 MET C C -3.947 -4.624 -19.048 1.00 . A A . 16 MET C 1 1 19 7410 1 1 16 MET CA C -2.896 -5.273 -19.944 1.00 . A A . 16 MET CA 1 1 19 7411 1 1 16 MET CB C -2.712 -4.445 -21.217 1.00 . A A . 16 MET CB 1 1 19 7412 1 1 16 MET CE C 1.046 -2.748 -21.245 1.00 . A A . 16 MET CE 1 1 19 7413 1 1 16 MET CG C -1.256 -4.247 -21.607 1.00 . A A . 16 MET CG 1 1 19 7414 1 1 16 MET H H -2.689 -7.379 -20.004 1.00 . A A . 16 MET H 1 1 19 7415 1 1 16 MET HA H -1.959 -5.310 -19.410 1.00 . A A . 16 MET HA 1 1 19 7416 1 1 16 MET HB2 H -3.216 -4.942 -22.032 1.00 . A A . 16 MET HB2 1 1 19 7417 1 1 16 MET HB3 H -3.157 -3.473 -21.068 1.00 . A A . 16 MET HB3 1 1 19 7418 1 1 16 MET HE1 H 1.454 -1.903 -20.709 1.00 . A A . 16 MET HE1 1 1 19 7419 1 1 16 MET HE2 H 1.238 -3.653 -20.688 1.00 . A A . 16 MET HE2 1 1 19 7420 1 1 16 MET HE3 H 1.512 -2.817 -22.217 1.00 . A A . 16 MET HE3 1 1 19 7421 1 1 16 MET HG2 H -0.639 -4.863 -20.971 1.00 . A A . 16 MET HG2 1 1 19 7422 1 1 16 MET HG3 H -1.129 -4.554 -22.635 1.00 . A A . 16 MET HG3 1 1 19 7423 1 1 16 MET N N -3.273 -6.641 -20.279 1.00 . A A . 16 MET N 1 1 19 7424 1 1 16 MET O O -4.992 -4.180 -19.523 1.00 . A A . 16 MET O 1 1 19 7425 1 1 16 MET SD S -0.721 -2.533 -21.444 1.00 . A A . 16 MET SD 1 1 19 7426 1 1 17 ASN C C -3.973 -3.956 -15.392 1.00 . A A . 17 ASN C 1 1 19 7427 1 1 17 ASN CA C -4.585 -3.978 -16.790 1.00 . A A . 17 ASN CA 1 1 19 7428 1 1 17 ASN CB C -5.903 -4.753 -16.770 1.00 . A A . 17 ASN CB 1 1 19 7429 1 1 17 ASN CG C -6.987 -4.073 -17.583 1.00 . A A . 17 ASN CG 1 1 19 7430 1 1 17 ASN H H -2.814 -4.943 -17.432 1.00 . A A . 17 ASN H 1 1 19 7431 1 1 17 ASN HA H -4.779 -2.963 -17.101 1.00 . A A . 17 ASN HA 1 1 19 7432 1 1 17 ASN HB2 H -5.740 -5.740 -17.178 1.00 . A A . 17 ASN HB2 1 1 19 7433 1 1 17 ASN HB3 H -6.246 -4.842 -15.750 1.00 . A A . 17 ASN HB3 1 1 19 7434 1 1 17 ASN HD21 H -7.858 -5.825 -17.935 1.00 . A A . 17 ASN HD21 1 1 19 7435 1 1 17 ASN HD22 H -8.632 -4.448 -18.634 1.00 . A A . 17 ASN HD22 1 1 19 7436 1 1 17 ASN N N -3.663 -4.572 -17.751 1.00 . A A . 17 ASN N 1 1 19 7437 1 1 17 ASN ND2 N -7.920 -4.862 -18.103 1.00 . A A . 17 ASN ND2 1 1 19 7438 1 1 17 ASN O O -4.327 -4.766 -14.537 1.00 . A A . 17 ASN O 1 1 19 7439 1 1 17 ASN OD1 O -6.985 -2.852 -17.743 1.00 . A A . 17 ASN OD1 1 1 19 7440 1 1 18 DAL C C -3.384 -2.416 -12.838 1.00 . A A . 18 DAL C 1 1 19 7441 1 1 18 DAL CA C -2.389 -2.892 -13.865 1.00 . A A . 18 DAL CA 1 1 19 7442 1 1 18 DAL CB C -1.829 -4.253 -13.442 1.00 . A A . 18 DAL CB 1 1 19 7443 1 1 18 DAL H H -2.815 -2.405 -15.891 1.00 . A A . 18 DAL H 1 1 19 7444 1 1 18 DAL HA H -1.574 -2.172 -13.943 1.00 . A A . 18 DAL HA 1 1 19 7445 1 1 18 DAL HB1 H -0.757 -4.167 -13.269 1.00 . A A . 18 DAL HB1 1 1 19 7446 1 1 18 DAL HB2 H -2.320 -4.577 -12.524 1.00 . A A . 18 DAL HB2 1 1 19 7447 1 1 18 DAL N N -3.054 -3.022 -15.169 1.00 . A A . 18 DAL N 1 1 19 7448 1 1 18 DAL O O -3.354 -1.259 -12.420 1.00 . A A . 18 DAL O 1 1 19 7449 1 1 19 PHE C C -4.863 -3.428 -10.041 1.00 . A A . 19 PHE C 1 1 19 7450 1 1 19 PHE CA C -5.292 -2.978 -11.435 1.00 . A A . 19 PHE CA 1 1 19 7451 1 1 19 PHE CB C -6.627 -3.628 -11.805 1.00 . A A . 19 PHE CB 1 1 19 7452 1 1 19 PHE CD1 C -6.811 -2.476 -14.027 1.00 . A A . 19 PHE CD1 1 1 19 7453 1 1 19 PHE CD2 C -8.727 -2.514 -12.607 1.00 . A A . 19 PHE CD2 1 1 19 7454 1 1 19 PHE CE1 C -7.524 -1.768 -14.976 1.00 . A A . 19 PHE CE1 1 1 19 7455 1 1 19 PHE CE2 C -9.445 -1.805 -13.553 1.00 . A A . 19 PHE CE2 1 1 19 7456 1 1 19 PHE CG C -7.404 -2.857 -12.834 1.00 . A A . 19 PHE CG 1 1 19 7457 1 1 19 PHE CZ C -8.842 -1.431 -14.738 1.00 . A A . 19 PHE CZ 1 1 19 7458 1 1 19 PHE H H -4.247 -4.219 -12.795 1.00 . A A . 19 PHE H 1 1 19 7459 1 1 19 PHE HA H -5.412 -1.905 -11.433 1.00 . A A . 19 PHE HA 1 1 19 7460 1 1 19 PHE HB2 H -6.441 -4.615 -12.201 1.00 . A A . 19 PHE HB2 1 1 19 7461 1 1 19 PHE HB3 H -7.237 -3.709 -10.918 1.00 . A A . 19 PHE HB3 1 1 19 7462 1 1 19 PHE HD1 H -5.780 -2.739 -14.214 1.00 . A A . 19 PHE HD1 1 1 19 7463 1 1 19 PHE HD2 H -9.199 -2.805 -11.681 1.00 . A A . 19 PHE HD2 1 1 19 7464 1 1 19 PHE HE1 H -7.049 -1.476 -15.901 1.00 . A A . 19 PHE HE1 1 1 19 7465 1 1 19 PHE HE2 H -10.475 -1.543 -13.364 1.00 . A A . 19 PHE HE2 1 1 19 7466 1 1 19 PHE HZ H -9.401 -0.878 -15.478 1.00 . A A . 19 PHE HZ 1 1 19 7467 1 1 19 PHE N N -4.275 -3.312 -12.425 1.00 . A A . 19 PHE N 1 1 19 7468 1 1 19 PHE O O -4.868 -2.640 -9.096 1.00 . A A . 19 PHE O 1 1 19 7469 1 1 20 GLN C C -3.706 -6.730 -8.787 1.00 . A A . 20 GLN C 1 1 19 7470 1 1 20 GLN CA C -4.064 -5.255 -8.646 1.00 . A A . 20 GLN CA 1 1 19 7471 1 1 20 GLN CB C -5.163 -5.082 -7.596 1.00 . A A . 20 GLN CB 1 1 19 7472 1 1 20 GLN CD C -5.920 -3.873 -5.511 1.00 . A A . 20 GLN CD 1 1 19 7473 1 1 20 GLN CG C -4.761 -4.184 -6.437 1.00 . A A . 20 GLN CG 1 1 19 7474 1 1 20 GLN H H -4.512 -5.277 -10.715 1.00 . A A . 20 GLN H 1 1 19 7475 1 1 20 GLN HA H -3.187 -4.713 -8.328 1.00 . A A . 20 GLN HA 1 1 19 7476 1 1 20 GLN HB2 H -6.034 -4.655 -8.070 1.00 . A A . 20 GLN HB2 1 1 19 7477 1 1 20 GLN HB3 H -5.419 -6.053 -7.198 1.00 . A A . 20 GLN HB3 1 1 19 7478 1 1 20 GLN HE21 H -6.973 -3.145 -7.033 1.00 . A A . 20 GLN HE21 1 1 19 7479 1 1 20 GLN HE22 H -7.755 -3.108 -5.492 1.00 . A A . 20 GLN HE22 1 1 19 7480 1 1 20 GLN HG2 H -3.987 -4.676 -5.867 1.00 . A A . 20 GLN HG2 1 1 19 7481 1 1 20 GLN HG3 H -4.378 -3.255 -6.835 1.00 . A A . 20 GLN HG3 1 1 19 7482 1 1 20 GLN N N -4.494 -4.699 -9.924 1.00 . A A . 20 GLN N 1 1 19 7483 1 1 20 GLN NE2 N -6.991 -3.319 -6.068 1.00 . A A . 20 GLN NE2 1 1 19 7484 1 1 20 GLN O O -3.991 -7.354 -9.809 1.00 . A A . 20 GLN O 1 1 19 7485 1 1 20 GLN OE1 O -5.854 -4.127 -4.308 1.00 . A A . 20 GLN OE1 1 1 19 7486 1 1 21 PHE C C -3.420 -9.469 -6.684 1.00 . A A . 21 PHE C 1 1 19 7487 1 1 21 PHE CA C -2.679 -8.685 -7.763 1.00 . A A . 21 PHE CA 1 1 19 7488 1 1 21 PHE CB C -1.168 -8.809 -7.553 1.00 . A A . 21 PHE CB 1 1 19 7489 1 1 21 PHE CD1 C 0.136 -9.349 -9.627 1.00 . A A . 21 PHE CD1 1 1 19 7490 1 1 21 PHE CD2 C -0.096 -7.061 -8.999 1.00 . A A . 21 PHE CD2 1 1 19 7491 1 1 21 PHE CE1 C 0.880 -8.975 -10.730 1.00 . A A . 21 PHE CE1 1 1 19 7492 1 1 21 PHE CE2 C 0.646 -6.680 -10.100 1.00 . A A . 21 PHE CE2 1 1 19 7493 1 1 21 PHE CG C -0.360 -8.398 -8.750 1.00 . A A . 21 PHE CG 1 1 19 7494 1 1 21 PHE CZ C 1.136 -7.638 -10.967 1.00 . A A . 21 PHE CZ 1 1 19 7495 1 1 21 PHE H H -2.878 -6.733 -6.967 1.00 . A A . 21 PHE H 1 1 19 7496 1 1 21 PHE HA H -2.934 -9.095 -8.728 1.00 . A A . 21 PHE HA 1 1 19 7497 1 1 21 PHE HB2 H -0.875 -8.182 -6.724 1.00 . A A . 21 PHE HB2 1 1 19 7498 1 1 21 PHE HB3 H -0.927 -9.836 -7.324 1.00 . A A . 21 PHE HB3 1 1 19 7499 1 1 21 PHE HD1 H -0.064 -10.396 -9.443 1.00 . A A . 21 PHE HD1 1 1 19 7500 1 1 21 PHE HD2 H -0.477 -6.311 -8.322 1.00 . A A . 21 PHE HD2 1 1 19 7501 1 1 21 PHE HE1 H 1.261 -9.727 -11.405 1.00 . A A . 21 PHE HE1 1 1 19 7502 1 1 21 PHE HE2 H 0.846 -5.635 -10.283 1.00 . A A . 21 PHE HE2 1 1 19 7503 1 1 21 PHE HZ H 1.716 -7.344 -11.828 1.00 . A A . 21 PHE HZ 1 1 19 7504 1 1 21 PHE N N -3.078 -7.283 -7.754 1.00 . A A . 21 PHE N 1 1 19 7505 1 1 21 PHE O O -2.865 -9.769 -5.627 1.00 . A A . 21 PHE O 1 1 19 7506 1 1 22 VAL C C -5.171 -12.034 -6.061 1.00 . A A . 22 VAL C 1 1 19 7507 1 1 22 VAL CA C -5.498 -10.545 -6.013 1.00 . A A . 22 VAL CA 1 1 19 7508 1 1 22 VAL CB C -7.000 -10.351 -6.293 1.00 . A A . 22 VAL CB 1 1 19 7509 1 1 22 VAL CG1 C -7.420 -8.922 -5.983 1.00 . A A . 22 VAL CG1 1 1 19 7510 1 1 22 VAL CG2 C -7.322 -10.709 -7.736 1.00 . A A . 22 VAL CG2 1 1 19 7511 1 1 22 VAL H H -5.066 -9.529 -7.818 1.00 . A A . 22 VAL H 1 1 19 7512 1 1 22 VAL HA H -5.287 -10.173 -5.021 1.00 . A A . 22 VAL HA 1 1 19 7513 1 1 22 VAL HB H -7.555 -11.015 -5.647 1.00 . A A . 22 VAL HB 1 1 19 7514 1 1 22 VAL HG11 H -6.548 -8.338 -5.728 1.00 . A A . 22 VAL HG11 1 1 19 7515 1 1 22 VAL HG12 H -7.903 -8.493 -6.848 1.00 . A A . 22 VAL HG12 1 1 19 7516 1 1 22 VAL HG13 H -8.108 -8.923 -5.150 1.00 . A A . 22 VAL HG13 1 1 19 7517 1 1 22 VAL HG21 H -7.314 -9.813 -8.339 1.00 . A A . 22 VAL HG21 1 1 19 7518 1 1 22 VAL HG22 H -6.582 -11.401 -8.110 1.00 . A A . 22 VAL HG22 1 1 19 7519 1 1 22 VAL HG23 H -8.299 -11.166 -7.784 1.00 . A A . 22 VAL HG23 1 1 19 7520 1 1 22 VAL N N -4.679 -9.797 -6.959 1.00 . A A . 22 VAL N 1 1 19 7521 1 1 22 VAL O O -5.481 -12.779 -5.132 1.00 . A A . 22 VAL O 1 1 19 7522 1 1 23 PHE C C -2.831 -13.987 -8.036 1.00 . A A . 23 PHE C 1 1 19 7523 1 1 23 PHE CA C -4.175 -13.861 -7.323 1.00 . A A . 23 PHE CA 1 1 19 7524 1 1 23 PHE CB C -5.255 -14.602 -8.113 1.00 . A A . 23 PHE CB 1 1 19 7525 1 1 23 PHE CD1 C -6.875 -15.060 -6.252 1.00 . A A . 23 PHE CD1 1 1 19 7526 1 1 23 PHE CD2 C -7.652 -13.861 -8.161 1.00 . A A . 23 PHE CD2 1 1 19 7527 1 1 23 PHE CE1 C -8.131 -14.972 -5.681 1.00 . A A . 23 PHE CE1 1 1 19 7528 1 1 23 PHE CE2 C -8.910 -13.770 -7.595 1.00 . A A . 23 PHE CE2 1 1 19 7529 1 1 23 PHE CG C -6.621 -14.506 -7.496 1.00 . A A . 23 PHE CG 1 1 19 7530 1 1 23 PHE CZ C -9.150 -14.327 -6.354 1.00 . A A . 23 PHE CZ 1 1 19 7531 1 1 23 PHE H H -4.323 -11.818 -7.859 1.00 . A A . 23 PHE H 1 1 19 7532 1 1 23 PHE HA H -4.091 -14.303 -6.342 1.00 . A A . 23 PHE HA 1 1 19 7533 1 1 23 PHE HB2 H -5.312 -14.188 -9.108 1.00 . A A . 23 PHE HB2 1 1 19 7534 1 1 23 PHE HB3 H -4.992 -15.647 -8.177 1.00 . A A . 23 PHE HB3 1 1 19 7535 1 1 23 PHE HD1 H -6.078 -15.565 -5.724 1.00 . A A . 23 PHE HD1 1 1 19 7536 1 1 23 PHE HD2 H -7.467 -13.426 -9.132 1.00 . A A . 23 PHE HD2 1 1 19 7537 1 1 23 PHE HE1 H -8.315 -15.409 -4.710 1.00 . A A . 23 PHE HE1 1 1 19 7538 1 1 23 PHE HE2 H -9.705 -13.266 -8.124 1.00 . A A . 23 PHE HE2 1 1 19 7539 1 1 23 PHE HZ H -10.131 -14.257 -5.910 1.00 . A A . 23 PHE HZ 1 1 19 7540 1 1 23 PHE N N -4.543 -12.461 -7.152 1.00 . A A . 23 PHE N 1 1 19 7541 1 1 23 PHE O O -2.475 -15.058 -8.525 1.00 . A A . 23 PHE O 1 1 19 7542 1 1 24 DBU C C -0.842 -12.619 -10.173 1.00 . A A . 24 DBU C 1 1 19 7543 1 1 24 DBU CA C -0.872 -12.871 -8.701 1.00 . A A . 24 DBU CA 1 1 19 7544 1 1 24 DBU CB C 0.325 -13.062 -8.117 1.00 . A A . 24 DBU CB 1 1 19 7545 1 1 24 DBU CG C 0.568 -13.331 -6.665 1.00 . A A . 24 DBU CG 1 1 19 7546 1 1 24 DBU HG1 H 1.626 -13.441 -6.414 1.00 . A A . 24 DBU HG1 1 1 19 7547 1 1 24 DBU HG2 H 0.055 -14.252 -6.371 1.00 . A A . 24 DBU HG2 1 1 19 7548 1 1 24 DBU HG3 H 0.164 -12.509 -6.066 1.00 . A A . 24 DBU HG3 1 1 19 7549 1 1 24 DBU N N -2.092 -12.884 -8.090 1.00 . A A . 24 DBU N 1 1 19 7550 1 1 24 DBU O O 0.044 -13.102 -10.879 1.00 . A A . 24 DBU O 1 1 19 7551 1 1 25 CYS C C -2.182 -10.046 -12.280 1.00 . A A . 25 CYS C 1 1 19 7552 1 1 25 CYS CA C -1.902 -11.532 -12.076 1.00 . A A . 25 CYS CA 1 1 19 7553 1 1 25 CYS CB C -2.998 -12.365 -12.744 1.00 . A A . 25 CYS CB 1 1 19 7554 1 1 25 CYS H H -2.494 -11.498 -10.044 1.00 . A A . 25 CYS H 1 1 19 7555 1 1 25 CYS HA H -0.953 -11.773 -12.529 1.00 . A A . 25 CYS HA 1 1 19 7556 1 1 25 CYS HB2 H -3.960 -11.929 -12.517 1.00 . A A . 25 CYS HB2 1 1 19 7557 1 1 25 CYS HB3 H -2.847 -12.354 -13.813 1.00 . A A . 25 CYS HB3 1 1 19 7558 1 1 25 CYS N N -1.816 -11.855 -10.657 1.00 . A A . 25 CYS N 1 1 19 7559 1 1 25 CYS O O -2.174 -9.265 -11.328 1.00 . A A . 25 CYS O 1 1 19 7560 1 1 25 CYS SG S -3.041 -14.105 -12.207 1.00 . A A . 25 CYS SG 1 1 19 7561 1 1 26 CYS C C -3.970 -8.160 -14.714 1.00 . A A . 26 CYS C 1 1 19 7562 1 1 26 CYS CA C -2.711 -8.271 -13.859 1.00 . A A . 26 CYS CA 1 1 19 7563 1 1 26 CYS CB C -1.523 -7.650 -14.597 1.00 . A A . 26 CYS CB 1 1 19 7564 1 1 26 CYS H H -2.421 -10.332 -14.245 1.00 . A A . 26 CYS H 1 1 19 7565 1 1 26 CYS HA H -2.870 -7.736 -12.936 1.00 . A A . 26 CYS HA 1 1 19 7566 1 1 26 CYS HB2 H -0.606 -8.029 -14.171 1.00 . A A . 26 CYS HB2 1 1 19 7567 1 1 26 CYS HB3 H -1.572 -7.928 -15.640 1.00 . A A . 26 CYS HB3 1 1 19 7568 1 1 26 CYS N N -2.429 -9.662 -13.528 1.00 . A A . 26 CYS N 1 1 19 7569 1 1 26 CYS O O -3.962 -7.527 -15.770 1.00 . A A . 26 CYS O 1 1 19 7570 1 1 26 CYS SG S -1.463 -5.831 -14.510 1.00 . A A . 26 CYS SG 1 1 19 7571 1 1 27 SER C C -7.400 -9.496 -14.198 1.00 . A A . 27 SER C 1 1 19 7572 1 1 27 SER CA C -6.316 -8.753 -14.973 1.00 . A A . 27 SER CA 1 1 19 7573 1 1 27 SER CB C -6.148 -9.375 -16.361 1.00 . A A . 27 SER CB 1 1 19 7574 1 1 27 SER H H -4.994 -9.267 -13.402 1.00 . A A . 27 SER H 1 1 19 7575 1 1 27 SER HA H -6.613 -7.721 -15.085 1.00 . A A . 27 SER HA 1 1 19 7576 1 1 27 SER HB2 H -5.112 -9.638 -16.512 1.00 . A A . 27 SER HB2 1 1 19 7577 1 1 27 SER HB3 H -6.759 -10.264 -16.430 1.00 . A A . 27 SER HB3 1 1 19 7578 1 1 27 SER HG H -7.422 -8.135 -17.184 1.00 . A A . 27 SER HG 1 1 19 7579 1 1 27 SER N N -5.050 -8.779 -14.250 1.00 . A A . 27 SER N 1 1 19 7580 1 1 27 SER O O -8.546 -9.053 -14.135 1.00 . A A . 27 SER O 1 1 19 7581 1 1 27 SER OG O -6.543 -8.470 -17.377 1.00 . A A . 27 SER OG 1 1 20 7582 1 1 1 LYS C C 2.545 0.102 -8.852 1.00 . A A . 1 LYS C 1 1 20 7583 1 1 1 LYS CA C 1.597 -0.680 -9.756 1.00 . A A . 1 LYS CA 1 1 20 7584 1 1 1 LYS CB C 1.617 -0.089 -11.168 1.00 . A A . 1 LYS CB 1 1 20 7585 1 1 1 LYS CD C 2.655 -0.087 -13.455 1.00 . A A . 1 LYS CD 1 1 20 7586 1 1 1 LYS CE C 3.995 0.595 -13.687 1.00 . A A . 1 LYS CE 1 1 20 7587 1 1 1 LYS CG C 2.605 -0.770 -12.099 1.00 . A A . 1 LYS CG 1 1 20 7588 1 1 1 LYS H1 H -0.454 -1.199 -9.668 1.00 . A A . 1 LYS H1 1 1 20 7589 1 1 1 LYS HA H 1.927 -1.707 -9.801 1.00 . A A . 1 LYS HA 1 1 20 7590 1 1 1 LYS HB2 H 0.630 -0.177 -11.596 1.00 . A A . 1 LYS HB2 1 1 20 7591 1 1 1 LYS HB3 H 1.879 0.958 -11.103 1.00 . A A . 1 LYS HB3 1 1 20 7592 1 1 1 LYS HD2 H 2.502 -0.827 -14.227 1.00 . A A . 1 LYS HD2 1 1 20 7593 1 1 1 LYS HD3 H 1.870 0.655 -13.504 1.00 . A A . 1 LYS HD3 1 1 20 7594 1 1 1 LYS HE2 H 4.784 -0.099 -13.441 1.00 . A A . 1 LYS HE2 1 1 20 7595 1 1 1 LYS HE3 H 4.069 0.869 -14.728 1.00 . A A . 1 LYS HE3 1 1 20 7596 1 1 1 LYS HG2 H 3.588 -0.736 -11.654 1.00 . A A . 1 LYS HG2 1 1 20 7597 1 1 1 LYS HG3 H 2.305 -1.800 -12.235 1.00 . A A . 1 LYS HG3 1 1 20 7598 1 1 1 LYS HZ1 H 4.752 1.616 -12.029 1.00 . A A . 1 LYS HZ1 1 1 20 7599 1 1 1 LYS HZ2 H 3.217 2.136 -12.512 1.00 . A A . 1 LYS HZ2 1 1 20 7600 1 1 1 LYS HZ3 H 4.580 2.581 -13.409 1.00 . A A . 1 LYS HZ3 1 1 20 7601 1 1 1 LYS N N 0.240 -0.668 -9.222 1.00 . A A . 1 LYS N 1 1 20 7602 1 1 1 LYS NZ N 4.146 1.818 -12.851 1.00 . A A . 1 LYS NZ 1 1 20 7603 1 1 1 LYS O O 3.565 0.621 -9.306 1.00 . A A . 1 LYS O 1 1 20 7604 1 1 2 LYS C C 3.178 0.089 -5.317 1.00 . A A . 2 LYS C 1 1 20 7605 1 1 2 LYS CA C 3.023 0.897 -6.602 1.00 . A A . 2 LYS CA 1 1 20 7606 1 1 2 LYS CB C 2.405 2.261 -6.288 1.00 . A A . 2 LYS CB 1 1 20 7607 1 1 2 LYS CD C 3.580 4.026 -7.634 1.00 . A A . 2 LYS CD 1 1 20 7608 1 1 2 LYS CE C 4.006 5.483 -7.530 1.00 . A A . 2 LYS CE 1 1 20 7609 1 1 2 LYS CG C 3.415 3.395 -6.262 1.00 . A A . 2 LYS CG 1 1 20 7610 1 1 2 LYS H H 1.377 -0.254 -7.269 1.00 . A A . 2 LYS H 1 1 20 7611 1 1 2 LYS HA H 3.999 1.045 -7.039 1.00 . A A . 2 LYS HA 1 1 20 7612 1 1 2 LYS HB2 H 1.661 2.487 -7.037 1.00 . A A . 2 LYS HB2 1 1 20 7613 1 1 2 LYS HB3 H 1.926 2.212 -5.320 1.00 . A A . 2 LYS HB3 1 1 20 7614 1 1 2 LYS HD2 H 4.334 3.481 -8.183 1.00 . A A . 2 LYS HD2 1 1 20 7615 1 1 2 LYS HD3 H 2.638 3.972 -8.161 1.00 . A A . 2 LYS HD3 1 1 20 7616 1 1 2 LYS HE2 H 4.694 5.585 -6.705 1.00 . A A . 2 LYS HE2 1 1 20 7617 1 1 2 LYS HE3 H 4.499 5.766 -8.448 1.00 . A A . 2 LYS HE3 1 1 20 7618 1 1 2 LYS HG2 H 3.077 4.151 -5.568 1.00 . A A . 2 LYS HG2 1 1 20 7619 1 1 2 LYS HG3 H 4.370 3.007 -5.937 1.00 . A A . 2 LYS HG3 1 1 20 7620 1 1 2 LYS HZ1 H 2.645 6.467 -6.288 1.00 . A A . 2 LYS HZ1 1 1 20 7621 1 1 2 LYS HZ2 H 2.000 6.007 -7.782 1.00 . A A . 2 LYS HZ2 1 1 20 7622 1 1 2 LYS HZ3 H 3.047 7.332 -7.685 1.00 . A A . 2 LYS HZ3 1 1 20 7623 1 1 2 LYS N N 2.202 0.181 -7.571 1.00 . A A . 2 LYS N 1 1 20 7624 1 1 2 LYS NZ N 2.843 6.386 -7.306 1.00 . A A . 2 LYS NZ 1 1 20 7625 1 1 2 LYS O O 4.284 -0.307 -4.950 1.00 . A A . 2 LYS O 1 1 20 7626 1 1 3 LYS C C 2.794 -2.247 -3.581 1.00 . A A . 3 LYS C 1 1 20 7627 1 1 3 LYS CA C 2.072 -0.917 -3.396 1.00 . A A . 3 LYS CA 1 1 20 7628 1 1 3 LYS CB C 0.641 -1.164 -2.914 1.00 . A A . 3 LYS CB 1 1 20 7629 1 1 3 LYS CD C -1.631 -2.059 -3.505 1.00 . A A . 3 LYS CD 1 1 20 7630 1 1 3 LYS CE C -2.054 -3.128 -2.509 1.00 . A A . 3 LYS CE 1 1 20 7631 1 1 3 LYS CG C -0.140 -2.125 -3.793 1.00 . A A . 3 LYS CG 1 1 20 7632 1 1 3 LYS H H 1.209 0.189 -4.982 1.00 . A A . 3 LYS H 1 1 20 7633 1 1 3 LYS HA H 2.598 -0.335 -2.654 1.00 . A A . 3 LYS HA 1 1 20 7634 1 1 3 LYS HB2 H 0.676 -1.570 -1.914 1.00 . A A . 3 LYS HB2 1 1 20 7635 1 1 3 LYS HB3 H 0.113 -0.221 -2.891 1.00 . A A . 3 LYS HB3 1 1 20 7636 1 1 3 LYS HD2 H -1.867 -1.088 -3.095 1.00 . A A . 3 LYS HD2 1 1 20 7637 1 1 3 LYS HD3 H -2.174 -2.203 -4.428 1.00 . A A . 3 LYS HD3 1 1 20 7638 1 1 3 LYS HE2 H -2.292 -4.031 -3.050 1.00 . A A . 3 LYS HE2 1 1 20 7639 1 1 3 LYS HE3 H -1.232 -3.319 -1.835 1.00 . A A . 3 LYS HE3 1 1 20 7640 1 1 3 LYS HG2 H 0.027 -1.869 -4.828 1.00 . A A . 3 LYS HG2 1 1 20 7641 1 1 3 LYS HG3 H 0.209 -3.131 -3.608 1.00 . A A . 3 LYS HG3 1 1 20 7642 1 1 3 LYS HZ1 H -2.943 -2.198 -0.864 1.00 . A A . 3 LYS HZ1 1 1 20 7643 1 1 3 LYS HZ2 H -3.795 -3.544 -1.432 1.00 . A A . 3 LYS HZ2 1 1 20 7644 1 1 3 LYS HZ3 H -3.850 -2.085 -2.287 1.00 . A A . 3 LYS HZ3 1 1 20 7645 1 1 3 LYS N N 2.062 -0.153 -4.638 1.00 . A A . 3 LYS N 1 1 20 7646 1 1 3 LYS NZ N -3.244 -2.709 -1.718 1.00 . A A . 3 LYS NZ 1 1 20 7647 1 1 3 LYS O O 3.413 -2.763 -2.650 1.00 . A A . 3 LYS O 1 1 20 7648 1 1 4 SER C C 4.093 -3.998 -6.427 1.00 . A A . 4 SER C 1 1 20 7649 1 1 4 SER CA C 3.355 -4.070 -5.094 1.00 . A A . 4 SER CA 1 1 20 7650 1 1 4 SER CB C 2.318 -5.194 -5.131 1.00 . A A . 4 SER CB 1 1 20 7651 1 1 4 SER H H 2.203 -2.338 -5.489 1.00 . A A . 4 SER H 1 1 20 7652 1 1 4 SER HA H 4.069 -4.276 -4.311 1.00 . A A . 4 SER HA 1 1 20 7653 1 1 4 SER HB2 H 1.829 -5.261 -4.172 1.00 . A A . 4 SER HB2 1 1 20 7654 1 1 4 SER HB3 H 1.585 -4.979 -5.896 1.00 . A A . 4 SER HB3 1 1 20 7655 1 1 4 SER HG H 3.683 -6.570 -4.843 1.00 . A A . 4 SER HG 1 1 20 7656 1 1 4 SER N N 2.711 -2.798 -4.788 1.00 . A A . 4 SER N 1 1 20 7657 1 1 4 SER O O 5.323 -3.990 -6.469 1.00 . A A . 4 SER O 1 1 20 7658 1 1 4 SER OG O 2.928 -6.440 -5.421 1.00 . A A . 4 SER OG 1 1 20 7659 1 1 5 GLY C C 4.866 -5.036 -9.111 1.00 . A A . 5 GLY C 1 1 20 7660 1 1 5 GLY CA C 3.930 -3.877 -8.837 1.00 . A A . 5 GLY CA 1 1 20 7661 1 1 5 GLY H H 2.356 -3.956 -7.422 1.00 . A A . 5 GLY H 1 1 20 7662 1 1 5 GLY HA2 H 3.143 -3.880 -9.576 1.00 . A A . 5 GLY HA2 1 1 20 7663 1 1 5 GLY HA3 H 4.484 -2.954 -8.919 1.00 . A A . 5 GLY HA3 1 1 20 7664 1 1 5 GLY N N 3.332 -3.947 -7.516 1.00 . A A . 5 GLY N 1 1 20 7665 1 1 5 GLY O O 5.988 -4.840 -9.578 1.00 . A A . 5 GLY O 1 1 20 7666 1 1 6 VAL C C 5.793 -7.467 -10.445 1.00 . A A . 6 VAL C 1 1 20 7667 1 1 6 VAL CA C 5.211 -7.445 -9.036 1.00 . A A . 6 VAL CA 1 1 20 7668 1 1 6 VAL CB C 4.385 -8.725 -8.813 1.00 . A A . 6 VAL CB 1 1 20 7669 1 1 6 VAL CG1 C 5.190 -9.955 -9.205 1.00 . A A . 6 VAL CG1 1 1 20 7670 1 1 6 VAL CG2 C 3.926 -8.817 -7.366 1.00 . A A . 6 VAL CG2 1 1 20 7671 1 1 6 VAL H H 3.504 -6.341 -8.449 1.00 . A A . 6 VAL H 1 1 20 7672 1 1 6 VAL HA H 6.022 -7.436 -8.323 1.00 . A A . 6 VAL HA 1 1 20 7673 1 1 6 VAL HB H 3.510 -8.679 -9.444 1.00 . A A . 6 VAL HB 1 1 20 7674 1 1 6 VAL HG11 H 6.243 -9.754 -9.069 1.00 . A A . 6 VAL HG11 1 1 20 7675 1 1 6 VAL HG12 H 4.899 -10.790 -8.584 1.00 . A A . 6 VAL HG12 1 1 20 7676 1 1 6 VAL HG13 H 5.001 -10.194 -10.241 1.00 . A A . 6 VAL HG13 1 1 20 7677 1 1 6 VAL HG21 H 4.776 -8.694 -6.711 1.00 . A A . 6 VAL HG21 1 1 20 7678 1 1 6 VAL HG22 H 3.203 -8.040 -7.167 1.00 . A A . 6 VAL HG22 1 1 20 7679 1 1 6 VAL HG23 H 3.474 -9.782 -7.192 1.00 . A A . 6 VAL HG23 1 1 20 7680 1 1 6 VAL N N 4.406 -6.249 -8.819 1.00 . A A . 6 VAL N 1 1 20 7681 1 1 6 VAL O O 6.954 -7.116 -10.654 1.00 . A A . 6 VAL O 1 1 20 7682 1 1 7 ILE C C 4.272 -7.588 -13.748 1.00 . A A . 7 ILE C 1 1 20 7683 1 1 7 ILE CA C 5.410 -7.948 -12.800 1.00 . A A . 7 ILE CA 1 1 20 7684 1 1 7 ILE CB C 5.939 -9.349 -13.158 1.00 . A A . 7 ILE CB 1 1 20 7685 1 1 7 ILE CD1 C 8.350 -8.819 -12.536 1.00 . A A . 7 ILE CD1 1 1 20 7686 1 1 7 ILE CG1 C 7.147 -9.701 -12.286 1.00 . A A . 7 ILE CG1 1 1 20 7687 1 1 7 ILE CG2 C 6.307 -9.415 -14.633 1.00 . A A . 7 ILE CG2 1 1 20 7688 1 1 7 ILE H H 4.063 -8.148 -11.180 1.00 . A A . 7 ILE H 1 1 20 7689 1 1 7 ILE HA H 6.213 -7.237 -12.932 1.00 . A A . 7 ILE HA 1 1 20 7690 1 1 7 ILE HB H 5.152 -10.064 -12.976 1.00 . A A . 7 ILE HB 1 1 20 7691 1 1 7 ILE HD11 H 9.151 -9.411 -12.952 1.00 . A A . 7 ILE HD11 1 1 20 7692 1 1 7 ILE HD12 H 8.084 -8.033 -13.227 1.00 . A A . 7 ILE HD12 1 1 20 7693 1 1 7 ILE HD13 H 8.674 -8.381 -11.602 1.00 . A A . 7 ILE HD13 1 1 20 7694 1 1 7 ILE HG12 H 6.874 -9.603 -11.248 1.00 . A A . 7 ILE HG12 1 1 20 7695 1 1 7 ILE HG13 H 7.437 -10.723 -12.483 1.00 . A A . 7 ILE HG13 1 1 20 7696 1 1 7 ILE HG21 H 7.229 -9.965 -14.750 1.00 . A A . 7 ILE HG21 1 1 20 7697 1 1 7 ILE HG22 H 5.519 -9.914 -15.178 1.00 . A A . 7 ILE HG22 1 1 20 7698 1 1 7 ILE HG23 H 6.433 -8.415 -15.018 1.00 . A A . 7 ILE HG23 1 1 20 7699 1 1 7 ILE N N 4.977 -7.881 -11.409 1.00 . A A . 7 ILE N 1 1 20 7700 1 1 7 ILE O O 3.247 -8.268 -13.813 1.00 . A A . 7 ILE O 1 1 20 7701 1 1 8 PRO C C 3.319 -6.949 -16.667 1.00 . A A . 8 PRO C 1 1 20 7702 1 1 8 PRO CA C 3.453 -6.021 -15.464 1.00 . A A . 8 PRO CA 1 1 20 7703 1 1 8 PRO CB C 3.996 -4.658 -15.898 1.00 . A A . 8 PRO CB 1 1 20 7704 1 1 8 PRO CD C 5.650 -5.637 -14.477 1.00 . A A . 8 PRO CD 1 1 20 7705 1 1 8 PRO CG C 5.466 -4.747 -15.675 1.00 . A A . 8 PRO CG 1 1 20 7706 1 1 8 PRO HA H 2.486 -5.894 -15.000 1.00 . A A . 8 PRO HA 1 1 20 7707 1 1 8 PRO HB2 H 3.763 -4.490 -16.941 1.00 . A A . 8 PRO HB2 1 1 20 7708 1 1 8 PRO HB3 H 3.551 -3.880 -15.295 1.00 . A A . 8 PRO HB3 1 1 20 7709 1 1 8 PRO HD2 H 6.549 -6.226 -14.579 1.00 . A A . 8 PRO HD2 1 1 20 7710 1 1 8 PRO HD3 H 5.682 -5.049 -13.572 1.00 . A A . 8 PRO HD3 1 1 20 7711 1 1 8 PRO HG2 H 5.943 -5.180 -16.541 1.00 . A A . 8 PRO HG2 1 1 20 7712 1 1 8 PRO HG3 H 5.867 -3.764 -15.476 1.00 . A A . 8 PRO HG3 1 1 20 7713 1 1 8 PRO N N 4.453 -6.495 -14.503 1.00 . A A . 8 PRO N 1 1 20 7714 1 1 8 PRO O O 3.776 -6.629 -17.763 1.00 . A A . 8 PRO O 1 1 20 7715 1 1 9 . C C 2.945 -10.440 -17.058 1.00 . A A . 9 DBB C 1 1 20 7716 1 1 9 . CA C 2.495 -9.082 -17.529 1.00 . A A . 9 DBB CA 1 1 20 7717 1 1 9 . CB C 1.013 -9.137 -17.905 1.00 . A A . 9 DBB CB 1 1 20 7718 1 1 9 . CG C 0.200 -8.320 -16.899 1.00 . A A . 9 DBB CG 1 1 20 7719 1 1 9 . H H 2.348 -8.299 -15.556 1.00 . A A . 9 DBB H 1 1 20 7720 1 1 9 . HA H 3.081 -8.787 -18.399 1.00 . A A . 9 DBB HA 1 1 20 7721 1 1 9 . HB2 H 0.673 -10.172 -17.893 1.00 . A A . 9 DBB HB2 1 1 20 7722 1 1 9 . HG1 H 0.479 -7.269 -16.974 1.00 . A A . 9 DBB HG1 1 1 20 7723 1 1 9 . HG2 H -0.862 -8.431 -17.115 1.00 . A A . 9 DBB HG2 1 1 20 7724 1 1 9 . HG3 H 0.406 -8.679 -15.890 1.00 . A A . 9 DBB HG3 1 1 20 7725 1 1 9 . N N 2.690 -8.100 -16.453 1.00 . A A . 9 DBB N 1 1 20 7726 1 1 9 . O O 3.762 -11.094 -17.706 1.00 . A A . 9 DBB O 1 1 20 7727 1 1 10 VAL C C 1.580 -13.132 -15.412 1.00 . A A . 10 VAL C 1 1 20 7728 1 1 10 VAL CA C 2.762 -12.171 -15.356 1.00 . A A . 10 VAL CA 1 1 20 7729 1 1 10 VAL CB C 3.234 -12.039 -13.896 1.00 . A A . 10 VAL CB 1 1 20 7730 1 1 10 VAL CG1 C 2.253 -11.199 -13.091 1.00 . A A . 10 VAL CG1 1 1 20 7731 1 1 10 VAL CG2 C 3.411 -13.414 -13.268 1.00 . A A . 10 VAL CG2 1 1 20 7732 1 1 10 VAL H H 1.765 -10.306 -15.449 1.00 . A A . 10 VAL H 1 1 20 7733 1 1 10 VAL HA H 3.574 -12.580 -15.939 1.00 . A A . 10 VAL HA 1 1 20 7734 1 1 10 VAL HB H 4.191 -11.539 -13.891 1.00 . A A . 10 VAL HB 1 1 20 7735 1 1 10 VAL HG11 H 1.973 -11.733 -12.195 1.00 . A A . 10 VAL HG11 1 1 20 7736 1 1 10 VAL HG12 H 2.718 -10.262 -12.823 1.00 . A A . 10 VAL HG12 1 1 20 7737 1 1 10 VAL HG13 H 1.372 -11.008 -13.686 1.00 . A A . 10 VAL HG13 1 1 20 7738 1 1 10 VAL HG21 H 2.557 -13.638 -12.647 1.00 . A A . 10 VAL HG21 1 1 20 7739 1 1 10 VAL HG22 H 3.495 -14.158 -14.047 1.00 . A A . 10 VAL HG22 1 1 20 7740 1 1 10 VAL HG23 H 4.307 -13.422 -12.665 1.00 . A A . 10 VAL HG23 1 1 20 7741 1 1 10 VAL N N 2.411 -10.873 -15.920 1.00 . A A . 10 VAL N 1 1 20 7742 1 1 10 VAL O O 1.758 -14.343 -15.533 1.00 . A A . 10 VAL O 1 1 20 7743 1 1 11 DAL C C -0.977 -14.043 -16.722 1.00 . A A . 11 DAL C 1 1 20 7744 1 1 11 DAL CA C -0.849 -13.398 -15.366 1.00 . A A . 11 DAL CA 1 1 20 7745 1 1 11 DAL CB C -0.774 -14.483 -14.290 1.00 . A A . 11 DAL CB 1 1 20 7746 1 1 11 DAL H H 0.296 -11.611 -15.230 1.00 . A A . 11 DAL H 1 1 20 7747 1 1 11 DAL HA H -1.716 -12.763 -15.183 1.00 . A A . 11 DAL HA 1 1 20 7748 1 1 11 DAL HB1 H -1.769 -14.890 -14.113 1.00 . A A . 11 DAL HB1 1 1 20 7749 1 1 11 DAL HB2 H -0.110 -15.280 -14.624 1.00 . A A . 11 DAL HB2 1 1 20 7750 1 1 11 DAL N N 0.373 -12.583 -15.325 1.00 . A A . 11 DAL N 1 1 20 7751 1 1 11 DAL O O 0.021 -14.289 -17.401 1.00 . A A . 11 DAL O 1 1 20 7752 1 1 12 HIS C C -2.893 -13.904 -19.450 1.00 . A A . 12 HIS C 1 1 20 7753 1 1 12 HIS CA C -2.472 -14.946 -18.419 1.00 . A A . 12 HIS CA 1 1 20 7754 1 1 12 HIS CB C -3.556 -16.016 -18.284 1.00 . A A . 12 HIS CB 1 1 20 7755 1 1 12 HIS CD2 C -2.840 -17.563 -16.329 1.00 . A A . 12 HIS CD2 1 1 20 7756 1 1 12 HIS CE1 C -2.388 -19.364 -17.495 1.00 . A A . 12 HIS CE1 1 1 20 7757 1 1 12 HIS CG C -3.077 -17.275 -17.630 1.00 . A A . 12 HIS CG 1 1 20 7758 1 1 12 HIS H H -2.967 -14.102 -16.541 1.00 . A A . 12 HIS H 1 1 20 7759 1 1 12 HIS HA H -1.557 -15.414 -18.751 1.00 . A A . 12 HIS HA 1 1 20 7760 1 1 12 HIS HB2 H -4.368 -15.623 -17.690 1.00 . A A . 12 HIS HB2 1 1 20 7761 1 1 12 HIS HB3 H -3.926 -16.270 -19.266 1.00 . A A . 12 HIS HB3 1 1 20 7762 1 1 12 HIS HD1 H -2.856 -18.534 -19.306 1.00 . A A . 12 HIS HD1 1 1 20 7763 1 1 12 HIS HD2 H -2.963 -16.892 -15.491 1.00 . A A . 12 HIS HD2 1 1 20 7764 1 1 12 HIS HE1 H -2.093 -20.367 -17.763 1.00 . A A . 12 HIS HE1 1 1 20 7765 1 1 12 HIS N N -2.212 -14.322 -17.126 1.00 . A A . 12 HIS N 1 1 20 7766 1 1 12 HIS ND1 N -2.784 -18.424 -18.335 1.00 . A A . 12 HIS ND1 1 1 20 7767 1 1 12 HIS NE2 N -2.412 -18.867 -16.272 1.00 . A A . 12 HIS NE2 1 1 20 7768 1 1 12 HIS O O -2.186 -13.664 -20.428 1.00 . A A . 12 HIS O 1 1 20 7769 1 1 13 ASP C C -3.816 -10.957 -19.960 1.00 . A A . 13 ASP C 1 1 20 7770 1 1 13 ASP CA C -4.566 -12.274 -20.135 1.00 . A A . 13 ASP CA 1 1 20 7771 1 1 13 ASP CB C -6.061 -12.059 -19.898 1.00 . A A . 13 ASP CB 1 1 20 7772 1 1 13 ASP CG C -6.857 -13.344 -20.016 1.00 . A A . 13 ASP CG 1 1 20 7773 1 1 13 ASP H H -4.569 -13.526 -18.427 1.00 . A A . 13 ASP H 1 1 20 7774 1 1 13 ASP HA H -4.418 -12.627 -21.144 1.00 . A A . 13 ASP HA 1 1 20 7775 1 1 13 ASP HB2 H -6.208 -11.657 -18.906 1.00 . A A . 13 ASP HB2 1 1 20 7776 1 1 13 ASP HB3 H -6.437 -11.355 -20.626 1.00 . A A . 13 ASP HB3 1 1 20 7777 1 1 13 ASP N N -4.050 -13.291 -19.225 1.00 . A A . 13 ASP N 1 1 20 7778 1 1 13 ASP O O -4.257 -10.072 -19.227 1.00 . A A . 13 ASP O 1 1 20 7779 1 1 13 ASP OD1 O -8.024 -13.363 -19.571 1.00 . A A . 13 ASP OD1 1 1 20 7780 1 1 13 ASP OD2 O -6.313 -14.331 -20.554 1.00 . A A . 13 ASP OD2 1 1 20 7781 1 1 14 CYS C C -1.930 -8.841 -21.862 1.00 . A A . 14 CYS C 1 1 20 7782 1 1 14 CYS CA C -1.866 -9.628 -20.556 1.00 . A A . 14 CYS CA 1 1 20 7783 1 1 14 CYS CB C -0.414 -9.987 -20.235 1.00 . A A . 14 CYS CB 1 1 20 7784 1 1 14 CYS H H -2.379 -11.577 -21.205 1.00 . A A . 14 CYS H 1 1 20 7785 1 1 14 CYS HA H -2.260 -9.015 -19.761 1.00 . A A . 14 CYS HA 1 1 20 7786 1 1 14 CYS HB2 H -0.400 -10.749 -19.469 1.00 . A A . 14 CYS HB2 1 1 20 7787 1 1 14 CYS HB3 H 0.060 -10.371 -21.126 1.00 . A A . 14 CYS HB3 1 1 20 7788 1 1 14 CYS N N -2.679 -10.836 -20.637 1.00 . A A . 14 CYS N 1 1 20 7789 1 1 14 CYS O O -1.506 -9.324 -22.912 1.00 . A A . 14 CYS O 1 1 20 7790 1 1 14 CYS SG S 0.583 -8.585 -19.636 1.00 . A A . 14 CYS SG 1 1 20 7791 1 1 15 HIS C C -2.260 -5.320 -22.615 1.00 . A A . 15 HIS C 1 1 20 7792 1 1 15 HIS CA C -2.581 -6.770 -22.964 1.00 . A A . 15 HIS CA 1 1 20 7793 1 1 15 HIS CB C -3.990 -6.867 -23.550 1.00 . A A . 15 HIS CB 1 1 20 7794 1 1 15 HIS CD2 C -5.899 -5.733 -22.210 1.00 . A A . 15 HIS CD2 1 1 20 7795 1 1 15 HIS CE1 C -6.399 -7.407 -20.885 1.00 . A A . 15 HIS CE1 1 1 20 7796 1 1 15 HIS CG C -5.075 -6.760 -22.523 1.00 . A A . 15 HIS CG 1 1 20 7797 1 1 15 HIS H H -2.782 -7.296 -20.923 1.00 . A A . 15 HIS H 1 1 20 7798 1 1 15 HIS HA H -1.870 -7.116 -23.699 1.00 . A A . 15 HIS HA 1 1 20 7799 1 1 15 HIS HB2 H -4.130 -6.069 -24.265 1.00 . A A . 15 HIS HB2 1 1 20 7800 1 1 15 HIS HB3 H -4.100 -7.817 -24.053 1.00 . A A . 15 HIS HB3 1 1 20 7801 1 1 15 HIS HD1 H -4.993 -8.678 -21.657 1.00 . A A . 15 HIS HD1 1 1 20 7802 1 1 15 HIS HD2 H -5.915 -4.757 -22.675 1.00 . A A . 15 HIS HD2 1 1 20 7803 1 1 15 HIS HE1 H -6.869 -8.007 -20.121 1.00 . A A . 15 HIS HE1 1 1 20 7804 1 1 15 HIS N N -2.462 -7.625 -21.788 1.00 . A A . 15 HIS N 1 1 20 7805 1 1 15 HIS ND1 N -5.413 -7.793 -21.675 1.00 . A A . 15 HIS ND1 1 1 20 7806 1 1 15 HIS NE2 N -6.712 -6.160 -21.189 1.00 . A A . 15 HIS NE2 1 1 20 7807 1 1 15 HIS O O -1.544 -4.639 -23.348 1.00 . A A . 15 HIS O 1 1 20 7808 1 1 16 MET C C -3.205 -3.242 -19.683 1.00 . A A . 16 MET C 1 1 20 7809 1 1 16 MET CA C -2.567 -3.484 -21.047 1.00 . A A . 16 MET CA 1 1 20 7810 1 1 16 MET CB C -3.128 -2.492 -22.068 1.00 . A A . 16 MET CB 1 1 20 7811 1 1 16 MET CE C -3.817 1.012 -23.097 1.00 . A A . 16 MET CE 1 1 20 7812 1 1 16 MET CG C -2.423 -1.145 -22.057 1.00 . A A . 16 MET CG 1 1 20 7813 1 1 16 MET H H -3.360 -5.444 -20.949 1.00 . A A . 16 MET H 1 1 20 7814 1 1 16 MET HA H -1.501 -3.338 -20.964 1.00 . A A . 16 MET HA 1 1 20 7815 1 1 16 MET HB2 H -3.030 -2.917 -23.056 1.00 . A A . 16 MET HB2 1 1 20 7816 1 1 16 MET HB3 H -4.174 -2.329 -21.857 1.00 . A A . 16 MET HB3 1 1 20 7817 1 1 16 MET HE1 H -4.109 1.598 -23.956 1.00 . A A . 16 MET HE1 1 1 20 7818 1 1 16 MET HE2 H -4.688 0.535 -22.673 1.00 . A A . 16 MET HE2 1 1 20 7819 1 1 16 MET HE3 H -3.364 1.658 -22.358 1.00 . A A . 16 MET HE3 1 1 20 7820 1 1 16 MET HG2 H -2.823 -0.551 -21.249 1.00 . A A . 16 MET HG2 1 1 20 7821 1 1 16 MET HG3 H -1.368 -1.308 -21.893 1.00 . A A . 16 MET HG3 1 1 20 7822 1 1 16 MET N N -2.797 -4.854 -21.492 1.00 . A A . 16 MET N 1 1 20 7823 1 1 16 MET O O -4.196 -2.522 -19.570 1.00 . A A . 16 MET O 1 1 20 7824 1 1 16 MET SD S -2.636 -0.237 -23.600 1.00 . A A . 16 MET SD 1 1 20 7825 1 1 17 ASN C C -2.018 -3.826 -16.269 1.00 . A A . 17 ASN C 1 1 20 7826 1 1 17 ASN CA C -3.142 -3.698 -17.292 1.00 . A A . 17 ASN CA 1 1 20 7827 1 1 17 ASN CB C -4.222 -4.746 -17.015 1.00 . A A . 17 ASN CB 1 1 20 7828 1 1 17 ASN CG C -5.196 -4.892 -18.168 1.00 . A A . 17 ASN CG 1 1 20 7829 1 1 17 ASN H H -1.840 -4.410 -18.803 1.00 . A A . 17 ASN H 1 1 20 7830 1 1 17 ASN HA H -3.578 -2.714 -17.210 1.00 . A A . 17 ASN HA 1 1 20 7831 1 1 17 ASN HB2 H -3.750 -5.703 -16.844 1.00 . A A . 17 ASN HB2 1 1 20 7832 1 1 17 ASN HB3 H -4.775 -4.460 -16.133 1.00 . A A . 17 ASN HB3 1 1 20 7833 1 1 17 ASN HD21 H -6.605 -3.950 -17.128 1.00 . A A . 17 ASN HD21 1 1 20 7834 1 1 17 ASN HD22 H -7.059 -4.466 -18.714 1.00 . A A . 17 ASN HD22 1 1 20 7835 1 1 17 ASN N N -2.629 -3.848 -18.649 1.00 . A A . 17 ASN N 1 1 20 7836 1 1 17 ASN ND2 N -6.409 -4.385 -17.985 1.00 . A A . 17 ASN ND2 1 1 20 7837 1 1 17 ASN O O -0.840 -3.806 -16.621 1.00 . A A . 17 ASN O 1 1 20 7838 1 1 17 ASN OD1 O -4.861 -5.455 -19.210 1.00 . A A . 17 ASN OD1 1 1 20 7839 1 1 18 DAL C C -1.700 -3.070 -12.846 1.00 . A A . 18 DAL C 1 1 20 7840 1 1 18 DAL CA C -1.409 -4.090 -13.916 1.00 . A A . 18 DAL CA 1 1 20 7841 1 1 18 DAL CB C -1.496 -5.496 -13.319 1.00 . A A . 18 DAL CB 1 1 20 7842 1 1 18 DAL H H -3.348 -3.966 -14.782 1.00 . A A . 18 DAL H 1 1 20 7843 1 1 18 DAL HA H -0.407 -3.925 -14.313 1.00 . A A . 18 DAL HA 1 1 20 7844 1 1 18 DAL HB1 H -0.578 -6.041 -13.536 1.00 . A A . 18 DAL HB1 1 1 20 7845 1 1 18 DAL HB2 H -1.630 -5.424 -12.240 1.00 . A A . 18 DAL HB2 1 1 20 7846 1 1 18 DAL N N -2.393 -3.957 -15.000 1.00 . A A . 18 DAL N 1 1 20 7847 1 1 18 DAL O O -0.958 -2.102 -12.678 1.00 . A A . 18 DAL O 1 1 20 7848 1 1 19 PHE C C -2.902 -2.981 -9.677 1.00 . A A . 19 PHE C 1 1 20 7849 1 1 19 PHE CA C -3.182 -2.370 -11.046 1.00 . A A . 19 PHE CA 1 1 20 7850 1 1 19 PHE CB C -4.667 -2.020 -11.167 1.00 . A A . 19 PHE CB 1 1 20 7851 1 1 19 PHE CD1 C -5.177 -0.280 -12.901 1.00 . A A . 19 PHE CD1 1 1 20 7852 1 1 19 PHE CD2 C -5.362 -2.577 -13.513 1.00 . A A . 19 PHE CD2 1 1 20 7853 1 1 19 PHE CE1 C -5.554 0.094 -14.178 1.00 . A A . 19 PHE CE1 1 1 20 7854 1 1 19 PHE CE2 C -5.739 -2.209 -14.791 1.00 . A A . 19 PHE CE2 1 1 20 7855 1 1 19 PHE CG C -5.077 -1.618 -12.555 1.00 . A A . 19 PHE CG 1 1 20 7856 1 1 19 PHE CZ C -5.836 -0.872 -15.123 1.00 . A A . 19 PHE CZ 1 1 20 7857 1 1 19 PHE H H -3.340 -4.072 -12.295 1.00 . A A . 19 PHE H 1 1 20 7858 1 1 19 PHE HA H -2.599 -1.468 -11.151 1.00 . A A . 19 PHE HA 1 1 20 7859 1 1 19 PHE HB2 H -5.256 -2.880 -10.884 1.00 . A A . 19 PHE HB2 1 1 20 7860 1 1 19 PHE HB3 H -4.891 -1.200 -10.502 1.00 . A A . 19 PHE HB3 1 1 20 7861 1 1 19 PHE HD1 H -4.957 0.477 -12.162 1.00 . A A . 19 PHE HD1 1 1 20 7862 1 1 19 PHE HD2 H -5.288 -3.623 -13.255 1.00 . A A . 19 PHE HD2 1 1 20 7863 1 1 19 PHE HE1 H -5.628 1.140 -14.434 1.00 . A A . 19 PHE HE1 1 1 20 7864 1 1 19 PHE HE2 H -5.959 -2.967 -15.529 1.00 . A A . 19 PHE HE2 1 1 20 7865 1 1 19 PHE HZ H -6.129 -0.582 -16.121 1.00 . A A . 19 PHE HZ 1 1 20 7866 1 1 19 PHE N N -2.788 -3.283 -12.113 1.00 . A A . 19 PHE N 1 1 20 7867 1 1 19 PHE O O -2.391 -2.311 -8.780 1.00 . A A . 19 PHE O 1 1 20 7868 1 1 20 GLN C C -3.097 -6.469 -8.463 1.00 . A A . 20 GLN C 1 1 20 7869 1 1 20 GLN CA C -3.028 -4.959 -8.264 1.00 . A A . 20 GLN CA 1 1 20 7870 1 1 20 GLN CB C -4.066 -4.521 -7.230 1.00 . A A . 20 GLN CB 1 1 20 7871 1 1 20 GLN CD C -4.482 -3.639 -4.899 1.00 . A A . 20 GLN CD 1 1 20 7872 1 1 20 GLN CG C -3.459 -3.881 -5.992 1.00 . A A . 20 GLN CG 1 1 20 7873 1 1 20 GLN H H -3.645 -4.738 -10.276 1.00 . A A . 20 GLN H 1 1 20 7874 1 1 20 GLN HA H -2.043 -4.701 -7.904 1.00 . A A . 20 GLN HA 1 1 20 7875 1 1 20 GLN HB2 H -4.734 -3.807 -7.688 1.00 . A A . 20 GLN HB2 1 1 20 7876 1 1 20 GLN HB3 H -4.634 -5.385 -6.920 1.00 . A A . 20 GLN HB3 1 1 20 7877 1 1 20 GLN HE21 H -4.621 -1.725 -5.420 1.00 . A A . 20 GLN HE21 1 1 20 7878 1 1 20 GLN HE22 H -5.617 -2.217 -4.097 1.00 . A A . 20 GLN HE22 1 1 20 7879 1 1 20 GLN HG2 H -2.690 -4.533 -5.605 1.00 . A A . 20 GLN HG2 1 1 20 7880 1 1 20 GLN HG3 H -3.020 -2.935 -6.270 1.00 . A A . 20 GLN HG3 1 1 20 7881 1 1 20 GLN N N -3.241 -4.257 -9.524 1.00 . A A . 20 GLN N 1 1 20 7882 1 1 20 GLN NE2 N -4.954 -2.402 -4.794 1.00 . A A . 20 GLN NE2 1 1 20 7883 1 1 20 GLN O O -3.912 -6.967 -9.240 1.00 . A A . 20 GLN O 1 1 20 7884 1 1 20 GLN OE1 O -4.844 -4.553 -4.158 1.00 . A A . 20 GLN OE1 1 1 20 7885 1 1 21 PHE C C -2.936 -9.294 -6.688 1.00 . A A . 21 PHE C 1 1 20 7886 1 1 21 PHE CA C -2.198 -8.649 -7.858 1.00 . A A . 21 PHE CA 1 1 20 7887 1 1 21 PHE CB C -0.750 -9.141 -7.895 1.00 . A A . 21 PHE CB 1 1 20 7888 1 1 21 PHE CD1 C 0.408 -9.105 -10.121 1.00 . A A . 21 PHE CD1 1 1 20 7889 1 1 21 PHE CD2 C 0.557 -7.171 -8.735 1.00 . A A . 21 PHE CD2 1 1 20 7890 1 1 21 PHE CE1 C 1.178 -8.480 -11.083 1.00 . A A . 21 PHE CE1 1 1 20 7891 1 1 21 PHE CE2 C 1.328 -6.541 -9.693 1.00 . A A . 21 PHE CE2 1 1 20 7892 1 1 21 PHE CG C 0.088 -8.459 -8.938 1.00 . A A . 21 PHE CG 1 1 20 7893 1 1 21 PHE CZ C 1.640 -7.196 -10.868 1.00 . A A . 21 PHE CZ 1 1 20 7894 1 1 21 PHE H H -1.610 -6.740 -7.154 1.00 . A A . 21 PHE H 1 1 20 7895 1 1 21 PHE HA H -2.689 -8.930 -8.777 1.00 . A A . 21 PHE HA 1 1 20 7896 1 1 21 PHE HB2 H -0.292 -8.964 -6.934 1.00 . A A . 21 PHE HB2 1 1 20 7897 1 1 21 PHE HB3 H -0.743 -10.201 -8.103 1.00 . A A . 21 PHE HB3 1 1 20 7898 1 1 21 PHE HD1 H 0.047 -10.110 -10.290 1.00 . A A . 21 PHE HD1 1 1 20 7899 1 1 21 PHE HD2 H 0.315 -6.657 -7.816 1.00 . A A . 21 PHE HD2 1 1 20 7900 1 1 21 PHE HE1 H 1.420 -8.995 -12.001 1.00 . A A . 21 PHE HE1 1 1 20 7901 1 1 21 PHE HE2 H 1.688 -5.537 -9.522 1.00 . A A . 21 PHE HE2 1 1 20 7902 1 1 21 PHE HZ H 2.242 -6.705 -11.618 1.00 . A A . 21 PHE HZ 1 1 20 7903 1 1 21 PHE N N -2.236 -7.195 -7.757 1.00 . A A . 21 PHE N 1 1 20 7904 1 1 21 PHE O O -2.661 -8.997 -5.526 1.00 . A A . 21 PHE O 1 1 20 7905 1 1 22 VAL C C -3.870 -12.029 -5.384 1.00 . A A . 22 VAL C 1 1 20 7906 1 1 22 VAL CA C -4.655 -10.867 -5.982 1.00 . A A . 22 VAL CA 1 1 20 7907 1 1 22 VAL CB C -5.984 -11.398 -6.551 1.00 . A A . 22 VAL CB 1 1 20 7908 1 1 22 VAL CG1 C -6.751 -12.168 -5.487 1.00 . A A . 22 VAL CG1 1 1 20 7909 1 1 22 VAL CG2 C -6.823 -10.254 -7.101 1.00 . A A . 22 VAL CG2 1 1 20 7910 1 1 22 VAL H H -4.050 -10.373 -7.950 1.00 . A A . 22 VAL H 1 1 20 7911 1 1 22 VAL HA H -4.880 -10.157 -5.200 1.00 . A A . 22 VAL HA 1 1 20 7912 1 1 22 VAL HB H -5.760 -12.075 -7.362 1.00 . A A . 22 VAL HB 1 1 20 7913 1 1 22 VAL HG11 H -6.769 -13.217 -5.744 1.00 . A A . 22 VAL HG11 1 1 20 7914 1 1 22 VAL HG12 H -6.266 -12.039 -4.530 1.00 . A A . 22 VAL HG12 1 1 20 7915 1 1 22 VAL HG13 H -7.763 -11.794 -5.431 1.00 . A A . 22 VAL HG13 1 1 20 7916 1 1 22 VAL HG21 H -7.717 -10.651 -7.557 1.00 . A A . 22 VAL HG21 1 1 20 7917 1 1 22 VAL HG22 H -7.095 -9.587 -6.296 1.00 . A A . 22 VAL HG22 1 1 20 7918 1 1 22 VAL HG23 H -6.252 -9.711 -7.839 1.00 . A A . 22 VAL HG23 1 1 20 7919 1 1 22 VAL N N -3.877 -10.179 -7.005 1.00 . A A . 22 VAL N 1 1 20 7920 1 1 22 VAL O O -3.384 -11.948 -4.256 1.00 . A A . 22 VAL O 1 1 20 7921 1 1 23 PHE C C -1.713 -14.449 -6.456 1.00 . A A . 23 PHE C 1 1 20 7922 1 1 23 PHE CA C -3.025 -14.290 -5.693 1.00 . A A . 23 PHE CA 1 1 20 7923 1 1 23 PHE CB C -3.885 -15.543 -5.869 1.00 . A A . 23 PHE CB 1 1 20 7924 1 1 23 PHE CD1 C -5.427 -14.915 -3.992 1.00 . A A . 23 PHE CD1 1 1 20 7925 1 1 23 PHE CD2 C -6.378 -15.799 -5.991 1.00 . A A . 23 PHE CD2 1 1 20 7926 1 1 23 PHE CE1 C -6.689 -14.797 -3.440 1.00 . A A . 23 PHE CE1 1 1 20 7927 1 1 23 PHE CE2 C -7.642 -15.683 -5.445 1.00 . A A . 23 PHE CE2 1 1 20 7928 1 1 23 PHE CG C -5.257 -15.417 -5.272 1.00 . A A . 23 PHE CG 1 1 20 7929 1 1 23 PHE CZ C -7.797 -15.183 -4.167 1.00 . A A . 23 PHE CZ 1 1 20 7930 1 1 23 PHE H H -4.160 -13.114 -7.038 1.00 . A A . 23 PHE H 1 1 20 7931 1 1 23 PHE HA H -2.804 -14.160 -4.645 1.00 . A A . 23 PHE HA 1 1 20 7932 1 1 23 PHE HB2 H -4.000 -15.747 -6.923 1.00 . A A . 23 PHE HB2 1 1 20 7933 1 1 23 PHE HB3 H -3.392 -16.379 -5.396 1.00 . A A . 23 PHE HB3 1 1 20 7934 1 1 23 PHE HD1 H -4.559 -14.613 -3.422 1.00 . A A . 23 PHE HD1 1 1 20 7935 1 1 23 PHE HD2 H -6.258 -16.192 -6.990 1.00 . A A . 23 PHE HD2 1 1 20 7936 1 1 23 PHE HE1 H -6.806 -14.405 -2.440 1.00 . A A . 23 PHE HE1 1 1 20 7937 1 1 23 PHE HE2 H -8.508 -15.986 -6.015 1.00 . A A . 23 PHE HE2 1 1 20 7938 1 1 23 PHE HZ H -8.784 -15.090 -3.738 1.00 . A A . 23 PHE HZ 1 1 20 7939 1 1 23 PHE N N -3.750 -13.110 -6.148 1.00 . A A . 23 PHE N 1 1 20 7940 1 1 23 PHE O O -1.182 -15.553 -6.575 1.00 . A A . 23 PHE O 1 1 20 7941 1 1 24 DBU C C -0.042 -12.761 -9.046 1.00 . A A . 24 DBU C 1 1 20 7942 1 1 24 DBU CA C -0.027 -13.353 -7.675 1.00 . A A . 24 DBU CA 1 1 20 7943 1 1 24 DBU CB C 1.155 -13.847 -7.264 1.00 . A A . 24 DBU CB 1 1 20 7944 1 1 24 DBU CG C 1.435 -14.488 -5.941 1.00 . A A . 24 DBU CG 1 1 20 7945 1 1 24 DBU HG1 H 0.707 -14.227 -5.169 1.00 . A A . 24 DBU HG1 1 1 20 7946 1 1 24 DBU HG2 H 2.425 -14.185 -5.587 1.00 . A A . 24 DBU HG2 1 1 20 7947 1 1 24 DBU HG3 H 1.430 -15.577 -6.052 1.00 . A A . 24 DBU HG3 1 1 20 7948 1 1 24 DBU N N -1.196 -13.338 -6.971 1.00 . A A . 24 DBU N 1 1 20 7949 1 1 24 DBU O O 0.843 -11.985 -9.408 1.00 . A A . 24 DBU O 1 1 20 7950 1 1 25 CYS C C -1.881 -11.260 -11.202 1.00 . A A . 25 CYS C 1 1 20 7951 1 1 25 CYS CA C -1.184 -12.617 -11.191 1.00 . A A . 25 CYS CA 1 1 20 7952 1 1 25 CYS CB C -1.965 -13.611 -12.053 1.00 . A A . 25 CYS CB 1 1 20 7953 1 1 25 CYS H H -1.727 -13.745 -9.484 1.00 . A A . 25 CYS H 1 1 20 7954 1 1 25 CYS HA H -0.192 -12.501 -11.599 1.00 . A A . 25 CYS HA 1 1 20 7955 1 1 25 CYS HB2 H -2.864 -13.901 -11.529 1.00 . A A . 25 CYS HB2 1 1 20 7956 1 1 25 CYS HB3 H -2.234 -13.134 -12.984 1.00 . A A . 25 CYS HB3 1 1 20 7957 1 1 25 CYS N N -1.053 -13.122 -9.829 1.00 . A A . 25 CYS N 1 1 20 7958 1 1 25 CYS O O -2.177 -10.693 -10.150 1.00 . A A . 25 CYS O 1 1 20 7959 1 1 25 CYS SG S -1.044 -15.131 -12.453 1.00 . A A . 25 CYS SG 1 1 20 7960 1 1 26 CYS C C -4.265 -9.635 -12.945 1.00 . A A . 26 CYS C 1 1 20 7961 1 1 26 CYS CA C -2.802 -9.454 -12.549 1.00 . A A . 26 CYS CA 1 1 20 7962 1 1 26 CYS CB C -2.080 -8.605 -13.597 1.00 . A A . 26 CYS CB 1 1 20 7963 1 1 26 CYS H H -1.880 -11.244 -13.202 1.00 . A A . 26 CYS H 1 1 20 7964 1 1 26 CYS HA H -2.761 -8.946 -11.597 1.00 . A A . 26 CYS HA 1 1 20 7965 1 1 26 CYS HB2 H -1.033 -8.541 -13.338 1.00 . A A . 26 CYS HB2 1 1 20 7966 1 1 26 CYS HB3 H -2.177 -9.080 -14.562 1.00 . A A . 26 CYS HB3 1 1 20 7967 1 1 26 CYS N N -2.141 -10.744 -12.399 1.00 . A A . 26 CYS N 1 1 20 7968 1 1 26 CYS O O -4.590 -9.742 -14.128 1.00 . A A . 26 CYS O 1 1 20 7969 1 1 26 CYS SG S -2.718 -6.906 -13.747 1.00 . A A . 26 CYS SG 1 1 20 7970 1 1 27 SER C C -6.843 -11.156 -12.917 1.00 . A A . 27 SER C 1 1 20 7971 1 1 27 SER CA C -6.570 -9.842 -12.191 1.00 . A A . 27 SER CA 1 1 20 7972 1 1 27 SER CB C -7.114 -8.671 -13.011 1.00 . A A . 27 SER CB 1 1 20 7973 1 1 27 SER H H -4.822 -9.580 -11.026 1.00 . A A . 27 SER H 1 1 20 7974 1 1 27 SER HA H -7.069 -9.863 -11.234 1.00 . A A . 27 SER HA 1 1 20 7975 1 1 27 SER HB2 H -6.580 -7.771 -12.747 1.00 . A A . 27 SER HB2 1 1 20 7976 1 1 27 SER HB3 H -6.975 -8.876 -14.063 1.00 . A A . 27 SER HB3 1 1 20 7977 1 1 27 SER HG H -8.965 -8.414 -13.599 1.00 . A A . 27 SER HG 1 1 20 7978 1 1 27 SER N N -5.143 -9.670 -11.948 1.00 . A A . 27 SER N 1 1 20 7979 1 1 27 SER O O -7.728 -11.918 -12.531 1.00 . A A . 27 SER O 1 1 20 7980 1 1 27 SER OG O -8.495 -8.473 -12.764 1.00 . A A . 27 SER OG 1 1 stop_ save_
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