NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
519965 | 2lds | 17681 | cing | 4-filtered-FRED | STAR | entry | full | 149 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2lds # This FRED archive file contains, for PDB entry <2lds>: # # - 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_2lds _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2lds _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 4121.39 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 $Insecticidal_toxin_LaIT1 A . 1 1 stop_ save_ save_Insecticidal_toxin_LaIT1 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Insecticidal toxin LaIT1" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code DFPLSKEYETCVRPRKCQPPLKCNKAQICVDPKKGW _Entity.Number_of_monomers 36 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 ASP . 1 1 2 PHE . 1 1 3 PRO . 1 1 4 LEU . 1 1 5 SER . 1 1 6 LYS . 1 1 7 GLU . 1 1 8 TYR . 1 1 9 GLU . 1 1 10 THR . 1 1 11 CYS . 1 1 12 VAL . 1 1 13 ARG . 1 1 14 PRO . 1 1 15 ARG . 1 1 16 LYS . 1 1 17 CYS . 1 1 18 GLN . 1 1 19 PRO . 1 1 20 PRO . 1 1 21 LEU . 1 1 22 LYS . 1 1 23 CYS . 1 1 24 ASN . 1 1 25 LYS . 1 1 26 ALA . 1 1 27 GLN . 1 1 28 ILE . 1 1 29 CYS . 1 1 30 VAL . 1 1 31 ASP . 1 1 32 PRO . 1 1 33 LYS . 1 1 34 LYS . 1 1 35 GLY . 1 1 36 TRP . 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 ASP 1 1 1 1 PHE 2 2 1 1 PRO 3 3 1 1 LEU 4 4 1 1 SER 5 5 1 1 LYS 6 6 1 1 GLU 7 7 1 1 TYR 8 8 1 1 GLU 9 9 1 1 THR 10 10 1 1 CYS 11 11 1 1 VAL 12 12 1 1 ARG 13 13 1 1 PRO 14 14 1 1 ARG 15 15 1 1 LYS 16 16 1 1 CYS 17 17 1 1 GLN 18 18 1 1 PRO 19 19 1 1 PRO 20 20 1 1 LEU 21 21 1 1 LYS 22 22 1 1 CYS 23 23 1 1 ASN 24 24 1 1 LYS 25 25 1 1 ALA 26 26 1 1 GLN 27 27 1 1 ILE 28 28 1 1 CYS 29 29 1 1 VAL 30 30 1 1 ASP 31 31 1 1 PRO 32 32 1 1 LYS 33 33 1 1 LYS 34 34 1 1 GLY 35 35 1 1 TRP 36 36 1 1 stop_ save_ save_DYANA/DIANA_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 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 12 VAL HB . 12 VAL HB 1 1 1 1 2 1 1 13 ARG H . 13 ARG H 1 1 2 1 1 1 1 12 VAL QG . 12 VAL QQG 1 1 2 1 2 1 1 13 ARG H . 13 ARG H 1 1 3 1 1 1 1 22 LYS H . 22 LYS H 1 1 3 1 2 1 1 29 CYS HA . 29 CYSS HA 1 1 4 1 1 1 1 24 ASN H . 24 ASN H 1 1 4 1 2 1 1 29 CYS HA . 29 CYSS HA 1 1 5 1 1 1 1 26 ALA MB . 26 ALA QB 1 1 5 1 2 1 1 27 GLN H . 27 GLN H 1 1 6 1 1 1 1 1 ASP H1 . 1 ASP H 1 1 6 1 2 1 1 2 PHE HA . 2 PHE HA 1 1 7 1 1 1 1 12 VAL H . 12 VAL H 1 1 7 1 2 1 1 13 ARG HA . 13 ARG HA 1 1 8 1 1 1 1 28 ILE MG . 28 ILE QG2 1 1 8 1 2 1 1 30 VAL H . 30 VAL H 1 1 9 1 1 1 1 11 CYS H . 11 CYSS H 1 1 9 1 2 1 1 12 VAL H . 12 VAL H 1 1 10 1 1 1 1 35 GLY H . 35 GLY H 1 1 10 1 2 1 1 36 TRP H . 36 TRP H 1 1 11 1 1 1 1 33 LYS H . 33 LYS H 1 1 11 1 2 1 1 34 LYS H . 34 LYS H 1 1 12 1 1 1 1 22 LYS H . 22 LYS H 1 1 12 1 2 1 1 30 VAL H . 30 VAL H 1 1 13 1 1 1 1 8 TYR H . 8 TYR H 1 1 13 1 2 1 1 28 ILE MG . 28 ILE QG2 1 1 14 1 1 1 1 8 TYR H . 8 TYR H 1 1 14 1 2 1 1 28 ILE HB . 28 ILE HB 1 1 15 1 1 1 1 9 GLU H . 9 GLU H 1 1 15 1 2 1 1 28 ILE MG . 28 ILE QG2 1 1 16 1 1 1 1 8 TYR H . 8 TYR H 1 1 16 1 2 1 1 9 GLU H . 9 GLU H 1 1 17 1 1 1 1 10 THR H . 10 THR H 1 1 17 1 2 1 1 28 ILE MG . 28 ILE QG2 1 1 18 1 1 1 1 10 THR H . 10 THR H 1 1 18 1 2 1 1 27 GLN HA . 27 GLN HA 1 1 19 1 1 1 1 11 CYS H . 11 CYSS H 1 1 19 1 2 1 1 27 GLN HA . 27 GLN HA 1 1 20 1 1 1 1 11 CYS H . 11 CYSS H 1 1 20 1 2 1 1 28 ILE MG . 28 ILE QG2 1 1 21 1 1 1 1 11 CYS H . 11 CYSS H 1 1 21 1 2 1 1 12 VAL QG . 12 VAL QQG 1 1 22 1 1 1 1 10 THR MG . 10 THR QG2 1 1 22 1 2 1 1 11 CYS H . 11 CYSS H 1 1 23 1 1 1 1 12 VAL QG . 12 VAL QQG 1 1 23 1 2 1 1 15 ARG H . 15 ARG H 1 1 24 1 1 1 1 12 VAL HB . 12 VAL HB 1 1 24 1 2 1 1 15 ARG H . 15 ARG H 1 1 25 1 1 1 1 18 GLN H . 18 GLN H 1 1 25 1 2 1 1 21 LEU HG . 21 LEU HG 1 1 26 1 1 1 1 22 LYS H . 22 LYS H 1 1 26 1 2 1 1 28 ILE MG . 28 ILE QG2 1 1 27 1 1 1 1 24 ASN H . 24 ASN H 1 1 27 1 2 1 1 28 ILE MG . 28 ILE QG2 1 1 28 1 1 1 1 25 LYS H . 25 LYS H 1 1 28 1 2 1 1 26 ALA H . 26 ALA H 1 1 29 1 1 1 1 24 ASN HB3 . 24 ASN HB3 1 1 29 1 2 1 1 26 ALA H . 26 ALA H 1 1 30 1 1 1 1 27 GLN H . 27 GLN H 1 1 30 1 2 1 1 28 ILE MG . 28 ILE QG2 1 1 31 1 1 1 1 27 GLN H . 27 GLN H 1 1 31 1 2 1 1 28 ILE HA . 28 ILE HA 1 1 32 1 1 1 1 24 ASN H . 24 ASN H 1 1 32 1 2 1 1 28 ILE H . 28 ILE H 1 1 33 1 1 1 1 28 ILE MG . 28 ILE QG2 1 1 33 1 2 1 1 29 CYS H . 29 CYSS H 1 1 34 1 1 1 1 8 TYR HA . 8 TYR HA 1 1 34 1 2 1 1 29 CYS H . 29 CYSS H 1 1 35 1 1 1 1 29 CYS H . 29 CYSS H 1 1 35 1 2 1 1 30 VAL H . 30 VAL H 1 1 36 1 1 1 1 28 ILE MG . 28 ILE QG2 1 1 36 1 2 1 1 31 ASP H . 31 ASP H 1 1 37 1 1 1 1 31 ASP HB3 . 31 ASP HB3 1 1 37 1 2 1 1 33 LYS H . 33 LYS H 1 1 38 1 1 1 1 30 VAL HB . 30 VAL HB 1 1 38 1 2 1 1 36 TRP H . 36 TRP H 1 1 39 1 1 1 1 28 ILE MG . 28 ILE QG2 1 1 39 1 2 1 1 36 TRP H . 36 TRP H 1 1 40 1 1 1 1 12 VAL H . 12 VAL H 1 1 40 1 2 1 1 13 ARG H . 13 ARG H 1 1 41 1 1 1 1 26 ALA H . 26 ALA H 1 1 41 1 2 1 1 27 GLN H . 27 GLN H 1 1 42 1 1 1 1 27 GLN H . 27 GLN H 1 1 42 1 2 1 1 28 ILE H . 28 ILE H 1 1 43 1 1 1 1 23 CYS H . 23 CYSS H 1 1 43 1 2 1 1 29 CYS HA . 29 CYSS HA 1 1 44 1 1 1 1 9 GLU H . 9 GLU H 1 1 44 1 2 1 1 28 ILE HB . 28 ILE HB 1 1 45 1 1 1 1 2 PHE HB3 . 2 PHE HB3 1 1 45 1 2 1 1 16 LYS H . 16 LYS H 1 1 46 1 1 1 1 11 CYS HB3 . 11 CYSS HB3 1 1 46 1 2 1 1 16 LYS H . 16 LYS H 1 1 47 1 1 1 1 25 LYS HA . 25 LYS HA 1 1 47 1 2 1 1 27 GLN H . 27 GLN H 1 1 48 1 1 1 1 32 PRO HA . 32 PRO HA 1 1 48 1 2 1 1 34 LYS H . 34 LYS H 1 1 49 1 1 1 1 32 PRO HA . 32 PRO HA 1 1 49 1 2 1 1 35 GLY H . 35 GLY H 1 1 50 1 1 1 1 12 VAL QG . 12 VAL QQG 1 1 50 1 2 1 1 27 GLN HE21 . 27 GLN HE21 1 1 51 1 1 1 1 12 VAL QG . 12 VAL QQG 1 1 51 1 2 1 1 27 GLN HE22 . 27 GLN HE22 1 1 52 1 1 1 1 10 THR HB . 10 THR HB 1 1 52 1 2 1 1 12 VAL H . 12 VAL H 1 1 53 1 1 1 1 10 THR HB . 10 THR HB 1 1 53 1 2 1 1 28 ILE MD . 28 ILE QD1 1 1 54 1 1 1 1 10 THR HB . 10 THR HB 1 1 54 1 2 1 1 11 CYS H . 11 CYSS H 1 1 55 1 1 1 1 10 THR HA . 10 THR HA 1 1 55 1 2 1 1 28 ILE MG . 28 ILE QG2 1 1 56 1 1 1 1 28 ILE MG . 28 ILE QG2 1 1 56 1 2 1 1 36 TRP HA . 36 TRP HA 1 1 57 1 1 1 1 28 ILE MG . 28 ILE QG2 1 1 57 1 2 1 1 29 CYS HA . 29 CYSS HA 1 1 58 1 1 1 1 8 TYR HB3 . 8 TYR HB3 1 1 58 1 2 1 1 28 ILE MG . 28 ILE QG2 1 1 59 1 1 1 1 12 VAL QG . 12 VAL QQG 1 1 59 1 2 1 1 27 GLN HG3 . 27 GLN HG3 1 1 60 1 1 1 1 27 GLN HA . 27 GLN HA 1 1 60 1 2 1 1 27 GLN HG3 . 27 GLN HG3 1 1 61 1 1 1 1 26 ALA HA . 26 ALA HA 1 1 61 1 2 1 1 27 GLN HG3 . 27 GLN HG3 1 1 62 1 1 1 1 17 CYS HB3 . 17 CYSS HB3 1 1 62 1 2 1 1 21 LEU HB3 . 21 LEU HB3 1 1 63 1 1 1 1 24 ASN HB3 . 24 ASN HB3 1 1 63 1 2 1 1 28 ILE MG . 28 ILE QG2 1 1 64 1 1 1 1 31 ASP HA . 31 ASP HA 1 1 64 1 2 1 1 32 PRO HD3 . 32 PRO HD3 1 1 65 1 1 1 1 30 VAL HB . 30 VAL HB 1 1 65 1 2 1 1 31 ASP HA . 31 ASP HA 1 1 66 1 1 1 1 8 TYR HA . 8 TYR HA 1 1 66 1 2 1 1 28 ILE HB . 28 ILE HB 1 1 67 1 1 1 1 24 ASN HD21 . 24 ASN HD21 1 1 67 1 2 1 1 28 ILE HG13 . 28 ILE HG13 1 1 68 1 1 1 1 15 ARG H . 15 ARG H 1 1 68 1 2 1 1 15 ARG HB3 . 15 ARG HB3 1 1 69 1 1 1 1 5 SER H . 5 SER H 1 1 69 1 2 1 1 5 SER HB3 . 5 SER HB3 1 1 70 1 1 1 1 5 SER HB3 . 5 SER HB3 1 1 70 1 2 1 1 6 LYS H . 6 LYS H 1 1 71 1 1 1 1 12 VAL HA . 12 VAL HA 1 1 71 1 2 1 1 13 ARG H . 13 ARG H 1 1 72 1 1 1 1 7 GLU HA . 7 GLU HA 1 1 72 1 2 1 1 8 TYR H . 8 TYR H 1 1 73 1 1 1 1 26 ALA H . 26 ALA H 1 1 73 1 2 1 1 27 GLN HA . 27 GLN HA 1 1 74 1 1 1 1 10 THR HA . 10 THR HA 1 1 74 1 2 1 1 12 VAL H . 12 VAL H 1 1 75 1 1 1 1 6 LYS HA . 6 LYS HA 1 1 75 1 2 1 1 7 GLU H . 7 GLU H 1 1 76 1 1 1 1 25 LYS H . 25 LYS H 1 1 76 1 2 1 1 26 ALA HA . 26 ALA HA 1 1 77 1 1 1 1 24 ASN H . 24 ASN H 1 1 77 1 2 1 1 27 GLN HA . 27 GLN HA 1 1 78 1 1 1 1 2 PHE HA . 2 PHE HA 1 1 78 1 2 1 1 3 PRO HD3 . 3 PRO HD3 1 1 79 1 1 1 1 8 TYR HB3 . 8 TYR HB3 1 1 79 1 2 1 1 9 GLU H . 9 GLU H 1 1 80 1 1 1 1 11 CYS HB3 . 11 CYSS HB3 1 1 80 1 2 1 1 17 CYS H . 17 CYSS H 1 1 81 1 1 1 1 11 CYS HB3 . 11 CYSS HB3 1 1 81 1 2 1 1 12 VAL H . 12 VAL H 1 1 82 1 1 1 1 23 CYS H . 23 CYSS H 1 1 82 1 2 1 1 23 CYS HB3 . 23 CYSS HB3 1 1 83 1 1 1 1 31 ASP H . 31 ASP H 1 1 83 1 2 1 1 31 ASP HB3 . 31 ASP HB3 1 1 84 1 1 1 1 31 ASP HB3 . 31 ASP HB3 1 1 84 1 2 1 1 34 LYS H . 34 LYS H 1 1 85 1 1 1 1 4 LEU HB3 . 4 LEU HB3 1 1 85 1 2 1 1 5 SER H . 5 SER H 1 1 86 1 1 1 1 24 ASN HD21 . 24 ASN HD21 1 1 86 1 2 1 1 28 ILE HB . 28 ILE HB 1 1 87 1 1 1 1 24 ASN HD22 . 24 ASN HD22 1 1 87 1 2 1 1 28 ILE HB . 28 ILE HB 1 1 88 1 1 1 1 28 ILE H . 28 ILE H 1 1 88 1 2 1 1 28 ILE HB . 28 ILE HB 1 1 89 1 1 1 1 28 ILE HB . 28 ILE HB 1 1 89 1 2 1 1 29 CYS H . 29 CYSS H 1 1 90 1 1 1 1 21 LEU HB3 . 21 LEU HB3 1 1 90 1 2 1 1 30 VAL H . 30 VAL H 1 1 91 1 1 1 1 21 LEU HB3 . 21 LEU HB3 1 1 91 1 2 1 1 22 LYS H . 22 LYS H 1 1 92 1 1 1 1 17 CYS HB3 . 17 CYSS HB3 1 1 92 1 2 1 1 18 GLN H . 18 GLN H 1 1 93 1 1 1 1 17 CYS H . 17 CYSS H 1 1 93 1 2 1 1 17 CYS HB3 . 17 CYSS HB3 1 1 94 1 1 1 1 24 ASN HB3 . 24 ASN HB3 1 1 94 1 2 1 1 25 LYS H . 25 LYS H 1 1 95 1 1 1 1 30 VAL HB . 30 VAL HB 1 1 95 1 2 1 1 31 ASP H . 31 ASP H 1 1 96 1 1 1 1 18 GLN H . 18 GLN H 1 1 96 1 2 1 1 18 GLN HG3 . 18 GLN HG3 1 1 97 1 1 1 1 6 LYS HB3 . 6 LYS HB3 1 1 97 1 2 1 1 7 GLU H . 7 GLU H 1 1 98 1 1 1 1 27 GLN H . 27 GLN H 1 1 98 1 2 1 1 28 ILE HG13 . 28 ILE HG13 1 1 99 1 1 1 1 24 ASN HD22 . 24 ASN HD22 1 1 99 1 2 1 1 28 ILE HG13 . 28 ILE HG13 1 1 100 1 1 1 1 7 GLU H . 7 GLU H 1 1 100 1 2 1 1 21 LEU HG . 21 LEU HG 1 1 101 1 1 1 1 10 THR MG . 10 THR QG2 1 1 101 1 2 1 1 12 VAL H . 12 VAL H 1 1 102 1 1 1 1 18 GLN H . 18 GLN H 1 1 102 1 2 1 1 18 GLN HB3 . 18 GLN HB3 1 1 103 1 1 1 1 7 GLU HG3 . 7 GLU HG3 1 1 103 1 2 1 1 8 TYR H . 8 TYR H 1 1 104 1 1 1 1 7 GLU H . 7 GLU H 1 1 104 1 2 1 1 7 GLU HG3 . 7 GLU HG3 1 1 105 1 1 1 1 4 LEU HG . 4 LEU HG 1 1 105 1 2 1 1 18 GLN H . 18 GLN H 1 1 106 1 1 1 1 21 LEU HG . 21 LEU HG 1 1 106 1 2 1 1 22 LYS H . 22 LYS H 1 1 107 1 1 1 1 28 ILE MD . 28 ILE QD1 1 1 107 1 2 1 1 29 CYS H . 29 CYSS H 1 1 108 1 1 1 1 8 TYR QD . 8 TYR QD 1 1 108 1 2 1 1 28 ILE MD . 28 ILE QD1 1 1 109 1 1 1 1 8 TYR HA . 8 TYR HA 1 1 109 1 2 1 1 28 ILE MD . 28 ILE QD1 1 1 110 1 1 1 1 10 THR HA . 10 THR HA 1 1 110 1 2 1 1 28 ILE MD . 28 ILE QD1 1 1 111 1 1 1 1 32 PRO HD3 . 32 PRO HD3 1 1 111 1 2 1 1 33 LYS H . 33 LYS H 1 1 112 1 1 1 1 5 SER HA . 5 SER HA 1 1 112 1 2 1 1 6 LYS H . 6 LYS H 1 1 113 1 1 1 1 12 VAL H . 12 VAL H 1 1 113 1 2 1 1 15 ARG HB3 . 15 ARG HB3 1 1 114 1 1 1 1 12 VAL HA . 12 VAL HA 1 1 114 1 2 1 1 15 ARG HB3 . 15 ARG HB3 1 1 115 1 1 1 1 3 PRO HB3 . 3 PRO HB3 1 1 115 1 2 1 1 4 LEU H . 4 LEU H 1 1 116 1 1 1 1 27 GLN HB3 . 27 GLN HB3 1 1 116 1 2 1 1 28 ILE H . 28 ILE H 1 1 117 1 1 1 1 6 LYS H . 6 LYS H 1 1 117 1 2 1 1 6 LYS HG3 . 6 LYS HG3 1 1 118 1 1 1 1 6 LYS HG3 . 6 LYS HG3 1 1 118 1 2 1 1 7 GLU H . 7 GLU H 1 1 119 1 1 1 1 22 LYS H . 22 LYS H 1 1 119 1 2 1 1 22 LYS HG3 . 22 LYS HG3 1 1 120 1 1 1 1 21 LEU HA . 21 LEU HA 1 1 120 1 2 1 1 22 LYS H . 22 LYS H 1 1 121 1 1 1 1 21 LEU HA . 21 LEU HA 1 1 121 1 2 1 1 30 VAL H . 30 VAL H 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . . . 4.3 1 1 2 1 . . . . . . . 8.89 1 1 3 1 . . . . . . . 6.9 1 1 4 1 . . . . . . . 6.06 1 1 5 1 . . . . . . . 8.02 1 1 6 1 . . . . . . . 4.97 1 1 7 1 . . . . . . . 6.69 1 1 8 1 . . . . . . . 6.51 1 1 9 1 . . . . . . . 4.61 1 1 10 1 . . . . . . . 5.28 1 1 11 1 . . . . . . . 4.76 1 1 12 1 . . . . . . . 5.23 1 1 13 1 . . . . . . . 7.97 1 1 14 1 . . . . . . . 7.0 1 1 15 1 . . . . . . . 8.02 1 1 16 1 . . . . . . . 5.13 1 1 17 1 . . . . . . . 8.02 1 1 18 1 . . . . . . . 7.0 1 1 19 1 . . . . . . . 6.9 1 1 20 1 . . . . . . . 8.02 1 1 21 1 . . . . . . . 6.51 1 1 22 1 . . . . . . . 8.02 1 1 23 1 . . . . . . . 9.1 1 1 24 1 . . . . . . . 6.79 1 1 25 1 . . . . . . . 5.96 1 1 26 1 . . . . . . . 8.02 1 1 27 1 . . . . . . . 8.02 1 1 28 1 . . . . . . . 6.32 1 1 29 1 . . . . . . . 7.0 1 1 30 1 . . . . . . . 8.02 1 1 31 1 . . . . . . . 7.0 1 1 32 1 . . . . . . . 5.49 1 1 33 1 . . . . . . . 7.39 1 1 34 1 . . . . . . . 6.74 1 1 35 1 . . . . . . . 6.9 1 1 36 1 . . . . . . . 8.02 1 1 37 1 . . . . . . . 7.0 1 1 38 1 . . . . . . . 6.74 1 1 39 1 . . . . . . . 8.02 1 1 40 1 . . . . . . . 7.0 1 1 41 1 . . . . . . . 4.5 1 1 42 1 . . . . . . . 4.87 1 1 43 1 . . . . . . . 6.74 1 1 44 1 . . . . . . . 7.0 1 1 45 1 . . . . . . . 7.0 1 1 46 1 . . . . . . . 7.0 1 1 47 1 . . . . . . . 6.12 1 1 48 1 . . . . . . . 6.38 1 1 49 1 . . . . . . . 6.48 1 1 50 1 . . . . . . . 9.1 1 1 51 1 . . . . . . . 9.1 1 1 52 1 . . . . . . . 5.08 1 1 53 1 . . . . . . . 6.56 1 1 54 1 . . . . . . . 4.4 1 1 55 1 . . . . . . . 6.25 1 1 56 1 . . . . . . . 7.39 1 1 57 1 . . . . . . . 7.39 1 1 58 1 . . . . . . . 6.67 1 1 59 1 . . . . . . . 8.37 1 1 60 1 . . . . . . . 3.98 1 1 61 1 . . . . . . . 5.86 1 1 62 1 . . . . . . . 4.24 1 1 63 1 . . . . . . . 5.99 1 1 64 1 . . . . . . . 3.62 1 1 65 1 . . . . . . . 3.72 1 1 66 1 . . . . . . . 4.24 1 1 67 1 . . . . . . . 5.34 1 1 68 1 . . . . . . . 3.98 1 1 69 1 . . . . . . . 3.93 1 1 70 1 . . . . . . . 4.24 1 1 71 1 . . . . . . . 3.15 1 1 72 1 . . . . . . . 3.1 1 1 73 1 . . . . . . . 4.87 1 1 74 1 . . . . . . . 5.39 1 1 75 1 . . . . . . . 3.46 1 1 76 1 . . . . . . . 4.61 1 1 77 1 . . . . . . . 5.39 1 1 78 1 . . . . . . . 3.72 1 1 79 1 . . . . . . . 5.34 1 1 80 1 . . . . . . . 5.23 1 1 81 1 . . . . . . . 5.8 1 1 82 1 . . . . . . . 4.04 1 1 83 1 . . . . . . . 3.93 1 1 84 1 . . . . . . . 5.54 1 1 85 1 . . . . . . . 4.61 1 1 86 1 . . . . . . . 4.87 1 1 87 1 . . . . . . . 4.87 1 1 88 1 . . . . . . . 4.19 1 1 89 1 . . . . . . . 3.98 1 1 90 1 . . . . . . . 4.87 1 1 91 1 . . . . . . . 4.45 1 1 92 1 . . . . . . . 4.56 1 1 93 1 . . . . . . . 4.09 1 1 94 1 . . . . . . . 5.65 1 1 95 1 . . . . . . . 3.72 1 1 96 1 . . . . . . . 5.34 1 1 97 1 . . . . . . . 3.88 1 1 98 1 . . . . . . . 5.65 1 1 99 1 . . . . . . . 5.34 1 1 100 1 . . . . . . . 3.72 1 1 101 1 . . . . . . . 6.04 1 1 102 1 . . . . . . . 4.09 1 1 103 1 . . . . . . . 4.5 1 1 104 1 . . . . . . . 4.87 1 1 105 1 . . . . . . . 4.87 1 1 106 1 . . . . . . . 5.08 1 1 107 1 . . . . . . . 6.51 1 1 108 1 . . . . . . . 8.28 1 1 109 1 . . . . . . . 5.42 1 1 110 1 . . . . . . . 5.94 1 1 111 1 . . . . . . . 4.76 1 1 112 1 . . . . . . . 3.15 1 1 113 1 . . . . . . . 5.7 1 1 114 1 . . . . . . . 5.8 1 1 115 1 . . . . . . . 4.61 1 1 116 1 . . . . . . . 5.8 1 1 117 1 . . . . . . . 4.4 1 1 118 1 . . . . . . . 5.08 1 1 119 1 . . . . . . . 5.18 1 1 120 1 . . . . . . . 3.31 1 1 121 1 . . . . . . . 5.18 1 1 stop_ save_ save_DYANA/DIANA_distance_constraints_3_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type "disulfide bond" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 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 CYS SG . 11 CYSS SG 1 2 1 1 2 1 1 23 CYS SG . 23 CYSS SG 1 2 2 1 1 1 1 11 CYS SG . 11 CYSS SG 1 2 2 1 2 1 1 23 CYS CB . 23 CYSS CB 1 2 3 1 1 1 1 11 CYS CB . 11 CYSS CB 1 2 3 1 2 1 1 23 CYS SG . 23 CYSS SG 1 2 4 1 1 1 1 17 CYS SG . 17 CYSS SG 1 2 4 1 2 1 1 29 CYS SG . 29 CYSS SG 1 2 5 1 1 1 1 17 CYS SG . 17 CYSS SG 1 2 5 1 2 1 1 29 CYS CB . 29 CYSS CB 1 2 6 1 1 1 1 17 CYS CB . 17 CYSS CB 1 2 6 1 2 1 1 29 CYS SG . 29 CYSS 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 . . . . . . . 3.0 1 2 3 1 . . . . . . . 3.0 1 2 4 1 . . . . . . . 2.0 1 2 5 1 . . . . . . . 3.0 1 2 6 1 . . . . . . . 3.0 1 2 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 3 _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 3 2 1 . . . 1 3 3 1 . . . 1 3 4 1 . . . 1 3 5 1 . . . 1 3 6 1 . . . 1 3 7 1 . . . 1 3 8 1 . . . 1 3 9 1 . . . 1 3 10 1 . . . 1 3 11 1 . . . 1 3 12 1 . . . 1 3 13 1 . . . 1 3 14 1 . . . 1 3 15 1 . . . 1 3 16 1 . . . 1 3 17 1 . . . 1 3 18 1 . . . 1 3 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 4 LEU QD . 4 LEU QQD 1 3 1 1 2 1 1 5 SER H . 5 SER H 1 3 2 1 1 1 1 4 LEU QD . 4 LEU QQD 1 3 2 1 2 1 1 6 LYS HA . 6 LYS HA 1 3 3 1 1 1 1 4 LEU QD . 4 LEU QQD 1 3 3 1 2 1 1 16 LYS H . 16 LYS H 1 3 4 1 1 1 1 4 LEU QD . 4 LEU QQD 1 3 4 1 2 1 1 17 CYS H . 17 CYSS H 1 3 5 1 1 1 1 6 LYS H . 6 LYS H 1 3 5 1 2 1 1 21 LEU QD . 21 LEU QQD 1 3 6 1 1 1 1 7 GLU H . 7 GLU H 1 3 6 1 2 1 1 21 LEU QD . 21 LEU QQD 1 3 7 1 1 1 1 7 GLU H . 7 GLU H 1 3 7 1 2 1 1 30 VAL QG . 30 VAL QQG 1 3 8 1 1 1 1 7 GLU HA . 7 GLU HA 1 3 8 1 2 1 1 21 LEU QD . 21 LEU QQD 1 3 9 1 1 1 1 8 TYR H . 8 TYR H 1 3 9 1 2 1 1 21 LEU QD . 21 LEU QQD 1 3 10 1 1 1 1 12 VAL HA . 12 VAL HA 1 3 10 1 2 1 1 27 GLN QE . 27 GLN QE2 1 3 11 1 1 1 1 21 LEU QD . 21 LEU QQD 1 3 11 1 2 1 1 22 LYS H . 22 LYS H 1 3 12 1 1 1 1 21 LEU QD . 21 LEU QQD 1 3 12 1 2 1 1 30 VAL H . 30 VAL H 1 3 13 1 1 1 1 21 LEU QD . 21 LEU QQD 1 3 13 1 2 1 1 31 ASP H . 31 ASP H 1 3 14 1 1 1 1 21 LEU QD . 21 LEU QQD 1 3 14 1 2 1 1 31 ASP HA . 31 ASP HA 1 3 15 1 1 1 1 24 ASN QD . 24 ASN QD2 1 3 15 1 2 1 1 26 ALA MB . 26 ALA QB 1 3 16 1 1 1 1 24 ASN QD . 24 ASN QD2 1 3 16 1 2 1 1 28 ILE HB . 28 ILE HB 1 3 17 1 1 1 1 24 ASN QD . 24 ASN QD2 1 3 17 1 2 1 1 28 ILE MG . 28 ILE QG2 1 3 18 1 1 1 1 30 VAL QG . 30 VAL QQG 1 3 18 1 2 1 1 31 ASP H . 31 ASP H 1 3 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 . . . . . . . 6.21 1 3 2 1 . . . . . . . 5.66 1 3 3 1 . . . . . . . 7.84 1 3 4 1 . . . . . . . 7.84 1 3 5 1 . . . . . . . 7.84 1 3 6 1 . . . . . . . 7.84 1 3 7 1 . . . . . . . 7.15 1 3 8 1 . . . . . . . 6.41 1 3 9 1 . . . . . . . 7.84 1 3 10 1 . . . . . . . 5.53 1 3 11 1 . . . . . . . 7.84 1 3 12 1 . . . . . . . 7.84 1 3 13 1 . . . . . . . 7.84 1 3 14 1 . . . . . . . 5.11 1 3 15 1 . . . . . . . 5.55 1 3 16 1 . . . . . . . 4.15 1 3 17 1 . . . . . . . 7.1 1 3 18 1 . . . . . . . 6.06 1 3 stop_ save_ save_DYANA/DIANA_distance_constraints_5_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 4 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 4 2 1 . . . 1 4 3 1 . . . 1 4 4 1 . . . 1 4 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 22 LYS H . 22 LYS H 1 4 1 1 2 1 1 30 VAL O . 30 VAL O 1 4 2 1 1 1 1 22 LYS N . 22 LYS N 1 4 2 1 2 1 1 30 VAL O . 30 VAL O 1 4 3 1 1 1 1 22 LYS O . 22 LYS O 1 4 3 1 2 1 1 30 VAL H . 30 VAL H 1 4 4 1 1 1 1 22 LYS O . 22 LYS O 1 4 4 1 2 1 1 30 VAL N . 30 VAL N 1 4 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . . . 3.5 1 4 2 1 . . . . . . . 2.5 1 4 3 1 . . . . . . . 3.5 1 4 4 1 . . . . . . . 2.5 1 4 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 ASP C C -13.048 -5.250 -4.421 1.00 . A A . 1 ASP C 1 1 1 2 1 1 1 ASP CA C -13.889 -6.241 -3.620 1.00 . A A . 1 ASP CA 1 1 1 3 1 1 1 ASP CB C -14.103 -5.715 -2.199 1.00 . A A . 1 ASP CB 1 1 1 4 1 1 1 ASP CG C -15.417 -6.180 -1.602 1.00 . A A . 1 ASP CG 1 1 1 5 1 1 1 ASP H1 H -12.726 -7.850 -4.355 1.00 . A A . 1 ASP H1 1 1 1 6 1 1 1 ASP HA H -14.848 -6.351 -4.101 1.00 . A A . 1 ASP HA 1 1 1 7 1 1 1 ASP HB3 H -14.098 -4.635 -2.217 1.00 . A A . 1 ASP HB3 1 1 1 8 1 1 1 ASP N N -13.252 -7.553 -3.584 1.00 . A A . 1 ASP N 1 1 1 9 1 1 1 ASP O O -13.524 -4.659 -5.390 1.00 . A A . 1 ASP O 1 1 1 10 1 1 1 ASP OD1 O -16.454 -5.542 -1.880 1.00 . A A . 1 ASP OD1 1 1 1 11 1 1 1 ASP OD2 O -15.407 -7.182 -0.857 1.00 . A A . 1 ASP OD2 1 1 1 12 1 1 2 PHE C C -9.663 -4.890 -5.211 1.00 . A A . 2 PHE C 1 1 1 13 1 1 2 PHE CA C -10.892 -4.154 -4.685 1.00 . A A . 2 PHE CA 1 1 1 14 1 1 2 PHE CB C -10.462 -3.036 -3.734 1.00 . A A . 2 PHE CB 1 1 1 15 1 1 2 PHE CD1 C -12.614 -1.744 -3.706 1.00 . A A . 2 PHE CD1 1 1 1 16 1 1 2 PHE CD2 C -10.608 -0.591 -4.284 1.00 . A A . 2 PHE CD2 1 1 1 17 1 1 2 PHE CE1 C -13.336 -0.577 -3.868 1.00 . A A . 2 PHE CE1 1 1 1 18 1 1 2 PHE CE2 C -11.325 0.579 -4.447 1.00 . A A . 2 PHE CE2 1 1 1 19 1 1 2 PHE CG C -11.244 -1.765 -3.911 1.00 . A A . 2 PHE CG 1 1 1 20 1 1 2 PHE CZ C -12.691 0.586 -4.239 1.00 . A A . 2 PHE CZ 1 1 1 21 1 1 2 PHE H H -11.477 -5.575 -3.228 1.00 . A A . 2 PHE H 1 1 1 22 1 1 2 PHE HA H -11.423 -3.722 -5.519 1.00 . A A . 2 PHE HA 1 1 1 23 1 1 2 PHE HB3 H -9.419 -2.812 -3.901 1.00 . A A . 2 PHE HB3 1 1 1 24 1 1 2 PHE HD1 H -13.120 -2.655 -3.415 1.00 . A A . 2 PHE HD1 1 1 1 25 1 1 2 PHE HD2 H -9.541 -0.595 -4.448 1.00 . A A . 2 PHE HD2 1 1 1 26 1 1 2 PHE HE1 H -14.404 -0.575 -3.705 1.00 . A A . 2 PHE HE1 1 1 1 27 1 1 2 PHE HE2 H -10.818 1.487 -4.739 1.00 . A A . 2 PHE HE2 1 1 1 28 1 1 2 PHE HZ H -13.253 1.499 -4.366 1.00 . A A . 2 PHE HZ 1 1 1 29 1 1 2 PHE N N -11.798 -5.074 -4.008 1.00 . A A . 2 PHE N 1 1 1 30 1 1 2 PHE O O -9.337 -5.995 -4.778 1.00 . A A . 2 PHE O 1 1 1 31 1 1 3 PRO C C -6.583 -4.877 -5.806 1.00 . A A . 3 PRO C 1 1 1 32 1 1 3 PRO CA C -7.760 -4.839 -6.775 1.00 . A A . 3 PRO CA 1 1 1 33 1 1 3 PRO CB C -7.461 -3.891 -7.939 1.00 . A A . 3 PRO CB 1 1 1 34 1 1 3 PRO CD C -9.294 -2.943 -6.732 1.00 . A A . 3 PRO CD 1 1 1 35 1 1 3 PRO CG C -8.074 -2.594 -7.539 1.00 . A A . 3 PRO CG 1 1 1 36 1 1 3 PRO HA H -7.944 -5.833 -7.156 1.00 . A A . 3 PRO HA 1 1 1 37 1 1 3 PRO HB3 H -7.907 -4.275 -8.844 1.00 . A A . 3 PRO HB3 1 1 1 38 1 1 3 PRO HD3 H -10.163 -3.004 -7.371 1.00 . A A . 3 PRO HD3 1 1 1 39 1 1 3 PRO HG3 H -8.354 -2.033 -8.418 1.00 . A A . 3 PRO HG3 1 1 1 40 1 1 3 PRO N N -8.963 -4.263 -6.169 1.00 . A A . 3 PRO N 1 1 1 41 1 1 3 PRO O O -5.921 -5.906 -5.658 1.00 . A A . 3 PRO O 1 1 1 42 1 1 4 LEU C C -3.890 -3.890 -4.873 1.00 . A A . 4 LEU C 1 1 1 43 1 1 4 LEU CA C -5.233 -3.658 -4.188 1.00 . A A . 4 LEU CA 1 1 1 44 1 1 4 LEU CB C -5.425 -4.674 -3.060 1.00 . A A . 4 LEU CB 1 1 1 45 1 1 4 LEU CD1 C -4.494 -3.134 -1.316 1.00 . A A . 4 LEU CD1 1 1 1 46 1 1 4 LEU CD2 C -4.828 -5.557 -0.792 1.00 . A A . 4 LEU CD2 1 1 1 47 1 1 4 LEU CG C -4.469 -4.549 -1.874 1.00 . A A . 4 LEU CG 1 1 1 48 1 1 4 LEU H H -6.892 -2.968 -5.305 1.00 . A A . 4 LEU H 1 1 1 49 1 1 4 LEU HA H -5.243 -2.663 -3.769 1.00 . A A . 4 LEU HA 1 1 1 50 1 1 4 LEU HB3 H -5.303 -5.662 -3.482 1.00 . A A . 4 LEU HB3 1 1 1 51 1 1 4 LEU HD11 H -3.556 -2.647 -1.530 1.00 . A A . 4 LEU HD11 1 1 1 52 1 1 4 LEU HD12 H -4.644 -3.172 -0.248 1.00 . A A . 4 LEU HD12 1 1 1 53 1 1 4 LEU HD13 H -5.301 -2.582 -1.774 1.00 . A A . 4 LEU HD13 1 1 1 54 1 1 4 LEU HD21 H -5.827 -5.929 -0.962 1.00 . A A . 4 LEU HD21 1 1 1 55 1 1 4 LEU HD22 H -4.781 -5.078 0.175 1.00 . A A . 4 LEU HD22 1 1 1 56 1 1 4 LEU HD23 H -4.128 -6.380 -0.820 1.00 . A A . 4 LEU HD23 1 1 1 57 1 1 4 LEU HG H -3.462 -4.758 -2.207 1.00 . A A . 4 LEU HG 1 1 1 58 1 1 4 LEU N N -6.330 -3.753 -5.145 1.00 . A A . 4 LEU N 1 1 1 59 1 1 4 LEU O O -3.832 -4.419 -5.984 1.00 . A A . 4 LEU O 1 1 1 60 1 1 5 SER C C -0.442 -3.791 -3.630 1.00 . A A . 5 SER C 1 1 1 61 1 1 5 SER CA C -1.470 -3.655 -4.749 1.00 . A A . 5 SER CA 1 1 1 62 1 1 5 SER CB C -1.113 -2.467 -5.643 1.00 . A A . 5 SER CB 1 1 1 63 1 1 5 SER H H -2.925 -3.077 -3.323 1.00 . A A . 5 SER H 1 1 1 64 1 1 5 SER HA H -1.461 -4.557 -5.341 1.00 . A A . 5 SER HA 1 1 1 65 1 1 5 SER HB3 H -0.093 -2.169 -5.451 1.00 . A A . 5 SER HB3 1 1 1 66 1 1 5 SER HG H -0.940 -2.070 -7.554 1.00 . A A . 5 SER HG 1 1 1 67 1 1 5 SER N N -2.814 -3.493 -4.204 1.00 . A A . 5 SER N 1 1 1 68 1 1 5 SER O O -0.788 -3.774 -2.447 1.00 . A A . 5 SER O 1 1 1 69 1 1 5 SER OG O -1.239 -2.806 -7.014 1.00 . A A . 5 SER OG 1 1 1 70 1 1 6 LYS C C 2.964 -2.984 -3.252 1.00 . A A . 6 LYS C 1 1 1 71 1 1 6 LYS CA C 1.904 -4.062 -3.042 1.00 . A A . 6 LYS CA 1 1 1 72 1 1 6 LYS CB C 2.542 -5.448 -3.151 1.00 . A A . 6 LYS CB 1 1 1 73 1 1 6 LYS CD C 2.272 -6.789 -5.259 1.00 . A A . 6 LYS CD 1 1 1 74 1 1 6 LYS CE C 2.350 -8.146 -4.577 1.00 . A A . 6 LYS CE 1 1 1 75 1 1 6 LYS CG C 3.107 -5.750 -4.529 1.00 . A A . 6 LYS CG 1 1 1 76 1 1 6 LYS H H 1.036 -3.930 -4.968 1.00 . A A . 6 LYS H 1 1 1 77 1 1 6 LYS HA H 1.481 -3.946 -2.055 1.00 . A A . 6 LYS HA 1 1 1 78 1 1 6 LYS HB3 H 1.795 -6.194 -2.921 1.00 . A A . 6 LYS HB3 1 1 1 79 1 1 6 LYS HD3 H 2.636 -6.883 -6.272 1.00 . A A . 6 LYS HD3 1 1 1 80 1 1 6 LYS HE3 H 1.523 -8.236 -3.888 1.00 . A A . 6 LYS HE3 1 1 1 81 1 1 6 LYS HG3 H 4.116 -6.123 -4.419 1.00 . A A . 6 LYS HG3 1 1 1 82 1 1 6 LYS HZ1 H 1.513 -9.913 -5.311 1.00 . A A . 6 LYS HZ1 1 1 1 83 1 1 6 LYS HZ2 H 3.182 -9.792 -5.557 1.00 . A A . 6 LYS HZ2 1 1 1 84 1 1 6 LYS HZ3 H 2.118 -8.890 -6.515 1.00 . A A . 6 LYS HZ3 1 1 1 85 1 1 6 LYS N N 0.823 -3.924 -4.011 1.00 . A A . 6 LYS N 1 1 1 86 1 1 6 LYS NZ N 2.286 -9.264 -5.559 1.00 . A A . 6 LYS NZ 1 1 1 87 1 1 6 LYS O O 3.119 -2.463 -4.356 1.00 . A A . 6 LYS O 1 1 1 88 1 1 7 GLU C C 4.144 -0.277 -2.598 1.00 . A A . 7 GLU C 1 1 1 89 1 1 7 GLU CA C 4.734 -1.644 -2.258 1.00 . A A . 7 GLU CA 1 1 1 90 1 1 7 GLU CB C 5.784 -2.032 -3.302 1.00 . A A . 7 GLU CB 1 1 1 91 1 1 7 GLU CD C 8.079 -3.076 -3.459 1.00 . A A . 7 GLU CD 1 1 1 92 1 1 7 GLU CG C 7.203 -2.055 -2.759 1.00 . A A . 7 GLU CG 1 1 1 93 1 1 7 GLU H H 3.518 -3.110 -1.335 1.00 . A A . 7 GLU H 1 1 1 94 1 1 7 GLU HA H 5.208 -1.587 -1.289 1.00 . A A . 7 GLU HA 1 1 1 95 1 1 7 GLU HB3 H 5.744 -1.322 -4.115 1.00 . A A . 7 GLU HB3 1 1 1 96 1 1 7 GLU HG3 H 7.168 -2.294 -1.706 1.00 . A A . 7 GLU HG3 1 1 1 97 1 1 7 GLU N N 3.689 -2.659 -2.188 1.00 . A A . 7 GLU N 1 1 1 98 1 1 7 GLU O O 2.927 -0.096 -2.591 1.00 . A A . 7 GLU O 1 1 1 99 1 1 7 GLU OE1 O 7.671 -4.253 -3.538 1.00 . A A . 7 GLU OE1 1 1 1 100 1 1 7 GLU OE2 O 9.172 -2.697 -3.928 1.00 . A A . 7 GLU OE2 1 1 1 101 1 1 8 TYR C C 3.577 2.008 -4.379 1.00 . A A . 8 TYR C 1 1 1 102 1 1 8 TYR CA C 4.584 2.030 -3.232 1.00 . A A . 8 TYR CA 1 1 1 103 1 1 8 TYR CB C 5.788 2.894 -3.613 1.00 . A A . 8 TYR CB 1 1 1 104 1 1 8 TYR CD1 C 7.476 1.386 -4.732 1.00 . A A . 8 TYR CD1 1 1 1 105 1 1 8 TYR CD2 C 6.281 2.938 -6.089 1.00 . A A . 8 TYR CD2 1 1 1 106 1 1 8 TYR CE1 C 8.155 0.929 -5.844 1.00 . A A . 8 TYR CE1 1 1 1 107 1 1 8 TYR CE2 C 6.955 2.487 -7.207 1.00 . A A . 8 TYR CE2 1 1 1 108 1 1 8 TYR CG C 6.528 2.397 -4.834 1.00 . A A . 8 TYR CG 1 1 1 109 1 1 8 TYR CZ C 7.890 1.482 -7.080 1.00 . A A . 8 TYR CZ 1 1 1 110 1 1 8 TYR H H 5.975 0.474 -2.881 1.00 . A A . 8 TYR H 1 1 1 111 1 1 8 TYR HA H 4.109 2.455 -2.360 1.00 . A A . 8 TYR HA 1 1 1 112 1 1 8 TYR HB3 H 6.484 2.913 -2.787 1.00 . A A . 8 TYR HB3 1 1 1 113 1 1 8 TYR HD1 H 7.680 0.954 -3.763 1.00 . A A . 8 TYR HD1 1 1 1 114 1 1 8 TYR HD2 H 5.547 3.726 -6.184 1.00 . A A . 8 TYR HD2 1 1 1 115 1 1 8 TYR HE1 H 8.888 0.141 -5.745 1.00 . A A . 8 TYR HE1 1 1 1 116 1 1 8 TYR HE2 H 6.748 2.921 -8.174 1.00 . A A . 8 TYR HE2 1 1 1 117 1 1 8 TYR HH H 9.370 1.540 -8.305 1.00 . A A . 8 TYR HH 1 1 1 118 1 1 8 TYR N N 5.017 0.679 -2.893 1.00 . A A . 8 TYR N 1 1 1 119 1 1 8 TYR O O 3.851 1.464 -5.448 1.00 . A A . 8 TYR O 1 1 1 120 1 1 8 TYR OH O 8.565 1.031 -8.191 1.00 . A A . 8 TYR OH 1 1 1 121 1 1 9 GLU C C 0.132 3.383 -4.633 1.00 . A A . 9 GLU C 1 1 1 122 1 1 9 GLU CA C 1.364 2.652 -5.159 1.00 . A A . 9 GLU CA 1 1 1 123 1 1 9 GLU CB C 0.982 1.237 -5.598 1.00 . A A . 9 GLU CB 1 1 1 124 1 1 9 GLU CD C 1.108 -0.511 -7.416 1.00 . A A . 9 GLU CD 1 1 1 125 1 1 9 GLU CG C 1.276 0.952 -7.061 1.00 . A A . 9 GLU CG 1 1 1 126 1 1 9 GLU H H 2.254 3.020 -3.273 1.00 . A A . 9 GLU H 1 1 1 127 1 1 9 GLU HA H 1.752 3.191 -6.011 1.00 . A A . 9 GLU HA 1 1 1 128 1 1 9 GLU HB3 H -0.075 1.095 -5.431 1.00 . A A . 9 GLU HB3 1 1 1 129 1 1 9 GLU HG3 H 2.294 1.245 -7.274 1.00 . A A . 9 GLU HG3 1 1 1 130 1 1 9 GLU N N 2.413 2.603 -4.146 1.00 . A A . 9 GLU N 1 1 1 131 1 1 9 GLU O O -0.220 4.459 -5.119 1.00 . A A . 9 GLU O 1 1 1 132 1 1 9 GLU OE1 O 1.704 -1.362 -6.722 1.00 . A A . 9 GLU OE1 1 1 1 133 1 1 9 GLU OE2 O 0.380 -0.808 -8.388 1.00 . A A . 9 GLU OE2 1 1 1 134 1 1 10 THR C C -2.278 2.497 -1.942 1.00 . A A . 10 THR C 1 1 1 135 1 1 10 THR CA C -1.712 3.385 -3.045 1.00 . A A . 10 THR CA 1 1 1 136 1 1 10 THR CB C -2.803 3.627 -4.104 1.00 . A A . 10 THR CB 1 1 1 137 1 1 10 THR CG2 C -3.010 2.388 -4.962 1.00 . A A . 10 THR CG2 1 1 1 138 1 1 10 THR H H -0.188 1.936 -3.292 1.00 . A A . 10 THR H 1 1 1 139 1 1 10 THR HA H -1.435 4.338 -2.620 1.00 . A A . 10 THR HA 1 1 1 140 1 1 10 THR HB H -2.490 4.440 -4.743 1.00 . A A . 10 THR HB 1 1 1 141 1 1 10 THR HG1 H -3.933 4.828 -3.022 1.00 . A A . 10 THR HG1 1 1 1 142 1 1 10 THR HG21 H -3.802 2.570 -5.672 1.00 . A A . 10 THR HG21 1 1 1 143 1 1 10 THR HG22 H -3.277 1.553 -4.331 1.00 . A A . 10 THR HG22 1 1 1 144 1 1 10 THR HG23 H -2.097 2.161 -5.492 1.00 . A A . 10 THR HG23 1 1 1 145 1 1 10 THR N N -0.519 2.792 -3.636 1.00 . A A . 10 THR N 1 1 1 146 1 1 10 THR O O -2.013 1.295 -1.902 1.00 . A A . 10 THR O 1 1 1 147 1 1 10 THR OG1 O -4.035 3.983 -3.467 1.00 . A A . 10 THR OG1 1 1 1 148 1 1 11 CYS C C -4.802 3.160 0.682 1.00 . A A . 11 CYS C 1 1 1 149 1 1 11 CYS CA C -3.664 2.359 0.053 1.00 . A A . 11 CYS CA 1 1 1 150 1 1 11 CYS CB C -2.611 2.031 1.113 1.00 . A A . 11 CYS CB 1 1 1 151 1 1 11 CYS H H -3.234 4.057 -1.136 1.00 . A A . 11 CYS H 1 1 1 152 1 1 11 CYS HA H -4.064 1.438 -0.341 1.00 . A A . 11 CYS HA 1 1 1 153 1 1 11 CYS HB3 H -1.876 1.366 0.685 1.00 . A A . 11 CYS HB3 1 1 1 154 1 1 11 CYS N N -3.060 3.096 -1.051 1.00 . A A . 11 CYS N 1 1 1 155 1 1 11 CYS O O -4.799 3.423 1.885 1.00 . A A . 11 CYS O 1 1 1 156 1 1 11 CYS SG S -1.730 3.488 1.761 1.00 . A A . 11 CYS SG 1 1 1 157 1 1 12 VAL C C -7.779 3.484 1.284 1.00 . A A . 12 VAL C 1 1 1 158 1 1 12 VAL CA C -6.918 4.310 0.335 1.00 . A A . 12 VAL CA 1 1 1 159 1 1 12 VAL CB C -7.791 4.800 -0.837 1.00 . A A . 12 VAL CB 1 1 1 160 1 1 12 VAL CG1 C -7.023 5.794 -1.695 1.00 . A A . 12 VAL CG1 1 1 1 161 1 1 12 VAL CG2 C -8.271 3.622 -1.671 1.00 . A A . 12 VAL CG2 1 1 1 162 1 1 12 VAL H H -5.719 3.301 -1.088 1.00 . A A . 12 VAL H 1 1 1 163 1 1 12 VAL HA H -6.544 5.175 0.863 1.00 . A A . 12 VAL HA 1 1 1 164 1 1 12 VAL HB H -8.656 5.302 -0.429 1.00 . A A . 12 VAL HB 1 1 1 165 1 1 12 VAL HG11 H -7.449 5.815 -2.688 1.00 . A A . 12 VAL HG11 1 1 1 166 1 1 12 VAL HG12 H -7.088 6.777 -1.253 1.00 . A A . 12 VAL HG12 1 1 1 167 1 1 12 VAL HG13 H -5.988 5.493 -1.756 1.00 . A A . 12 VAL HG13 1 1 1 168 1 1 12 VAL HG21 H -9.026 3.957 -2.367 1.00 . A A . 12 VAL HG21 1 1 1 169 1 1 12 VAL HG22 H -7.438 3.205 -2.217 1.00 . A A . 12 VAL HG22 1 1 1 170 1 1 12 VAL HG23 H -8.690 2.867 -1.022 1.00 . A A . 12 VAL HG23 1 1 1 171 1 1 12 VAL N N -5.773 3.542 -0.140 1.00 . A A . 12 VAL N 1 1 1 172 1 1 12 VAL O O -7.446 2.344 1.607 1.00 . A A . 12 VAL O 1 1 1 173 1 1 13 ARG C C -10.178 2.009 2.102 1.00 . A A . 13 ARG C 1 1 1 174 1 1 13 ARG CA C -9.797 3.385 2.641 1.00 . A A . 13 ARG CA 1 1 1 175 1 1 13 ARG CB C -11.056 4.224 2.862 1.00 . A A . 13 ARG CB 1 1 1 176 1 1 13 ARG CD C -10.975 6.176 4.443 1.00 . A A . 13 ARG CD 1 1 1 177 1 1 13 ARG CG C -11.238 4.685 4.299 1.00 . A A . 13 ARG CG 1 1 1 178 1 1 13 ARG CZ C -13.087 6.922 5.459 1.00 . A A . 13 ARG CZ 1 1 1 179 1 1 13 ARG H H -9.100 4.978 1.434 1.00 . A A . 13 ARG H 1 1 1 180 1 1 13 ARG HA H -9.287 3.261 3.584 1.00 . A A . 13 ARG HA 1 1 1 181 1 1 13 ARG HB3 H -11.919 3.637 2.584 1.00 . A A . 13 ARG HB3 1 1 1 182 1 1 13 ARG HD3 H -10.367 6.503 3.613 1.00 . A A . 13 ARG HD3 1 1 1 183 1 1 13 ARG HE H -12.403 7.518 3.682 1.00 . A A . 13 ARG HE 1 1 1 184 1 1 13 ARG HG3 H -10.547 4.144 4.929 1.00 . A A . 13 ARG HG3 1 1 1 185 1 1 13 ARG HH11 H -12.025 5.610 6.569 1.00 . A A . 13 ARG HH11 1 1 1 186 1 1 13 ARG HH12 H -13.516 6.144 7.274 1.00 . A A . 13 ARG HH12 1 1 1 187 1 1 13 ARG HH21 H -14.367 8.228 4.599 1.00 . A A . 13 ARG HH21 1 1 1 188 1 1 13 ARG HH22 H -14.847 7.632 6.152 1.00 . A A . 13 ARG HH22 1 1 1 189 1 1 13 ARG N N -8.888 4.067 1.727 1.00 . A A . 13 ARG N 1 1 1 190 1 1 13 ARG NE N -12.214 6.950 4.458 1.00 . A A . 13 ARG NE 1 1 1 191 1 1 13 ARG NH1 N -12.857 6.163 6.522 1.00 . A A . 13 ARG NH1 1 1 1 192 1 1 13 ARG NH2 N -14.191 7.655 5.399 1.00 . A A . 13 ARG NH2 1 1 1 193 1 1 13 ARG O O -9.930 0.979 2.730 1.00 . A A . 13 ARG O 1 1 1 194 1 1 14 PRO C C -10.044 -0.089 -0.225 1.00 . A A . 14 PRO C 1 1 1 195 1 1 14 PRO CA C -11.223 0.746 0.263 1.00 . A A . 14 PRO CA 1 1 1 196 1 1 14 PRO CB C -12.059 1.235 -0.923 1.00 . A A . 14 PRO CB 1 1 1 197 1 1 14 PRO CD C -11.122 3.178 0.107 1.00 . A A . 14 PRO CD 1 1 1 198 1 1 14 PRO CG C -11.538 2.599 -1.217 1.00 . A A . 14 PRO CG 1 1 1 199 1 1 14 PRO HA H -11.839 0.149 0.918 1.00 . A A . 14 PRO HA 1 1 1 200 1 1 14 PRO HB3 H -13.102 1.263 -0.646 1.00 . A A . 14 PRO HB3 1 1 1 201 1 1 14 PRO HD3 H -11.938 3.730 0.550 1.00 . A A . 14 PRO HD3 1 1 1 202 1 1 14 PRO HG3 H -12.316 3.202 -1.661 1.00 . A A . 14 PRO HG3 1 1 1 203 1 1 14 PRO N N -10.795 1.989 0.912 1.00 . A A . 14 PRO N 1 1 1 204 1 1 14 PRO O O -10.217 -1.224 -0.669 1.00 . A A . 14 PRO O 1 1 1 205 1 1 15 ARG C C -6.705 -0.467 0.609 1.00 . A A . 15 ARG C 1 1 1 206 1 1 15 ARG CA C -7.639 -0.213 -0.572 1.00 . A A . 15 ARG CA 1 1 1 207 1 1 15 ARG CB C -6.913 0.604 -1.643 1.00 . A A . 15 ARG CB 1 1 1 208 1 1 15 ARG CD C -6.868 1.424 -4.017 1.00 . A A . 15 ARG CD 1 1 1 209 1 1 15 ARG CG C -7.687 0.724 -2.945 1.00 . A A . 15 ARG CG 1 1 1 210 1 1 15 ARG CZ C -8.491 2.337 -5.623 1.00 . A A . 15 ARG CZ 1 1 1 211 1 1 15 ARG H H -8.772 1.386 0.224 1.00 . A A . 15 ARG H 1 1 1 212 1 1 15 ARG HA H -7.933 -1.162 -0.993 1.00 . A A . 15 ARG HA 1 1 1 213 1 1 15 ARG HB3 H -5.965 0.134 -1.855 1.00 . A A . 15 ARG HB3 1 1 1 214 1 1 15 ARG HD3 H -6.598 0.702 -4.773 1.00 . A A . 15 ARG HD3 1 1 1 215 1 1 15 ARG HE H -7.438 3.424 -4.325 1.00 . A A . 15 ARG HE 1 1 1 216 1 1 15 ARG HG3 H -8.590 1.291 -2.766 1.00 . A A . 15 ARG HG3 1 1 1 217 1 1 15 ARG HH11 H -8.269 0.331 -5.688 1.00 . A A . 15 ARG HH11 1 1 1 218 1 1 15 ARG HH12 H -9.410 0.987 -6.814 1.00 . A A . 15 ARG HH12 1 1 1 219 1 1 15 ARG HH21 H -8.938 4.300 -5.803 1.00 . A A . 15 ARG HH21 1 1 1 220 1 1 15 ARG HH22 H -9.788 3.245 -6.880 1.00 . A A . 15 ARG HH22 1 1 1 221 1 1 15 ARG N N -8.845 0.480 -0.139 1.00 . A A . 15 ARG N 1 1 1 222 1 1 15 ARG NE N -7.608 2.515 -4.647 1.00 . A A . 15 ARG NE 1 1 1 223 1 1 15 ARG NH1 N -8.743 1.118 -6.079 1.00 . A A . 15 ARG NH1 1 1 1 224 1 1 15 ARG NH2 N -9.125 3.380 -6.145 1.00 . A A . 15 ARG NH2 1 1 1 225 1 1 15 ARG O O -5.635 0.133 0.708 1.00 . A A . 15 ARG O 1 1 1 226 1 1 16 LYS C C -5.223 -2.696 2.318 1.00 . A A . 16 LYS C 1 1 1 227 1 1 16 LYS CA C -6.319 -1.697 2.673 1.00 . A A . 16 LYS CA 1 1 1 228 1 1 16 LYS CB C -7.211 -2.274 3.774 1.00 . A A . 16 LYS CB 1 1 1 229 1 1 16 LYS CD C -7.686 -4.726 4.048 1.00 . A A . 16 LYS CD 1 1 1 230 1 1 16 LYS CE C -8.797 -5.762 3.963 1.00 . A A . 16 LYS CE 1 1 1 231 1 1 16 LYS CG C -8.061 -3.447 3.317 1.00 . A A . 16 LYS CG 1 1 1 232 1 1 16 LYS H H -7.981 -1.807 1.366 1.00 . A A . 16 LYS H 1 1 1 233 1 1 16 LYS HA H -5.859 -0.788 3.033 1.00 . A A . 16 LYS HA 1 1 1 234 1 1 16 LYS HB3 H -7.871 -1.496 4.131 1.00 . A A . 16 LYS HB3 1 1 1 235 1 1 16 LYS HD3 H -7.500 -4.495 5.087 1.00 . A A . 16 LYS HD3 1 1 1 236 1 1 16 LYS HE3 H -9.664 -5.304 3.511 1.00 . A A . 16 LYS HE3 1 1 1 237 1 1 16 LYS HG3 H -7.915 -3.592 2.256 1.00 . A A . 16 LYS HG3 1 1 1 238 1 1 16 LYS HZ1 H -9.002 -7.755 3.372 1.00 . A A . 16 LYS HZ1 1 1 1 239 1 1 16 LYS HZ2 H -7.404 -7.196 3.357 1.00 . A A . 16 LYS HZ2 1 1 1 240 1 1 16 LYS HZ3 H -8.477 -6.725 2.137 1.00 . A A . 16 LYS HZ3 1 1 1 241 1 1 16 LYS N N -7.118 -1.362 1.500 1.00 . A A . 16 LYS N 1 1 1 242 1 1 16 LYS NZ N -8.392 -6.942 3.150 1.00 . A A . 16 LYS NZ 1 1 1 243 1 1 16 LYS O O -5.503 -3.840 1.958 1.00 . A A . 16 LYS O 1 1 1 244 1 1 17 CYS C C -2.957 -4.460 2.818 1.00 . A A . 17 CYS C 1 1 1 245 1 1 17 CYS CA C -2.833 -3.112 2.112 1.00 . A A . 17 CYS CA 1 1 1 246 1 1 17 CYS CB C -1.528 -2.427 2.522 1.00 . A A . 17 CYS CB 1 1 1 247 1 1 17 CYS H H -3.812 -1.334 2.713 1.00 . A A . 17 CYS H 1 1 1 248 1 1 17 CYS HA H -2.823 -3.278 1.045 1.00 . A A . 17 CYS HA 1 1 1 249 1 1 17 CYS HB3 H -0.749 -3.171 2.603 1.00 . A A . 17 CYS HB3 1 1 1 250 1 1 17 CYS N N -3.973 -2.258 2.421 1.00 . A A . 17 CYS N 1 1 1 251 1 1 17 CYS O O -2.939 -4.532 4.046 1.00 . A A . 17 CYS O 1 1 1 252 1 1 17 CYS SG S -0.958 -1.152 1.352 1.00 . A A . 17 CYS SG 1 1 1 253 1 1 18 GLN C C -1.953 -7.263 3.350 1.00 . A A . 18 GLN C 1 1 1 254 1 1 18 GLN CA C -3.209 -6.868 2.581 1.00 . A A . 18 GLN CA 1 1 1 255 1 1 18 GLN CB C -3.475 -7.877 1.462 1.00 . A A . 18 GLN CB 1 1 1 256 1 1 18 GLN CD C -5.165 -9.352 0.301 1.00 . A A . 18 GLN CD 1 1 1 257 1 1 18 GLN CG C -4.943 -8.236 1.301 1.00 . A A . 18 GLN CG 1 1 1 258 1 1 18 GLN H H -3.090 -5.402 1.060 1.00 . A A . 18 GLN H 1 1 1 259 1 1 18 GLN HA H -4.048 -6.870 3.261 1.00 . A A . 18 GLN HA 1 1 1 260 1 1 18 GLN HB3 H -2.926 -8.783 1.673 1.00 . A A . 18 GLN HB3 1 1 1 261 1 1 18 GLN HE21 H -6.960 -8.625 -0.150 1.00 . A A . 18 GLN HE21 1 1 1 262 1 1 18 GLN HE22 H -6.492 -10.053 -1.002 1.00 . A A . 18 GLN HE22 1 1 1 263 1 1 18 GLN HG3 H -5.479 -7.360 0.967 1.00 . A A . 18 GLN HG3 1 1 1 264 1 1 18 GLN N N -3.082 -5.524 2.031 1.00 . A A . 18 GLN N 1 1 1 265 1 1 18 GLN NE2 N -6.323 -9.343 -0.350 1.00 . A A . 18 GLN NE2 1 1 1 266 1 1 18 GLN O O -1.998 -7.585 4.537 1.00 . A A . 18 GLN O 1 1 1 267 1 1 18 GLN OE1 O -4.305 -10.214 0.114 1.00 . A A . 18 GLN OE1 1 1 1 268 1 1 19 PRO C C 0.961 -6.553 4.269 1.00 . A A . 19 PRO C 1 1 1 269 1 1 19 PRO CA C 0.487 -7.592 3.257 1.00 . A A . 19 PRO CA 1 1 1 270 1 1 19 PRO CB C 1.434 -7.638 2.056 1.00 . A A . 19 PRO CB 1 1 1 271 1 1 19 PRO CD C -0.675 -6.866 1.240 1.00 . A A . 19 PRO CD 1 1 1 272 1 1 19 PRO CG C 0.809 -6.738 1.046 1.00 . A A . 19 PRO CG 1 1 1 273 1 1 19 PRO HA H 0.454 -8.563 3.729 1.00 . A A . 19 PRO HA 1 1 1 274 1 1 19 PRO HB3 H 1.508 -8.652 1.689 1.00 . A A . 19 PRO HB3 1 1 1 275 1 1 19 PRO HD3 H -1.075 -7.640 0.601 1.00 . A A . 19 PRO HD3 1 1 1 276 1 1 19 PRO HG3 H 1.086 -7.055 0.050 1.00 . A A . 19 PRO HG3 1 1 1 277 1 1 19 PRO N N -0.804 -7.239 2.658 1.00 . A A . 19 PRO N 1 1 1 278 1 1 19 PRO O O 0.384 -5.474 4.401 1.00 . A A . 19 PRO O 1 1 1 279 1 1 20 PRO C C 3.285 -4.774 5.392 1.00 . A A . 20 PRO C 1 1 1 280 1 1 20 PRO CA C 2.609 -5.993 6.011 1.00 . A A . 20 PRO CA 1 1 1 281 1 1 20 PRO CB C 3.643 -6.875 6.716 1.00 . A A . 20 PRO CB 1 1 1 282 1 1 20 PRO CD C 2.772 -8.155 4.894 1.00 . A A . 20 PRO CD 1 1 1 283 1 1 20 PRO CG C 4.013 -7.906 5.706 1.00 . A A . 20 PRO CG 1 1 1 284 1 1 20 PRO HA H 1.865 -5.669 6.723 1.00 . A A . 20 PRO HA 1 1 1 285 1 1 20 PRO HB3 H 3.200 -7.324 7.593 1.00 . A A . 20 PRO HB3 1 1 1 286 1 1 20 PRO HD3 H 2.201 -8.968 5.318 1.00 . A A . 20 PRO HD3 1 1 1 287 1 1 20 PRO HG3 H 4.323 -8.813 6.204 1.00 . A A . 20 PRO HG3 1 1 1 288 1 1 20 PRO N N 2.035 -6.885 4.999 1.00 . A A . 20 PRO N 1 1 1 289 1 1 20 PRO O O 4.513 -4.693 5.336 1.00 . A A . 20 PRO O 1 1 1 290 1 1 21 LEU C C 2.828 -1.414 5.250 1.00 . A A . 21 LEU C 1 1 1 291 1 1 21 LEU CA C 2.996 -2.610 4.316 1.00 . A A . 21 LEU CA 1 1 1 292 1 1 21 LEU CB C 2.282 -2.340 2.991 1.00 . A A . 21 LEU CB 1 1 1 293 1 1 21 LEU CD1 C 1.752 -3.030 0.640 1.00 . A A . 21 LEU CD1 1 1 1 294 1 1 21 LEU CD2 C 4.134 -2.890 1.392 1.00 . A A . 21 LEU CD2 1 1 1 295 1 1 21 LEU CG C 2.706 -3.213 1.811 1.00 . A A . 21 LEU CG 1 1 1 296 1 1 21 LEU H H 1.506 -3.947 5.004 1.00 . A A . 21 LEU H 1 1 1 297 1 1 21 LEU HA H 4.048 -2.757 4.127 1.00 . A A . 21 LEU HA 1 1 1 298 1 1 21 LEU HB3 H 2.464 -1.308 2.722 1.00 . A A . 21 LEU HB3 1 1 1 299 1 1 21 LEU HD11 H 0.753 -3.308 0.944 1.00 . A A . 21 LEU HD11 1 1 1 300 1 1 21 LEU HD12 H 2.066 -3.657 -0.182 1.00 . A A . 21 LEU HD12 1 1 1 301 1 1 21 LEU HD13 H 1.760 -1.996 0.328 1.00 . A A . 21 LEU HD13 1 1 1 302 1 1 21 LEU HD21 H 4.128 -2.437 0.412 1.00 . A A . 21 LEU HD21 1 1 1 303 1 1 21 LEU HD22 H 4.715 -3.800 1.366 1.00 . A A . 21 LEU HD22 1 1 1 304 1 1 21 LEU HD23 H 4.570 -2.204 2.104 1.00 . A A . 21 LEU HD23 1 1 1 305 1 1 21 LEU HG H 2.672 -4.252 2.109 1.00 . A A . 21 LEU HG 1 1 1 306 1 1 21 LEU N N 2.476 -3.826 4.932 1.00 . A A . 21 LEU N 1 1 1 307 1 1 21 LEU O O 2.201 -1.519 6.304 1.00 . A A . 21 LEU O 1 1 1 308 1 1 22 LYS C C 3.139 2.165 4.759 1.00 . A A . 22 LYS C 1 1 1 309 1 1 22 LYS CA C 3.303 0.939 5.652 1.00 . A A . 22 LYS CA 1 1 1 310 1 1 22 LYS CB C 4.551 1.094 6.524 1.00 . A A . 22 LYS CB 1 1 1 311 1 1 22 LYS CD C 5.539 1.846 8.708 1.00 . A A . 22 LYS CD 1 1 1 312 1 1 22 LYS CE C 6.003 0.464 9.139 1.00 . A A . 22 LYS CE 1 1 1 313 1 1 22 LYS CG C 4.282 1.771 7.857 1.00 . A A . 22 LYS CG 1 1 1 314 1 1 22 LYS H H 3.879 -0.257 4.003 1.00 . A A . 22 LYS H 1 1 1 315 1 1 22 LYS HA H 2.437 0.856 6.290 1.00 . A A . 22 LYS HA 1 1 1 316 1 1 22 LYS HB3 H 5.281 1.682 5.986 1.00 . A A . 22 LYS HB3 1 1 1 317 1 1 22 LYS HD3 H 5.331 2.438 9.589 1.00 . A A . 22 LYS HD3 1 1 1 318 1 1 22 LYS HE3 H 5.161 -0.212 9.104 1.00 . A A . 22 LYS HE3 1 1 1 319 1 1 22 LYS HG3 H 3.530 1.207 8.390 1.00 . A A . 22 LYS HG3 1 1 1 320 1 1 22 LYS HZ1 H 6.697 -0.782 7.612 1.00 . A A . 22 LYS HZ1 1 1 1 321 1 1 22 LYS HZ2 H 7.836 -0.489 8.828 1.00 . A A . 22 LYS HZ2 1 1 1 322 1 1 22 LYS HZ3 H 7.487 0.712 7.691 1.00 . A A . 22 LYS HZ3 1 1 1 323 1 1 22 LYS N N 3.392 -0.277 4.854 1.00 . A A . 22 LYS N 1 1 1 324 1 1 22 LYS NZ N 7.081 -0.060 8.256 1.00 . A A . 22 LYS NZ 1 1 1 325 1 1 22 LYS O O 4.003 2.464 3.934 1.00 . A A . 22 LYS O 1 1 1 326 1 1 23 CYS C C 2.407 5.293 4.763 1.00 . A A . 23 CYS C 1 1 1 327 1 1 23 CYS CA C 1.749 4.065 4.141 1.00 . A A . 23 CYS CA 1 1 1 328 1 1 23 CYS CB C 0.241 4.286 4.023 1.00 . A A . 23 CYS CB 1 1 1 329 1 1 23 CYS H H 1.375 2.583 5.604 1.00 . A A . 23 CYS H 1 1 1 330 1 1 23 CYS HA H 2.160 3.913 3.153 1.00 . A A . 23 CYS HA 1 1 1 331 1 1 23 CYS HB3 H 0.055 5.109 3.350 1.00 . A A . 23 CYS HB3 1 1 1 332 1 1 23 CYS N N 2.027 2.871 4.930 1.00 . A A . 23 CYS N 1 1 1 333 1 1 23 CYS O O 3.213 5.178 5.685 1.00 . A A . 23 CYS O 1 1 1 334 1 1 23 CYS SG S -0.675 2.841 3.397 1.00 . A A . 23 CYS SG 1 1 1 335 1 1 24 ASN C C 1.508 8.738 5.019 1.00 . A A . 24 ASN C 1 1 1 336 1 1 24 ASN CA C 2.613 7.719 4.756 1.00 . A A . 24 ASN CA 1 1 1 337 1 1 24 ASN CB C 3.623 8.291 3.760 1.00 . A A . 24 ASN CB 1 1 1 338 1 1 24 ASN CG C 3.388 7.793 2.348 1.00 . A A . 24 ASN CG 1 1 1 339 1 1 24 ASN H H 1.408 6.496 3.517 1.00 . A A . 24 ASN H 1 1 1 340 1 1 24 ASN HA H 3.117 7.506 5.686 1.00 . A A . 24 ASN HA 1 1 1 341 1 1 24 ASN HB3 H 4.619 8.005 4.063 1.00 . A A . 24 ASN HB3 1 1 1 342 1 1 24 ASN HD21 H 2.598 9.544 1.835 1.00 . A A . 24 ASN HD21 1 1 1 343 1 1 24 ASN HD22 H 2.662 8.353 0.584 1.00 . A A . 24 ASN HD22 1 1 1 344 1 1 24 ASN N N 2.056 6.469 4.251 1.00 . A A . 24 ASN N 1 1 1 345 1 1 24 ASN ND2 N 2.826 8.650 1.503 1.00 . A A . 24 ASN ND2 1 1 1 346 1 1 24 ASN O O 1.316 9.185 6.151 1.00 . A A . 24 ASN O 1 1 1 347 1 1 24 ASN OD1 O 3.708 6.650 2.019 1.00 . A A . 24 ASN OD1 1 1 1 348 1 1 25 LYS C C -0.974 10.296 2.731 1.00 . A A . 25 LYS C 1 1 1 349 1 1 25 LYS CA C -0.304 10.067 4.082 1.00 . A A . 25 LYS CA 1 1 1 350 1 1 25 LYS CB C 0.221 11.394 4.634 1.00 . A A . 25 LYS CB 1 1 1 351 1 1 25 LYS CD C -0.255 13.383 6.093 1.00 . A A . 25 LYS CD 1 1 1 352 1 1 25 LYS CE C -1.495 14.261 6.032 1.00 . A A . 25 LYS CE 1 1 1 353 1 1 25 LYS CG C -0.587 11.929 5.803 1.00 . A A . 25 LYS CG 1 1 1 354 1 1 25 LYS H H 0.984 8.711 3.091 1.00 . A A . 25 LYS H 1 1 1 355 1 1 25 LYS HA H -1.034 9.665 4.768 1.00 . A A . 25 LYS HA 1 1 1 356 1 1 25 LYS HB3 H 0.203 12.131 3.844 1.00 . A A . 25 LYS HB3 1 1 1 357 1 1 25 LYS HD3 H 0.459 13.732 5.360 1.00 . A A . 25 LYS HD3 1 1 1 358 1 1 25 LYS HE3 H -2.364 13.648 6.220 1.00 . A A . 25 LYS HE3 1 1 1 359 1 1 25 LYS HG3 H -0.369 11.338 6.681 1.00 . A A . 25 LYS HG3 1 1 1 360 1 1 25 LYS HZ1 H -2.283 15.308 7.659 1.00 . A A . 25 LYS HZ1 1 1 1 361 1 1 25 LYS HZ2 H -1.438 16.281 6.562 1.00 . A A . 25 LYS HZ2 1 1 1 362 1 1 25 LYS HZ3 H -0.592 15.271 7.622 1.00 . A A . 25 LYS HZ3 1 1 1 363 1 1 25 LYS N N 0.783 9.102 3.967 1.00 . A A . 25 LYS N 1 1 1 364 1 1 25 LYS NZ N -1.449 15.357 7.039 1.00 . A A . 25 LYS NZ 1 1 1 365 1 1 25 LYS O O -2.184 10.511 2.656 1.00 . A A . 25 LYS O 1 1 1 366 1 1 26 ALA C C -1.040 9.112 -0.341 1.00 . A A . 26 ALA C 1 1 1 367 1 1 26 ALA CA C -0.699 10.445 0.318 1.00 . A A . 26 ALA CA 1 1 1 368 1 1 26 ALA CB C 0.309 11.210 -0.527 1.00 . A A . 26 ALA CB 1 1 1 369 1 1 26 ALA H H 0.775 10.071 1.790 1.00 . A A . 26 ALA H 1 1 1 370 1 1 26 ALA HA H -1.597 11.040 0.389 1.00 . A A . 26 ALA HA 1 1 1 371 1 1 26 ALA HB1 H -0.214 11.788 -1.274 1.00 . A A . 26 ALA HB1 1 1 1 372 1 1 26 ALA HB2 H 0.880 11.873 0.106 1.00 . A A . 26 ALA HB2 1 1 1 373 1 1 26 ALA HB3 H 0.975 10.513 -1.012 1.00 . A A . 26 ALA HB3 1 1 1 374 1 1 26 ALA N N -0.181 10.246 1.666 1.00 . A A . 26 ALA N 1 1 1 375 1 1 26 ALA O O -1.091 9.011 -1.566 1.00 . A A . 26 ALA O 1 1 1 376 1 1 27 GLN C C -0.499 6.232 -0.925 1.00 . A A . 27 GLN C 1 1 1 377 1 1 27 GLN CA C -1.606 6.767 -0.023 1.00 . A A . 27 GLN CA 1 1 1 378 1 1 27 GLN CB C -2.930 6.808 -0.789 1.00 . A A . 27 GLN CB 1 1 1 379 1 1 27 GLN CD C -4.111 7.828 1.198 1.00 . A A . 27 GLN CD 1 1 1 380 1 1 27 GLN CG C -4.154 6.773 0.110 1.00 . A A . 27 GLN CG 1 1 1 381 1 1 27 GLN H H -1.214 8.237 1.448 1.00 . A A . 27 GLN H 1 1 1 382 1 1 27 GLN HA H -1.712 6.108 0.825 1.00 . A A . 27 GLN HA 1 1 1 383 1 1 27 GLN HB3 H -2.974 5.959 -1.455 1.00 . A A . 27 GLN HB3 1 1 1 384 1 1 27 GLN HE21 H -4.136 9.273 -0.168 1.00 . A A . 27 GLN HE21 1 1 1 385 1 1 27 GLN HE22 H -4.081 9.796 1.477 1.00 . A A . 27 GLN HE22 1 1 1 386 1 1 27 GLN HG3 H -4.216 5.800 0.575 1.00 . A A . 27 GLN HG3 1 1 1 387 1 1 27 GLN N N -1.271 8.094 0.481 1.00 . A A . 27 GLN N 1 1 1 388 1 1 27 GLN NE2 N -4.108 9.093 0.796 1.00 . A A . 27 GLN NE2 1 1 1 389 1 1 27 GLN O O -0.423 6.581 -2.104 1.00 . A A . 27 GLN O 1 1 1 390 1 1 27 GLN OE1 O -4.080 7.510 2.387 1.00 . A A . 27 GLN OE1 1 1 1 391 1 1 28 ILE C C 1.755 3.381 -0.650 1.00 . A A . 28 ILE C 1 1 1 392 1 1 28 ILE CA C 1.458 4.800 -1.120 1.00 . A A . 28 ILE CA 1 1 1 393 1 1 28 ILE CB C 2.738 5.648 -0.994 1.00 . A A . 28 ILE CB 1 1 1 394 1 1 28 ILE CD1 C 2.266 7.025 -3.083 1.00 . A A . 28 ILE CD1 1 1 1 395 1 1 28 ILE CG1 C 2.514 7.040 -1.590 1.00 . A A . 28 ILE CG1 1 1 1 396 1 1 28 ILE CG2 C 3.904 4.954 -1.681 1.00 . A A . 28 ILE CG2 1 1 1 397 1 1 28 ILE H H 0.243 5.144 0.578 1.00 . A A . 28 ILE H 1 1 1 398 1 1 28 ILE HA H 1.170 4.771 -2.161 1.00 . A A . 28 ILE HA 1 1 1 399 1 1 28 ILE HB H 2.976 5.748 0.054 1.00 . A A . 28 ILE HB 1 1 1 400 1 1 28 ILE HD11 H 2.211 6.003 -3.428 1.00 . A A . 28 ILE HD11 1 1 1 401 1 1 28 ILE HD12 H 1.334 7.526 -3.298 1.00 . A A . 28 ILE HD12 1 1 1 402 1 1 28 ILE HD13 H 3.074 7.533 -3.588 1.00 . A A . 28 ILE HD13 1 1 1 403 1 1 28 ILE HG13 H 3.388 7.648 -1.405 1.00 . A A . 28 ILE HG13 1 1 1 404 1 1 28 ILE HG21 H 3.632 4.715 -2.699 1.00 . A A . 28 ILE HG21 1 1 1 405 1 1 28 ILE HG22 H 4.762 5.608 -1.683 1.00 . A A . 28 ILE HG22 1 1 1 406 1 1 28 ILE HG23 H 4.144 4.045 -1.151 1.00 . A A . 28 ILE HG23 1 1 1 407 1 1 28 ILE N N 0.356 5.384 -0.365 1.00 . A A . 28 ILE N 1 1 1 408 1 1 28 ILE O O 1.856 2.456 -1.458 1.00 . A A . 28 ILE O 1 1 1 409 1 1 29 CYS C C 3.566 1.421 0.834 1.00 . A A . 29 CYS C 1 1 1 410 1 1 29 CYS CA C 2.176 1.906 1.239 1.00 . A A . 29 CYS CA 1 1 1 411 1 1 29 CYS CB C 1.122 0.890 0.799 1.00 . A A . 29 CYS CB 1 1 1 412 1 1 29 CYS H H 1.801 3.989 1.254 1.00 . A A . 29 CYS H 1 1 1 413 1 1 29 CYS HA H 2.143 2.003 2.314 1.00 . A A . 29 CYS HA 1 1 1 414 1 1 29 CYS HB3 H 1.608 0.080 0.276 1.00 . A A . 29 CYS HB3 1 1 1 415 1 1 29 CYS N N 1.893 3.213 0.661 1.00 . A A . 29 CYS N 1 1 1 416 1 1 29 CYS O O 3.891 1.358 -0.352 1.00 . A A . 29 CYS O 1 1 1 417 1 1 29 CYS SG S 0.164 0.169 2.171 1.00 . A A . 29 CYS SG 1 1 1 418 1 1 30 VAL C C 6.360 0.031 2.843 1.00 . A A . 30 VAL C 1 1 1 419 1 1 30 VAL CA C 5.734 0.601 1.575 1.00 . A A . 30 VAL CA 1 1 1 420 1 1 30 VAL CB C 6.636 1.724 1.030 1.00 . A A . 30 VAL CB 1 1 1 421 1 1 30 VAL CG1 C 6.776 1.611 -0.480 1.00 . A A . 30 VAL CG1 1 1 1 422 1 1 30 VAL CG2 C 6.084 3.086 1.423 1.00 . A A . 30 VAL CG2 1 1 1 423 1 1 30 VAL H H 4.064 1.153 2.752 1.00 . A A . 30 VAL H 1 1 1 424 1 1 30 VAL HA H 5.679 -0.181 0.831 1.00 . A A . 30 VAL HA 1 1 1 425 1 1 30 VAL HB H 7.616 1.616 1.470 1.00 . A A . 30 VAL HB 1 1 1 426 1 1 30 VAL HG11 H 6.027 2.226 -0.957 1.00 . A A . 30 VAL HG11 1 1 1 427 1 1 30 VAL HG12 H 7.760 1.945 -0.777 1.00 . A A . 30 VAL HG12 1 1 1 428 1 1 30 VAL HG13 H 6.640 0.582 -0.778 1.00 . A A . 30 VAL HG13 1 1 1 429 1 1 30 VAL HG21 H 5.246 3.332 0.789 1.00 . A A . 30 VAL HG21 1 1 1 430 1 1 30 VAL HG22 H 5.762 3.060 2.453 1.00 . A A . 30 VAL HG22 1 1 1 431 1 1 30 VAL HG23 H 6.855 3.834 1.306 1.00 . A A . 30 VAL HG23 1 1 1 432 1 1 30 VAL N N 4.381 1.081 1.828 1.00 . A A . 30 VAL N 1 1 1 433 1 1 30 VAL O O 5.730 0.001 3.900 1.00 . A A . 30 VAL O 1 1 1 434 1 1 31 ASP C C 9.762 -1.315 3.497 1.00 . A A . 31 ASP C 1 1 1 435 1 1 31 ASP CA C 8.319 -0.988 3.868 1.00 . A A . 31 ASP CA 1 1 1 436 1 1 31 ASP CB C 7.609 -2.249 4.365 1.00 . A A . 31 ASP CB 1 1 1 437 1 1 31 ASP CG C 7.046 -3.082 3.229 1.00 . A A . 31 ASP CG 1 1 1 438 1 1 31 ASP H H 8.054 -0.370 1.860 1.00 . A A . 31 ASP H 1 1 1 439 1 1 31 ASP HA H 8.321 -0.253 4.658 1.00 . A A . 31 ASP HA 1 1 1 440 1 1 31 ASP HB3 H 6.795 -1.963 5.015 1.00 . A A . 31 ASP HB3 1 1 1 441 1 1 31 ASP N N 7.605 -0.421 2.730 1.00 . A A . 31 ASP N 1 1 1 442 1 1 31 ASP O O 10.107 -1.472 2.325 1.00 . A A . 31 ASP O 1 1 1 443 1 1 31 ASP OD1 O 7.653 -3.085 2.138 1.00 . A A . 31 ASP OD1 1 1 1 444 1 1 31 ASP OD2 O 6.000 -3.732 3.434 1.00 . A A . 31 ASP OD2 1 1 1 445 1 1 32 PRO C C 12.270 -3.162 3.859 1.00 . A A . 32 PRO C 1 1 1 446 1 1 32 PRO CA C 12.046 -1.727 4.323 1.00 . A A . 32 PRO CA 1 1 1 447 1 1 32 PRO CB C 12.649 -1.514 5.713 1.00 . A A . 32 PRO CB 1 1 1 448 1 1 32 PRO CD C 10.284 -1.244 5.938 1.00 . A A . 32 PRO CD 1 1 1 449 1 1 32 PRO CG C 11.515 -1.729 6.654 1.00 . A A . 32 PRO CG 1 1 1 450 1 1 32 PRO HA H 12.507 -1.047 3.621 1.00 . A A . 32 PRO HA 1 1 1 451 1 1 32 PRO HB3 H 13.040 -0.511 5.790 1.00 . A A . 32 PRO HB3 1 1 1 452 1 1 32 PRO HD3 H 10.101 -0.203 6.165 1.00 . A A . 32 PRO HD3 1 1 1 453 1 1 32 PRO HG3 H 11.672 -1.156 7.556 1.00 . A A . 32 PRO HG3 1 1 1 454 1 1 32 PRO N N 10.626 -1.419 4.517 1.00 . A A . 32 PRO N 1 1 1 455 1 1 32 PRO O O 13.326 -3.494 3.320 1.00 . A A . 32 PRO O 1 1 1 456 1 1 33 LYS C C 11.530 -5.537 2.162 1.00 . A A . 33 LYS C 1 1 1 457 1 1 33 LYS CA C 11.354 -5.410 3.672 1.00 . A A . 33 LYS CA 1 1 1 458 1 1 33 LYS CB C 10.099 -6.165 4.115 1.00 . A A . 33 LYS CB 1 1 1 459 1 1 33 LYS CD C 9.381 -5.937 6.511 1.00 . A A . 33 LYS CD 1 1 1 460 1 1 33 LYS CE C 9.153 -6.711 7.801 1.00 . A A . 33 LYS CE 1 1 1 461 1 1 33 LYS CG C 10.200 -6.742 5.518 1.00 . A A . 33 LYS CG 1 1 1 462 1 1 33 LYS H H 10.452 -3.686 4.504 1.00 . A A . 33 LYS H 1 1 1 463 1 1 33 LYS HA H 12.215 -5.842 4.160 1.00 . A A . 33 LYS HA 1 1 1 464 1 1 33 LYS HB3 H 9.921 -6.978 3.426 1.00 . A A . 33 LYS HB3 1 1 1 465 1 1 33 LYS HD3 H 8.424 -5.702 6.069 1.00 . A A . 33 LYS HD3 1 1 1 466 1 1 33 LYS HE3 H 8.847 -6.018 8.571 1.00 . A A . 33 LYS HE3 1 1 1 467 1 1 33 LYS HG3 H 11.236 -6.734 5.826 1.00 . A A . 33 LYS HG3 1 1 1 468 1 1 33 LYS HZ1 H 7.350 -7.413 7.014 1.00 . A A . 33 LYS HZ1 1 1 1 469 1 1 33 LYS HZ2 H 7.688 -7.987 8.568 1.00 . A A . 33 LYS HZ2 1 1 1 470 1 1 33 LYS HZ3 H 8.517 -8.618 7.236 1.00 . A A . 33 LYS HZ3 1 1 1 471 1 1 33 LYS N N 11.269 -4.010 4.070 1.00 . A A . 33 LYS N 1 1 1 472 1 1 33 LYS NZ N 8.103 -7.755 7.644 1.00 . A A . 33 LYS NZ 1 1 1 473 1 1 33 LYS O O 12.369 -6.302 1.687 1.00 . A A . 33 LYS O 1 1 1 474 1 1 34 LYS C C 10.363 -3.471 -0.632 1.00 . A A . 34 LYS C 1 1 1 475 1 1 34 LYS CA C 10.803 -4.807 -0.043 1.00 . A A . 34 LYS CA 1 1 1 476 1 1 34 LYS CB C 9.926 -5.933 -0.596 1.00 . A A . 34 LYS CB 1 1 1 477 1 1 34 LYS CD C 10.629 -8.323 -0.922 1.00 . A A . 34 LYS CD 1 1 1 478 1 1 34 LYS CE C 11.584 -9.248 -1.659 1.00 . A A . 34 LYS CE 1 1 1 479 1 1 34 LYS CG C 10.679 -6.911 -1.482 1.00 . A A . 34 LYS CG 1 1 1 480 1 1 34 LYS H H 10.085 -4.192 1.851 1.00 . A A . 34 LYS H 1 1 1 481 1 1 34 LYS HA H 11.829 -4.991 -0.324 1.00 . A A . 34 LYS HA 1 1 1 482 1 1 34 LYS HB3 H 9.124 -5.498 -1.176 1.00 . A A . 34 LYS HB3 1 1 1 483 1 1 34 LYS HD3 H 9.623 -8.705 -1.023 1.00 . A A . 34 LYS HD3 1 1 1 484 1 1 34 LYS HE3 H 12.442 -9.435 -1.030 1.00 . A A . 34 LYS HE3 1 1 1 485 1 1 34 LYS HG3 H 11.711 -6.597 -1.552 1.00 . A A . 34 LYS HG3 1 1 1 486 1 1 34 LYS HZ1 H 10.193 -10.769 -1.319 1.00 . A A . 34 LYS HZ1 1 1 1 487 1 1 34 LYS HZ2 H 11.651 -11.310 -1.986 1.00 . A A . 34 LYS HZ2 1 1 1 488 1 1 34 LYS HZ3 H 10.527 -10.500 -2.955 1.00 . A A . 34 LYS HZ3 1 1 1 489 1 1 34 LYS N N 10.734 -4.782 1.413 1.00 . A A . 34 LYS N 1 1 1 490 1 1 34 LYS NZ N 10.943 -10.548 -2.004 1.00 . A A . 34 LYS NZ 1 1 1 491 1 1 34 LYS O O 9.185 -3.118 -0.585 1.00 . A A . 34 LYS O 1 1 1 492 1 1 35 GLY C C 12.022 -0.377 -1.412 1.00 . A A . 35 GLY C 1 1 1 493 1 1 35 GLY CA C 11.008 -1.442 -1.779 1.00 . A A . 35 GLY CA 1 1 1 494 1 1 35 GLY H H 12.240 -3.062 -1.196 1.00 . A A . 35 GLY H 1 1 1 495 1 1 35 GLY HA2 H 10.984 -1.547 -2.853 1.00 . A A . 35 GLY HA2 1 1 1 496 1 1 35 GLY HA3 H 10.033 -1.127 -1.436 1.00 . A A . 35 GLY HA3 1 1 1 497 1 1 35 GLY N N 11.318 -2.731 -1.187 1.00 . A A . 35 GLY N 1 1 1 498 1 1 35 GLY O O 13.226 -0.572 -1.580 1.00 . A A . 35 GLY O 1 1 1 499 1 1 36 TRP C C 13.188 2.383 -1.719 1.00 . A A . 36 TRP C 1 1 1 500 1 1 36 TRP CA C 12.409 1.854 -0.519 1.00 . A A . 36 TRP CA 1 1 1 501 1 1 36 TRP CB C 13.378 1.400 0.574 1.00 . A A . 36 TRP CB 1 1 1 502 1 1 36 TRP CD1 C 14.895 3.345 1.268 1.00 . A A . 36 TRP CD1 1 1 1 503 1 1 36 TRP CD2 C 13.227 2.922 2.703 1.00 . A A . 36 TRP CD2 1 1 1 504 1 1 36 TRP CE2 C 13.981 4.004 3.197 1.00 . A A . 36 TRP CE2 1 1 1 505 1 1 36 TRP CE3 C 12.125 2.477 3.437 1.00 . A A . 36 TRP CE3 1 1 1 506 1 1 36 TRP CG C 13.828 2.516 1.468 1.00 . A A . 36 TRP CG 1 1 1 507 1 1 36 TRP CH2 C 12.581 4.189 5.091 1.00 . A A . 36 TRP CH2 1 1 1 508 1 1 36 TRP CZ2 C 13.666 4.645 4.391 1.00 . A A . 36 TRP CZ2 1 1 1 509 1 1 36 TRP CZ3 C 11.814 3.114 4.623 1.00 . A A . 36 TRP CZ3 1 1 1 510 1 1 36 TRP H H 10.566 0.849 -0.799 1.00 . A A . 36 TRP H 1 1 1 511 1 1 36 TRP HA H 11.787 2.646 -0.131 1.00 . A A . 36 TRP HA 1 1 1 512 1 1 36 TRP HB3 H 14.253 0.967 0.112 1.00 . A A . 36 TRP HB3 1 1 1 513 1 1 36 TRP HD1 H 15.557 3.291 0.418 1.00 . A A . 36 TRP HD1 1 1 1 514 1 1 36 TRP HE1 H 15.675 4.941 2.390 1.00 . A A . 36 TRP HE1 1 1 1 515 1 1 36 TRP HE3 H 11.521 1.650 3.093 1.00 . A A . 36 TRP HE3 1 1 1 516 1 1 36 TRP HH2 H 12.302 4.657 6.022 1.00 . A A . 36 TRP HH2 1 1 1 517 1 1 36 TRP HZ2 H 14.247 5.476 4.765 1.00 . A A . 36 TRP HZ2 1 1 1 518 1 1 36 TRP HZ3 H 10.965 2.784 5.205 1.00 . A A . 36 TRP HZ3 1 1 1 519 1 1 36 TRP N N 11.536 0.752 -0.910 1.00 . A A . 36 TRP N 1 1 1 520 1 1 36 TRP NE1 N 14.992 4.242 2.305 1.00 . A A . 36 TRP NE1 1 1 1 521 1 1 36 TRP O O 13.368 3.590 -1.871 1.00 . A A . 36 TRP O 1 1 2 522 1 1 1 ASP C C -10.329 -9.914 -2.351 1.00 . A A . 1 ASP C 1 1 2 523 1 1 1 ASP CA C -10.100 -10.865 -1.179 1.00 . A A . 1 ASP CA 1 1 2 524 1 1 1 ASP CB C -10.113 -12.313 -1.672 1.00 . A A . 1 ASP CB 1 1 2 525 1 1 1 ASP CG C -8.924 -12.633 -2.556 1.00 . A A . 1 ASP CG 1 1 2 526 1 1 1 ASP H1 H -11.468 -9.772 0.010 1.00 . A A . 1 ASP H1 1 1 2 527 1 1 1 ASP HA H -9.137 -10.651 -0.742 1.00 . A A . 1 ASP HA 1 1 2 528 1 1 1 ASP HB3 H -11.017 -12.486 -2.237 1.00 . A A . 1 ASP HB3 1 1 2 529 1 1 1 ASP N N -11.113 -10.672 -0.149 1.00 . A A . 1 ASP N 1 1 2 530 1 1 1 ASP O O -10.510 -10.347 -3.489 1.00 . A A . 1 ASP O 1 1 2 531 1 1 1 ASP OD1 O -7.777 -12.432 -2.104 1.00 . A A . 1 ASP OD1 1 1 2 532 1 1 1 ASP OD2 O -9.141 -13.087 -3.700 1.00 . A A . 1 ASP OD2 1 1 2 533 1 1 2 PHE C C -9.242 -7.353 -3.876 1.00 . A A . 2 PHE C 1 1 2 534 1 1 2 PHE CA C -10.527 -7.605 -3.092 1.00 . A A . 2 PHE CA 1 1 2 535 1 1 2 PHE CB C -11.017 -6.299 -2.462 1.00 . A A . 2 PHE CB 1 1 2 536 1 1 2 PHE CD1 C -13.384 -7.019 -2.038 1.00 . A A . 2 PHE CD1 1 1 2 537 1 1 2 PHE CD2 C -13.014 -4.986 -3.229 1.00 . A A . 2 PHE CD2 1 1 2 538 1 1 2 PHE CE1 C -14.750 -6.836 -2.145 1.00 . A A . 2 PHE CE1 1 1 2 539 1 1 2 PHE CE2 C -14.379 -4.798 -3.338 1.00 . A A . 2 PHE CE2 1 1 2 540 1 1 2 PHE CG C -12.501 -6.097 -2.579 1.00 . A A . 2 PHE CG 1 1 2 541 1 1 2 PHE CZ C -15.247 -5.723 -2.795 1.00 . A A . 2 PHE CZ 1 1 2 542 1 1 2 PHE H H -10.169 -8.334 -1.138 1.00 . A A . 2 PHE H 1 1 2 543 1 1 2 PHE HA H -11.282 -7.973 -3.770 1.00 . A A . 2 PHE HA 1 1 2 544 1 1 2 PHE HB3 H -10.529 -5.468 -2.947 1.00 . A A . 2 PHE HB3 1 1 2 545 1 1 2 PHE HD1 H -12.996 -7.889 -1.529 1.00 . A A . 2 PHE HD1 1 1 2 546 1 1 2 PHE HD2 H -12.334 -4.261 -3.654 1.00 . A A . 2 PHE HD2 1 1 2 547 1 1 2 PHE HE1 H -15.427 -7.560 -1.719 1.00 . A A . 2 PHE HE1 1 1 2 548 1 1 2 PHE HE2 H -14.764 -3.927 -3.846 1.00 . A A . 2 PHE HE2 1 1 2 549 1 1 2 PHE HZ H -16.314 -5.578 -2.880 1.00 . A A . 2 PHE HZ 1 1 2 550 1 1 2 PHE N N -10.319 -8.617 -2.063 1.00 . A A . 2 PHE N 1 1 2 551 1 1 2 PHE O O -8.140 -7.670 -3.427 1.00 . A A . 2 PHE O 1 1 2 552 1 1 3 PRO C C -7.382 -5.336 -5.395 1.00 . A A . 3 PRO C 1 1 2 553 1 1 3 PRO CA C -8.249 -6.463 -5.948 1.00 . A A . 3 PRO CA 1 1 2 554 1 1 3 PRO CB C -8.912 -6.034 -7.258 1.00 . A A . 3 PRO CB 1 1 2 555 1 1 3 PRO CD C -10.670 -6.366 -5.673 1.00 . A A . 3 PRO CD 1 1 2 556 1 1 3 PRO CG C -10.257 -5.536 -6.856 1.00 . A A . 3 PRO CG 1 1 2 557 1 1 3 PRO HA H -7.635 -7.335 -6.121 1.00 . A A . 3 PRO HA 1 1 2 558 1 1 3 PRO HB3 H -8.987 -6.880 -7.922 1.00 . A A . 3 PRO HB3 1 1 2 559 1 1 3 PRO HD3 H -11.232 -7.229 -5.995 1.00 . A A . 3 PRO HD3 1 1 2 560 1 1 3 PRO HG3 H -10.955 -5.669 -7.669 1.00 . A A . 3 PRO HG3 1 1 2 561 1 1 3 PRO N N -9.386 -6.770 -5.075 1.00 . A A . 3 PRO N 1 1 2 562 1 1 3 PRO O O -7.855 -4.217 -5.194 1.00 . A A . 3 PRO O 1 1 2 563 1 1 4 LEU C C -3.735 -5.073 -4.876 1.00 . A A . 4 LEU C 1 1 2 564 1 1 4 LEU CA C -5.178 -4.651 -4.620 1.00 . A A . 4 LEU CA 1 1 2 565 1 1 4 LEU CB C -5.407 -4.457 -3.121 1.00 . A A . 4 LEU CB 1 1 2 566 1 1 4 LEU CD1 C -5.152 -5.264 -0.761 1.00 . A A . 4 LEU CD1 1 1 2 567 1 1 4 LEU CD2 C -4.945 -6.878 -2.661 1.00 . A A . 4 LEU CD2 1 1 2 568 1 1 4 LEU CG C -4.695 -5.449 -2.200 1.00 . A A . 4 LEU CG 1 1 2 569 1 1 4 LEU H H -5.793 -6.547 -5.330 1.00 . A A . 4 LEU H 1 1 2 570 1 1 4 LEU HA H -5.362 -3.716 -5.128 1.00 . A A . 4 LEU HA 1 1 2 571 1 1 4 LEU HB3 H -6.468 -4.535 -2.936 1.00 . A A . 4 LEU HB3 1 1 2 572 1 1 4 LEU HD11 H -5.066 -6.201 -0.233 1.00 . A A . 4 LEU HD11 1 1 2 573 1 1 4 LEU HD12 H -6.182 -4.938 -0.750 1.00 . A A . 4 LEU HD12 1 1 2 574 1 1 4 LEU HD13 H -4.534 -4.520 -0.280 1.00 . A A . 4 LEU HD13 1 1 2 575 1 1 4 LEU HD21 H -4.871 -7.546 -1.817 1.00 . A A . 4 LEU HD21 1 1 2 576 1 1 4 LEU HD22 H -4.207 -7.150 -3.401 1.00 . A A . 4 LEU HD22 1 1 2 577 1 1 4 LEU HD23 H -5.932 -6.949 -3.094 1.00 . A A . 4 LEU HD23 1 1 2 578 1 1 4 LEU HG H -3.631 -5.266 -2.237 1.00 . A A . 4 LEU HG 1 1 2 579 1 1 4 LEU N N -6.112 -5.639 -5.151 1.00 . A A . 4 LEU N 1 1 2 580 1 1 4 LEU O O -3.476 -6.181 -5.347 1.00 . A A . 4 LEU O 1 1 2 581 1 1 5 SER C C -0.579 -4.112 -3.509 1.00 . A A . 5 SER C 1 1 2 582 1 1 5 SER CA C -1.381 -4.464 -4.759 1.00 . A A . 5 SER CA 1 1 2 583 1 1 5 SER CB C -0.847 -3.679 -5.959 1.00 . A A . 5 SER CB 1 1 2 584 1 1 5 SER H H -3.068 -3.318 -4.190 1.00 . A A . 5 SER H 1 1 2 585 1 1 5 SER HA H -1.276 -5.520 -4.955 1.00 . A A . 5 SER HA 1 1 2 586 1 1 5 SER HB3 H 0.233 -3.668 -5.926 1.00 . A A . 5 SER HB3 1 1 2 587 1 1 5 SER HG H -2.082 -4.747 -7.041 1.00 . A A . 5 SER HG 1 1 2 588 1 1 5 SER N N -2.799 -4.184 -4.562 1.00 . A A . 5 SER N 1 1 2 589 1 1 5 SER O O -1.141 -3.727 -2.484 1.00 . A A . 5 SER O 1 1 2 590 1 1 5 SER OG O -1.261 -4.269 -7.179 1.00 . A A . 5 SER OG 1 1 2 591 1 1 6 LYS C C 2.647 -2.886 -2.868 1.00 . A A . 6 LYS C 1 1 2 592 1 1 6 LYS CA C 1.622 -3.946 -2.482 1.00 . A A . 6 LYS CA 1 1 2 593 1 1 6 LYS CB C 2.337 -5.215 -2.011 1.00 . A A . 6 LYS CB 1 1 2 594 1 1 6 LYS CD C 3.840 -7.137 -2.605 1.00 . A A . 6 LYS CD 1 1 2 595 1 1 6 LYS CE C 3.941 -8.092 -3.785 1.00 . A A . 6 LYS CE 1 1 2 596 1 1 6 LYS CG C 3.309 -5.780 -3.032 1.00 . A A . 6 LYS CG 1 1 2 597 1 1 6 LYS H H 1.129 -4.561 -4.447 1.00 . A A . 6 LYS H 1 1 2 598 1 1 6 LYS HA H 1.014 -3.566 -1.674 1.00 . A A . 6 LYS HA 1 1 2 599 1 1 6 LYS HB3 H 1.596 -5.972 -1.794 1.00 . A A . 6 LYS HB3 1 1 2 600 1 1 6 LYS HD3 H 3.173 -7.559 -1.867 1.00 . A A . 6 LYS HD3 1 1 2 601 1 1 6 LYS HE3 H 3.402 -7.670 -4.619 1.00 . A A . 6 LYS HE3 1 1 2 602 1 1 6 LYS HG3 H 4.139 -5.096 -3.141 1.00 . A A . 6 LYS HG3 1 1 2 603 1 1 6 LYS HZ1 H 5.659 -9.276 -3.897 1.00 . A A . 6 LYS HZ1 1 1 2 604 1 1 6 LYS HZ2 H 5.976 -7.621 -3.741 1.00 . A A . 6 LYS HZ2 1 1 2 605 1 1 6 LYS HZ3 H 5.449 -8.246 -5.222 1.00 . A A . 6 LYS HZ3 1 1 2 606 1 1 6 LYS N N 0.739 -4.249 -3.602 1.00 . A A . 6 LYS N 1 1 2 607 1 1 6 LYS NZ N 5.356 -8.325 -4.189 1.00 . A A . 6 LYS NZ 1 1 2 608 1 1 6 LYS O O 2.548 -2.272 -3.930 1.00 . A A . 6 LYS O 1 1 2 609 1 1 7 GLU C C 4.069 -0.329 -2.583 1.00 . A A . 7 GLU C 1 1 2 610 1 1 7 GLU CA C 4.675 -1.690 -2.252 1.00 . A A . 7 GLU CA 1 1 2 611 1 1 7 GLU CB C 5.577 -2.151 -3.398 1.00 . A A . 7 GLU CB 1 1 2 612 1 1 7 GLU CD C 7.222 -3.622 -2.170 1.00 . A A . 7 GLU CD 1 1 2 613 1 1 7 GLU CG C 7.025 -2.361 -2.988 1.00 . A A . 7 GLU CG 1 1 2 614 1 1 7 GLU H H 3.656 -3.197 -1.169 1.00 . A A . 7 GLU H 1 1 2 615 1 1 7 GLU HA H 5.268 -1.598 -1.355 1.00 . A A . 7 GLU HA 1 1 2 616 1 1 7 GLU HB3 H 5.551 -1.407 -4.182 1.00 . A A . 7 GLU HB3 1 1 2 617 1 1 7 GLU HG3 H 7.344 -1.514 -2.399 1.00 . A A . 7 GLU HG3 1 1 2 618 1 1 7 GLU N N 3.632 -2.676 -2.000 1.00 . A A . 7 GLU N 1 1 2 619 1 1 7 GLU O O 2.857 -0.136 -2.482 1.00 . A A . 7 GLU O 1 1 2 620 1 1 7 GLU OE1 O 7.112 -3.548 -0.927 1.00 . A A . 7 GLU OE1 1 1 2 621 1 1 7 GLU OE2 O 7.486 -4.683 -2.772 1.00 . A A . 7 GLU OE2 1 1 2 622 1 1 8 TYR C C 3.402 1.910 -4.409 1.00 . A A . 8 TYR C 1 1 2 623 1 1 8 TYR CA C 4.470 1.955 -3.319 1.00 . A A . 8 TYR CA 1 1 2 624 1 1 8 TYR CB C 5.652 2.808 -3.783 1.00 . A A . 8 TYR CB 1 1 2 625 1 1 8 TYR CD1 C 7.271 1.288 -4.984 1.00 . A A . 8 TYR CD1 1 1 2 626 1 1 8 TYR CD2 C 5.983 2.813 -6.287 1.00 . A A . 8 TYR CD2 1 1 2 627 1 1 8 TYR CE1 C 7.880 0.815 -6.131 1.00 . A A . 8 TYR CE1 1 1 2 628 1 1 8 TYR CE2 C 6.585 2.345 -7.439 1.00 . A A . 8 TYR CE2 1 1 2 629 1 1 8 TYR CG C 6.315 2.294 -5.042 1.00 . A A . 8 TYR CG 1 1 2 630 1 1 8 TYR CZ C 7.533 1.347 -7.355 1.00 . A A . 8 TYR CZ 1 1 2 631 1 1 8 TYR H H 5.875 0.398 -3.037 1.00 . A A . 8 TYR H 1 1 2 632 1 1 8 TYR HA H 4.045 2.398 -2.432 1.00 . A A . 8 TYR HA 1 1 2 633 1 1 8 TYR HB3 H 6.397 2.834 -3.002 1.00 . A A . 8 TYR HB3 1 1 2 634 1 1 8 TYR HD1 H 7.541 0.874 -4.023 1.00 . A A . 8 TYR HD1 1 1 2 635 1 1 8 TYR HD2 H 5.241 3.596 -6.348 1.00 . A A . 8 TYR HD2 1 1 2 636 1 1 8 TYR HE1 H 8.622 0.033 -6.066 1.00 . A A . 8 TYR HE1 1 1 2 637 1 1 8 TYR HE2 H 6.315 2.761 -8.398 1.00 . A A . 8 TYR HE2 1 1 2 638 1 1 8 TYR HH H 7.466 0.696 -9.163 1.00 . A A . 8 TYR HH 1 1 2 639 1 1 8 TYR N N 4.921 0.611 -2.977 1.00 . A A . 8 TYR N 1 1 2 640 1 1 8 TYR O O 3.613 1.335 -5.476 1.00 . A A . 8 TYR O 1 1 2 641 1 1 8 TYR OH O 8.137 0.879 -8.501 1.00 . A A . 8 TYR OH 1 1 2 642 1 1 9 GLU C C -0.009 3.382 -4.547 1.00 . A A . 9 GLU C 1 1 2 643 1 1 9 GLU CA C 1.155 2.555 -5.085 1.00 . A A . 9 GLU CA 1 1 2 644 1 1 9 GLU CB C 0.683 1.133 -5.399 1.00 . A A . 9 GLU CB 1 1 2 645 1 1 9 GLU CD C -0.568 -0.042 -7.252 1.00 . A A . 9 GLU CD 1 1 2 646 1 1 9 GLU CG C -0.584 1.084 -6.236 1.00 . A A . 9 GLU CG 1 1 2 647 1 1 9 GLU H H 2.149 2.965 -3.261 1.00 . A A . 9 GLU H 1 1 2 648 1 1 9 GLU HA H 1.516 3.012 -5.993 1.00 . A A . 9 GLU HA 1 1 2 649 1 1 9 GLU HB3 H 0.496 0.616 -4.470 1.00 . A A . 9 GLU HB3 1 1 2 650 1 1 9 GLU HG3 H -0.690 2.022 -6.760 1.00 . A A . 9 GLU HG3 1 1 2 651 1 1 9 GLU N N 2.256 2.524 -4.130 1.00 . A A . 9 GLU N 1 1 2 652 1 1 9 GLU O O -0.230 4.515 -4.974 1.00 . A A . 9 GLU O 1 1 2 653 1 1 9 GLU OE1 O 0.455 -0.196 -7.951 1.00 . A A . 9 GLU OE1 1 1 2 654 1 1 9 GLU OE2 O -1.580 -0.768 -7.347 1.00 . A A . 9 GLU OE2 1 1 2 655 1 1 10 THR C C -2.555 2.621 -1.944 1.00 . A A . 10 THR C 1 1 2 656 1 1 10 THR CA C -1.894 3.487 -3.011 1.00 . A A . 10 THR CA 1 1 2 657 1 1 10 THR CB C -2.942 3.861 -4.075 1.00 . A A . 10 THR CB 1 1 2 658 1 1 10 THR CG2 C -2.925 5.359 -4.348 1.00 . A A . 10 THR CG2 1 1 2 659 1 1 10 THR H H -0.524 1.900 -3.307 1.00 . A A . 10 THR H 1 1 2 660 1 1 10 THR HA H -1.536 4.397 -2.551 1.00 . A A . 10 THR HA 1 1 2 661 1 1 10 THR HB H -3.921 3.590 -3.706 1.00 . A A . 10 THR HB 1 1 2 662 1 1 10 THR HG1 H -3.332 3.400 -5.952 1.00 . A A . 10 THR HG1 1 1 2 663 1 1 10 THR HG21 H -2.882 5.528 -5.413 1.00 . A A . 10 THR HG21 1 1 2 664 1 1 10 THR HG22 H -2.058 5.800 -3.878 1.00 . A A . 10 THR HG22 1 1 2 665 1 1 10 THR HG23 H -3.821 5.808 -3.947 1.00 . A A . 10 THR HG23 1 1 2 666 1 1 10 THR N N -0.751 2.806 -3.606 1.00 . A A . 10 THR N 1 1 2 667 1 1 10 THR O O -2.976 1.496 -2.216 1.00 . A A . 10 THR O 1 1 2 668 1 1 10 THR OG1 O -2.686 3.147 -5.289 1.00 . A A . 10 THR OG1 1 1 2 669 1 1 11 CYS C C -4.775 2.380 0.226 1.00 . A A . 11 CYS C 1 1 2 670 1 1 11 CYS CA C -3.257 2.428 0.378 1.00 . A A . 11 CYS CA 1 1 2 671 1 1 11 CYS CB C -2.889 3.087 1.710 1.00 . A A . 11 CYS CB 1 1 2 672 1 1 11 CYS H H -2.293 4.054 -0.574 1.00 . A A . 11 CYS H 1 1 2 673 1 1 11 CYS HA H -2.874 1.420 0.367 1.00 . A A . 11 CYS HA 1 1 2 674 1 1 11 CYS HB3 H -3.165 2.426 2.517 1.00 . A A . 11 CYS HB3 1 1 2 675 1 1 11 CYS N N -2.646 3.153 -0.730 1.00 . A A . 11 CYS N 1 1 2 676 1 1 11 CYS O O -5.359 1.310 0.058 1.00 . A A . 11 CYS O 1 1 2 677 1 1 11 CYS SG S -1.116 3.467 1.885 1.00 . A A . 11 CYS SG 1 1 2 678 1 1 12 VAL C C -7.561 2.937 1.305 1.00 . A A . 12 VAL C 1 1 2 679 1 1 12 VAL CA C -6.857 3.639 0.150 1.00 . A A . 12 VAL CA 1 1 2 680 1 1 12 VAL CB C -7.338 3.028 -1.179 1.00 . A A . 12 VAL CB 1 1 2 681 1 1 12 VAL CG1 C -8.696 3.592 -1.566 1.00 . A A . 12 VAL CG1 1 1 2 682 1 1 12 VAL CG2 C -6.316 3.272 -2.279 1.00 . A A . 12 VAL CG2 1 1 2 683 1 1 12 VAL H H -4.887 4.368 0.418 1.00 . A A . 12 VAL H 1 1 2 684 1 1 12 VAL HA H -7.127 4.685 0.159 1.00 . A A . 12 VAL HA 1 1 2 685 1 1 12 VAL HB H -7.441 1.961 -1.044 1.00 . A A . 12 VAL HB 1 1 2 686 1 1 12 VAL HG11 H -8.966 4.382 -0.881 1.00 . A A . 12 VAL HG11 1 1 2 687 1 1 12 VAL HG12 H -8.649 3.985 -2.571 1.00 . A A . 12 VAL HG12 1 1 2 688 1 1 12 VAL HG13 H -9.438 2.808 -1.520 1.00 . A A . 12 VAL HG13 1 1 2 689 1 1 12 VAL HG21 H -5.856 4.239 -2.135 1.00 . A A . 12 VAL HG21 1 1 2 690 1 1 12 VAL HG22 H -5.559 2.504 -2.244 1.00 . A A . 12 VAL HG22 1 1 2 691 1 1 12 VAL HG23 H -6.809 3.248 -3.240 1.00 . A A . 12 VAL HG23 1 1 2 692 1 1 12 VAL N N -5.408 3.548 0.283 1.00 . A A . 12 VAL N 1 1 2 693 1 1 12 VAL O O -7.021 2.001 1.897 1.00 . A A . 12 VAL O 1 1 2 694 1 1 13 ARG C C -10.041 1.415 2.330 1.00 . A A . 13 ARG C 1 1 2 695 1 1 13 ARG CA C -9.546 2.808 2.706 1.00 . A A . 13 ARG CA 1 1 2 696 1 1 13 ARG CB C -10.735 3.708 3.051 1.00 . A A . 13 ARG CB 1 1 2 697 1 1 13 ARG CD C -11.842 5.205 4.740 1.00 . A A . 13 ARG CD 1 1 2 698 1 1 13 ARG CG C -10.579 4.444 4.373 1.00 . A A . 13 ARG CG 1 1 2 699 1 1 13 ARG CZ C -11.230 7.541 4.284 1.00 . A A . 13 ARG CZ 1 1 2 700 1 1 13 ARG H H -9.144 4.142 1.112 1.00 . A A . 13 ARG H 1 1 2 701 1 1 13 ARG HA H -8.904 2.729 3.570 1.00 . A A . 13 ARG HA 1 1 2 702 1 1 13 ARG HB3 H -11.626 3.101 3.106 1.00 . A A . 13 ARG HB3 1 1 2 703 1 1 13 ARG HD3 H -12.328 4.695 5.559 1.00 . A A . 13 ARG HD3 1 1 2 704 1 1 13 ARG HE H -11.612 6.795 6.094 1.00 . A A . 13 ARG HE 1 1 2 705 1 1 13 ARG HG3 H -9.759 5.142 4.289 1.00 . A A . 13 ARG HG3 1 1 2 706 1 1 13 ARG HH11 H -11.334 6.356 2.652 1.00 . A A . 13 ARG HH11 1 1 2 707 1 1 13 ARG HH12 H -10.903 8.006 2.345 1.00 . A A . 13 ARG HH12 1 1 2 708 1 1 13 ARG HH21 H -11.046 8.970 5.702 1.00 . A A . 13 ARG HH21 1 1 2 709 1 1 13 ARG HH22 H -10.739 9.492 4.081 1.00 . A A . 13 ARG HH22 1 1 2 710 1 1 13 ARG N N -8.768 3.394 1.621 1.00 . A A . 13 ARG N 1 1 2 711 1 1 13 ARG NE N -11.557 6.579 5.139 1.00 . A A . 13 ARG NE 1 1 2 712 1 1 13 ARG NH1 N -11.149 7.280 2.987 1.00 . A A . 13 ARG NH1 1 1 2 713 1 1 13 ARG NH2 N -10.985 8.768 4.724 1.00 . A A . 13 ARG NH2 1 1 2 714 1 1 13 ARG O O -9.696 0.416 2.963 1.00 . A A . 13 ARG O 1 1 2 715 1 1 14 PRO C C -10.376 -0.812 0.149 1.00 . A A . 14 PRO C 1 1 2 716 1 1 14 PRO CA C -11.430 0.079 0.795 1.00 . A A . 14 PRO CA 1 1 2 717 1 1 14 PRO CB C -12.465 0.523 -0.242 1.00 . A A . 14 PRO CB 1 1 2 718 1 1 14 PRO CD C -11.323 2.495 0.479 1.00 . A A . 14 PRO CD 1 1 2 719 1 1 14 PRO CG C -11.987 1.854 -0.708 1.00 . A A . 14 PRO CG 1 1 2 720 1 1 14 PRO HA H -11.923 -0.465 1.589 1.00 . A A . 14 PRO HA 1 1 2 721 1 1 14 PRO HB3 H -13.438 0.592 0.221 1.00 . A A . 14 PRO HB3 1 1 2 722 1 1 14 PRO HD3 H -12.034 3.092 1.032 1.00 . A A . 14 PRO HD3 1 1 2 723 1 1 14 PRO HG3 H -12.826 2.450 -1.036 1.00 . A A . 14 PRO HG3 1 1 2 724 1 1 14 PRO N N -10.870 1.345 1.279 1.00 . A A . 14 PRO N 1 1 2 725 1 1 14 PRO O O -10.497 -2.038 0.154 1.00 . A A . 14 PRO O 1 1 2 726 1 1 15 ARG C C -7.062 -1.068 -0.129 1.00 . A A . 15 ARG C 1 1 2 727 1 1 15 ARG CA C -8.265 -0.928 -1.057 1.00 . A A . 15 ARG CA 1 1 2 728 1 1 15 ARG CB C -7.846 -0.225 -2.351 1.00 . A A . 15 ARG CB 1 1 2 729 1 1 15 ARG CD C -9.330 -0.225 -4.379 1.00 . A A . 15 ARG CD 1 1 2 730 1 1 15 ARG CG C -8.253 -0.974 -3.609 1.00 . A A . 15 ARG CG 1 1 2 731 1 1 15 ARG CZ C -7.962 1.199 -5.844 1.00 . A A . 15 ARG CZ 1 1 2 732 1 1 15 ARG H H -9.300 0.789 -0.378 1.00 . A A . 15 ARG H 1 1 2 733 1 1 15 ARG HA H -8.636 -1.913 -1.297 1.00 . A A . 15 ARG HA 1 1 2 734 1 1 15 ARG HB3 H -6.772 -0.117 -2.354 1.00 . A A . 15 ARG HB3 1 1 2 735 1 1 15 ARG HD3 H -10.174 -0.062 -3.725 1.00 . A A . 15 ARG HD3 1 1 2 736 1 1 15 ARG HE H -9.217 1.874 -4.449 1.00 . A A . 15 ARG HE 1 1 2 737 1 1 15 ARG HG3 H -8.632 -1.947 -3.332 1.00 . A A . 15 ARG HG3 1 1 2 738 1 1 15 ARG HH11 H -7.740 -0.787 -6.140 1.00 . A A . 15 ARG HH11 1 1 2 739 1 1 15 ARG HH12 H -6.783 0.227 -7.167 1.00 . A A . 15 ARG HH12 1 1 2 740 1 1 15 ARG HH21 H -7.960 3.220 -5.795 1.00 . A A . 15 ARG HH21 1 1 2 741 1 1 15 ARG HH22 H -6.907 2.506 -6.970 1.00 . A A . 15 ARG HH22 1 1 2 742 1 1 15 ARG N N -9.341 -0.190 -0.407 1.00 . A A . 15 ARG N 1 1 2 743 1 1 15 ARG NE N -8.854 1.066 -4.869 1.00 . A A . 15 ARG NE 1 1 2 744 1 1 15 ARG NH1 N -7.452 0.125 -6.431 1.00 . A A . 15 ARG NH1 1 1 2 745 1 1 15 ARG NH2 N -7.579 2.407 -6.235 1.00 . A A . 15 ARG NH2 1 1 2 746 1 1 15 ARG O O -5.919 -1.136 -0.582 1.00 . A A . 15 ARG O 1 1 2 747 1 1 16 LYS C C -5.300 -2.356 1.785 1.00 . A A . 16 LYS C 1 1 2 748 1 1 16 LYS CA C -6.268 -1.239 2.166 1.00 . A A . 16 LYS CA 1 1 2 749 1 1 16 LYS CB C -6.866 -1.518 3.546 1.00 . A A . 16 LYS CB 1 1 2 750 1 1 16 LYS CD C -7.239 -0.702 5.893 1.00 . A A . 16 LYS CD 1 1 2 751 1 1 16 LYS CE C -7.189 0.494 6.830 1.00 . A A . 16 LYS CE 1 1 2 752 1 1 16 LYS CG C -6.817 -0.324 4.483 1.00 . A A . 16 LYS CG 1 1 2 753 1 1 16 LYS H H -8.259 -1.048 1.473 1.00 . A A . 16 LYS H 1 1 2 754 1 1 16 LYS HA H -5.727 -0.306 2.199 1.00 . A A . 16 LYS HA 1 1 2 755 1 1 16 LYS HB3 H -6.322 -2.331 4.004 1.00 . A A . 16 LYS HB3 1 1 2 756 1 1 16 LYS HD3 H -6.574 -1.469 6.265 1.00 . A A . 16 LYS HD3 1 1 2 757 1 1 16 LYS HE3 H -8.161 0.623 7.281 1.00 . A A . 16 LYS HE3 1 1 2 758 1 1 16 LYS HG3 H -7.481 0.443 4.111 1.00 . A A . 16 LYS HG3 1 1 2 759 1 1 16 LYS HZ1 H -5.425 -0.331 7.587 1.00 . A A . 16 LYS HZ1 1 1 2 760 1 1 16 LYS HZ2 H -6.624 -0.088 8.754 1.00 . A A . 16 LYS HZ2 1 1 2 761 1 1 16 LYS HZ3 H -5.750 1.229 8.155 1.00 . A A . 16 LYS HZ3 1 1 2 762 1 1 16 LYS N N -7.327 -1.108 1.172 1.00 . A A . 16 LYS N 1 1 2 763 1 1 16 LYS NZ N -6.176 0.313 7.907 1.00 . A A . 16 LYS NZ 1 1 2 764 1 1 16 LYS O O -5.717 -3.471 1.466 1.00 . A A . 16 LYS O 1 1 2 765 1 1 17 CYS C C -3.190 -4.328 2.253 1.00 . A A . 17 CYS C 1 1 2 766 1 1 17 CYS CA C -2.981 -3.028 1.481 1.00 . A A . 17 CYS CA 1 1 2 767 1 1 17 CYS CB C -1.590 -2.463 1.779 1.00 . A A . 17 CYS CB 1 1 2 768 1 1 17 CYS H H -3.737 -1.145 2.084 1.00 . A A . 17 CYS H 1 1 2 769 1 1 17 CYS HA H -3.057 -3.235 0.425 1.00 . A A . 17 CYS HA 1 1 2 770 1 1 17 CYS HB3 H -0.845 -3.170 1.448 1.00 . A A . 17 CYS HB3 1 1 2 771 1 1 17 CYS N N -4.007 -2.051 1.821 1.00 . A A . 17 CYS N 1 1 2 772 1 1 17 CYS O O -3.372 -4.315 3.470 1.00 . A A . 17 CYS O 1 1 2 773 1 1 17 CYS SG S -1.246 -0.870 0.967 1.00 . A A . 17 CYS SG 1 1 2 774 1 1 18 GLN C C -2.163 -7.110 3.045 1.00 . A A . 18 GLN C 1 1 2 775 1 1 18 GLN CA C -3.349 -6.755 2.154 1.00 . A A . 18 GLN CA 1 1 2 776 1 1 18 GLN CB C -3.534 -7.827 1.080 1.00 . A A . 18 GLN CB 1 1 2 777 1 1 18 GLN CD C -5.176 -9.334 2.270 1.00 . A A . 18 GLN CD 1 1 2 778 1 1 18 GLN CG C -4.924 -8.444 1.069 1.00 . A A . 18 GLN CG 1 1 2 779 1 1 18 GLN H H -3.013 -5.391 0.570 1.00 . A A . 18 GLN H 1 1 2 780 1 1 18 GLN HA H -4.239 -6.709 2.762 1.00 . A A . 18 GLN HA 1 1 2 781 1 1 18 GLN HB3 H -2.816 -8.616 1.248 1.00 . A A . 18 GLN HB3 1 1 2 782 1 1 18 GLN HE21 H -6.534 -8.058 2.962 1.00 . A A . 18 GLN HE21 1 1 2 783 1 1 18 GLN HE22 H -6.266 -9.467 3.926 1.00 . A A . 18 GLN HE22 1 1 2 784 1 1 18 GLN HG3 H -5.035 -9.034 0.171 1.00 . A A . 18 GLN HG3 1 1 2 785 1 1 18 GLN N N -3.162 -5.446 1.536 1.00 . A A . 18 GLN N 1 1 2 786 1 1 18 GLN NE2 N -6.083 -8.911 3.141 1.00 . A A . 18 GLN NE2 1 1 2 787 1 1 18 GLN O O -2.306 -7.345 4.245 1.00 . A A . 18 GLN O 1 1 2 788 1 1 18 GLN OE1 O -4.563 -10.392 2.412 1.00 . A A . 18 GLN OE1 1 1 2 789 1 1 19 PRO C C 0.682 -6.374 4.138 1.00 . A A . 19 PRO C 1 1 2 790 1 1 19 PRO CA C 0.270 -7.475 3.167 1.00 . A A . 19 PRO CA 1 1 2 791 1 1 19 PRO CB C 1.307 -7.620 2.050 1.00 . A A . 19 PRO CB 1 1 2 792 1 1 19 PRO CD C -0.719 -6.880 1.020 1.00 . A A . 19 PRO CD 1 1 2 793 1 1 19 PRO CG C 0.779 -6.785 0.935 1.00 . A A . 19 PRO CG 1 1 2 794 1 1 19 PRO HA H 0.182 -8.410 3.702 1.00 . A A . 19 PRO HA 1 1 2 795 1 1 19 PRO HB3 H 1.390 -8.656 1.763 1.00 . A A . 19 PRO HB3 1 1 2 796 1 1 19 PRO HD3 H -1.082 -7.692 0.406 1.00 . A A . 19 PRO HD3 1 1 2 797 1 1 19 PRO HG3 H 1.126 -7.175 -0.011 1.00 . A A . 19 PRO HG3 1 1 2 798 1 1 19 PRO N N -0.963 -7.150 2.446 1.00 . A A . 19 PRO N 1 1 2 799 1 1 19 PRO O O 0.136 -5.272 4.132 1.00 . A A . 19 PRO O 1 1 2 800 1 1 20 PRO C C 2.952 -4.579 5.345 1.00 . A A . 20 PRO C 1 1 2 801 1 1 20 PRO CA C 2.178 -5.725 5.986 1.00 . A A . 20 PRO CA 1 1 2 802 1 1 20 PRO CB C 3.107 -6.579 6.853 1.00 . A A . 20 PRO CB 1 1 2 803 1 1 20 PRO CD C 2.368 -7.973 5.057 1.00 . A A . 20 PRO CD 1 1 2 804 1 1 20 PRO CG C 3.534 -7.696 5.965 1.00 . A A . 20 PRO CG 1 1 2 805 1 1 20 PRO HA H 1.382 -5.325 6.595 1.00 . A A . 20 PRO HA 1 1 2 806 1 1 20 PRO HB3 H 2.567 -6.944 7.714 1.00 . A A . 20 PRO HB3 1 1 2 807 1 1 20 PRO HD3 H 1.730 -8.733 5.485 1.00 . A A . 20 PRO HD3 1 1 2 808 1 1 20 PRO HG3 H 3.762 -8.569 6.558 1.00 . A A . 20 PRO HG3 1 1 2 809 1 1 20 PRO N N 1.670 -6.677 4.994 1.00 . A A . 20 PRO N 1 1 2 810 1 1 20 PRO O O 4.149 -4.697 5.078 1.00 . A A . 20 PRO O 1 1 2 811 1 1 21 LEU C C 2.703 -1.065 5.371 1.00 . A A . 21 LEU C 1 1 2 812 1 1 21 LEU CA C 2.888 -2.299 4.494 1.00 . A A . 21 LEU CA 1 1 2 813 1 1 21 LEU CB C 2.295 -2.045 3.106 1.00 . A A . 21 LEU CB 1 1 2 814 1 1 21 LEU CD1 C 2.017 -2.694 0.700 1.00 . A A . 21 LEU CD1 1 1 2 815 1 1 21 LEU CD2 C 4.260 -2.879 1.792 1.00 . A A . 21 LEU CD2 1 1 2 816 1 1 21 LEU CG C 2.756 -2.991 1.996 1.00 . A A . 21 LEU CG 1 1 2 817 1 1 21 LEU H H 1.313 -3.434 5.338 1.00 . A A . 21 LEU H 1 1 2 818 1 1 21 LEU HA H 3.943 -2.500 4.394 1.00 . A A . 21 LEU HA 1 1 2 819 1 1 21 LEU HB3 H 2.558 -1.038 2.814 1.00 . A A . 21 LEU HB3 1 1 2 820 1 1 21 LEU HD11 H 2.125 -3.529 0.025 1.00 . A A . 21 LEU HD11 1 1 2 821 1 1 21 LEU HD12 H 2.431 -1.807 0.245 1.00 . A A . 21 LEU HD12 1 1 2 822 1 1 21 LEU HD13 H 0.970 -2.534 0.912 1.00 . A A . 21 LEU HD13 1 1 2 823 1 1 21 LEU HD21 H 4.711 -3.854 1.902 1.00 . A A . 21 LEU HD21 1 1 2 824 1 1 21 LEU HD22 H 4.675 -2.206 2.527 1.00 . A A . 21 LEU HD22 1 1 2 825 1 1 21 LEU HD23 H 4.461 -2.499 0.801 1.00 . A A . 21 LEU HD23 1 1 2 826 1 1 21 LEU HG H 2.531 -4.009 2.283 1.00 . A A . 21 LEU HG 1 1 2 827 1 1 21 LEU N N 2.263 -3.469 5.103 1.00 . A A . 21 LEU N 1 1 2 828 1 1 21 LEU O O 1.911 -1.072 6.314 1.00 . A A . 21 LEU O 1 1 2 829 1 1 22 LYS C C 3.243 2.438 4.874 1.00 . A A . 22 LYS C 1 1 2 830 1 1 22 LYS CA C 3.355 1.239 5.810 1.00 . A A . 22 LYS CA 1 1 2 831 1 1 22 LYS CB C 4.581 1.395 6.712 1.00 . A A . 22 LYS CB 1 1 2 832 1 1 22 LYS CD C 6.190 -0.222 7.764 1.00 . A A . 22 LYS CD 1 1 2 833 1 1 22 LYS CE C 6.693 -0.314 9.196 1.00 . A A . 22 LYS CE 1 1 2 834 1 1 22 LYS CG C 4.751 0.263 7.709 1.00 . A A . 22 LYS CG 1 1 2 835 1 1 22 LYS H H 4.052 -0.060 4.291 1.00 . A A . 22 LYS H 1 1 2 836 1 1 22 LYS HA H 2.470 1.194 6.426 1.00 . A A . 22 LYS HA 1 1 2 837 1 1 22 LYS HB3 H 4.494 2.321 7.261 1.00 . A A . 22 LYS HB3 1 1 2 838 1 1 22 LYS HD3 H 6.815 0.470 7.215 1.00 . A A . 22 LYS HD3 1 1 2 839 1 1 22 LYS HE3 H 5.917 -0.750 9.809 1.00 . A A . 22 LYS HE3 1 1 2 840 1 1 22 LYS HG3 H 4.114 -0.560 7.417 1.00 . A A . 22 LYS HG3 1 1 2 841 1 1 22 LYS HZ1 H 8.728 -0.567 9.595 1.00 . A A . 22 LYS HZ1 1 1 2 842 1 1 22 LYS HZ2 H 8.136 -1.585 8.379 1.00 . A A . 22 LYS HZ2 1 1 2 843 1 1 22 LYS HZ3 H 7.779 -1.907 10.000 1.00 . A A . 22 LYS HZ3 1 1 2 844 1 1 22 LYS N N 3.439 -0.005 5.054 1.00 . A A . 22 LYS N 1 1 2 845 1 1 22 LYS NZ N 7.920 -1.152 9.300 1.00 . A A . 22 LYS NZ 1 1 2 846 1 1 22 LYS O O 4.093 2.644 4.007 1.00 . A A . 22 LYS O 1 1 2 847 1 1 23 CYS C C 2.779 5.593 4.741 1.00 . A A . 23 CYS C 1 1 2 848 1 1 23 CYS CA C 1.966 4.407 4.228 1.00 . A A . 23 CYS CA 1 1 2 849 1 1 23 CYS CB C 0.479 4.767 4.205 1.00 . A A . 23 CYS CB 1 1 2 850 1 1 23 CYS H H 1.545 3.012 5.763 1.00 . A A . 23 CYS H 1 1 2 851 1 1 23 CYS HA H 2.286 4.175 3.224 1.00 . A A . 23 CYS HA 1 1 2 852 1 1 23 CYS HB3 H 0.314 5.537 3.467 1.00 . A A . 23 CYS HB3 1 1 2 853 1 1 23 CYS N N 2.189 3.228 5.055 1.00 . A A . 23 CYS N 1 1 2 854 1 1 23 CYS O O 3.636 5.442 5.610 1.00 . A A . 23 CYS O 1 1 2 855 1 1 23 CYS SG S -0.617 3.368 3.803 1.00 . A A . 23 CYS SG 1 1 2 856 1 1 24 ASN C C 2.224 9.117 4.882 1.00 . A A . 24 ASN C 1 1 2 857 1 1 24 ASN CA C 3.207 7.985 4.598 1.00 . A A . 24 ASN CA 1 1 2 858 1 1 24 ASN CB C 4.193 8.412 3.508 1.00 . A A . 24 ASN CB 1 1 2 859 1 1 24 ASN CG C 3.732 8.006 2.121 1.00 . A A . 24 ASN CG 1 1 2 860 1 1 24 ASN H H 1.807 6.832 3.507 1.00 . A A . 24 ASN H 1 1 2 861 1 1 24 ASN HA H 3.755 7.765 5.502 1.00 . A A . 24 ASN HA 1 1 2 862 1 1 24 ASN HB3 H 5.152 7.953 3.698 1.00 . A A . 24 ASN HB3 1 1 2 863 1 1 24 ASN HD21 H 5.587 7.475 1.635 1.00 . A A . 24 ASN HD21 1 1 2 864 1 1 24 ASN HD22 H 4.397 7.266 0.400 1.00 . A A . 24 ASN HD22 1 1 2 865 1 1 24 ASN N N 2.502 6.774 4.196 1.00 . A A . 24 ASN N 1 1 2 866 1 1 24 ASN ND2 N 4.666 7.535 1.303 1.00 . A A . 24 ASN ND2 1 1 2 867 1 1 24 ASN O O 2.245 9.718 5.956 1.00 . A A . 24 ASN O 1 1 2 868 1 1 24 ASN OD1 O 2.552 8.115 1.790 1.00 . A A . 24 ASN OD1 1 1 2 869 1 1 25 LYS C C -0.492 10.572 2.803 1.00 . A A . 25 LYS C 1 1 2 870 1 1 25 LYS CA C 0.370 10.462 4.055 1.00 . A A . 25 LYS CA 1 1 2 871 1 1 25 LYS CB C 1.059 11.800 4.332 1.00 . A A . 25 LYS CB 1 1 2 872 1 1 25 LYS CD C 0.247 13.735 5.715 1.00 . A A . 25 LYS CD 1 1 2 873 1 1 25 LYS CE C -0.680 13.978 6.894 1.00 . A A . 25 LYS CE 1 1 2 874 1 1 25 LYS CG C 0.820 12.327 5.737 1.00 . A A . 25 LYS CG 1 1 2 875 1 1 25 LYS H H 1.395 8.889 3.077 1.00 . A A . 25 LYS H 1 1 2 876 1 1 25 LYS HA H -0.262 10.211 4.893 1.00 . A A . 25 LYS HA 1 1 2 877 1 1 25 LYS HB3 H 0.691 12.533 3.628 1.00 . A A . 25 LYS HB3 1 1 2 878 1 1 25 LYS HD3 H -0.307 13.874 4.797 1.00 . A A . 25 LYS HD3 1 1 2 879 1 1 25 LYS HE3 H -0.531 13.194 7.621 1.00 . A A . 25 LYS HE3 1 1 2 880 1 1 25 LYS HG3 H 1.758 12.339 6.272 1.00 . A A . 25 LYS HG3 1 1 2 881 1 1 25 LYS HZ1 H -0.623 15.238 8.560 1.00 . A A . 25 LYS HZ1 1 1 2 882 1 1 25 LYS HZ2 H -1.029 16.026 7.119 1.00 . A A . 25 LYS HZ2 1 1 2 883 1 1 25 LYS HZ3 H 0.572 15.568 7.409 1.00 . A A . 25 LYS HZ3 1 1 2 884 1 1 25 LYS N N 1.364 9.403 3.911 1.00 . A A . 25 LYS N 1 1 2 885 1 1 25 LYS NZ N -0.422 15.295 7.541 1.00 . A A . 25 LYS NZ 1 1 2 886 1 1 25 LYS O O -1.702 10.786 2.888 1.00 . A A . 25 LYS O 1 1 2 887 1 1 26 ALA C C -0.964 9.115 -0.128 1.00 . A A . 26 ALA C 1 1 2 888 1 1 26 ALA CA C -0.576 10.503 0.372 1.00 . A A . 26 ALA CA 1 1 2 889 1 1 26 ALA CB C 0.273 11.222 -0.665 1.00 . A A . 26 ALA CB 1 1 2 890 1 1 26 ALA H H 1.100 10.255 1.638 1.00 . A A . 26 ALA H 1 1 2 891 1 1 26 ALA HA H -1.475 11.082 0.528 1.00 . A A . 26 ALA HA 1 1 2 892 1 1 26 ALA HB1 H -0.051 10.936 -1.656 1.00 . A A . 26 ALA HB1 1 1 2 893 1 1 26 ALA HB2 H 0.163 12.289 -0.544 1.00 . A A . 26 ALA HB2 1 1 2 894 1 1 26 ALA HB3 H 1.310 10.948 -0.533 1.00 . A A . 26 ALA HB3 1 1 2 895 1 1 26 ALA N N 0.136 10.423 1.641 1.00 . A A . 26 ALA N 1 1 2 896 1 1 26 ALA O O -1.180 8.915 -1.323 1.00 . A A . 26 ALA O 1 1 2 897 1 1 27 GLN C C -0.434 6.217 -0.578 1.00 . A A . 27 GLN C 1 1 2 898 1 1 27 GLN CA C -1.409 6.792 0.445 1.00 . A A . 27 GLN CA 1 1 2 899 1 1 27 GLN CB C -2.835 6.742 -0.108 1.00 . A A . 27 GLN CB 1 1 2 900 1 1 27 GLN CD C -4.024 7.055 2.099 1.00 . A A . 27 GLN CD 1 1 2 901 1 1 27 GLN CG C -3.825 7.575 0.690 1.00 . A A . 27 GLN CG 1 1 2 902 1 1 27 GLN H H -0.865 8.383 1.729 1.00 . A A . 27 GLN H 1 1 2 903 1 1 27 GLN HA H -1.361 6.197 1.344 1.00 . A A . 27 GLN HA 1 1 2 904 1 1 27 GLN HB3 H -3.174 5.717 -0.104 1.00 . A A . 27 GLN HB3 1 1 2 905 1 1 27 GLN HE21 H -3.044 8.617 2.841 1.00 . A A . 27 GLN HE21 1 1 2 906 1 1 27 GLN HE22 H -3.628 7.477 4.001 1.00 . A A . 27 GLN HE22 1 1 2 907 1 1 27 GLN HG3 H -4.777 7.565 0.179 1.00 . A A . 27 GLN HG3 1 1 2 908 1 1 27 GLN N N -1.049 8.161 0.793 1.00 . A A . 27 GLN N 1 1 2 909 1 1 27 GLN NE2 N -3.514 7.789 3.080 1.00 . A A . 27 GLN NE2 1 1 2 910 1 1 27 GLN O O -0.582 6.435 -1.781 1.00 . A A . 27 GLN O 1 1 2 911 1 1 27 GLN OE1 O -4.630 6.002 2.305 1.00 . A A . 27 GLN OE1 1 1 2 912 1 1 28 ILE C C 1.843 3.435 -0.554 1.00 . A A . 28 ILE C 1 1 2 913 1 1 28 ILE CA C 1.558 4.876 -0.963 1.00 . A A . 28 ILE CA 1 1 2 914 1 1 28 ILE CB C 2.877 5.672 -0.949 1.00 . A A . 28 ILE CB 1 1 2 915 1 1 28 ILE CD1 C 2.151 7.184 -2.863 1.00 . A A . 28 ILE CD1 1 1 2 916 1 1 28 ILE CG1 C 2.639 7.103 -1.434 1.00 . A A . 28 ILE CG1 1 1 2 917 1 1 28 ILE CG2 C 3.922 4.981 -1.813 1.00 . A A . 28 ILE CG2 1 1 2 918 1 1 28 ILE H H 0.625 5.345 0.876 1.00 . A A . 28 ILE H 1 1 2 919 1 1 28 ILE HA H 1.168 4.882 -1.971 1.00 . A A . 28 ILE HA 1 1 2 920 1 1 28 ILE HB H 3.245 5.698 0.065 1.00 . A A . 28 ILE HB 1 1 2 921 1 1 28 ILE HD11 H 2.040 6.187 -3.263 1.00 . A A . 28 ILE HD11 1 1 2 922 1 1 28 ILE HD12 H 1.196 7.690 -2.889 1.00 . A A . 28 ILE HD12 1 1 2 923 1 1 28 ILE HD13 H 2.866 7.733 -3.457 1.00 . A A . 28 ILE HD13 1 1 2 924 1 1 28 ILE HG13 H 3.565 7.656 -1.366 1.00 . A A . 28 ILE HG13 1 1 2 925 1 1 28 ILE HG21 H 4.310 4.120 -1.289 1.00 . A A . 28 ILE HG21 1 1 2 926 1 1 28 ILE HG22 H 3.468 4.663 -2.740 1.00 . A A . 28 ILE HG22 1 1 2 927 1 1 28 ILE HG23 H 4.727 5.668 -2.023 1.00 . A A . 28 ILE HG23 1 1 2 928 1 1 28 ILE N N 0.560 5.482 -0.091 1.00 . A A . 28 ILE N 1 1 2 929 1 1 28 ILE O O 1.999 2.556 -1.401 1.00 . A A . 28 ILE O 1 1 2 930 1 1 29 CYS C C 3.584 1.410 0.921 1.00 . A A . 29 CYS C 1 1 2 931 1 1 29 CYS CA C 2.172 1.864 1.277 1.00 . A A . 29 CYS CA 1 1 2 932 1 1 29 CYS CB C 1.149 0.866 0.728 1.00 . A A . 29 CYS CB 1 1 2 933 1 1 29 CYS H H 1.774 3.941 1.380 1.00 . A A . 29 CYS H 1 1 2 934 1 1 29 CYS HA H 2.080 1.905 2.351 1.00 . A A . 29 CYS HA 1 1 2 935 1 1 29 CYS HB3 H 1.674 0.037 0.276 1.00 . A A . 29 CYS HB3 1 1 2 936 1 1 29 CYS N N 1.907 3.199 0.753 1.00 . A A . 29 CYS N 1 1 2 937 1 1 29 CYS O O 3.924 1.268 -0.254 1.00 . A A . 29 CYS O 1 1 2 938 1 1 29 CYS SG S 0.021 0.190 1.987 1.00 . A A . 29 CYS SG 1 1 2 939 1 1 30 VAL C C 6.414 0.304 3.054 1.00 . A A . 30 VAL C 1 1 2 940 1 1 30 VAL CA C 5.777 0.742 1.740 1.00 . A A . 30 VAL CA 1 1 2 941 1 1 30 VAL CB C 6.635 1.856 1.112 1.00 . A A . 30 VAL CB 1 1 2 942 1 1 30 VAL CG1 C 6.787 1.635 -0.386 1.00 . A A . 30 VAL CG1 1 1 2 943 1 1 30 VAL CG2 C 6.029 3.222 1.399 1.00 . A A . 30 VAL CG2 1 1 2 944 1 1 30 VAL H H 4.073 1.313 2.857 1.00 . A A . 30 VAL H 1 1 2 945 1 1 30 VAL HA H 5.762 -0.097 1.060 1.00 . A A . 30 VAL HA 1 1 2 946 1 1 30 VAL HB H 7.618 1.822 1.559 1.00 . A A . 30 VAL HB 1 1 2 947 1 1 30 VAL HG11 H 6.710 0.579 -0.602 1.00 . A A . 30 VAL HG11 1 1 2 948 1 1 30 VAL HG12 H 6.008 2.169 -0.909 1.00 . A A . 30 VAL HG12 1 1 2 949 1 1 30 VAL HG13 H 7.752 1.999 -0.706 1.00 . A A . 30 VAL HG13 1 1 2 950 1 1 30 VAL HG21 H 6.763 3.990 1.210 1.00 . A A . 30 VAL HG21 1 1 2 951 1 1 30 VAL HG22 H 5.173 3.376 0.758 1.00 . A A . 30 VAL HG22 1 1 2 952 1 1 30 VAL HG23 H 5.717 3.268 2.432 1.00 . A A . 30 VAL HG23 1 1 2 953 1 1 30 VAL N N 4.402 1.182 1.943 1.00 . A A . 30 VAL N 1 1 2 954 1 1 30 VAL O O 5.776 0.335 4.106 1.00 . A A . 30 VAL O 1 1 2 955 1 1 31 ASP C C 9.849 -0.886 3.826 1.00 . A A . 31 ASP C 1 1 2 956 1 1 31 ASP CA C 8.402 -0.549 4.170 1.00 . A A . 31 ASP CA 1 1 2 957 1 1 31 ASP CB C 7.714 -1.767 4.788 1.00 . A A . 31 ASP CB 1 1 2 958 1 1 31 ASP CG C 7.121 -2.690 3.742 1.00 . A A . 31 ASP CG 1 1 2 959 1 1 31 ASP H H 8.131 -0.107 2.116 1.00 . A A . 31 ASP H 1 1 2 960 1 1 31 ASP HA H 8.394 0.259 4.885 1.00 . A A . 31 ASP HA 1 1 2 961 1 1 31 ASP HB3 H 6.920 -1.432 5.439 1.00 . A A . 31 ASP HB3 1 1 2 962 1 1 31 ASP N N 7.676 -0.105 2.985 1.00 . A A . 31 ASP N 1 1 2 963 1 1 31 ASP O O 10.196 -1.139 2.672 1.00 . A A . 31 ASP O 1 1 2 964 1 1 31 ASP OD1 O 7.717 -2.812 2.651 1.00 . A A . 31 ASP OD1 1 1 2 965 1 1 31 ASP OD2 O 6.062 -3.293 4.014 1.00 . A A . 31 ASP OD2 1 1 2 966 1 1 32 PRO C C 12.383 -2.660 4.342 1.00 . A A . 32 PRO C 1 1 2 967 1 1 32 PRO CA C 12.140 -1.194 4.680 1.00 . A A . 32 PRO CA 1 1 2 968 1 1 32 PRO CB C 12.739 -0.853 6.047 1.00 . A A . 32 PRO CB 1 1 2 969 1 1 32 PRO CD C 10.372 -0.597 6.251 1.00 . A A . 32 PRO CD 1 1 2 970 1 1 32 PRO CG C 11.608 -1.002 7.005 1.00 . A A . 32 PRO CG 1 1 2 971 1 1 32 PRO HA H 12.590 -0.571 3.921 1.00 . A A . 32 PRO HA 1 1 2 972 1 1 32 PRO HB3 H 13.118 0.158 6.036 1.00 . A A . 32 PRO HB3 1 1 2 973 1 1 32 PRO HD3 H 10.174 0.456 6.387 1.00 . A A . 32 PRO HD3 1 1 2 974 1 1 32 PRO HG3 H 11.759 -0.351 7.854 1.00 . A A . 32 PRO HG3 1 1 2 975 1 1 32 PRO N N 10.715 -0.890 4.849 1.00 . A A . 32 PRO N 1 1 2 976 1 1 32 PRO O O 13.474 -3.036 3.911 1.00 . A A . 32 PRO O 1 1 2 977 1 1 33 LYS C C 11.743 -5.151 2.772 1.00 . A A . 33 LYS C 1 1 2 978 1 1 33 LYS CA C 11.462 -4.912 4.253 1.00 . A A . 33 LYS CA 1 1 2 979 1 1 33 LYS CB C 10.171 -5.627 4.659 1.00 . A A . 33 LYS CB 1 1 2 980 1 1 33 LYS CD C 9.728 -8.086 4.918 1.00 . A A . 33 LYS CD 1 1 2 981 1 1 33 LYS CE C 9.853 -9.293 5.834 1.00 . A A . 33 LYS CE 1 1 2 982 1 1 33 LYS CG C 10.404 -6.862 5.512 1.00 . A A . 33 LYS CG 1 1 2 983 1 1 33 LYS H H 10.516 -3.126 4.883 1.00 . A A . 33 LYS H 1 1 2 984 1 1 33 LYS HA H 12.282 -5.309 4.832 1.00 . A A . 33 LYS HA 1 1 2 985 1 1 33 LYS HB3 H 9.643 -5.928 3.765 1.00 . A A . 33 LYS HB3 1 1 2 986 1 1 33 LYS HD3 H 10.190 -8.316 3.967 1.00 . A A . 33 LYS HD3 1 1 2 987 1 1 33 LYS HE3 H 10.818 -9.261 6.319 1.00 . A A . 33 LYS HE3 1 1 2 988 1 1 33 LYS HG3 H 10.005 -6.686 6.501 1.00 . A A . 33 LYS HG3 1 1 2 989 1 1 33 LYS HZ1 H 8.806 -10.218 7.387 1.00 . A A . 33 LYS HZ1 1 1 2 990 1 1 33 LYS HZ2 H 7.855 -9.196 6.432 1.00 . A A . 33 LYS HZ2 1 1 2 991 1 1 33 LYS HZ3 H 8.937 -8.539 7.554 1.00 . A A . 33 LYS HZ3 1 1 2 992 1 1 33 LYS N N 11.361 -3.486 4.537 1.00 . A A . 33 LYS N 1 1 2 993 1 1 33 LYS NZ N 8.788 -9.313 6.875 1.00 . A A . 33 LYS NZ 1 1 2 994 1 1 33 LYS O O 12.587 -5.974 2.416 1.00 . A A . 33 LYS O 1 1 2 995 1 1 34 LYS C C 10.830 -3.264 -0.240 1.00 . A A . 34 LYS C 1 1 2 996 1 1 34 LYS CA C 11.208 -4.557 0.474 1.00 . A A . 34 LYS CA 1 1 2 997 1 1 34 LYS CB C 10.360 -5.714 -0.061 1.00 . A A . 34 LYS CB 1 1 2 998 1 1 34 LYS CD C 10.230 -6.845 -2.300 1.00 . A A . 34 LYS CD 1 1 2 999 1 1 34 LYS CE C 9.333 -8.060 -2.106 1.00 . A A . 34 LYS CE 1 1 2 1000 1 1 34 LYS CG C 11.086 -6.584 -1.073 1.00 . A A . 34 LYS CG 1 1 2 1001 1 1 34 LYS H H 10.375 -3.787 2.260 1.00 . A A . 34 LYS H 1 1 2 1002 1 1 34 LYS HA H 12.250 -4.769 0.283 1.00 . A A . 34 LYS HA 1 1 2 1003 1 1 34 LYS HB3 H 9.478 -5.309 -0.535 1.00 . A A . 34 LYS HB3 1 1 2 1004 1 1 34 LYS HD3 H 10.876 -7.018 -3.149 1.00 . A A . 34 LYS HD3 1 1 2 1005 1 1 34 LYS HE3 H 9.813 -8.738 -1.415 1.00 . A A . 34 LYS HE3 1 1 2 1006 1 1 34 LYS HG3 H 11.334 -7.528 -0.610 1.00 . A A . 34 LYS HG3 1 1 2 1007 1 1 34 LYS HZ1 H 7.364 -8.507 -1.572 1.00 . A A . 34 LYS HZ1 1 1 2 1008 1 1 34 LYS HZ2 H 7.577 -6.931 -2.148 1.00 . A A . 34 LYS HZ2 1 1 2 1009 1 1 34 LYS HZ3 H 8.093 -7.338 -0.589 1.00 . A A . 34 LYS HZ3 1 1 2 1010 1 1 34 LYS N N 11.034 -4.426 1.915 1.00 . A A . 34 LYS N 1 1 2 1011 1 1 34 LYS NZ N 7.998 -7.683 -1.565 1.00 . A A . 34 LYS NZ 1 1 2 1012 1 1 34 LYS O O 9.753 -2.713 -0.019 1.00 . A A . 34 LYS O 1 1 2 1013 1 1 35 GLY C C 11.911 -0.324 -1.078 1.00 . A A . 35 GLY C 1 1 2 1014 1 1 35 GLY CA C 11.464 -1.559 -1.835 1.00 . A A . 35 GLY CA 1 1 2 1015 1 1 35 GLY H H 12.567 -3.266 -1.238 1.00 . A A . 35 GLY H 1 1 2 1016 1 1 35 GLY HA2 H 11.989 -1.601 -2.778 1.00 . A A . 35 GLY HA2 1 1 2 1017 1 1 35 GLY HA3 H 10.404 -1.486 -2.026 1.00 . A A . 35 GLY HA3 1 1 2 1018 1 1 35 GLY N N 11.724 -2.784 -1.100 1.00 . A A . 35 GLY N 1 1 2 1019 1 1 35 GLY O O 12.095 -0.367 0.138 1.00 . A A . 35 GLY O 1 1 2 1020 1 1 36 TRP C C 11.839 3.221 -1.854 1.00 . A A . 36 TRP C 1 1 2 1021 1 1 36 TRP CA C 12.517 2.030 -1.187 1.00 . A A . 36 TRP CA 1 1 2 1022 1 1 36 TRP CB C 14.036 2.173 -1.282 1.00 . A A . 36 TRP CB 1 1 2 1023 1 1 36 TRP CD1 C 14.484 3.010 -3.663 1.00 . A A . 36 TRP CD1 1 1 2 1024 1 1 36 TRP CD2 C 15.227 0.936 -3.262 1.00 . A A . 36 TRP CD2 1 1 2 1025 1 1 36 TRP CE2 C 15.533 1.273 -4.595 1.00 . A A . 36 TRP CE2 1 1 2 1026 1 1 36 TRP CE3 C 15.600 -0.323 -2.784 1.00 . A A . 36 TRP CE3 1 1 2 1027 1 1 36 TRP CG C 14.557 2.061 -2.684 1.00 . A A . 36 TRP CG 1 1 2 1028 1 1 36 TRP CH2 C 16.546 -0.830 -4.956 1.00 . A A . 36 TRP CH2 1 1 2 1029 1 1 36 TRP CZ2 C 16.193 0.395 -5.451 1.00 . A A . 36 TRP CZ2 1 1 2 1030 1 1 36 TRP CZ3 C 16.254 -1.192 -3.635 1.00 . A A . 36 TRP CZ3 1 1 2 1031 1 1 36 TRP H H 11.924 0.748 -2.765 1.00 . A A . 36 TRP H 1 1 2 1032 1 1 36 TRP HA H 12.231 2.004 -0.146 1.00 . A A . 36 TRP HA 1 1 2 1033 1 1 36 TRP HB3 H 14.501 1.398 -0.691 1.00 . A A . 36 TRP HB3 1 1 2 1034 1 1 36 TRP HD1 H 14.030 3.981 -3.537 1.00 . A A . 36 TRP HD1 1 1 2 1035 1 1 36 TRP HE1 H 15.143 3.040 -5.657 1.00 . A A . 36 TRP HE1 1 1 2 1036 1 1 36 TRP HE3 H 15.384 -0.621 -1.768 1.00 . A A . 36 TRP HE3 1 1 2 1037 1 1 36 TRP HH2 H 17.059 -1.541 -5.585 1.00 . A A . 36 TRP HH2 1 1 2 1038 1 1 36 TRP HZ2 H 16.426 0.660 -6.473 1.00 . A A . 36 TRP HZ2 1 1 2 1039 1 1 36 TRP HZ3 H 16.550 -2.170 -3.282 1.00 . A A . 36 TRP HZ3 1 1 2 1040 1 1 36 TRP N N 12.087 0.777 -1.799 1.00 . A A . 36 TRP N 1 1 2 1041 1 1 36 TRP NE1 N 15.069 2.543 -4.815 1.00 . A A . 36 TRP NE1 1 1 2 1042 1 1 36 TRP O O 11.833 4.328 -1.314 1.00 . A A . 36 TRP O 1 1 3 1043 1 1 1 ASP C C -10.278 -10.041 -1.325 1.00 . A A . 1 ASP C 1 1 3 1044 1 1 1 ASP CA C -10.435 -10.958 -0.116 1.00 . A A . 1 ASP CA 1 1 3 1045 1 1 1 ASP CB C -9.920 -12.358 -0.451 1.00 . A A . 1 ASP CB 1 1 3 1046 1 1 1 ASP CG C -9.830 -13.250 0.770 1.00 . A A . 1 ASP CG 1 1 3 1047 1 1 1 ASP H1 H -12.250 -10.218 0.685 1.00 . A A . 1 ASP H1 1 1 3 1048 1 1 1 ASP HA H -9.855 -10.556 0.702 1.00 . A A . 1 ASP HA 1 1 3 1049 1 1 1 ASP HB3 H -8.935 -12.277 -0.889 1.00 . A A . 1 ASP HB3 1 1 3 1050 1 1 1 ASP N N -11.828 -11.020 0.311 1.00 . A A . 1 ASP N 1 1 3 1051 1 1 1 ASP O O -10.800 -10.324 -2.404 1.00 . A A . 1 ASP O 1 1 3 1052 1 1 1 ASP OD1 O -10.882 -13.519 1.386 1.00 . A A . 1 ASP OD1 1 1 3 1053 1 1 1 ASP OD2 O -8.707 -13.678 1.112 1.00 . A A . 1 ASP OD2 1 1 3 1054 1 1 2 PHE C C -7.979 -8.211 -2.873 1.00 . A A . 2 PHE C 1 1 3 1055 1 1 2 PHE CA C -9.334 -7.979 -2.211 1.00 . A A . 2 PHE CA 1 1 3 1056 1 1 2 PHE CB C -9.414 -6.550 -1.672 1.00 . A A . 2 PHE CB 1 1 3 1057 1 1 2 PHE CD1 C -11.583 -5.986 -2.801 1.00 . A A . 2 PHE CD1 1 1 3 1058 1 1 2 PHE CD2 C -11.347 -5.479 -0.483 1.00 . A A . 2 PHE CD2 1 1 3 1059 1 1 2 PHE CE1 C -12.867 -5.476 -2.786 1.00 . A A . 2 PHE CE1 1 1 3 1060 1 1 2 PHE CE2 C -12.631 -4.967 -0.462 1.00 . A A . 2 PHE CE2 1 1 3 1061 1 1 2 PHE CG C -10.809 -5.994 -1.652 1.00 . A A . 2 PHE CG 1 1 3 1062 1 1 2 PHE CZ C -13.391 -4.965 -1.615 1.00 . A A . 2 PHE CZ 1 1 3 1063 1 1 2 PHE H H -9.168 -8.769 -0.254 1.00 . A A . 2 PHE H 1 1 3 1064 1 1 2 PHE HA H -10.110 -8.121 -2.949 1.00 . A A . 2 PHE HA 1 1 3 1065 1 1 2 PHE HB3 H -8.808 -5.905 -2.290 1.00 . A A . 2 PHE HB3 1 1 3 1066 1 1 2 PHE HD1 H -11.173 -6.386 -3.719 1.00 . A A . 2 PHE HD1 1 1 3 1067 1 1 2 PHE HD2 H -10.753 -5.479 0.419 1.00 . A A . 2 PHE HD2 1 1 3 1068 1 1 2 PHE HE1 H -13.459 -5.476 -3.689 1.00 . A A . 2 PHE HE1 1 1 3 1069 1 1 2 PHE HE2 H -13.038 -4.568 0.455 1.00 . A A . 2 PHE HE2 1 1 3 1070 1 1 2 PHE HZ H -14.395 -4.566 -1.601 1.00 . A A . 2 PHE HZ 1 1 3 1071 1 1 2 PHE N N -9.558 -8.940 -1.136 1.00 . A A . 2 PHE N 1 1 3 1072 1 1 2 PHE O O -7.083 -8.839 -2.309 1.00 . A A . 2 PHE O 1 1 3 1073 1 1 3 PRO C C -5.440 -7.010 -4.269 1.00 . A A . 3 PRO C 1 1 3 1074 1 1 3 PRO CA C -6.582 -7.826 -4.866 1.00 . A A . 3 PRO CA 1 1 3 1075 1 1 3 PRO CB C -6.957 -7.289 -6.249 1.00 . A A . 3 PRO CB 1 1 3 1076 1 1 3 PRO CD C -8.849 -6.930 -4.833 1.00 . A A . 3 PRO CD 1 1 3 1077 1 1 3 PRO CG C -8.091 -6.356 -5.998 1.00 . A A . 3 PRO CG 1 1 3 1078 1 1 3 PRO HA H -6.278 -8.860 -4.950 1.00 . A A . 3 PRO HA 1 1 3 1079 1 1 3 PRO HB3 H -7.254 -8.107 -6.889 1.00 . A A . 3 PRO HB3 1 1 3 1080 1 1 3 PRO HD3 H -9.637 -7.582 -5.181 1.00 . A A . 3 PRO HD3 1 1 3 1081 1 1 3 PRO HG3 H -8.725 -6.307 -6.870 1.00 . A A . 3 PRO HG3 1 1 3 1082 1 1 3 PRO N N -7.823 -7.690 -4.100 1.00 . A A . 3 PRO N 1 1 3 1083 1 1 3 PRO O O -4.269 -7.366 -4.409 1.00 . A A . 3 PRO O 1 1 3 1084 1 1 4 LEU C C -3.668 -4.722 -3.964 1.00 . A A . 4 LEU C 1 1 3 1085 1 1 4 LEU CA C -4.791 -5.047 -2.985 1.00 . A A . 4 LEU CA 1 1 3 1086 1 1 4 LEU CB C -4.216 -5.711 -1.733 1.00 . A A . 4 LEU CB 1 1 3 1087 1 1 4 LEU CD1 C -1.846 -6.252 -1.119 1.00 . A A . 4 LEU CD1 1 1 3 1088 1 1 4 LEU CD2 C -3.454 -8.097 -1.636 1.00 . A A . 4 LEU CD2 1 1 3 1089 1 1 4 LEU CG C -3.045 -6.667 -1.959 1.00 . A A . 4 LEU CG 1 1 3 1090 1 1 4 LEU H H -6.736 -5.682 -3.526 1.00 . A A . 4 LEU H 1 1 3 1091 1 1 4 LEU HA H -5.283 -4.127 -2.701 1.00 . A A . 4 LEU HA 1 1 3 1092 1 1 4 LEU HB3 H -5.012 -6.267 -1.259 1.00 . A A . 4 LEU HB3 1 1 3 1093 1 1 4 LEU HD11 H -2.183 -5.672 -0.274 1.00 . A A . 4 LEU HD11 1 1 3 1094 1 1 4 LEU HD12 H -1.176 -5.655 -1.720 1.00 . A A . 4 LEU HD12 1 1 3 1095 1 1 4 LEU HD13 H -1.328 -7.133 -0.770 1.00 . A A . 4 LEU HD13 1 1 3 1096 1 1 4 LEU HD21 H -2.613 -8.625 -1.212 1.00 . A A . 4 LEU HD21 1 1 3 1097 1 1 4 LEU HD22 H -3.772 -8.593 -2.542 1.00 . A A . 4 LEU HD22 1 1 3 1098 1 1 4 LEU HD23 H -4.269 -8.087 -0.927 1.00 . A A . 4 LEU HD23 1 1 3 1099 1 1 4 LEU HG H -2.752 -6.629 -2.999 1.00 . A A . 4 LEU HG 1 1 3 1100 1 1 4 LEU N N -5.788 -5.914 -3.604 1.00 . A A . 4 LEU N 1 1 3 1101 1 1 4 LEU O O -3.774 -4.999 -5.159 1.00 . A A . 4 LEU O 1 1 3 1102 1 1 5 SER C C -0.255 -3.376 -3.415 1.00 . A A . 5 SER C 1 1 3 1103 1 1 5 SER CA C -1.450 -3.770 -4.278 1.00 . A A . 5 SER CA 1 1 3 1104 1 1 5 SER CB C -1.819 -2.618 -5.215 1.00 . A A . 5 SER CB 1 1 3 1105 1 1 5 SER H H -2.569 -3.940 -2.489 1.00 . A A . 5 SER H 1 1 3 1106 1 1 5 SER HA H -1.182 -4.633 -4.871 1.00 . A A . 5 SER HA 1 1 3 1107 1 1 5 SER HB3 H -1.849 -2.981 -6.233 1.00 . A A . 5 SER HB3 1 1 3 1108 1 1 5 SER HG H -3.096 -1.825 -3.960 1.00 . A A . 5 SER HG 1 1 3 1109 1 1 5 SER N N -2.593 -4.134 -3.449 1.00 . A A . 5 SER N 1 1 3 1110 1 1 5 SER O O -0.346 -2.472 -2.584 1.00 . A A . 5 SER O 1 1 3 1111 1 1 5 SER OG O -3.087 -2.079 -4.885 1.00 . A A . 5 SER OG 1 1 3 1112 1 1 6 LYS C C 2.790 -2.548 -3.404 1.00 . A A . 6 LYS C 1 1 3 1113 1 1 6 LYS CA C 2.079 -3.784 -2.860 1.00 . A A . 6 LYS CA 1 1 3 1114 1 1 6 LYS CB C 3.021 -4.988 -2.907 1.00 . A A . 6 LYS CB 1 1 3 1115 1 1 6 LYS CD C 2.080 -7.289 -3.273 1.00 . A A . 6 LYS CD 1 1 3 1116 1 1 6 LYS CE C 3.311 -7.998 -3.815 1.00 . A A . 6 LYS CE 1 1 3 1117 1 1 6 LYS CG C 2.451 -6.233 -2.246 1.00 . A A . 6 LYS CG 1 1 3 1118 1 1 6 LYS H H 0.875 -4.771 -4.294 1.00 . A A . 6 LYS H 1 1 3 1119 1 1 6 LYS HA H 1.796 -3.600 -1.835 1.00 . A A . 6 LYS HA 1 1 3 1120 1 1 6 LYS HB3 H 3.942 -4.730 -2.405 1.00 . A A . 6 LYS HB3 1 1 3 1121 1 1 6 LYS HD3 H 1.559 -6.814 -4.093 1.00 . A A . 6 LYS HD3 1 1 3 1122 1 1 6 LYS HE3 H 3.336 -9.003 -3.419 1.00 . A A . 6 LYS HE3 1 1 3 1123 1 1 6 LYS HG3 H 1.567 -5.960 -1.688 1.00 . A A . 6 LYS HG3 1 1 3 1124 1 1 6 LYS HZ1 H 2.371 -7.796 -5.668 1.00 . A A . 6 LYS HZ1 1 1 3 1125 1 1 6 LYS HZ2 H 3.528 -9.029 -5.618 1.00 . A A . 6 LYS HZ2 1 1 3 1126 1 1 6 LYS HZ3 H 4.018 -7.412 -5.691 1.00 . A A . 6 LYS HZ3 1 1 3 1127 1 1 6 LYS N N 0.864 -4.061 -3.617 1.00 . A A . 6 LYS N 1 1 3 1128 1 1 6 LYS NZ N 3.306 -8.063 -5.302 1.00 . A A . 6 LYS NZ 1 1 3 1129 1 1 6 LYS O O 2.593 -2.165 -4.556 1.00 . A A . 6 LYS O 1 1 3 1130 1 1 7 GLU C C 3.404 0.412 -3.282 1.00 . A A . 7 GLU C 1 1 3 1131 1 1 7 GLU CA C 4.356 -0.738 -2.964 1.00 . A A . 7 GLU CA 1 1 3 1132 1 1 7 GLU CB C 5.233 -1.038 -4.181 1.00 . A A . 7 GLU CB 1 1 3 1133 1 1 7 GLU CD C 7.557 -1.023 -5.174 1.00 . A A . 7 GLU CD 1 1 3 1134 1 1 7 GLU CG C 6.680 -0.604 -4.010 1.00 . A A . 7 GLU CG 1 1 3 1135 1 1 7 GLU H H 3.730 -2.283 -1.659 1.00 . A A . 7 GLU H 1 1 3 1136 1 1 7 GLU HA H 4.987 -0.449 -2.139 1.00 . A A . 7 GLU HA 1 1 3 1137 1 1 7 GLU HB3 H 4.825 -0.527 -5.040 1.00 . A A . 7 GLU HB3 1 1 3 1138 1 1 7 GLU HG3 H 7.071 -1.047 -3.106 1.00 . A A . 7 GLU HG3 1 1 3 1139 1 1 7 GLU N N 3.616 -1.929 -2.566 1.00 . A A . 7 GLU N 1 1 3 1140 1 1 7 GLU O O 2.205 0.332 -3.015 1.00 . A A . 7 GLU O 1 1 3 1141 1 1 7 GLU OE1 O 7.002 -1.373 -6.237 1.00 . A A . 7 GLU OE1 1 1 3 1142 1 1 7 GLU OE2 O 8.796 -1.001 -5.023 1.00 . A A . 7 GLU OE2 1 1 3 1143 1 1 8 TYR C C 1.923 2.246 -5.018 1.00 . A A . 8 TYR C 1 1 3 1144 1 1 8 TYR CA C 3.149 2.649 -4.205 1.00 . A A . 8 TYR CA 1 1 3 1145 1 1 8 TYR CB C 3.992 3.651 -4.994 1.00 . A A . 8 TYR CB 1 1 3 1146 1 1 8 TYR CD1 C 5.675 2.306 -6.312 1.00 . A A . 8 TYR CD1 1 1 3 1147 1 1 8 TYR CD2 C 3.902 3.365 -7.502 1.00 . A A . 8 TYR CD2 1 1 3 1148 1 1 8 TYR CE1 C 6.172 1.798 -7.497 1.00 . A A . 8 TYR CE1 1 1 3 1149 1 1 8 TYR CE2 C 4.391 2.860 -8.691 1.00 . A A . 8 TYR CE2 1 1 3 1150 1 1 8 TYR CG C 4.533 3.097 -6.294 1.00 . A A . 8 TYR CG 1 1 3 1151 1 1 8 TYR CZ C 5.526 2.077 -8.683 1.00 . A A . 8 TYR CZ 1 1 3 1152 1 1 8 TYR H H 4.909 1.486 -4.041 1.00 . A A . 8 TYR H 1 1 3 1153 1 1 8 TYR HA H 2.820 3.115 -3.287 1.00 . A A . 8 TYR HA 1 1 3 1154 1 1 8 TYR HB3 H 4.833 3.959 -4.389 1.00 . A A . 8 TYR HB3 1 1 3 1155 1 1 8 TYR HD1 H 6.178 2.089 -5.381 1.00 . A A . 8 TYR HD1 1 1 3 1156 1 1 8 TYR HD2 H 3.013 3.979 -7.504 1.00 . A A . 8 TYR HD2 1 1 3 1157 1 1 8 TYR HE1 H 7.061 1.185 -7.491 1.00 . A A . 8 TYR HE1 1 1 3 1158 1 1 8 TYR HE2 H 3.885 3.079 -9.620 1.00 . A A . 8 TYR HE2 1 1 3 1159 1 1 8 TYR HH H 6.949 1.363 -9.761 1.00 . A A . 8 TYR HH 1 1 3 1160 1 1 8 TYR N N 3.948 1.481 -3.853 1.00 . A A . 8 TYR N 1 1 3 1161 1 1 8 TYR O O 2.045 1.670 -6.100 1.00 . A A . 8 TYR O 1 1 3 1162 1 1 8 TYR OH O 6.018 1.574 -9.865 1.00 . A A . 8 TYR OH 1 1 3 1163 1 1 9 GLU C C -1.704 2.779 -4.404 1.00 . A A . 9 GLU C 1 1 3 1164 1 1 9 GLU CA C -0.505 2.223 -5.169 1.00 . A A . 9 GLU CA 1 1 3 1165 1 1 9 GLU CB C -0.644 0.707 -5.319 1.00 . A A . 9 GLU CB 1 1 3 1166 1 1 9 GLU CD C -0.148 -0.519 -7.472 1.00 . A A . 9 GLU CD 1 1 3 1167 1 1 9 GLU CG C -1.167 0.276 -6.679 1.00 . A A . 9 GLU CG 1 1 3 1168 1 1 9 GLU H H 0.710 3.012 -3.625 1.00 . A A . 9 GLU H 1 1 3 1169 1 1 9 GLU HA H -0.480 2.672 -6.149 1.00 . A A . 9 GLU HA 1 1 3 1170 1 1 9 GLU HB3 H -1.324 0.343 -4.564 1.00 . A A . 9 GLU HB3 1 1 3 1171 1 1 9 GLU HG3 H -1.433 1.157 -7.245 1.00 . A A . 9 GLU HG3 1 1 3 1172 1 1 9 GLU N N 0.743 2.553 -4.491 1.00 . A A . 9 GLU N 1 1 3 1173 1 1 9 GLU O O -2.792 2.204 -4.426 1.00 . A A . 9 GLU O 1 1 3 1174 1 1 9 GLU OE1 O 0.432 -1.471 -6.908 1.00 . A A . 9 GLU OE1 1 1 3 1175 1 1 9 GLU OE2 O 0.071 -0.188 -8.657 1.00 . A A . 9 GLU OE2 1 1 3 1176 1 1 10 THR C C -3.236 3.537 -2.028 1.00 . A A . 10 THR C 1 1 3 1177 1 1 10 THR CA C -2.555 4.540 -2.954 1.00 . A A . 10 THR CA 1 1 3 1178 1 1 10 THR CB C -3.616 5.175 -3.872 1.00 . A A . 10 THR CB 1 1 3 1179 1 1 10 THR CG2 C -4.326 6.321 -3.166 1.00 . A A . 10 THR CG2 1 1 3 1180 1 1 10 THR H H -0.605 4.316 -3.747 1.00 . A A . 10 THR H 1 1 3 1181 1 1 10 THR HA H -2.110 5.322 -2.357 1.00 . A A . 10 THR HA 1 1 3 1182 1 1 10 THR HB H -4.347 4.422 -4.127 1.00 . A A . 10 THR HB 1 1 3 1183 1 1 10 THR HG1 H -2.347 6.324 -4.852 1.00 . A A . 10 THR HG1 1 1 3 1184 1 1 10 THR HG21 H -4.365 6.121 -2.106 1.00 . A A . 10 THR HG21 1 1 3 1185 1 1 10 THR HG22 H -5.330 6.414 -3.552 1.00 . A A . 10 THR HG22 1 1 3 1186 1 1 10 THR HG23 H -3.786 7.240 -3.339 1.00 . A A . 10 THR HG23 1 1 3 1187 1 1 10 THR N N -1.495 3.904 -3.726 1.00 . A A . 10 THR N 1 1 3 1188 1 1 10 THR O O -4.219 2.898 -2.403 1.00 . A A . 10 THR O 1 1 3 1189 1 1 10 THR OG1 O -3.001 5.656 -5.072 1.00 . A A . 10 THR OG1 1 1 3 1190 1 1 11 CYS C C -4.524 3.059 0.802 1.00 . A A . 11 CYS C 1 1 3 1191 1 1 11 CYS CA C -3.264 2.481 0.165 1.00 . A A . 11 CYS CA 1 1 3 1192 1 1 11 CYS CB C -2.229 2.171 1.248 1.00 . A A . 11 CYS CB 1 1 3 1193 1 1 11 CYS H H -1.923 3.943 -0.575 1.00 . A A . 11 CYS H 1 1 3 1194 1 1 11 CYS HA H -3.521 1.567 -0.348 1.00 . A A . 11 CYS HA 1 1 3 1195 1 1 11 CYS HB3 H -1.398 1.645 0.801 1.00 . A A . 11 CYS HB3 1 1 3 1196 1 1 11 CYS N N -2.707 3.406 -0.816 1.00 . A A . 11 CYS N 1 1 3 1197 1 1 11 CYS O O -4.592 3.241 2.018 1.00 . A A . 11 CYS O 1 1 3 1198 1 1 11 CYS SG S -1.565 3.645 2.088 1.00 . A A . 11 CYS SG 1 1 3 1199 1 1 12 VAL C C -7.635 2.828 1.123 1.00 . A A . 12 VAL C 1 1 3 1200 1 1 12 VAL CA C -6.782 3.900 0.453 1.00 . A A . 12 VAL CA 1 1 3 1201 1 1 12 VAL CB C -7.587 4.539 -0.693 1.00 . A A . 12 VAL CB 1 1 3 1202 1 1 12 VAL CG1 C -6.870 5.770 -1.228 1.00 . A A . 12 VAL CG1 1 1 3 1203 1 1 12 VAL CG2 C -7.829 3.528 -1.803 1.00 . A A . 12 VAL CG2 1 1 3 1204 1 1 12 VAL H H -5.409 3.178 -0.987 1.00 . A A . 12 VAL H 1 1 3 1205 1 1 12 VAL HA H -6.553 4.669 1.177 1.00 . A A . 12 VAL HA 1 1 3 1206 1 1 12 VAL HB H -8.546 4.850 -0.303 1.00 . A A . 12 VAL HB 1 1 3 1207 1 1 12 VAL HG11 H -5.874 5.815 -0.813 1.00 . A A . 12 VAL HG11 1 1 3 1208 1 1 12 VAL HG12 H -6.811 5.712 -2.306 1.00 . A A . 12 VAL HG12 1 1 3 1209 1 1 12 VAL HG13 H -7.417 6.657 -0.945 1.00 . A A . 12 VAL HG13 1 1 3 1210 1 1 12 VAL HG21 H -7.868 2.534 -1.383 1.00 . A A . 12 VAL HG21 1 1 3 1211 1 1 12 VAL HG22 H -8.766 3.749 -2.293 1.00 . A A . 12 VAL HG22 1 1 3 1212 1 1 12 VAL HG23 H -7.025 3.583 -2.522 1.00 . A A . 12 VAL HG23 1 1 3 1213 1 1 12 VAL N N -5.522 3.344 -0.028 1.00 . A A . 12 VAL N 1 1 3 1214 1 1 12 VAL O O -7.211 1.681 1.260 1.00 . A A . 12 VAL O 1 1 3 1215 1 1 13 ARG C C -9.908 1.004 1.374 1.00 . A A . 13 ARG C 1 1 3 1216 1 1 13 ARG CA C -9.751 2.282 2.194 1.00 . A A . 13 ARG CA 1 1 3 1217 1 1 13 ARG CB C -11.116 2.938 2.403 1.00 . A A . 13 ARG CB 1 1 3 1218 1 1 13 ARG CD C -12.638 4.216 3.942 1.00 . A A . 13 ARG CD 1 1 3 1219 1 1 13 ARG CG C -11.357 3.404 3.829 1.00 . A A . 13 ARG CG 1 1 3 1220 1 1 13 ARG CZ C -13.313 6.561 4.231 1.00 . A A . 13 ARG CZ 1 1 3 1221 1 1 13 ARG H H -9.118 4.140 1.400 1.00 . A A . 13 ARG H 1 1 3 1222 1 1 13 ARG HA H -9.332 2.030 3.156 1.00 . A A . 13 ARG HA 1 1 3 1223 1 1 13 ARG HB3 H -11.888 2.228 2.144 1.00 . A A . 13 ARG HB3 1 1 3 1224 1 1 13 ARG HD3 H -13.157 3.919 4.842 1.00 . A A . 13 ARG HD3 1 1 3 1225 1 1 13 ARG HE H -11.454 5.949 3.852 1.00 . A A . 13 ARG HE 1 1 3 1226 1 1 13 ARG HG3 H -10.524 4.017 4.143 1.00 . A A . 13 ARG HG3 1 1 3 1227 1 1 13 ARG HH11 H -14.811 5.218 4.408 1.00 . A A . 13 ARG HH11 1 1 3 1228 1 1 13 ARG HH12 H -15.273 6.875 4.611 1.00 . A A . 13 ARG HH12 1 1 3 1229 1 1 13 ARG HH21 H -12.050 8.135 4.115 1.00 . A A . 13 ARG HH21 1 1 3 1230 1 1 13 ARG HH22 H -13.702 8.534 4.442 1.00 . A A . 13 ARG HH22 1 1 3 1231 1 1 13 ARG N N -8.838 3.211 1.537 1.00 . A A . 13 ARG N 1 1 3 1232 1 1 13 ARG NE N -12.375 5.651 3.997 1.00 . A A . 13 ARG NE 1 1 3 1233 1 1 13 ARG NH1 N -14.569 6.188 4.433 1.00 . A A . 13 ARG NH1 1 1 3 1234 1 1 13 ARG NH2 N -12.996 7.849 4.265 1.00 . A A . 13 ARG NH2 1 1 3 1235 1 1 13 ARG O O -9.610 -0.097 1.834 1.00 . A A . 13 ARG O 1 1 3 1236 1 1 14 PRO C C -9.284 -0.588 -1.254 1.00 . A A . 14 PRO C 1 1 3 1237 1 1 14 PRO CA C -10.597 0.023 -0.778 1.00 . A A . 14 PRO CA 1 1 3 1238 1 1 14 PRO CB C -11.354 0.648 -1.953 1.00 . A A . 14 PRO CB 1 1 3 1239 1 1 14 PRO CD C -10.765 2.438 -0.483 1.00 . A A . 14 PRO CD 1 1 3 1240 1 1 14 PRO CG C -10.967 2.086 -1.931 1.00 . A A . 14 PRO CG 1 1 3 1241 1 1 14 PRO HA H -11.206 -0.744 -0.323 1.00 . A A . 14 PRO HA 1 1 3 1242 1 1 14 PRO HB3 H -12.417 0.522 -1.810 1.00 . A A . 14 PRO HB3 1 1 3 1243 1 1 14 PRO HD3 H -11.683 2.815 -0.055 1.00 . A A . 14 PRO HD3 1 1 3 1244 1 1 14 PRO HG3 H -11.759 2.686 -2.354 1.00 . A A . 14 PRO HG3 1 1 3 1245 1 1 14 PRO N N -10.389 1.153 0.131 1.00 . A A . 14 PRO N 1 1 3 1246 1 1 14 PRO O O -9.274 -1.631 -1.906 1.00 . A A . 14 PRO O 1 1 3 1247 1 1 15 ARG C C -6.020 -0.767 -0.093 1.00 . A A . 15 ARG C 1 1 3 1248 1 1 15 ARG CA C -6.857 -0.410 -1.318 1.00 . A A . 15 ARG CA 1 1 3 1249 1 1 15 ARG CB C -6.135 0.650 -2.151 1.00 . A A . 15 ARG CB 1 1 3 1250 1 1 15 ARG CD C -5.698 0.165 -4.578 1.00 . A A . 15 ARG CD 1 1 3 1251 1 1 15 ARG CG C -5.157 0.070 -3.160 1.00 . A A . 15 ARG CG 1 1 3 1252 1 1 15 ARG CZ C -6.476 1.890 -6.147 1.00 . A A . 15 ARG CZ 1 1 3 1253 1 1 15 ARG H H -8.249 0.896 -0.402 1.00 . A A . 15 ARG H 1 1 3 1254 1 1 15 ARG HA H -6.993 -1.297 -1.918 1.00 . A A . 15 ARG HA 1 1 3 1255 1 1 15 ARG HB3 H -5.589 1.303 -1.487 1.00 . A A . 15 ARG HB3 1 1 3 1256 1 1 15 ARG HD3 H -6.623 -0.388 -4.633 1.00 . A A . 15 ARG HD3 1 1 3 1257 1 1 15 ARG HE H -5.705 2.254 -4.344 1.00 . A A . 15 ARG HE 1 1 3 1258 1 1 15 ARG HG3 H -4.980 -0.967 -2.919 1.00 . A A . 15 ARG HG3 1 1 3 1259 1 1 15 ARG HH11 H -6.668 -0.010 -6.808 1.00 . A A . 15 ARG HH11 1 1 3 1260 1 1 15 ARG HH12 H -7.213 1.216 -7.905 1.00 . A A . 15 ARG HH12 1 1 3 1261 1 1 15 ARG HH21 H -6.420 3.877 -5.779 1.00 . A A . 15 ARG HH21 1 1 3 1262 1 1 15 ARG HH22 H -7.071 3.426 -7.318 1.00 . A A . 15 ARG HH22 1 1 3 1263 1 1 15 ARG N N -8.177 0.069 -0.923 1.00 . A A . 15 ARG N 1 1 3 1264 1 1 15 ARG NE N -5.946 1.547 -4.977 1.00 . A A . 15 ARG NE 1 1 3 1265 1 1 15 ARG NH1 N -6.813 0.955 -7.026 1.00 . A A . 15 ARG NH1 1 1 3 1266 1 1 15 ARG NH2 N -6.672 3.169 -6.438 1.00 . A A . 15 ARG NH2 1 1 3 1267 1 1 15 ARG O O -4.790 -0.742 -0.140 1.00 . A A . 15 ARG O 1 1 3 1268 1 1 16 LYS C C -4.964 -2.538 1.987 1.00 . A A . 16 LYS C 1 1 3 1269 1 1 16 LYS CA C -6.015 -1.462 2.240 1.00 . A A . 16 LYS CA 1 1 3 1270 1 1 16 LYS CB C -7.027 -1.955 3.276 1.00 . A A . 16 LYS CB 1 1 3 1271 1 1 16 LYS CD C -7.563 -2.368 5.695 1.00 . A A . 16 LYS CD 1 1 3 1272 1 1 16 LYS CE C -7.047 -2.304 7.125 1.00 . A A . 16 LYS CE 1 1 3 1273 1 1 16 LYS CG C -6.542 -1.824 4.710 1.00 . A A . 16 LYS CG 1 1 3 1274 1 1 16 LYS H H -7.675 -1.099 0.978 1.00 . A A . 16 LYS H 1 1 3 1275 1 1 16 LYS HA H -5.524 -0.578 2.620 1.00 . A A . 16 LYS HA 1 1 3 1276 1 1 16 LYS HB3 H -7.242 -2.996 3.084 1.00 . A A . 16 LYS HB3 1 1 3 1277 1 1 16 LYS HD3 H -7.778 -3.398 5.445 1.00 . A A . 16 LYS HD3 1 1 3 1278 1 1 16 LYS HE3 H -6.593 -1.338 7.286 1.00 . A A . 16 LYS HE3 1 1 3 1279 1 1 16 LYS HG3 H -6.368 -0.779 4.927 1.00 . A A . 16 LYS HG3 1 1 3 1280 1 1 16 LYS HZ1 H -9.064 -2.345 7.667 1.00 . A A . 16 LYS HZ1 1 1 3 1281 1 1 16 LYS HZ2 H -8.032 -1.825 8.903 1.00 . A A . 16 LYS HZ2 1 1 3 1282 1 1 16 LYS HZ3 H -8.107 -3.465 8.500 1.00 . A A . 16 LYS HZ3 1 1 3 1283 1 1 16 LYS N N -6.695 -1.098 1.002 1.00 . A A . 16 LYS N 1 1 3 1284 1 1 16 LYS NZ N -8.140 -2.499 8.118 1.00 . A A . 16 LYS NZ 1 1 3 1285 1 1 16 LYS O O -5.275 -3.616 1.480 1.00 . A A . 16 LYS O 1 1 3 1286 1 1 17 CYS C C -2.866 -4.463 2.954 1.00 . A A . 17 CYS C 1 1 3 1287 1 1 17 CYS CA C -2.624 -3.182 2.161 1.00 . A A . 17 CYS CA 1 1 3 1288 1 1 17 CYS CB C -1.299 -2.547 2.590 1.00 . A A . 17 CYS CB 1 1 3 1289 1 1 17 CYS H H -3.534 -1.364 2.747 1.00 . A A . 17 CYS H 1 1 3 1290 1 1 17 CYS HA H -2.572 -3.428 1.111 1.00 . A A . 17 CYS HA 1 1 3 1291 1 1 17 CYS HB3 H -0.608 -3.328 2.868 1.00 . A A . 17 CYS HB3 1 1 3 1292 1 1 17 CYS N N -3.720 -2.241 2.347 1.00 . A A . 17 CYS N 1 1 3 1293 1 1 17 CYS O O -2.724 -4.485 4.176 1.00 . A A . 17 CYS O 1 1 3 1294 1 1 17 CYS SG S -0.506 -1.537 1.298 1.00 . A A . 17 CYS SG 1 1 3 1295 1 1 18 GLN C C -2.342 -7.214 3.799 1.00 . A A . 18 GLN C 1 1 3 1296 1 1 18 GLN CA C -3.496 -6.813 2.886 1.00 . A A . 18 GLN CA 1 1 3 1297 1 1 18 GLN CB C -3.725 -7.894 1.829 1.00 . A A . 18 GLN CB 1 1 3 1298 1 1 18 GLN CD C -5.853 -8.928 2.713 1.00 . A A . 18 GLN CD 1 1 3 1299 1 1 18 GLN CG C -5.192 -8.189 1.566 1.00 . A A . 18 GLN CG 1 1 3 1300 1 1 18 GLN H H -3.329 -5.448 1.276 1.00 . A A . 18 GLN H 1 1 3 1301 1 1 18 GLN HA H -4.390 -6.711 3.482 1.00 . A A . 18 GLN HA 1 1 3 1302 1 1 18 GLN HB3 H -3.250 -8.807 2.156 1.00 . A A . 18 GLN HB3 1 1 3 1303 1 1 18 GLN HE21 H -7.612 -8.837 1.790 1.00 . A A . 18 GLN HE21 1 1 3 1304 1 1 18 GLN HE22 H -7.609 -9.630 3.325 1.00 . A A . 18 GLN HE22 1 1 3 1305 1 1 18 GLN HG3 H -5.271 -8.792 0.675 1.00 . A A . 18 GLN HG3 1 1 3 1306 1 1 18 GLN N N -3.233 -5.528 2.248 1.00 . A A . 18 GLN N 1 1 3 1307 1 1 18 GLN NE2 N -7.157 -9.154 2.599 1.00 . A A . 18 GLN NE2 1 1 3 1308 1 1 18 GLN O O -2.509 -7.407 5.003 1.00 . A A . 18 GLN O 1 1 3 1309 1 1 18 GLN OE1 O -5.200 -9.291 3.691 1.00 . A A . 18 GLN OE1 1 1 3 1310 1 1 19 PRO C C 0.533 -6.620 4.902 1.00 . A A . 19 PRO C 1 1 3 1311 1 1 19 PRO CA C 0.064 -7.721 3.957 1.00 . A A . 19 PRO CA 1 1 3 1312 1 1 19 PRO CB C 1.100 -7.958 2.855 1.00 . A A . 19 PRO CB 1 1 3 1313 1 1 19 PRO CD C -0.869 -7.127 1.784 1.00 . A A . 19 PRO CD 1 1 3 1314 1 1 19 PRO CG C 0.634 -7.125 1.712 1.00 . A A . 19 PRO CG 1 1 3 1315 1 1 19 PRO HA H -0.084 -8.634 4.515 1.00 . A A . 19 PRO HA 1 1 3 1316 1 1 19 PRO HB3 H 1.123 -9.006 2.597 1.00 . A A . 19 PRO HB3 1 1 3 1317 1 1 19 PRO HD3 H -1.273 -7.933 1.189 1.00 . A A . 19 PRO HD3 1 1 3 1318 1 1 19 PRO HG3 H 0.964 -7.561 0.780 1.00 . A A . 19 PRO HG3 1 1 3 1319 1 1 19 PRO N N -1.141 -7.342 3.214 1.00 . A A . 19 PRO N 1 1 3 1320 1 1 19 PRO O O 0.045 -5.491 4.867 1.00 . A A . 19 PRO O 1 1 3 1321 1 1 20 PRO C C 2.894 -4.917 6.068 1.00 . A A . 20 PRO C 1 1 3 1322 1 1 20 PRO CA C 2.061 -6.006 6.735 1.00 . A A . 20 PRO CA 1 1 3 1323 1 1 20 PRO CB C 2.943 -6.886 7.624 1.00 . A A . 20 PRO CB 1 1 3 1324 1 1 20 PRO CD C 2.132 -8.282 5.861 1.00 . A A . 20 PRO CD 1 1 3 1325 1 1 20 PRO CG C 3.312 -8.045 6.763 1.00 . A A . 20 PRO CG 1 1 3 1326 1 1 20 PRO HA H 1.286 -5.549 7.333 1.00 . A A . 20 PRO HA 1 1 3 1327 1 1 20 PRO HB3 H 2.385 -7.201 8.492 1.00 . A A . 20 PRO HB3 1 1 3 1328 1 1 20 PRO HD3 H 1.456 -8.997 6.305 1.00 . A A . 20 PRO HD3 1 1 3 1329 1 1 20 PRO HG3 H 3.494 -8.914 7.377 1.00 . A A . 20 PRO HG3 1 1 3 1330 1 1 20 PRO N N 1.504 -6.954 5.765 1.00 . A A . 20 PRO N 1 1 3 1331 1 1 20 PRO O O 4.114 -5.038 5.950 1.00 . A A . 20 PRO O 1 1 3 1332 1 1 21 LEU C C 2.833 -1.478 5.832 1.00 . A A . 21 LEU C 1 1 3 1333 1 1 21 LEU CA C 2.908 -2.740 4.979 1.00 . A A . 21 LEU CA 1 1 3 1334 1 1 21 LEU CB C 2.289 -2.477 3.605 1.00 . A A . 21 LEU CB 1 1 3 1335 1 1 21 LEU CD1 C 4.216 -2.750 2.024 1.00 . A A . 21 LEU CD1 1 1 3 1336 1 1 21 LEU CD2 C 2.968 -4.762 2.830 1.00 . A A . 21 LEU CD2 1 1 3 1337 1 1 21 LEU CG C 2.859 -3.294 2.444 1.00 . A A . 21 LEU CG 1 1 3 1338 1 1 21 LEU H H 1.257 -3.813 5.756 1.00 . A A . 21 LEU H 1 1 3 1339 1 1 21 LEU HA H 3.945 -3.014 4.852 1.00 . A A . 21 LEU HA 1 1 3 1340 1 1 21 LEU HB3 H 2.431 -1.431 3.374 1.00 . A A . 21 LEU HB3 1 1 3 1341 1 1 21 LEU HD11 H 4.325 -1.738 2.385 1.00 . A A . 21 LEU HD11 1 1 3 1342 1 1 21 LEU HD12 H 4.287 -2.758 0.946 1.00 . A A . 21 LEU HD12 1 1 3 1343 1 1 21 LEU HD13 H 4.997 -3.369 2.442 1.00 . A A . 21 LEU HD13 1 1 3 1344 1 1 21 LEU HD21 H 2.021 -5.104 3.221 1.00 . A A . 21 LEU HD21 1 1 3 1345 1 1 21 LEU HD22 H 3.732 -4.881 3.583 1.00 . A A . 21 LEU HD22 1 1 3 1346 1 1 21 LEU HD23 H 3.229 -5.345 1.958 1.00 . A A . 21 LEU HD23 1 1 3 1347 1 1 21 LEU HG H 2.192 -3.218 1.597 1.00 . A A . 21 LEU HG 1 1 3 1348 1 1 21 LEU N N 2.228 -3.852 5.634 1.00 . A A . 21 LEU N 1 1 3 1349 1 1 21 LEU O O 2.255 -1.483 6.919 1.00 . A A . 21 LEU O 1 1 3 1350 1 1 22 LYS C C 3.326 2.045 5.074 1.00 . A A . 22 LYS C 1 1 3 1351 1 1 22 LYS CA C 3.421 0.875 6.047 1.00 . A A . 22 LYS CA 1 1 3 1352 1 1 22 LYS CB C 4.686 1.007 6.897 1.00 . A A . 22 LYS CB 1 1 3 1353 1 1 22 LYS CD C 5.901 2.800 8.170 1.00 . A A . 22 LYS CD 1 1 3 1354 1 1 22 LYS CE C 6.699 2.221 9.328 1.00 . A A . 22 LYS CE 1 1 3 1355 1 1 22 LYS CG C 4.584 2.068 7.980 1.00 . A A . 22 LYS CG 1 1 3 1356 1 1 22 LYS H H 3.868 -0.455 4.461 1.00 . A A . 22 LYS H 1 1 3 1357 1 1 22 LYS HA H 2.558 0.890 6.695 1.00 . A A . 22 LYS HA 1 1 3 1358 1 1 22 LYS HB3 H 5.514 1.261 6.252 1.00 . A A . 22 LYS HB3 1 1 3 1359 1 1 22 LYS HD3 H 5.697 3.842 8.370 1.00 . A A . 22 LYS HD3 1 1 3 1360 1 1 22 LYS HE3 H 7.154 1.296 9.006 1.00 . A A . 22 LYS HE3 1 1 3 1361 1 1 22 LYS HG3 H 4.308 1.592 8.911 1.00 . A A . 22 LYS HG3 1 1 3 1362 1 1 22 LYS HZ1 H 7.586 4.110 9.423 1.00 . A A . 22 LYS HZ1 1 1 3 1363 1 1 22 LYS HZ2 H 8.693 2.830 9.444 1.00 . A A . 22 LYS HZ2 1 1 3 1364 1 1 22 LYS HZ3 H 7.786 3.188 10.826 1.00 . A A . 22 LYS HZ3 1 1 3 1365 1 1 22 LYS N N 3.422 -0.397 5.333 1.00 . A A . 22 LYS N 1 1 3 1366 1 1 22 LYS NZ N 7.766 3.152 9.788 1.00 . A A . 22 LYS NZ 1 1 3 1367 1 1 22 LYS O O 4.192 2.226 4.217 1.00 . A A . 22 LYS O 1 1 3 1368 1 1 23 CYS C C 2.819 5.210 4.868 1.00 . A A . 23 CYS C 1 1 3 1369 1 1 23 CYS CA C 2.061 3.993 4.345 1.00 . A A . 23 CYS CA 1 1 3 1370 1 1 23 CYS CB C 0.569 4.315 4.238 1.00 . A A . 23 CYS CB 1 1 3 1371 1 1 23 CYS H H 1.612 2.644 5.913 1.00 . A A . 23 CYS H 1 1 3 1372 1 1 23 CYS HA H 2.438 3.745 3.364 1.00 . A A . 23 CYS HA 1 1 3 1373 1 1 23 CYS HB3 H 0.432 5.122 3.535 1.00 . A A . 23 CYS HB3 1 1 3 1374 1 1 23 CYS N N 2.270 2.839 5.212 1.00 . A A . 23 CYS N 1 1 3 1375 1 1 23 CYS O O 3.645 5.098 5.774 1.00 . A A . 23 CYS O 1 1 3 1376 1 1 23 CYS SG S -0.456 2.914 3.684 1.00 . A A . 23 CYS SG 1 1 3 1377 1 1 24 ASN C C 2.155 8.697 4.999 1.00 . A A . 24 ASN C 1 1 3 1378 1 1 24 ASN CA C 3.184 7.610 4.701 1.00 . A A . 24 ASN CA 1 1 3 1379 1 1 24 ASN CB C 4.145 8.089 3.609 1.00 . A A . 24 ASN CB 1 1 3 1380 1 1 24 ASN CG C 5.398 7.238 3.531 1.00 . A A . 24 ASN CG 1 1 3 1381 1 1 24 ASN H H 1.863 6.399 3.576 1.00 . A A . 24 ASN H 1 1 3 1382 1 1 24 ASN HA H 3.747 7.408 5.600 1.00 . A A . 24 ASN HA 1 1 3 1383 1 1 24 ASN HB3 H 4.435 9.108 3.814 1.00 . A A . 24 ASN HB3 1 1 3 1384 1 1 24 ASN HD21 H 5.089 6.919 1.593 1.00 . A A . 24 ASN HD21 1 1 3 1385 1 1 24 ASN HD22 H 6.495 6.170 2.263 1.00 . A A . 24 ASN HD22 1 1 3 1386 1 1 24 ASN N N 2.531 6.373 4.292 1.00 . A A . 24 ASN N 1 1 3 1387 1 1 24 ASN ND2 N 5.691 6.724 2.341 1.00 . A A . 24 ASN ND2 1 1 3 1388 1 1 24 ASN O O 1.896 9.022 6.157 1.00 . A A . 24 ASN O 1 1 3 1389 1 1 24 ASN OD1 O 6.096 7.047 4.527 1.00 . A A . 24 ASN OD1 1 1 3 1390 1 1 25 LYS C C -0.223 10.484 2.799 1.00 . A A . 25 LYS C 1 1 3 1391 1 1 25 LYS CA C 0.567 10.303 4.091 1.00 . A A . 25 LYS CA 1 1 3 1392 1 1 25 LYS CB C 1.233 11.624 4.483 1.00 . A A . 25 LYS CB 1 1 3 1393 1 1 25 LYS CD C 2.473 13.324 3.110 1.00 . A A . 25 LYS CD 1 1 3 1394 1 1 25 LYS CE C 1.811 13.341 1.741 1.00 . A A . 25 LYS CE 1 1 3 1395 1 1 25 LYS CG C 2.500 11.923 3.698 1.00 . A A . 25 LYS CG 1 1 3 1396 1 1 25 LYS H H 1.818 8.953 3.045 1.00 . A A . 25 LYS H 1 1 3 1397 1 1 25 LYS HA H -0.113 10.006 4.875 1.00 . A A . 25 LYS HA 1 1 3 1398 1 1 25 LYS HB3 H 1.486 11.587 5.533 1.00 . A A . 25 LYS HB3 1 1 3 1399 1 1 25 LYS HD3 H 3.487 13.684 3.014 1.00 . A A . 25 LYS HD3 1 1 3 1400 1 1 25 LYS HE3 H 0.806 12.957 1.837 1.00 . A A . 25 LYS HE3 1 1 3 1401 1 1 25 LYS HG3 H 2.591 11.206 2.895 1.00 . A A . 25 LYS HG3 1 1 3 1402 1 1 25 LYS HZ1 H 2.278 14.752 0.273 1.00 . A A . 25 LYS HZ1 1 1 3 1403 1 1 25 LYS HZ2 H 2.173 15.395 1.835 1.00 . A A . 25 LYS HZ2 1 1 3 1404 1 1 25 LYS HZ3 H 0.764 14.987 0.992 1.00 . A A . 25 LYS HZ3 1 1 3 1405 1 1 25 LYS N N 1.570 9.255 3.944 1.00 . A A . 25 LYS N 1 1 3 1406 1 1 25 LYS NZ N 1.752 14.714 1.170 1.00 . A A . 25 LYS NZ 1 1 3 1407 1 1 25 LYS O O -1.433 10.707 2.826 1.00 . A A . 25 LYS O 1 1 3 1408 1 1 26 ALA C C -0.619 9.186 -0.184 1.00 . A A . 26 ALA C 1 1 3 1409 1 1 26 ALA CA C -0.169 10.535 0.366 1.00 . A A . 26 ALA CA 1 1 3 1410 1 1 26 ALA CB C 0.777 11.217 -0.610 1.00 . A A . 26 ALA CB 1 1 3 1411 1 1 26 ALA H H 1.431 10.207 1.711 1.00 . A A . 26 ALA H 1 1 3 1412 1 1 26 ALA HA H -1.037 11.169 0.490 1.00 . A A . 26 ALA HA 1 1 3 1413 1 1 26 ALA HB1 H 1.772 10.816 -0.485 1.00 . A A . 26 ALA HB1 1 1 3 1414 1 1 26 ALA HB2 H 0.441 11.039 -1.621 1.00 . A A . 26 ALA HB2 1 1 3 1415 1 1 26 ALA HB3 H 0.790 12.279 -0.417 1.00 . A A . 26 ALA HB3 1 1 3 1416 1 1 26 ALA N N 0.469 10.386 1.669 1.00 . A A . 26 ALA N 1 1 3 1417 1 1 26 ALA O O -0.851 9.041 -1.384 1.00 . A A . 26 ALA O 1 1 3 1418 1 1 27 GLN C C -0.142 6.236 -0.650 1.00 . A A . 27 GLN C 1 1 3 1419 1 1 27 GLN CA C -1.155 6.862 0.303 1.00 . A A . 27 GLN CA 1 1 3 1420 1 1 27 GLN CB C -2.532 6.913 -0.360 1.00 . A A . 27 GLN CB 1 1 3 1421 1 1 27 GLN CD C -4.120 8.879 -0.336 1.00 . A A . 27 GLN CD 1 1 3 1422 1 1 27 GLN CG C -3.563 7.698 0.435 1.00 . A A . 27 GLN CG 1 1 3 1423 1 1 27 GLN H H -0.536 8.379 1.643 1.00 . A A . 27 GLN H 1 1 3 1424 1 1 27 GLN HA H -1.217 6.256 1.193 1.00 . A A . 27 GLN HA 1 1 3 1425 1 1 27 GLN HB3 H -2.897 5.905 -0.483 1.00 . A A . 27 GLN HB3 1 1 3 1426 1 1 27 GLN HE21 H -5.869 8.691 0.592 1.00 . A A . 27 GLN HE21 1 1 3 1427 1 1 27 GLN HE22 H -5.763 9.974 -0.559 1.00 . A A . 27 GLN HE22 1 1 3 1428 1 1 27 GLN HG3 H -3.097 8.064 1.339 1.00 . A A . 27 GLN HG3 1 1 3 1429 1 1 27 GLN N N -0.736 8.202 0.701 1.00 . A A . 27 GLN N 1 1 3 1430 1 1 27 GLN NE2 N -5.378 9.215 -0.075 1.00 . A A . 27 GLN NE2 1 1 3 1431 1 1 27 GLN O O -0.185 6.469 -1.858 1.00 . A A . 27 GLN O 1 1 3 1432 1 1 27 GLN OE1 O -3.428 9.482 -1.156 1.00 . A A . 27 GLN OE1 1 1 3 1433 1 1 28 ILE C C 2.013 3.345 -0.432 1.00 . A A . 28 ILE C 1 1 3 1434 1 1 28 ILE CA C 1.792 4.780 -0.898 1.00 . A A . 28 ILE CA 1 1 3 1435 1 1 28 ILE CB C 3.130 5.539 -0.838 1.00 . A A . 28 ILE CB 1 1 3 1436 1 1 28 ILE CD1 C 2.493 7.224 -2.636 1.00 . A A . 28 ILE CD1 1 1 3 1437 1 1 28 ILE CG1 C 2.923 7.011 -1.202 1.00 . A A . 28 ILE CG1 1 1 3 1438 1 1 28 ILE CG2 C 4.146 4.895 -1.770 1.00 . A A . 28 ILE CG2 1 1 3 1439 1 1 28 ILE H H 0.750 5.295 0.871 1.00 . A A . 28 ILE H 1 1 3 1440 1 1 28 ILE HA H 1.454 4.766 -1.924 1.00 . A A . 28 ILE HA 1 1 3 1441 1 1 28 ILE HB H 3.510 5.476 0.170 1.00 . A A . 28 ILE HB 1 1 3 1442 1 1 28 ILE HD11 H 1.697 7.954 -2.669 1.00 . A A . 28 ILE HD11 1 1 3 1443 1 1 28 ILE HD12 H 3.332 7.582 -3.215 1.00 . A A . 28 ILE HD12 1 1 3 1444 1 1 28 ILE HD13 H 2.142 6.291 -3.050 1.00 . A A . 28 ILE HD13 1 1 3 1445 1 1 28 ILE HG13 H 3.850 7.545 -1.050 1.00 . A A . 28 ILE HG13 1 1 3 1446 1 1 28 ILE HG21 H 3.814 5.000 -2.792 1.00 . A A . 28 ILE HG21 1 1 3 1447 1 1 28 ILE HG22 H 5.103 5.382 -1.651 1.00 . A A . 28 ILE HG22 1 1 3 1448 1 1 28 ILE HG23 H 4.243 3.848 -1.528 1.00 . A A . 28 ILE HG23 1 1 3 1449 1 1 28 ILE N N 0.769 5.440 -0.097 1.00 . A A . 28 ILE N 1 1 3 1450 1 1 28 ILE O O 2.079 2.421 -1.242 1.00 . A A . 28 ILE O 1 1 3 1451 1 1 29 CYS C C 3.710 1.298 1.075 1.00 . A A . 29 CYS C 1 1 3 1452 1 1 29 CYS CA C 2.337 1.843 1.456 1.00 . A A . 29 CYS CA 1 1 3 1453 1 1 29 CYS CB C 1.246 0.878 0.987 1.00 . A A . 29 CYS CB 1 1 3 1454 1 1 29 CYS H H 2.063 3.942 1.476 1.00 . A A . 29 CYS H 1 1 3 1455 1 1 29 CYS HA H 2.286 1.937 2.530 1.00 . A A . 29 CYS HA 1 1 3 1456 1 1 29 CYS HB3 H 1.698 0.097 0.393 1.00 . A A . 29 CYS HB3 1 1 3 1457 1 1 29 CYS N N 2.125 3.165 0.880 1.00 . A A . 29 CYS N 1 1 3 1458 1 1 29 CYS O O 4.072 1.263 -0.102 1.00 . A A . 29 CYS O 1 1 3 1459 1 1 29 CYS SG S 0.324 0.084 2.342 1.00 . A A . 29 CYS SG 1 1 3 1460 1 1 30 VAL C C 6.318 -0.405 3.084 1.00 . A A . 30 VAL C 1 1 3 1461 1 1 30 VAL CA C 5.805 0.329 1.850 1.00 . A A . 30 VAL CA 1 1 3 1462 1 1 30 VAL CB C 6.806 1.436 1.471 1.00 . A A . 30 VAL CB 1 1 3 1463 1 1 30 VAL CG1 C 6.955 1.528 -0.040 1.00 . A A . 30 VAL CG1 1 1 3 1464 1 1 30 VAL CG2 C 6.369 2.772 2.054 1.00 . A A . 30 VAL CG2 1 1 3 1465 1 1 30 VAL H H 4.129 0.928 2.995 1.00 . A A . 30 VAL H 1 1 3 1466 1 1 30 VAL HA H 5.744 -0.369 1.028 1.00 . A A . 30 VAL HA 1 1 3 1467 1 1 30 VAL HB H 7.769 1.182 1.891 1.00 . A A . 30 VAL HB 1 1 3 1468 1 1 30 VAL HG11 H 7.945 1.886 -0.283 1.00 . A A . 30 VAL HG11 1 1 3 1469 1 1 30 VAL HG12 H 6.806 0.551 -0.476 1.00 . A A . 30 VAL HG12 1 1 3 1470 1 1 30 VAL HG13 H 6.219 2.215 -0.432 1.00 . A A . 30 VAL HG13 1 1 3 1471 1 1 30 VAL HG21 H 7.131 3.514 1.867 1.00 . A A . 30 VAL HG21 1 1 3 1472 1 1 30 VAL HG22 H 5.444 3.080 1.592 1.00 . A A . 30 VAL HG22 1 1 3 1473 1 1 30 VAL HG23 H 6.222 2.669 3.120 1.00 . A A . 30 VAL HG23 1 1 3 1474 1 1 30 VAL N N 4.473 0.874 2.079 1.00 . A A . 30 VAL N 1 1 3 1475 1 1 30 VAL O O 5.655 -0.434 4.122 1.00 . A A . 30 VAL O 1 1 3 1476 1 1 31 ASP C C 9.433 -2.350 3.651 1.00 . A A . 31 ASP C 1 1 3 1477 1 1 31 ASP CA C 8.106 -1.729 4.072 1.00 . A A . 31 ASP CA 1 1 3 1478 1 1 31 ASP CB C 7.154 -2.817 4.570 1.00 . A A . 31 ASP CB 1 1 3 1479 1 1 31 ASP CG C 6.623 -2.530 5.961 1.00 . A A . 31 ASP CG 1 1 3 1480 1 1 31 ASP H H 7.981 -0.937 2.112 1.00 . A A . 31 ASP H 1 1 3 1481 1 1 31 ASP HA H 8.288 -1.029 4.873 1.00 . A A . 31 ASP HA 1 1 3 1482 1 1 31 ASP HB3 H 7.677 -3.762 4.592 1.00 . A A . 31 ASP HB3 1 1 3 1483 1 1 31 ASP N N 7.502 -0.995 2.965 1.00 . A A . 31 ASP N 1 1 3 1484 1 1 31 ASP O O 9.714 -2.534 2.466 1.00 . A A . 31 ASP O 1 1 3 1485 1 1 31 ASP OD1 O 6.591 -1.344 6.350 1.00 . A A . 31 ASP OD1 1 1 3 1486 1 1 31 ASP OD2 O 6.239 -3.491 6.659 1.00 . A A . 31 ASP OD2 1 1 3 1487 1 1 32 PRO C C 11.477 -4.717 3.882 1.00 . A A . 32 PRO C 1 1 3 1488 1 1 32 PRO CA C 11.585 -3.287 4.402 1.00 . A A . 32 PRO CA 1 1 3 1489 1 1 32 PRO CB C 12.245 -3.268 5.783 1.00 . A A . 32 PRO CB 1 1 3 1490 1 1 32 PRO CD C 10.004 -2.492 6.079 1.00 . A A . 32 PRO CD 1 1 3 1491 1 1 32 PRO CG C 11.109 -3.264 6.745 1.00 . A A . 32 PRO CG 1 1 3 1492 1 1 32 PRO HA H 12.172 -2.699 3.712 1.00 . A A . 32 PRO HA 1 1 3 1493 1 1 32 PRO HB3 H 12.851 -2.380 5.884 1.00 . A A . 32 PRO HB3 1 1 3 1494 1 1 32 PRO HD3 H 10.060 -1.447 6.346 1.00 . A A . 32 PRO HD3 1 1 3 1495 1 1 32 PRO HG3 H 11.406 -2.777 7.662 1.00 . A A . 32 PRO HG3 1 1 3 1496 1 1 32 PRO N N 10.272 -2.682 4.644 1.00 . A A . 32 PRO N 1 1 3 1497 1 1 32 PRO O O 12.305 -5.165 3.089 1.00 . A A . 32 PRO O 1 1 3 1498 1 1 33 LYS C C 10.174 -6.913 2.397 1.00 . A A . 33 LYS C 1 1 3 1499 1 1 33 LYS CA C 10.234 -6.810 3.917 1.00 . A A . 33 LYS CA 1 1 3 1500 1 1 33 LYS CB C 8.939 -7.350 4.526 1.00 . A A . 33 LYS CB 1 1 3 1501 1 1 33 LYS CD C 8.131 -9.328 5.848 1.00 . A A . 33 LYS CD 1 1 3 1502 1 1 33 LYS CE C 8.115 -9.959 7.232 1.00 . A A . 33 LYS CE 1 1 3 1503 1 1 33 LYS CG C 9.160 -8.214 5.757 1.00 . A A . 33 LYS CG 1 1 3 1504 1 1 33 LYS H H 9.826 -5.018 4.968 1.00 . A A . 33 LYS H 1 1 3 1505 1 1 33 LYS HA H 11.064 -7.400 4.274 1.00 . A A . 33 LYS HA 1 1 3 1506 1 1 33 LYS HB3 H 8.426 -7.944 3.784 1.00 . A A . 33 LYS HB3 1 1 3 1507 1 1 33 LYS HD3 H 8.371 -10.088 5.118 1.00 . A A . 33 LYS HD3 1 1 3 1508 1 1 33 LYS HE3 H 7.406 -10.775 7.232 1.00 . A A . 33 LYS HE3 1 1 3 1509 1 1 33 LYS HG3 H 9.084 -7.594 6.639 1.00 . A A . 33 LYS HG3 1 1 3 1510 1 1 33 LYS HZ1 H 10.106 -10.430 6.810 1.00 . A A . 33 LYS HZ1 1 1 3 1511 1 1 33 LYS HZ2 H 9.377 -11.472 7.926 1.00 . A A . 33 LYS HZ2 1 1 3 1512 1 1 33 LYS HZ3 H 9.845 -9.917 8.402 1.00 . A A . 33 LYS HZ3 1 1 3 1513 1 1 33 LYS N N 10.452 -5.431 4.336 1.00 . A A . 33 LYS N 1 1 3 1514 1 1 33 LYS NZ N 9.454 -10.481 7.619 1.00 . A A . 33 LYS NZ 1 1 3 1515 1 1 33 LYS O O 10.905 -7.696 1.788 1.00 . A A . 33 LYS O 1 1 3 1516 1 1 34 LYS C C 8.778 -4.728 -0.170 1.00 . A A . 34 LYS C 1 1 3 1517 1 1 34 LYS CA C 9.148 -6.119 0.337 1.00 . A A . 34 LYS CA 1 1 3 1518 1 1 34 LYS CB C 8.078 -7.127 -0.083 1.00 . A A . 34 LYS CB 1 1 3 1519 1 1 34 LYS CD C 8.823 -9.029 -1.546 1.00 . A A . 34 LYS CD 1 1 3 1520 1 1 34 LYS CE C 8.458 -9.751 -2.834 1.00 . A A . 34 LYS CE 1 1 3 1521 1 1 34 LYS CG C 8.238 -7.627 -1.509 1.00 . A A . 34 LYS CG 1 1 3 1522 1 1 34 LYS H H 8.747 -5.516 2.327 1.00 . A A . 34 LYS H 1 1 3 1523 1 1 34 LYS HA H 10.093 -6.407 -0.096 1.00 . A A . 34 LYS HA 1 1 3 1524 1 1 34 LYS HB3 H 7.106 -6.662 0.005 1.00 . A A . 34 LYS HB3 1 1 3 1525 1 1 34 LYS HD3 H 8.438 -9.592 -0.707 1.00 . A A . 34 LYS HD3 1 1 3 1526 1 1 34 LYS HE3 H 9.298 -9.697 -3.511 1.00 . A A . 34 LYS HE3 1 1 3 1527 1 1 34 LYS HG3 H 8.899 -6.957 -2.043 1.00 . A A . 34 LYS HG3 1 1 3 1528 1 1 34 LYS HZ1 H 7.787 -11.623 -3.472 1.00 . A A . 34 LYS HZ1 1 1 3 1529 1 1 34 LYS HZ2 H 7.375 -11.255 -1.873 1.00 . A A . 34 LYS HZ2 1 1 3 1530 1 1 34 LYS HZ3 H 8.962 -11.693 -2.258 1.00 . A A . 34 LYS HZ3 1 1 3 1531 1 1 34 LYS N N 9.301 -6.118 1.788 1.00 . A A . 34 LYS N 1 1 3 1532 1 1 34 LYS NZ N 8.121 -11.181 -2.593 1.00 . A A . 34 LYS NZ 1 1 3 1533 1 1 34 LYS O O 7.619 -4.323 -0.110 1.00 . A A . 34 LYS O 1 1 3 1534 1 1 35 GLY C C 10.815 -1.922 -1.493 1.00 . A A . 35 GLY C 1 1 3 1535 1 1 35 GLY CA C 9.531 -2.666 -1.185 1.00 . A A . 35 GLY CA 1 1 3 1536 1 1 35 GLY H H 10.678 -4.378 -0.697 1.00 . A A . 35 GLY H 1 1 3 1537 1 1 35 GLY HA2 H 8.944 -2.739 -2.088 1.00 . A A . 35 GLY HA2 1 1 3 1538 1 1 35 GLY HA3 H 8.973 -2.107 -0.449 1.00 . A A . 35 GLY HA3 1 1 3 1539 1 1 35 GLY N N 9.773 -4.002 -0.673 1.00 . A A . 35 GLY N 1 1 3 1540 1 1 35 GLY O O 11.909 -2.428 -1.240 1.00 . A A . 35 GLY O 1 1 3 1541 1 1 36 TRP C C 12.805 -0.680 -3.283 1.00 . A A . 36 TRP C 1 1 3 1542 1 1 36 TRP CA C 11.843 0.093 -2.387 1.00 . A A . 36 TRP CA 1 1 3 1543 1 1 36 TRP CB C 12.565 0.553 -1.119 1.00 . A A . 36 TRP CB 1 1 3 1544 1 1 36 TRP CD1 C 11.567 2.035 0.719 1.00 . A A . 36 TRP CD1 1 1 3 1545 1 1 36 TRP CD2 C 11.865 3.075 -1.243 1.00 . A A . 36 TRP CD2 1 1 3 1546 1 1 36 TRP CE2 C 11.315 3.992 -0.326 1.00 . A A . 36 TRP CE2 1 1 3 1547 1 1 36 TRP CE3 C 12.140 3.504 -2.543 1.00 . A A . 36 TRP CE3 1 1 3 1548 1 1 36 TRP CG C 12.018 1.829 -0.555 1.00 . A A . 36 TRP CG 1 1 3 1549 1 1 36 TRP CH2 C 11.315 5.706 -1.951 1.00 . A A . 36 TRP CH2 1 1 3 1550 1 1 36 TRP CZ2 C 11.035 5.311 -0.672 1.00 . A A . 36 TRP CZ2 1 1 3 1551 1 1 36 TRP CZ3 C 11.862 4.815 -2.884 1.00 . A A . 36 TRP CZ3 1 1 3 1552 1 1 36 TRP H H 9.785 -0.371 -2.221 1.00 . A A . 36 TRP H 1 1 3 1553 1 1 36 TRP HA H 11.490 0.962 -2.924 1.00 . A A . 36 TRP HA 1 1 3 1554 1 1 36 TRP HB3 H 13.609 0.708 -1.346 1.00 . A A . 36 TRP HB3 1 1 3 1555 1 1 36 TRP HD1 H 11.550 1.277 1.488 1.00 . A A . 36 TRP HD1 1 1 3 1556 1 1 36 TRP HE1 H 10.776 3.723 1.683 1.00 . A A . 36 TRP HE1 1 1 3 1557 1 1 36 TRP HE3 H 12.562 2.833 -3.276 1.00 . A A . 36 TRP HE3 1 1 3 1558 1 1 36 TRP HH2 H 11.112 6.720 -2.262 1.00 . A A . 36 TRP HH2 1 1 3 1559 1 1 36 TRP HZ2 H 10.614 6.011 0.037 1.00 . A A . 36 TRP HZ2 1 1 3 1560 1 1 36 TRP HZ3 H 12.067 5.165 -3.885 1.00 . A A . 36 TRP HZ3 1 1 3 1561 1 1 36 TRP N N 10.683 -0.720 -2.042 1.00 . A A . 36 TRP N 1 1 3 1562 1 1 36 TRP NE1 N 11.142 3.333 0.862 1.00 . A A . 36 TRP NE1 1 1 3 1563 1 1 36 TRP O O 13.569 -0.091 -4.047 1.00 . A A . 36 TRP O 1 1 4 1564 1 1 1 ASP C C -6.706 -10.952 -0.521 1.00 . A A . 1 ASP C 1 1 4 1565 1 1 1 ASP CA C -6.693 -12.438 -0.173 1.00 . A A . 1 ASP CA 1 1 4 1566 1 1 1 ASP CB C -6.906 -13.272 -1.437 1.00 . A A . 1 ASP CB 1 1 4 1567 1 1 1 ASP CG C -6.472 -14.714 -1.258 1.00 . A A . 1 ASP CG 1 1 4 1568 1 1 1 ASP H1 H -7.884 -12.116 1.548 1.00 . A A . 1 ASP H1 1 1 4 1569 1 1 1 ASP HA H -5.733 -12.686 0.253 1.00 . A A . 1 ASP HA 1 1 4 1570 1 1 1 ASP HB3 H -6.336 -12.840 -2.246 1.00 . A A . 1 ASP HB3 1 1 4 1571 1 1 1 ASP N N -7.717 -12.749 0.818 1.00 . A A . 1 ASP N 1 1 4 1572 1 1 1 ASP O O -5.760 -10.225 -0.218 1.00 . A A . 1 ASP O 1 1 4 1573 1 1 1 ASP OD1 O -5.617 -14.972 -0.386 1.00 . A A . 1 ASP OD1 1 1 4 1574 1 1 1 ASP OD2 O -6.987 -15.583 -1.993 1.00 . A A . 1 ASP OD2 1 1 4 1575 1 1 2 PHE C C -6.694 -8.643 -2.331 1.00 . A A . 2 PHE C 1 1 4 1576 1 1 2 PHE CA C -7.919 -9.111 -1.551 1.00 . A A . 2 PHE CA 1 1 4 1577 1 1 2 PHE CB C -8.119 -8.231 -0.316 1.00 . A A . 2 PHE CB 1 1 4 1578 1 1 2 PHE CD1 C -10.448 -8.937 0.295 1.00 . A A . 2 PHE CD1 1 1 4 1579 1 1 2 PHE CD2 C -8.732 -9.148 1.937 1.00 . A A . 2 PHE CD2 1 1 4 1580 1 1 2 PHE CE1 C -11.370 -9.444 1.189 1.00 . A A . 2 PHE CE1 1 1 4 1581 1 1 2 PHE CE2 C -9.651 -9.656 2.837 1.00 . A A . 2 PHE CE2 1 1 4 1582 1 1 2 PHE CG C -9.120 -8.783 0.658 1.00 . A A . 2 PHE CG 1 1 4 1583 1 1 2 PHE CZ C -10.971 -9.805 2.462 1.00 . A A . 2 PHE CZ 1 1 4 1584 1 1 2 PHE H H -8.505 -11.138 -1.375 1.00 . A A . 2 PHE H 1 1 4 1585 1 1 2 PHE HA H -8.788 -9.028 -2.186 1.00 . A A . 2 PHE HA 1 1 4 1586 1 1 2 PHE HB3 H -8.461 -7.255 -0.630 1.00 . A A . 2 PHE HB3 1 1 4 1587 1 1 2 PHE HD1 H -10.761 -8.656 -0.700 1.00 . A A . 2 PHE HD1 1 1 4 1588 1 1 2 PHE HD2 H -7.699 -9.032 2.232 1.00 . A A . 2 PHE HD2 1 1 4 1589 1 1 2 PHE HE1 H -12.403 -9.560 0.894 1.00 . A A . 2 PHE HE1 1 1 4 1590 1 1 2 PHE HE2 H -9.335 -9.938 3.830 1.00 . A A . 2 PHE HE2 1 1 4 1591 1 1 2 PHE HZ H -11.691 -10.202 3.163 1.00 . A A . 2 PHE HZ 1 1 4 1592 1 1 2 PHE N N -7.784 -10.509 -1.160 1.00 . A A . 2 PHE N 1 1 4 1593 1 1 2 PHE O O -5.847 -7.908 -1.823 1.00 . A A . 2 PHE O 1 1 4 1594 1 1 3 PRO C C -5.510 -7.249 -4.878 1.00 . A A . 3 PRO C 1 1 4 1595 1 1 3 PRO CA C -5.478 -8.718 -4.473 1.00 . A A . 3 PRO CA 1 1 4 1596 1 1 3 PRO CB C -5.683 -9.615 -5.696 1.00 . A A . 3 PRO CB 1 1 4 1597 1 1 3 PRO CD C -7.568 -9.958 -4.267 1.00 . A A . 3 PRO CD 1 1 4 1598 1 1 3 PRO CG C -7.142 -9.911 -5.708 1.00 . A A . 3 PRO CG 1 1 4 1599 1 1 3 PRO HA H -4.525 -8.943 -4.016 1.00 . A A . 3 PRO HA 1 1 4 1600 1 1 3 PRO HB3 H -5.099 -10.517 -5.588 1.00 . A A . 3 PRO HB3 1 1 4 1601 1 1 3 PRO HD3 H -7.502 -10.966 -3.886 1.00 . A A . 3 PRO HD3 1 1 4 1602 1 1 3 PRO HG3 H -7.320 -10.866 -6.181 1.00 . A A . 3 PRO HG3 1 1 4 1603 1 1 3 PRO N N -6.595 -9.079 -3.596 1.00 . A A . 3 PRO N 1 1 4 1604 1 1 3 PRO O O -5.922 -6.910 -5.989 1.00 . A A . 3 PRO O 1 1 4 1605 1 1 4 LEU C C -3.643 -4.475 -4.578 1.00 . A A . 4 LEU C 1 1 4 1606 1 1 4 LEU CA C -5.053 -4.946 -4.238 1.00 . A A . 4 LEU CA 1 1 4 1607 1 1 4 LEU CB C -5.580 -4.176 -3.025 1.00 . A A . 4 LEU CB 1 1 4 1608 1 1 4 LEU CD1 C -4.263 -2.874 -1.334 1.00 . A A . 4 LEU CD1 1 1 4 1609 1 1 4 LEU CD2 C -5.511 -4.926 -0.633 1.00 . A A . 4 LEU CD2 1 1 4 1610 1 1 4 LEU CG C -4.730 -4.259 -1.755 1.00 . A A . 4 LEU CG 1 1 4 1611 1 1 4 LEU H H -4.760 -6.710 -3.106 1.00 . A A . 4 LEU H 1 1 4 1612 1 1 4 LEU HA H -5.698 -4.755 -5.082 1.00 . A A . 4 LEU HA 1 1 4 1613 1 1 4 LEU HB3 H -6.563 -4.560 -2.791 1.00 . A A . 4 LEU HB3 1 1 4 1614 1 1 4 LEU HD11 H -3.262 -2.938 -0.935 1.00 . A A . 4 LEU HD11 1 1 4 1615 1 1 4 LEU HD12 H -4.928 -2.486 -0.578 1.00 . A A . 4 LEU HD12 1 1 4 1616 1 1 4 LEU HD13 H -4.270 -2.216 -2.191 1.00 . A A . 4 LEU HD13 1 1 4 1617 1 1 4 LEU HD21 H -4.826 -5.270 0.127 1.00 . A A . 4 LEU HD21 1 1 4 1618 1 1 4 LEU HD22 H -6.063 -5.766 -1.029 1.00 . A A . 4 LEU HD22 1 1 4 1619 1 1 4 LEU HD23 H -6.200 -4.214 -0.203 1.00 . A A . 4 LEU HD23 1 1 4 1620 1 1 4 LEU HG H -3.853 -4.860 -1.956 1.00 . A A . 4 LEU HG 1 1 4 1621 1 1 4 LEU N N -5.074 -6.380 -3.973 1.00 . A A . 4 LEU N 1 1 4 1622 1 1 4 LEU O O -2.739 -5.287 -4.776 1.00 . A A . 4 LEU O 1 1 4 1623 1 1 5 SER C C -1.076 -3.156 -4.060 1.00 . A A . 5 SER C 1 1 4 1624 1 1 5 SER CA C -2.162 -2.582 -4.964 1.00 . A A . 5 SER CA 1 1 4 1625 1 1 5 SER CB C -2.209 -1.059 -4.820 1.00 . A A . 5 SER CB 1 1 4 1626 1 1 5 SER H H -4.223 -2.565 -4.476 1.00 . A A . 5 SER H 1 1 4 1627 1 1 5 SER HA H -1.932 -2.832 -5.988 1.00 . A A . 5 SER HA 1 1 4 1628 1 1 5 SER HB3 H -1.282 -0.713 -4.385 1.00 . A A . 5 SER HB3 1 1 4 1629 1 1 5 SER HG H -3.277 -0.087 -6.144 1.00 . A A . 5 SER HG 1 1 4 1630 1 1 5 SER N N -3.462 -3.160 -4.645 1.00 . A A . 5 SER N 1 1 4 1631 1 1 5 SER O O -1.365 -3.848 -3.084 1.00 . A A . 5 SER O 1 1 4 1632 1 1 5 SER OG O -2.384 -0.434 -6.080 1.00 . A A . 5 SER OG 1 1 4 1633 1 1 6 LYS C C 2.161 -2.186 -3.110 1.00 . A A . 6 LYS C 1 1 4 1634 1 1 6 LYS CA C 1.309 -3.349 -3.612 1.00 . A A . 6 LYS CA 1 1 4 1635 1 1 6 LYS CB C 2.166 -4.297 -4.453 1.00 . A A . 6 LYS CB 1 1 4 1636 1 1 6 LYS CD C 2.335 -6.483 -5.679 1.00 . A A . 6 LYS CD 1 1 4 1637 1 1 6 LYS CE C 2.982 -7.494 -4.744 1.00 . A A . 6 LYS CE 1 1 4 1638 1 1 6 LYS CG C 1.420 -5.533 -4.925 1.00 . A A . 6 LYS CG 1 1 4 1639 1 1 6 LYS H H 0.343 -2.306 -5.182 1.00 . A A . 6 LYS H 1 1 4 1640 1 1 6 LYS HA H 0.920 -3.887 -2.761 1.00 . A A . 6 LYS HA 1 1 4 1641 1 1 6 LYS HB3 H 3.013 -4.617 -3.862 1.00 . A A . 6 LYS HB3 1 1 4 1642 1 1 6 LYS HD3 H 3.111 -5.910 -6.167 1.00 . A A . 6 LYS HD3 1 1 4 1643 1 1 6 LYS HE3 H 2.410 -8.409 -4.774 1.00 . A A . 6 LYS HE3 1 1 4 1644 1 1 6 LYS HG3 H 0.615 -5.228 -5.579 1.00 . A A . 6 LYS HG3 1 1 4 1645 1 1 6 LYS HZ1 H 4.758 -8.579 -4.568 1.00 . A A . 6 LYS HZ1 1 1 4 1646 1 1 6 LYS HZ2 H 4.986 -6.952 -4.969 1.00 . A A . 6 LYS HZ2 1 1 4 1647 1 1 6 LYS HZ3 H 4.436 -8.042 -6.139 1.00 . A A . 6 LYS HZ3 1 1 4 1648 1 1 6 LYS N N 0.176 -2.864 -4.392 1.00 . A A . 6 LYS N 1 1 4 1649 1 1 6 LYS NZ N 4.388 -7.788 -5.133 1.00 . A A . 6 LYS NZ 1 1 4 1650 1 1 6 LYS O O 1.793 -1.023 -3.267 1.00 . A A . 6 LYS O 1 1 4 1651 1 1 7 GLU C C 4.475 -0.416 -3.032 1.00 . A A . 7 GLU C 1 1 4 1652 1 1 7 GLU CA C 4.205 -1.493 -1.985 1.00 . A A . 7 GLU CA 1 1 4 1653 1 1 7 GLU CB C 5.524 -2.130 -1.541 1.00 . A A . 7 GLU CB 1 1 4 1654 1 1 7 GLU CD C 7.477 -1.742 0.014 1.00 . A A . 7 GLU CD 1 1 4 1655 1 1 7 GLU CG C 6.532 -1.129 -1.002 1.00 . A A . 7 GLU CG 1 1 4 1656 1 1 7 GLU H H 3.540 -3.457 -2.414 1.00 . A A . 7 GLU H 1 1 4 1657 1 1 7 GLU HA H 3.731 -1.037 -1.130 1.00 . A A . 7 GLU HA 1 1 4 1658 1 1 7 GLU HB3 H 5.967 -2.636 -2.386 1.00 . A A . 7 GLU HB3 1 1 4 1659 1 1 7 GLU HG3 H 5.998 -0.317 -0.532 1.00 . A A . 7 GLU HG3 1 1 4 1660 1 1 7 GLU N N 3.301 -2.512 -2.509 1.00 . A A . 7 GLU N 1 1 4 1661 1 1 7 GLU O O 4.667 -0.714 -4.210 1.00 . A A . 7 GLU O 1 1 4 1662 1 1 7 GLU OE1 O 7.470 -2.982 0.159 1.00 . A A . 7 GLU OE1 1 1 4 1663 1 1 7 GLU OE2 O 8.222 -0.980 0.664 1.00 . A A . 7 GLU OE2 1 1 4 1664 1 1 8 TYR C C 3.630 2.066 -4.541 1.00 . A A . 8 TYR C 1 1 4 1665 1 1 8 TYR CA C 4.730 1.961 -3.489 1.00 . A A . 8 TYR CA 1 1 4 1666 1 1 8 TYR CB C 6.091 1.809 -4.171 1.00 . A A . 8 TYR CB 1 1 4 1667 1 1 8 TYR CD1 C 7.324 3.981 -3.804 1.00 . A A . 8 TYR CD1 1 1 4 1668 1 1 8 TYR CD2 C 6.554 3.484 -6.005 1.00 . A A . 8 TYR CD2 1 1 4 1669 1 1 8 TYR CE1 C 7.851 5.177 -4.253 1.00 . A A . 8 TYR CE1 1 1 4 1670 1 1 8 TYR CE2 C 7.080 4.676 -6.462 1.00 . A A . 8 TYR CE2 1 1 4 1671 1 1 8 TYR CG C 6.667 3.116 -4.669 1.00 . A A . 8 TYR CG 1 1 4 1672 1 1 8 TYR CZ C 7.727 5.520 -5.583 1.00 . A A . 8 TYR CZ 1 1 4 1673 1 1 8 TYR H H 4.327 1.012 -1.640 1.00 . A A . 8 TYR H 1 1 4 1674 1 1 8 TYR HA H 4.734 2.864 -2.897 1.00 . A A . 8 TYR HA 1 1 4 1675 1 1 8 TYR HB3 H 5.990 1.147 -5.020 1.00 . A A . 8 TYR HB3 1 1 4 1676 1 1 8 TYR HD1 H 7.420 3.710 -2.762 1.00 . A A . 8 TYR HD1 1 1 4 1677 1 1 8 TYR HD2 H 6.046 2.822 -6.690 1.00 . A A . 8 TYR HD2 1 1 4 1678 1 1 8 TYR HE1 H 8.359 5.837 -3.566 1.00 . A A . 8 TYR HE1 1 1 4 1679 1 1 8 TYR HE2 H 6.982 4.946 -7.504 1.00 . A A . 8 TYR HE2 1 1 4 1680 1 1 8 TYR HH H 7.606 7.409 -5.915 1.00 . A A . 8 TYR HH 1 1 4 1681 1 1 8 TYR N N 4.487 0.837 -2.592 1.00 . A A . 8 TYR N 1 1 4 1682 1 1 8 TYR O O 3.838 1.732 -5.707 1.00 . A A . 8 TYR O 1 1 4 1683 1 1 8 TYR OH O 8.251 6.708 -6.036 1.00 . A A . 8 TYR OH 1 1 4 1684 1 1 9 GLU C C 0.188 3.443 -4.349 1.00 . A A . 9 GLU C 1 1 4 1685 1 1 9 GLU CA C 1.325 2.681 -5.023 1.00 . A A . 9 GLU CA 1 1 4 1686 1 1 9 GLU CB C 0.832 1.310 -5.488 1.00 . A A . 9 GLU CB 1 1 4 1687 1 1 9 GLU CD C 2.186 0.026 -7.191 1.00 . A A . 9 GLU CD 1 1 4 1688 1 1 9 GLU CG C 1.082 1.040 -6.962 1.00 . A A . 9 GLU CG 1 1 4 1689 1 1 9 GLU H H 2.355 2.781 -3.176 1.00 . A A . 9 GLU H 1 1 4 1690 1 1 9 GLU HA H 1.659 3.244 -5.882 1.00 . A A . 9 GLU HA 1 1 4 1691 1 1 9 GLU HB3 H -0.231 1.244 -5.307 1.00 . A A . 9 GLU HB3 1 1 4 1692 1 1 9 GLU HG3 H 1.359 1.967 -7.443 1.00 . A A . 9 GLU HG3 1 1 4 1693 1 1 9 GLU N N 2.459 2.532 -4.118 1.00 . A A . 9 GLU N 1 1 4 1694 1 1 9 GLU O O -0.073 4.603 -4.666 1.00 . A A . 9 GLU O 1 1 4 1695 1 1 9 GLU OE1 O 2.062 -1.109 -6.685 1.00 . A A . 9 GLU OE1 1 1 4 1696 1 1 9 GLU OE2 O 3.174 0.368 -7.873 1.00 . A A . 9 GLU OE2 1 1 4 1697 1 1 10 THR C C -2.102 2.479 -1.582 1.00 . A A . 10 THR C 1 1 4 1698 1 1 10 THR CA C -1.600 3.389 -2.697 1.00 . A A . 10 THR CA 1 1 4 1699 1 1 10 THR CB C -2.770 3.715 -3.644 1.00 . A A . 10 THR CB 1 1 4 1700 1 1 10 THR CG2 C -2.928 5.219 -3.812 1.00 . A A . 10 THR CG2 1 1 4 1701 1 1 10 THR H H -0.233 1.856 -3.207 1.00 . A A . 10 THR H 1 1 4 1702 1 1 10 THR HA H -1.247 4.315 -2.263 1.00 . A A . 10 THR HA 1 1 4 1703 1 1 10 THR HB H -3.679 3.318 -3.217 1.00 . A A . 10 THR HB 1 1 4 1704 1 1 10 THR HG1 H -3.255 3.362 -5.522 1.00 . A A . 10 THR HG1 1 1 4 1705 1 1 10 THR HG21 H -2.027 5.715 -3.483 1.00 . A A . 10 THR HG21 1 1 4 1706 1 1 10 THR HG22 H -3.763 5.562 -3.220 1.00 . A A . 10 THR HG22 1 1 4 1707 1 1 10 THR HG23 H -3.105 5.448 -4.852 1.00 . A A . 10 THR HG23 1 1 4 1708 1 1 10 THR N N -0.489 2.778 -3.416 1.00 . A A . 10 THR N 1 1 4 1709 1 1 10 THR O O -1.577 1.384 -1.378 1.00 . A A . 10 THR O 1 1 4 1710 1 1 10 THR OG1 O -2.549 3.108 -4.922 1.00 . A A . 10 THR OG1 1 1 4 1711 1 1 11 CYS C C -4.852 2.916 0.881 1.00 . A A . 11 CYS C 1 1 4 1712 1 1 11 CYS CA C -3.693 2.165 0.232 1.00 . A A . 11 CYS CA 1 1 4 1713 1 1 11 CYS CB C -2.622 1.854 1.280 1.00 . A A . 11 CYS CB 1 1 4 1714 1 1 11 CYS H H -3.495 3.820 -1.073 1.00 . A A . 11 CYS H 1 1 4 1715 1 1 11 CYS HA H -4.065 1.238 -0.176 1.00 . A A . 11 CYS HA 1 1 4 1716 1 1 11 CYS HB3 H -1.935 1.125 0.877 1.00 . A A . 11 CYS HB3 1 1 4 1717 1 1 11 CYS N N -3.120 2.938 -0.862 1.00 . A A . 11 CYS N 1 1 4 1718 1 1 11 CYS O O -4.740 3.402 2.006 1.00 . A A . 11 CYS O 1 1 4 1719 1 1 11 CYS SG S -1.651 3.303 1.803 1.00 . A A . 11 CYS SG 1 1 4 1720 1 1 12 VAL C C -7.989 2.779 1.542 1.00 . A A . 12 VAL C 1 1 4 1721 1 1 12 VAL CA C -7.147 3.700 0.666 1.00 . A A . 12 VAL CA 1 1 4 1722 1 1 12 VAL CB C -8.019 4.235 -0.486 1.00 . A A . 12 VAL CB 1 1 4 1723 1 1 12 VAL CG1 C -7.313 5.372 -1.207 1.00 . A A . 12 VAL CG1 1 1 4 1724 1 1 12 VAL CG2 C -8.368 3.114 -1.453 1.00 . A A . 12 VAL CG2 1 1 4 1725 1 1 12 VAL H H -5.995 2.602 -0.730 1.00 . A A . 12 VAL H 1 1 4 1726 1 1 12 VAL HA H -6.814 4.540 1.258 1.00 . A A . 12 VAL HA 1 1 4 1727 1 1 12 VAL HB H -8.937 4.619 -0.066 1.00 . A A . 12 VAL HB 1 1 4 1728 1 1 12 VAL HG11 H -6.489 4.978 -1.783 1.00 . A A . 12 VAL HG11 1 1 4 1729 1 1 12 VAL HG12 H -8.009 5.870 -1.866 1.00 . A A . 12 VAL HG12 1 1 4 1730 1 1 12 VAL HG13 H -6.937 6.079 -0.481 1.00 . A A . 12 VAL HG13 1 1 4 1731 1 1 12 VAL HG21 H -8.332 2.167 -0.936 1.00 . A A . 12 VAL HG21 1 1 4 1732 1 1 12 VAL HG22 H -9.362 3.275 -1.845 1.00 . A A . 12 VAL HG22 1 1 4 1733 1 1 12 VAL HG23 H -7.658 3.107 -2.267 1.00 . A A . 12 VAL HG23 1 1 4 1734 1 1 12 VAL N N -5.966 3.009 0.161 1.00 . A A . 12 VAL N 1 1 4 1735 1 1 12 VAL O O -7.624 1.629 1.783 1.00 . A A . 12 VAL O 1 1 4 1736 1 1 13 ARG C C -10.445 1.231 2.171 1.00 . A A . 13 ARG C 1 1 4 1737 1 1 13 ARG CA C -10.014 2.519 2.867 1.00 . A A . 13 ARG CA 1 1 4 1738 1 1 13 ARG CB C -11.244 3.348 3.238 1.00 . A A . 13 ARG CB 1 1 4 1739 1 1 13 ARG CD C -12.530 4.571 5.019 1.00 . A A . 13 ARG CD 1 1 4 1740 1 1 13 ARG CG C -11.302 3.731 4.708 1.00 . A A . 13 ARG CG 1 1 4 1741 1 1 13 ARG CZ C -13.070 6.762 5.994 1.00 . A A . 13 ARG CZ 1 1 4 1742 1 1 13 ARG H H -9.356 4.218 1.790 1.00 . A A . 13 ARG H 1 1 4 1743 1 1 13 ARG HA H -9.477 2.265 3.769 1.00 . A A . 13 ARG HA 1 1 4 1744 1 1 13 ARG HB3 H -12.131 2.779 3.003 1.00 . A A . 13 ARG HB3 1 1 4 1745 1 1 13 ARG HD3 H -13.145 4.038 5.728 1.00 . A A . 13 ARG HD3 1 1 4 1746 1 1 13 ARG HE H -11.223 6.091 5.652 1.00 . A A . 13 ARG HE 1 1 4 1747 1 1 13 ARG HG3 H -10.416 4.296 4.957 1.00 . A A . 13 ARG HG3 1 1 4 1748 1 1 13 ARG HH11 H -14.671 5.618 5.533 1.00 . A A . 13 ARG HH11 1 1 4 1749 1 1 13 ARG HH12 H -15.037 7.166 6.223 1.00 . A A . 13 ARG HH12 1 1 4 1750 1 1 13 ARG HH21 H -11.694 8.130 6.560 1.00 . A A . 13 ARG HH21 1 1 4 1751 1 1 13 ARG HH22 H -13.344 8.593 6.806 1.00 . A A . 13 ARG HH22 1 1 4 1752 1 1 13 ARG N N -9.119 3.295 2.016 1.00 . A A . 13 ARG N 1 1 4 1753 1 1 13 ARG NE N -12.175 5.872 5.580 1.00 . A A . 13 ARG NE 1 1 4 1754 1 1 13 ARG NH1 N -14.366 6.494 5.909 1.00 . A A . 13 ARG NH1 1 1 4 1755 1 1 13 ARG NH2 N -12.670 7.924 6.495 1.00 . A A . 13 ARG NH2 1 1 4 1756 1 1 13 ARG O O -10.199 0.126 2.652 1.00 . A A . 13 ARG O 1 1 4 1757 1 1 14 PRO C C -10.443 -0.550 -0.409 1.00 . A A . 14 PRO C 1 1 4 1758 1 1 14 PRO CA C -11.584 0.237 0.226 1.00 . A A . 14 PRO CA 1 1 4 1759 1 1 14 PRO CB C -12.450 0.890 -0.854 1.00 . A A . 14 PRO CB 1 1 4 1760 1 1 14 PRO CD C -11.432 2.666 0.380 1.00 . A A . 14 PRO CD 1 1 4 1761 1 1 14 PRO CG C -11.907 2.272 -0.991 1.00 . A A . 14 PRO CG 1 1 4 1762 1 1 14 PRO HA H -12.191 -0.429 0.822 1.00 . A A . 14 PRO HA 1 1 4 1763 1 1 14 PRO HB3 H -13.481 0.901 -0.537 1.00 . A A . 14 PRO HB3 1 1 4 1764 1 1 14 PRO HD3 H -12.219 3.172 0.921 1.00 . A A . 14 PRO HD3 1 1 4 1765 1 1 14 PRO HG3 H -12.687 2.940 -1.324 1.00 . A A . 14 PRO HG3 1 1 4 1766 1 1 14 PRO N N -11.104 1.378 1.013 1.00 . A A . 14 PRO N 1 1 4 1767 1 1 14 PRO O O -10.659 -1.609 -0.998 1.00 . A A . 14 PRO O 1 1 4 1768 1 1 15 ARG C C -6.890 -0.655 0.141 1.00 . A A . 15 ARG C 1 1 4 1769 1 1 15 ARG CA C -8.053 -0.681 -0.847 1.00 . A A . 15 ARG CA 1 1 4 1770 1 1 15 ARG CB C -7.640 0.001 -2.154 1.00 . A A . 15 ARG CB 1 1 4 1771 1 1 15 ARG CD C -7.680 -0.651 -4.580 1.00 . A A . 15 ARG CD 1 1 4 1772 1 1 15 ARG CG C -7.115 -0.964 -3.205 1.00 . A A . 15 ARG CG 1 1 4 1773 1 1 15 ARG CZ C -9.141 -2.596 -4.943 1.00 . A A . 15 ARG CZ 1 1 4 1774 1 1 15 ARG H H -9.119 0.820 0.196 1.00 . A A . 15 ARG H 1 1 4 1775 1 1 15 ARG HA H -8.312 -1.708 -1.054 1.00 . A A . 15 ARG HA 1 1 4 1776 1 1 15 ARG HB3 H -6.866 0.723 -1.941 1.00 . A A . 15 ARG HB3 1 1 4 1777 1 1 15 ARG HD3 H -6.988 -1.007 -5.329 1.00 . A A . 15 ARG HD3 1 1 4 1778 1 1 15 ARG HE H -9.766 -0.704 -4.833 1.00 . A A . 15 ARG HE 1 1 4 1779 1 1 15 ARG HG3 H -7.396 -1.970 -2.928 1.00 . A A . 15 ARG HG3 1 1 4 1780 1 1 15 ARG HH11 H -7.178 -3.031 -4.752 1.00 . A A . 15 ARG HH11 1 1 4 1781 1 1 15 ARG HH12 H -8.218 -4.393 -5.008 1.00 . A A . 15 ARG HH12 1 1 4 1782 1 1 15 ARG HH21 H -11.147 -2.489 -5.170 1.00 . A A . 15 ARG HH21 1 1 4 1783 1 1 15 ARG HH22 H -10.477 -4.083 -5.246 1.00 . A A . 15 ARG HH22 1 1 4 1784 1 1 15 ARG N N -9.228 -0.026 -0.284 1.00 . A A . 15 ARG N 1 1 4 1785 1 1 15 ARG NE N -8.978 -1.286 -4.796 1.00 . A A . 15 ARG NE 1 1 4 1786 1 1 15 ARG NH1 N -8.094 -3.406 -4.898 1.00 . A A . 15 ARG NH1 1 1 4 1787 1 1 15 ARG NH2 N -10.354 -3.097 -5.136 1.00 . A A . 15 ARG NH2 1 1 4 1788 1 1 15 ARG O O -5.770 -0.288 -0.211 1.00 . A A . 15 ARG O 1 1 4 1789 1 1 16 LYS C C -5.086 -2.126 2.121 1.00 . A A . 16 LYS C 1 1 4 1790 1 1 16 LYS CA C -6.145 -1.070 2.420 1.00 . A A . 16 LYS CA 1 1 4 1791 1 1 16 LYS CB C -6.782 -1.346 3.784 1.00 . A A . 16 LYS CB 1 1 4 1792 1 1 16 LYS CD C -6.947 -0.741 6.216 1.00 . A A . 16 LYS CD 1 1 4 1793 1 1 16 LYS CE C -7.097 0.512 7.066 1.00 . A A . 16 LYS CE 1 1 4 1794 1 1 16 LYS CG C -6.275 -0.436 4.889 1.00 . A A . 16 LYS CG 1 1 4 1795 1 1 16 LYS H H -8.080 -1.328 1.601 1.00 . A A . 16 LYS H 1 1 4 1796 1 1 16 LYS HA H -5.672 -0.100 2.444 1.00 . A A . 16 LYS HA 1 1 4 1797 1 1 16 LYS HB3 H -6.575 -2.369 4.064 1.00 . A A . 16 LYS HB3 1 1 4 1798 1 1 16 LYS HD3 H -6.350 -1.462 6.756 1.00 . A A . 16 LYS HD3 1 1 4 1799 1 1 16 LYS HE3 H -6.507 1.302 6.625 1.00 . A A . 16 LYS HE3 1 1 4 1800 1 1 16 LYS HG3 H -6.478 0.591 4.619 1.00 . A A . 16 LYS HG3 1 1 4 1801 1 1 16 LYS HZ1 H -8.785 1.463 6.286 1.00 . A A . 16 LYS HZ1 1 1 4 1802 1 1 16 LYS HZ2 H -8.640 1.593 7.967 1.00 . A A . 16 LYS HZ2 1 1 4 1803 1 1 16 LYS HZ3 H -9.141 0.135 7.271 1.00 . A A . 16 LYS HZ3 1 1 4 1804 1 1 16 LYS N N -7.166 -1.046 1.380 1.00 . A A . 16 LYS N 1 1 4 1805 1 1 16 LYS NZ N -8.515 0.957 7.153 1.00 . A A . 16 LYS NZ 1 1 4 1806 1 1 16 LYS O O -5.407 -3.246 1.723 1.00 . A A . 16 LYS O 1 1 4 1807 1 1 17 CYS C C -2.947 -4.013 2.765 1.00 . A A . 17 CYS C 1 1 4 1808 1 1 17 CYS CA C -2.716 -2.677 2.064 1.00 . A A . 17 CYS CA 1 1 4 1809 1 1 17 CYS CB C -1.399 -2.060 2.539 1.00 . A A . 17 CYS CB 1 1 4 1810 1 1 17 CYS H H -3.630 -0.854 2.631 1.00 . A A . 17 CYS H 1 1 4 1811 1 1 17 CYS HA H -2.660 -2.848 0.999 1.00 . A A . 17 CYS HA 1 1 4 1812 1 1 17 CYS HB3 H -0.774 -2.838 2.951 1.00 . A A . 17 CYS HB3 1 1 4 1813 1 1 17 CYS N N -3.822 -1.762 2.313 1.00 . A A . 17 CYS N 1 1 4 1814 1 1 17 CYS O O -2.954 -4.087 3.993 1.00 . A A . 17 CYS O 1 1 4 1815 1 1 17 CYS SG S -0.453 -1.225 1.225 1.00 . A A . 17 CYS SG 1 1 4 1816 1 1 18 GLN C C -2.140 -6.894 3.281 1.00 . A A . 18 GLN C 1 1 4 1817 1 1 18 GLN CA C -3.364 -6.398 2.520 1.00 . A A . 18 GLN CA 1 1 4 1818 1 1 18 GLN CB C -3.714 -7.377 1.399 1.00 . A A . 18 GLN CB 1 1 4 1819 1 1 18 GLN CD C -2.135 -9.343 1.260 1.00 . A A . 18 GLN CD 1 1 4 1820 1 1 18 GLN CG C -3.470 -8.832 1.763 1.00 . A A . 18 GLN CG 1 1 4 1821 1 1 18 GLN H H -3.116 -4.942 1.003 1.00 . A A . 18 GLN H 1 1 4 1822 1 1 18 GLN HA H -4.197 -6.336 3.205 1.00 . A A . 18 GLN HA 1 1 4 1823 1 1 18 GLN HB3 H -3.116 -7.141 0.531 1.00 . A A . 18 GLN HB3 1 1 4 1824 1 1 18 GLN HE21 H -2.791 -9.284 -0.616 1.00 . A A . 18 GLN HE21 1 1 4 1825 1 1 18 GLN HE22 H -1.167 -9.831 -0.407 1.00 . A A . 18 GLN HE22 1 1 4 1826 1 1 18 GLN HG3 H -4.255 -9.435 1.332 1.00 . A A . 18 GLN HG3 1 1 4 1827 1 1 18 GLN N N -3.133 -5.065 1.975 1.00 . A A . 18 GLN N 1 1 4 1828 1 1 18 GLN NE2 N -2.019 -9.503 -0.054 1.00 . A A . 18 GLN NE2 1 1 4 1829 1 1 18 GLN O O -2.217 -7.270 4.451 1.00 . A A . 18 GLN O 1 1 4 1830 1 1 18 GLN OE1 O -1.217 -9.592 2.042 1.00 . A A . 18 GLN OE1 1 1 4 1831 1 1 19 PRO C C 0.795 -6.383 4.263 1.00 . A A . 19 PRO C 1 1 4 1832 1 1 19 PRO CA C 0.281 -7.346 3.196 1.00 . A A . 19 PRO CA 1 1 4 1833 1 1 19 PRO CB C 1.239 -7.384 2.003 1.00 . A A . 19 PRO CB 1 1 4 1834 1 1 19 PRO CD C -0.818 -6.463 1.206 1.00 . A A . 19 PRO CD 1 1 4 1835 1 1 19 PRO CG C 0.674 -6.404 1.033 1.00 . A A . 19 PRO CG 1 1 4 1836 1 1 19 PRO HA H 0.192 -8.335 3.620 1.00 . A A . 19 PRO HA 1 1 4 1837 1 1 19 PRO HB3 H 1.264 -8.379 1.589 1.00 . A A . 19 PRO HB3 1 1 4 1838 1 1 19 PRO HD3 H -1.249 -7.184 0.526 1.00 . A A . 19 PRO HD3 1 1 4 1839 1 1 19 PRO HG3 H 0.946 -6.686 0.027 1.00 . A A . 19 PRO HG3 1 1 4 1840 1 1 19 PRO N N -0.982 -6.897 2.604 1.00 . A A . 19 PRO N 1 1 4 1841 1 1 19 PRO O O 0.286 -5.274 4.429 1.00 . A A . 19 PRO O 1 1 4 1842 1 1 20 PRO C C 3.200 -4.808 5.514 1.00 . A A . 20 PRO C 1 1 4 1843 1 1 20 PRO CA C 2.433 -6.006 6.064 1.00 . A A . 20 PRO CA 1 1 4 1844 1 1 20 PRO CB C 3.388 -6.983 6.753 1.00 . A A . 20 PRO CB 1 1 4 1845 1 1 20 PRO CD C 2.483 -8.125 4.858 1.00 . A A . 20 PRO CD 1 1 4 1846 1 1 20 PRO CG C 3.717 -7.992 5.707 1.00 . A A . 20 PRO CG 1 1 4 1847 1 1 20 PRO HA H 1.693 -5.663 6.773 1.00 . A A . 20 PRO HA 1 1 4 1848 1 1 20 PRO HB3 H 2.896 -7.437 7.599 1.00 . A A . 20 PRO HB3 1 1 4 1849 1 1 20 PRO HD3 H 1.850 -8.916 5.233 1.00 . A A . 20 PRO HD3 1 1 4 1850 1 1 20 PRO HG3 H 3.955 -8.937 6.172 1.00 . A A . 20 PRO HG3 1 1 4 1851 1 1 20 PRO N N 1.827 -6.815 5.002 1.00 . A A . 20 PRO N 1 1 4 1852 1 1 20 PRO O O 4.431 -4.807 5.487 1.00 . A A . 20 PRO O 1 1 4 1853 1 1 21 LEU C C 2.888 -1.401 5.472 1.00 . A A . 21 LEU C 1 1 4 1854 1 1 21 LEU CA C 3.078 -2.585 4.530 1.00 . A A . 21 LEU CA 1 1 4 1855 1 1 21 LEU CB C 2.478 -2.263 3.160 1.00 . A A . 21 LEU CB 1 1 4 1856 1 1 21 LEU CD1 C 4.465 -2.370 1.636 1.00 . A A . 21 LEU CD1 1 1 4 1857 1 1 21 LEU CD2 C 3.248 -4.469 2.247 1.00 . A A . 21 LEU CD2 1 1 4 1858 1 1 21 LEU CG C 3.111 -2.979 1.966 1.00 . A A . 21 LEU CG 1 1 4 1859 1 1 21 LEU H H 1.489 -3.850 5.126 1.00 . A A . 21 LEU H 1 1 4 1860 1 1 21 LEU HA H 4.135 -2.773 4.416 1.00 . A A . 21 LEU HA 1 1 4 1861 1 1 21 LEU HB3 H 2.575 -1.200 2.999 1.00 . A A . 21 LEU HB3 1 1 4 1862 1 1 21 LEU HD11 H 5.141 -3.148 1.313 1.00 . A A . 21 LEU HD11 1 1 4 1863 1 1 21 LEU HD12 H 4.866 -1.886 2.514 1.00 . A A . 21 LEU HD12 1 1 4 1864 1 1 21 LEU HD13 H 4.350 -1.643 0.845 1.00 . A A . 21 LEU HD13 1 1 4 1865 1 1 21 LEU HD21 H 2.338 -4.835 2.696 1.00 . A A . 21 LEU HD21 1 1 4 1866 1 1 21 LEU HD22 H 4.076 -4.632 2.921 1.00 . A A . 21 LEU HD22 1 1 4 1867 1 1 21 LEU HD23 H 3.430 -4.994 1.321 1.00 . A A . 21 LEU HD23 1 1 4 1868 1 1 21 LEU HG H 2.473 -2.858 1.102 1.00 . A A . 21 LEU HG 1 1 4 1869 1 1 21 LEU N N 2.466 -3.791 5.078 1.00 . A A . 21 LEU N 1 1 4 1870 1 1 21 LEU O O 2.273 -1.528 6.531 1.00 . A A . 21 LEU O 1 1 4 1871 1 1 22 LYS C C 3.104 2.189 4.999 1.00 . A A . 22 LYS C 1 1 4 1872 1 1 22 LYS CA C 3.302 0.962 5.883 1.00 . A A . 22 LYS CA 1 1 4 1873 1 1 22 LYS CB C 4.550 1.141 6.750 1.00 . A A . 22 LYS CB 1 1 4 1874 1 1 22 LYS CD C 4.983 1.377 9.213 1.00 . A A . 22 LYS CD 1 1 4 1875 1 1 22 LYS CE C 4.034 0.464 9.975 1.00 . A A . 22 LYS CE 1 1 4 1876 1 1 22 LYS CG C 4.313 1.983 7.993 1.00 . A A . 22 LYS CG 1 1 4 1877 1 1 22 LYS H H 3.893 -0.208 4.222 1.00 . A A . 22 LYS H 1 1 4 1878 1 1 22 LYS HA H 2.441 0.853 6.525 1.00 . A A . 22 LYS HA 1 1 4 1879 1 1 22 LYS HB3 H 5.319 1.619 6.159 1.00 . A A . 22 LYS HB3 1 1 4 1880 1 1 22 LYS HD3 H 5.306 2.174 9.869 1.00 . A A . 22 LYS HD3 1 1 4 1881 1 1 22 LYS HE3 H 4.117 -0.534 9.573 1.00 . A A . 22 LYS HE3 1 1 4 1882 1 1 22 LYS HG3 H 3.249 2.050 8.172 1.00 . A A . 22 LYS HG3 1 1 4 1883 1 1 22 LYS HZ1 H 3.878 1.221 11.916 1.00 . A A . 22 LYS HZ1 1 1 4 1884 1 1 22 LYS HZ2 H 5.374 0.505 11.576 1.00 . A A . 22 LYS HZ2 1 1 4 1885 1 1 22 LYS HZ3 H 4.014 -0.463 11.846 1.00 . A A . 22 LYS HZ3 1 1 4 1886 1 1 22 LYS N N 3.416 -0.247 5.077 1.00 . A A . 22 LYS N 1 1 4 1887 1 1 22 LYS NZ N 4.347 0.429 11.430 1.00 . A A . 22 LYS NZ 1 1 4 1888 1 1 22 LYS O O 4.008 2.592 4.266 1.00 . A A . 22 LYS O 1 1 4 1889 1 1 23 CYS C C 2.276 5.202 4.857 1.00 . A A . 23 CYS C 1 1 4 1890 1 1 23 CYS CA C 1.600 3.963 4.280 1.00 . A A . 23 CYS CA 1 1 4 1891 1 1 23 CYS CB C 0.086 4.174 4.224 1.00 . A A . 23 CYS CB 1 1 4 1892 1 1 23 CYS H H 1.235 2.413 5.676 1.00 . A A . 23 CYS H 1 1 4 1893 1 1 23 CYS HA H 1.969 3.799 3.279 1.00 . A A . 23 CYS HA 1 1 4 1894 1 1 23 CYS HB3 H -0.128 5.030 3.601 1.00 . A A . 23 CYS HB3 1 1 4 1895 1 1 23 CYS N N 1.917 2.781 5.072 1.00 . A A . 23 CYS N 1 1 4 1896 1 1 23 CYS O O 3.050 5.113 5.809 1.00 . A A . 23 CYS O 1 1 4 1897 1 1 23 CYS SG S -0.839 2.755 3.551 1.00 . A A . 23 CYS SG 1 1 4 1898 1 1 24 ASN C C 1.484 8.691 4.870 1.00 . A A . 24 ASN C 1 1 4 1899 1 1 24 ASN CA C 2.558 7.617 4.729 1.00 . A A . 24 ASN CA 1 1 4 1900 1 1 24 ASN CB C 3.640 8.087 3.755 1.00 . A A . 24 ASN CB 1 1 4 1901 1 1 24 ASN CG C 4.898 7.245 3.838 1.00 . A A . 24 ASN CG 1 1 4 1902 1 1 24 ASN H H 1.354 6.366 3.518 1.00 . A A . 24 ASN H 1 1 4 1903 1 1 24 ASN HA H 3.007 7.444 5.695 1.00 . A A . 24 ASN HA 1 1 4 1904 1 1 24 ASN HB3 H 3.898 9.111 3.978 1.00 . A A . 24 ASN HB3 1 1 4 1905 1 1 24 ASN HD21 H 5.152 7.382 1.871 1.00 . A A . 24 ASN HD21 1 1 4 1906 1 1 24 ASN HD22 H 6.345 6.465 2.720 1.00 . A A . 24 ASN HD22 1 1 4 1907 1 1 24 ASN N N 1.979 6.359 4.273 1.00 . A A . 24 ASN N 1 1 4 1908 1 1 24 ASN ND2 N 5.529 7.007 2.694 1.00 . A A . 24 ASN ND2 1 1 4 1909 1 1 24 ASN O O 1.079 9.039 5.979 1.00 . A A . 24 ASN O 1 1 4 1910 1 1 24 ASN OD1 O 5.299 6.814 4.920 1.00 . A A . 24 ASN OD1 1 1 4 1911 1 1 25 LYS C C -0.650 10.364 2.355 1.00 . A A . 25 LYS C 1 1 4 1912 1 1 25 LYS CA C -0.004 10.246 3.732 1.00 . A A . 25 LYS CA 1 1 4 1913 1 1 25 LYS CB C 0.595 11.594 4.143 1.00 . A A . 25 LYS CB 1 1 4 1914 1 1 25 LYS CD C -0.014 13.935 3.467 1.00 . A A . 25 LYS CD 1 1 4 1915 1 1 25 LYS CE C -0.419 13.822 2.005 1.00 . A A . 25 LYS CE 1 1 4 1916 1 1 25 LYS CG C -0.432 12.706 4.257 1.00 . A A . 25 LYS CG 1 1 4 1917 1 1 25 LYS H H 1.386 8.895 2.883 1.00 . A A . 25 LYS H 1 1 4 1918 1 1 25 LYS HA H -0.760 9.964 4.448 1.00 . A A . 25 LYS HA 1 1 4 1919 1 1 25 LYS HB3 H 1.331 11.885 3.407 1.00 . A A . 25 LYS HB3 1 1 4 1920 1 1 25 LYS HD3 H 1.061 14.042 3.527 1.00 . A A . 25 LYS HD3 1 1 4 1921 1 1 25 LYS HE3 H -1.270 13.161 1.931 1.00 . A A . 25 LYS HE3 1 1 4 1922 1 1 25 LYS HG3 H -0.540 12.978 5.297 1.00 . A A . 25 LYS HG3 1 1 4 1923 1 1 25 LYS HZ1 H -1.805 15.304 1.509 1.00 . A A . 25 LYS HZ1 1 1 4 1924 1 1 25 LYS HZ2 H -0.514 15.179 0.421 1.00 . A A . 25 LYS HZ2 1 1 4 1925 1 1 25 LYS HZ3 H -0.281 15.905 1.931 1.00 . A A . 25 LYS HZ3 1 1 4 1926 1 1 25 LYS N N 1.024 9.213 3.737 1.00 . A A . 25 LYS N 1 1 4 1927 1 1 25 LYS NZ N -0.780 15.145 1.426 1.00 . A A . 25 LYS NZ 1 1 4 1928 1 1 25 LYS O O -1.863 10.534 2.242 1.00 . A A . 25 LYS O 1 1 4 1929 1 1 26 ALA C C -0.609 8.979 -0.631 1.00 . A A . 26 ALA C 1 1 4 1930 1 1 26 ALA CA C -0.324 10.361 -0.056 1.00 . A A . 26 ALA CA 1 1 4 1931 1 1 26 ALA CB C 0.678 11.103 -0.930 1.00 . A A . 26 ALA CB 1 1 4 1932 1 1 26 ALA H H 1.126 10.133 1.468 1.00 . A A . 26 ALA H 1 1 4 1933 1 1 26 ALA HA H -1.243 10.931 -0.042 1.00 . A A . 26 ALA HA 1 1 4 1934 1 1 26 ALA HB1 H 0.805 12.108 -0.555 1.00 . A A . 26 ALA HB1 1 1 4 1935 1 1 26 ALA HB2 H 1.625 10.586 -0.906 1.00 . A A . 26 ALA HB2 1 1 4 1936 1 1 26 ALA HB3 H 0.312 11.141 -1.944 1.00 . A A . 26 ALA HB3 1 1 4 1937 1 1 26 ALA N N 0.168 10.270 1.313 1.00 . A A . 26 ALA N 1 1 4 1938 1 1 26 ALA O O -0.669 8.804 -1.849 1.00 . A A . 26 ALA O 1 1 4 1939 1 1 27 GLN C C 0.086 6.079 -1.013 1.00 . A A . 27 GLN C 1 1 4 1940 1 1 27 GLN CA C -1.059 6.632 -0.172 1.00 . A A . 27 GLN CA 1 1 4 1941 1 1 27 GLN CB C -2.364 6.575 -0.966 1.00 . A A . 27 GLN CB 1 1 4 1942 1 1 27 GLN CD C -3.588 6.878 1.223 1.00 . A A . 27 GLN CD 1 1 4 1943 1 1 27 GLN CG C -3.540 7.222 -0.252 1.00 . A A . 27 GLN CG 1 1 4 1944 1 1 27 GLN H H -0.722 8.202 1.207 1.00 . A A . 27 GLN H 1 1 4 1945 1 1 27 GLN HA H -1.161 6.026 0.716 1.00 . A A . 27 GLN HA 1 1 4 1946 1 1 27 GLN HB3 H -2.612 5.541 -1.156 1.00 . A A . 27 GLN HB3 1 1 4 1947 1 1 27 GLN HE21 H -3.594 8.808 1.699 1.00 . A A . 27 GLN HE21 1 1 4 1948 1 1 27 GLN HE22 H -3.641 7.707 3.030 1.00 . A A . 27 GLN HE22 1 1 4 1949 1 1 27 GLN HG3 H -4.456 6.886 -0.716 1.00 . A A . 27 GLN HG3 1 1 4 1950 1 1 27 GLN N N -0.782 7.999 0.250 1.00 . A A . 27 GLN N 1 1 4 1951 1 1 27 GLN NE2 N -3.609 7.900 2.071 1.00 . A A . 27 GLN NE2 1 1 4 1952 1 1 27 GLN O O 0.114 6.254 -2.232 1.00 . A A . 27 GLN O 1 1 4 1953 1 1 27 GLN OE1 O -3.607 5.705 1.598 1.00 . A A . 27 GLN OE1 1 1 4 1954 1 1 28 ILE C C 2.475 3.431 -0.532 1.00 . A A . 28 ILE C 1 1 4 1955 1 1 28 ILE CA C 2.177 4.836 -1.043 1.00 . A A . 28 ILE CA 1 1 4 1956 1 1 28 ILE CB C 3.435 5.709 -0.873 1.00 . A A . 28 ILE CB 1 1 4 1957 1 1 28 ILE CD1 C 2.743 7.392 -2.654 1.00 . A A . 28 ILE CD1 1 1 4 1958 1 1 28 ILE CG1 C 3.117 7.169 -1.205 1.00 . A A . 28 ILE CG1 1 1 4 1959 1 1 28 ILE CG2 C 4.562 5.193 -1.756 1.00 . A A . 28 ILE CG2 1 1 4 1960 1 1 28 ILE H H 0.952 5.309 0.615 1.00 . A A . 28 ILE H 1 1 4 1961 1 1 28 ILE HA H 1.942 4.781 -2.096 1.00 . A A . 28 ILE HA 1 1 4 1962 1 1 28 ILE HB H 3.756 5.643 0.155 1.00 . A A . 28 ILE HB 1 1 4 1963 1 1 28 ILE HD11 H 1.760 7.837 -2.706 1.00 . A A . 28 ILE HD11 1 1 4 1964 1 1 28 ILE HD12 H 3.461 8.054 -3.113 1.00 . A A . 28 ILE HD12 1 1 4 1965 1 1 28 ILE HD13 H 2.737 6.446 -3.174 1.00 . A A . 28 ILE HD13 1 1 4 1966 1 1 28 ILE HG13 H 3.985 7.776 -0.988 1.00 . A A . 28 ILE HG13 1 1 4 1967 1 1 28 ILE HG21 H 5.407 5.862 -1.689 1.00 . A A . 28 ILE HG21 1 1 4 1968 1 1 28 ILE HG22 H 4.856 4.210 -1.424 1.00 . A A . 28 ILE HG22 1 1 4 1969 1 1 28 ILE HG23 H 4.223 5.142 -2.780 1.00 . A A . 28 ILE HG23 1 1 4 1970 1 1 28 ILE N N 1.031 5.415 -0.355 1.00 . A A . 28 ILE N 1 1 4 1971 1 1 28 ILE O O 2.729 2.515 -1.313 1.00 . A A . 28 ILE O 1 1 4 1972 1 1 29 CYS C C 4.157 1.555 1.190 1.00 . A A . 29 CYS C 1 1 4 1973 1 1 29 CYS CA C 2.705 1.975 1.406 1.00 . A A . 29 CYS CA 1 1 4 1974 1 1 29 CYS CB C 1.765 0.910 0.834 1.00 . A A . 29 CYS CB 1 1 4 1975 1 1 29 CYS H H 2.232 4.037 1.359 1.00 . A A . 29 CYS H 1 1 4 1976 1 1 29 CYS HA H 2.524 2.070 2.465 1.00 . A A . 29 CYS HA 1 1 4 1977 1 1 29 CYS HB3 H 2.346 0.050 0.537 1.00 . A A . 29 CYS HB3 1 1 4 1978 1 1 29 CYS N N 2.440 3.268 0.787 1.00 . A A . 29 CYS N 1 1 4 1979 1 1 29 CYS O O 4.646 1.530 0.061 1.00 . A A . 29 CYS O 1 1 4 1980 1 1 29 CYS SG S 0.488 0.342 2.002 1.00 . A A . 29 CYS SG 1 1 4 1981 1 1 30 VAL C C 6.660 0.104 3.497 1.00 . A A . 30 VAL C 1 1 4 1982 1 1 30 VAL CA C 6.233 0.806 2.213 1.00 . A A . 30 VAL CA 1 1 4 1983 1 1 30 VAL CB C 7.169 2.004 1.962 1.00 . A A . 30 VAL CB 1 1 4 1984 1 1 30 VAL CG1 C 7.568 2.071 0.496 1.00 . A A . 30 VAL CG1 1 1 4 1985 1 1 30 VAL CG2 C 6.504 3.300 2.401 1.00 . A A . 30 VAL CG2 1 1 4 1986 1 1 30 VAL H H 4.394 1.266 3.154 1.00 . A A . 30 VAL H 1 1 4 1987 1 1 30 VAL HA H 6.335 0.118 1.387 1.00 . A A . 30 VAL HA 1 1 4 1988 1 1 30 VAL HB H 8.064 1.866 2.550 1.00 . A A . 30 VAL HB 1 1 4 1989 1 1 30 VAL HG11 H 6.990 1.355 -0.068 1.00 . A A . 30 VAL HG11 1 1 4 1990 1 1 30 VAL HG12 H 7.382 3.065 0.117 1.00 . A A . 30 VAL HG12 1 1 4 1991 1 1 30 VAL HG13 H 8.619 1.840 0.398 1.00 . A A . 30 VAL HG13 1 1 4 1992 1 1 30 VAL HG21 H 6.081 3.172 3.387 1.00 . A A . 30 VAL HG21 1 1 4 1993 1 1 30 VAL HG22 H 7.239 4.091 2.424 1.00 . A A . 30 VAL HG22 1 1 4 1994 1 1 30 VAL HG23 H 5.720 3.557 1.705 1.00 . A A . 30 VAL HG23 1 1 4 1995 1 1 30 VAL N N 4.839 1.226 2.282 1.00 . A A . 30 VAL N 1 1 4 1996 1 1 30 VAL O O 5.865 -0.052 4.425 1.00 . A A . 30 VAL O 1 1 4 1997 1 1 31 ASP C C 9.937 -1.304 4.542 1.00 . A A . 31 ASP C 1 1 4 1998 1 1 31 ASP CA C 8.452 -1.002 4.717 1.00 . A A . 31 ASP CA 1 1 4 1999 1 1 31 ASP CB C 7.683 -2.299 4.970 1.00 . A A . 31 ASP CB 1 1 4 2000 1 1 31 ASP CG C 7.251 -2.977 3.685 1.00 . A A . 31 ASP CG 1 1 4 2001 1 1 31 ASP H H 8.504 -0.164 2.774 1.00 . A A . 31 ASP H 1 1 4 2002 1 1 31 ASP HA H 8.329 -0.349 5.568 1.00 . A A . 31 ASP HA 1 1 4 2003 1 1 31 ASP HB3 H 6.800 -2.079 5.553 1.00 . A A . 31 ASP HB3 1 1 4 2004 1 1 31 ASP N N 7.919 -0.318 3.545 1.00 . A A . 31 ASP N 1 1 4 2005 1 1 31 ASP O O 10.462 -1.333 3.428 1.00 . A A . 31 ASP O 1 1 4 2006 1 1 31 ASP OD1 O 8.015 -2.919 2.699 1.00 . A A . 31 ASP OD1 1 1 4 2007 1 1 31 ASP OD2 O 6.150 -3.565 3.664 1.00 . A A . 31 ASP OD2 1 1 4 2008 1 1 32 PRO C C 12.367 -3.213 5.079 1.00 . A A . 32 PRO C 1 1 4 2009 1 1 32 PRO CA C 12.066 -1.836 5.661 1.00 . A A . 32 PRO CA 1 1 4 2010 1 1 32 PRO CB C 12.443 -1.789 7.144 1.00 . A A . 32 PRO CB 1 1 4 2011 1 1 32 PRO CD C 10.071 -1.514 7.027 1.00 . A A . 32 PRO CD 1 1 4 2012 1 1 32 PRO CG C 11.176 -2.093 7.866 1.00 . A A . 32 PRO CG 1 1 4 2013 1 1 32 PRO HA H 12.629 -1.088 5.122 1.00 . A A . 32 PRO HA 1 1 4 2014 1 1 32 PRO HB3 H 12.813 -0.806 7.394 1.00 . A A . 32 PRO HB3 1 1 4 2015 1 1 32 PRO HD3 H 9.851 -0.504 7.338 1.00 . A A . 32 PRO HD3 1 1 4 2016 1 1 32 PRO HG3 H 11.188 -1.628 8.841 1.00 . A A . 32 PRO HG3 1 1 4 2017 1 1 32 PRO N N 10.632 -1.533 5.665 1.00 . A A . 32 PRO N 1 1 4 2018 1 1 32 PRO O O 13.482 -3.478 4.629 1.00 . A A . 32 PRO O 1 1 4 2019 1 1 33 LYS C C 11.989 -5.400 3.108 1.00 . A A . 33 LYS C 1 1 4 2020 1 1 33 LYS CA C 11.520 -5.435 4.559 1.00 . A A . 33 LYS CA 1 1 4 2021 1 1 33 LYS CB C 10.199 -6.200 4.660 1.00 . A A . 33 LYS CB 1 1 4 2022 1 1 33 LYS CD C 9.160 -8.069 5.978 1.00 . A A . 33 LYS CD 1 1 4 2023 1 1 33 LYS CE C 9.180 -7.452 7.368 1.00 . A A . 33 LYS CE 1 1 4 2024 1 1 33 LYS CG C 10.358 -7.627 5.156 1.00 . A A . 33 LYS CG 1 1 4 2025 1 1 33 LYS H H 10.499 -3.815 5.460 1.00 . A A . 33 LYS H 1 1 4 2026 1 1 33 LYS HA H 12.266 -5.941 5.154 1.00 . A A . 33 LYS HA 1 1 4 2027 1 1 33 LYS HB3 H 9.738 -6.230 3.683 1.00 . A A . 33 LYS HB3 1 1 4 2028 1 1 33 LYS HD3 H 9.175 -9.146 6.071 1.00 . A A . 33 LYS HD3 1 1 4 2029 1 1 33 LYS HE3 H 8.180 -7.128 7.618 1.00 . A A . 33 LYS HE3 1 1 4 2030 1 1 33 LYS HG3 H 11.247 -7.688 5.769 1.00 . A A . 33 LYS HG3 1 1 4 2031 1 1 33 LYS HZ1 H 8.897 -8.587 9.099 1.00 . A A . 33 LYS HZ1 1 1 4 2032 1 1 33 LYS HZ2 H 10.486 -8.047 8.886 1.00 . A A . 33 LYS HZ2 1 1 4 2033 1 1 33 LYS HZ3 H 9.895 -9.326 7.951 1.00 . A A . 33 LYS HZ3 1 1 4 2034 1 1 33 LYS N N 11.365 -4.086 5.088 1.00 . A A . 33 LYS N 1 1 4 2035 1 1 33 LYS NZ N 9.646 -8.421 8.399 1.00 . A A . 33 LYS NZ 1 1 4 2036 1 1 33 LYS O O 12.688 -6.304 2.649 1.00 . A A . 33 LYS O 1 1 4 2037 1 1 34 LYS C C 12.686 -2.860 0.765 1.00 . A A . 34 LYS C 1 1 4 2038 1 1 34 LYS CA C 11.984 -4.195 0.992 1.00 . A A . 34 LYS CA 1 1 4 2039 1 1 34 LYS CB C 10.752 -4.297 0.091 1.00 . A A . 34 LYS CB 1 1 4 2040 1 1 34 LYS CD C 11.220 -5.927 -1.762 1.00 . A A . 34 LYS CD 1 1 4 2041 1 1 34 LYS CE C 12.677 -6.365 -1.796 1.00 . A A . 34 LYS CE 1 1 4 2042 1 1 34 LYS CG C 11.087 -4.462 -1.381 1.00 . A A . 34 LYS CG 1 1 4 2043 1 1 34 LYS H H 11.045 -3.663 2.813 1.00 . A A . 34 LYS H 1 1 4 2044 1 1 34 LYS HA H 12.668 -4.994 0.745 1.00 . A A . 34 LYS HA 1 1 4 2045 1 1 34 LYS HB3 H 10.163 -3.398 0.205 1.00 . A A . 34 LYS HB3 1 1 4 2046 1 1 34 LYS HD3 H 10.785 -6.077 -2.741 1.00 . A A . 34 LYS HD3 1 1 4 2047 1 1 34 LYS HE3 H 13.284 -5.577 -1.376 1.00 . A A . 34 LYS HE3 1 1 4 2048 1 1 34 LYS HG3 H 12.022 -3.961 -1.587 1.00 . A A . 34 LYS HG3 1 1 4 2049 1 1 34 LYS HZ1 H 13.765 -7.534 -0.452 1.00 . A A . 34 LYS HZ1 1 1 4 2050 1 1 34 LYS HZ2 H 12.993 -8.425 -1.665 1.00 . A A . 34 LYS HZ2 1 1 4 2051 1 1 34 LYS HZ3 H 12.094 -7.788 -0.382 1.00 . A A . 34 LYS HZ3 1 1 4 2052 1 1 34 LYS N N 11.602 -4.351 2.391 1.00 . A A . 34 LYS N 1 1 4 2053 1 1 34 LYS NZ N 12.898 -7.616 -1.020 1.00 . A A . 34 LYS NZ 1 1 4 2054 1 1 34 LYS O O 12.132 -1.800 1.053 1.00 . A A . 34 LYS O 1 1 4 2055 1 1 35 GLY C C 14.153 -0.953 -1.224 1.00 . A A . 35 GLY C 1 1 4 2056 1 1 35 GLY CA C 14.664 -1.708 -0.013 1.00 . A A . 35 GLY CA 1 1 4 2057 1 1 35 GLY H H 14.300 -3.793 0.036 1.00 . A A . 35 GLY H 1 1 4 2058 1 1 35 GLY HA2 H 14.599 -1.065 0.852 1.00 . A A . 35 GLY HA2 1 1 4 2059 1 1 35 GLY HA3 H 15.699 -1.970 -0.177 1.00 . A A . 35 GLY HA3 1 1 4 2060 1 1 35 GLY N N 13.908 -2.919 0.245 1.00 . A A . 35 GLY N 1 1 4 2061 1 1 35 GLY O O 14.679 -1.107 -2.327 1.00 . A A . 35 GLY O 1 1 4 2062 1 1 36 TRP C C 12.007 -0.269 -3.206 1.00 . A A . 36 TRP C 1 1 4 2063 1 1 36 TRP CA C 12.543 0.643 -2.107 1.00 . A A . 36 TRP CA 1 1 4 2064 1 1 36 TRP CB C 13.581 1.605 -2.687 1.00 . A A . 36 TRP CB 1 1 4 2065 1 1 36 TRP CD1 C 12.613 3.024 -4.589 1.00 . A A . 36 TRP CD1 1 1 4 2066 1 1 36 TRP CD2 C 12.675 4.062 -2.605 1.00 . A A . 36 TRP CD2 1 1 4 2067 1 1 36 TRP CE2 C 12.125 4.943 -3.556 1.00 . A A . 36 TRP CE2 1 1 4 2068 1 1 36 TRP CE3 C 12.811 4.496 -1.284 1.00 . A A . 36 TRP CE3 1 1 4 2069 1 1 36 TRP CG C 12.979 2.839 -3.286 1.00 . A A . 36 TRP CG 1 1 4 2070 1 1 36 TRP CH2 C 11.860 6.632 -1.927 1.00 . A A . 36 TRP CH2 1 1 4 2071 1 1 36 TRP CZ2 C 11.716 6.232 -3.227 1.00 . A A . 36 TRP CZ2 1 1 4 2072 1 1 36 TRP CZ3 C 12.403 5.776 -0.958 1.00 . A A . 36 TRP CZ3 1 1 4 2073 1 1 36 TRP H H 12.749 -0.057 -0.119 1.00 . A A . 36 TRP H 1 1 4 2074 1 1 36 TRP HA H 11.723 1.216 -1.699 1.00 . A A . 36 TRP HA 1 1 4 2075 1 1 36 TRP HB3 H 14.140 1.097 -3.459 1.00 . A A . 36 TRP HB3 1 1 4 2076 1 1 36 TRP HD1 H 12.720 2.277 -5.361 1.00 . A A . 36 TRP HD1 1 1 4 2077 1 1 36 TRP HE1 H 11.767 4.656 -5.603 1.00 . A A . 36 TRP HE1 1 1 4 2078 1 1 36 TRP HE3 H 13.227 3.852 -0.524 1.00 . A A . 36 TRP HE3 1 1 4 2079 1 1 36 TRP HH2 H 11.556 7.622 -1.627 1.00 . A A . 36 TRP HH2 1 1 4 2080 1 1 36 TRP HZ2 H 11.295 6.904 -3.962 1.00 . A A . 36 TRP HZ2 1 1 4 2081 1 1 36 TRP HZ3 H 12.501 6.130 0.058 1.00 . A A . 36 TRP HZ3 1 1 4 2082 1 1 36 TRP N N 13.125 -0.137 -1.022 1.00 . A A . 36 TRP N 1 1 4 2083 1 1 36 TRP NE1 N 12.099 4.287 -4.759 1.00 . A A . 36 TRP NE1 1 1 4 2084 1 1 36 TRP O O 10.800 -0.333 -3.439 1.00 . A A . 36 TRP O 1 1 5 2085 1 1 1 ASP C C -10.810 -4.921 -0.450 1.00 . A A . 1 ASP C 1 1 5 2086 1 1 1 ASP CA C -11.643 -4.443 0.736 1.00 . A A . 1 ASP CA 1 1 5 2087 1 1 1 ASP CB C -11.044 -4.969 2.041 1.00 . A A . 1 ASP CB 1 1 5 2088 1 1 1 ASP CG C -11.710 -4.372 3.265 1.00 . A A . 1 ASP CG 1 1 5 2089 1 1 1 ASP H1 H -13.491 -4.747 -0.251 1.00 . A A . 1 ASP H1 1 1 5 2090 1 1 1 ASP HA H -11.632 -3.364 0.754 1.00 . A A . 1 ASP HA 1 1 5 2091 1 1 1 ASP HB3 H -9.992 -4.725 2.071 1.00 . A A . 1 ASP HB3 1 1 5 2092 1 1 1 ASP N N -13.029 -4.875 0.604 1.00 . A A . 1 ASP N 1 1 5 2093 1 1 1 ASP O O -10.077 -4.143 -1.061 1.00 . A A . 1 ASP O 1 1 5 2094 1 1 1 ASP OD1 O -12.920 -4.614 3.462 1.00 . A A . 1 ASP OD1 1 1 5 2095 1 1 1 ASP OD2 O -11.021 -3.663 4.028 1.00 . A A . 1 ASP OD2 1 1 5 2096 1 1 2 PHE C C -8.681 -6.744 -1.612 1.00 . A A . 2 PHE C 1 1 5 2097 1 1 2 PHE CA C -10.183 -6.789 -1.879 1.00 . A A . 2 PHE CA 1 1 5 2098 1 1 2 PHE CB C -10.503 -6.048 -3.179 1.00 . A A . 2 PHE CB 1 1 5 2099 1 1 2 PHE CD1 C -12.820 -6.839 -3.729 1.00 . A A . 2 PHE CD1 1 1 5 2100 1 1 2 PHE CD2 C -12.499 -4.529 -3.228 1.00 . A A . 2 PHE CD2 1 1 5 2101 1 1 2 PHE CE1 C -14.171 -6.613 -3.918 1.00 . A A . 2 PHE CE1 1 1 5 2102 1 1 2 PHE CE2 C -13.849 -4.298 -3.416 1.00 . A A . 2 PHE CE2 1 1 5 2103 1 1 2 PHE CG C -11.970 -5.800 -3.383 1.00 . A A . 2 PHE CG 1 1 5 2104 1 1 2 PHE CZ C -14.686 -5.342 -3.760 1.00 . A A . 2 PHE CZ 1 1 5 2105 1 1 2 PHE H H -11.528 -6.776 -0.244 1.00 . A A . 2 PHE H 1 1 5 2106 1 1 2 PHE HA H -10.489 -7.819 -1.978 1.00 . A A . 2 PHE HA 1 1 5 2107 1 1 2 PHE HB3 H -10.143 -6.630 -4.014 1.00 . A A . 2 PHE HB3 1 1 5 2108 1 1 2 PHE HD1 H -12.419 -7.833 -3.852 1.00 . A A . 2 PHE HD1 1 1 5 2109 1 1 2 PHE HD2 H -11.845 -3.711 -2.959 1.00 . A A . 2 PHE HD2 1 1 5 2110 1 1 2 PHE HE1 H -14.822 -7.431 -4.187 1.00 . A A . 2 PHE HE1 1 1 5 2111 1 1 2 PHE HE2 H -14.249 -3.302 -3.291 1.00 . A A . 2 PHE HE2 1 1 5 2112 1 1 2 PHE HZ H -15.741 -5.162 -3.907 1.00 . A A . 2 PHE HZ 1 1 5 2113 1 1 2 PHE N N -10.926 -6.206 -0.769 1.00 . A A . 2 PHE N 1 1 5 2114 1 1 2 PHE O O -8.182 -5.898 -0.870 1.00 . A A . 2 PHE O 1 1 5 2115 1 1 3 PRO C C -5.761 -6.611 -2.744 1.00 . A A . 3 PRO C 1 1 5 2116 1 1 3 PRO CA C -6.489 -7.770 -2.071 1.00 . A A . 3 PRO CA 1 1 5 2117 1 1 3 PRO CB C -6.140 -9.092 -2.757 1.00 . A A . 3 PRO CB 1 1 5 2118 1 1 3 PRO CD C -8.472 -8.722 -3.125 1.00 . A A . 3 PRO CD 1 1 5 2119 1 1 3 PRO CG C -7.234 -9.308 -3.744 1.00 . A A . 3 PRO CG 1 1 5 2120 1 1 3 PRO HA H -6.204 -7.816 -1.030 1.00 . A A . 3 PRO HA 1 1 5 2121 1 1 3 PRO HB3 H -6.107 -9.885 -2.025 1.00 . A A . 3 PRO HB3 1 1 5 2122 1 1 3 PRO HD3 H -9.008 -9.475 -2.566 1.00 . A A . 3 PRO HD3 1 1 5 2123 1 1 3 PRO HG3 H -7.368 -10.365 -3.919 1.00 . A A . 3 PRO HG3 1 1 5 2124 1 1 3 PRO N N -7.943 -7.680 -2.228 1.00 . A A . 3 PRO N 1 1 5 2125 1 1 3 PRO O O -6.386 -5.743 -3.355 1.00 . A A . 3 PRO O 1 1 5 2126 1 1 4 LEU C C -2.137 -5.849 -3.058 1.00 . A A . 4 LEU C 1 1 5 2127 1 1 4 LEU CA C -3.624 -5.552 -3.230 1.00 . A A . 4 LEU CA 1 1 5 2128 1 1 4 LEU CB C -3.960 -4.199 -2.600 1.00 . A A . 4 LEU CB 1 1 5 2129 1 1 4 LEU CD1 C -2.691 -2.851 -4.290 1.00 . A A . 4 LEU CD1 1 1 5 2130 1 1 4 LEU CD2 C -3.387 -1.804 -2.128 1.00 . A A . 4 LEU CD2 1 1 5 2131 1 1 4 LEU CG C -2.931 -3.087 -2.807 1.00 . A A . 4 LEU CG 1 1 5 2132 1 1 4 LEU H H -3.996 -7.323 -2.133 1.00 . A A . 4 LEU H 1 1 5 2133 1 1 4 LEU HA H -3.852 -5.516 -4.284 1.00 . A A . 4 LEU HA 1 1 5 2134 1 1 4 LEU HB3 H -4.077 -4.349 -1.536 1.00 . A A . 4 LEU HB3 1 1 5 2135 1 1 4 LEU HD11 H -1.671 -3.103 -4.534 1.00 . A A . 4 LEU HD11 1 1 5 2136 1 1 4 LEU HD12 H -2.871 -1.812 -4.523 1.00 . A A . 4 LEU HD12 1 1 5 2137 1 1 4 LEU HD13 H -3.363 -3.470 -4.866 1.00 . A A . 4 LEU HD13 1 1 5 2138 1 1 4 LEU HD21 H -3.752 -2.032 -1.137 1.00 . A A . 4 LEU HD21 1 1 5 2139 1 1 4 LEU HD22 H -4.178 -1.353 -2.707 1.00 . A A . 4 LEU HD22 1 1 5 2140 1 1 4 LEU HD23 H -2.556 -1.118 -2.057 1.00 . A A . 4 LEU HD23 1 1 5 2141 1 1 4 LEU HG H -1.993 -3.387 -2.361 1.00 . A A . 4 LEU HG 1 1 5 2142 1 1 4 LEU N N -4.437 -6.604 -2.630 1.00 . A A . 4 LEU N 1 1 5 2143 1 1 4 LEU O O -1.704 -6.315 -2.004 1.00 . A A . 4 LEU O 1 1 5 2144 1 1 5 SER C C 0.735 -5.012 -2.948 1.00 . A A . 5 SER C 1 1 5 2145 1 1 5 SER CA C 0.078 -5.813 -4.067 1.00 . A A . 5 SER CA 1 1 5 2146 1 1 5 SER CB C 0.710 -5.446 -5.411 1.00 . A A . 5 SER CB 1 1 5 2147 1 1 5 SER H H -1.765 -5.204 -4.914 1.00 . A A . 5 SER H 1 1 5 2148 1 1 5 SER HA H 0.234 -6.865 -3.879 1.00 . A A . 5 SER HA 1 1 5 2149 1 1 5 SER HB3 H 1.423 -4.649 -5.264 1.00 . A A . 5 SER HB3 1 1 5 2150 1 1 5 SER HG H 1.421 -6.453 -6.934 1.00 . A A . 5 SER HG 1 1 5 2151 1 1 5 SER N N -1.360 -5.574 -4.101 1.00 . A A . 5 SER N 1 1 5 2152 1 1 5 SER O O 0.056 -4.404 -2.121 1.00 . A A . 5 SER O 1 1 5 2153 1 1 5 SER OG O 1.378 -6.558 -5.980 1.00 . A A . 5 SER OG 1 1 5 2154 1 1 6 LYS C C 3.589 -3.127 -2.534 1.00 . A A . 6 LYS C 1 1 5 2155 1 1 6 LYS CA C 2.817 -4.287 -1.913 1.00 . A A . 6 LYS CA 1 1 5 2156 1 1 6 LYS CB C 3.784 -5.230 -1.193 1.00 . A A . 6 LYS CB 1 1 5 2157 1 1 6 LYS CD C 5.333 -7.139 -1.704 1.00 . A A . 6 LYS CD 1 1 5 2158 1 1 6 LYS CE C 6.246 -7.744 -2.760 1.00 . A A . 6 LYS CE 1 1 5 2159 1 1 6 LYS CG C 4.919 -5.724 -2.072 1.00 . A A . 6 LYS CG 1 1 5 2160 1 1 6 LYS H H 2.550 -5.517 -3.615 1.00 . A A . 6 LYS H 1 1 5 2161 1 1 6 LYS HA H 2.112 -3.892 -1.197 1.00 . A A . 6 LYS HA 1 1 5 2162 1 1 6 LYS HB3 H 3.232 -6.088 -0.837 1.00 . A A . 6 LYS HB3 1 1 5 2163 1 1 6 LYS HD3 H 4.447 -7.752 -1.612 1.00 . A A . 6 LYS HD3 1 1 5 2164 1 1 6 LYS HE3 H 6.366 -7.034 -3.564 1.00 . A A . 6 LYS HE3 1 1 5 2165 1 1 6 LYS HG3 H 5.768 -5.067 -1.951 1.00 . A A . 6 LYS HG3 1 1 5 2166 1 1 6 LYS HZ1 H 8.334 -7.732 -2.841 1.00 . A A . 6 LYS HZ1 1 1 5 2167 1 1 6 LYS HZ2 H 7.684 -9.111 -2.107 1.00 . A A . 6 LYS HZ2 1 1 5 2168 1 1 6 LYS HZ3 H 7.709 -7.640 -1.272 1.00 . A A . 6 LYS HZ3 1 1 5 2169 1 1 6 LYS N N 2.064 -5.014 -2.928 1.00 . A A . 6 LYS N 1 1 5 2170 1 1 6 LYS NZ N 7.587 -8.080 -2.206 1.00 . A A . 6 LYS NZ 1 1 5 2171 1 1 6 LYS O O 3.375 -2.780 -3.695 1.00 . A A . 6 LYS O 1 1 5 2172 1 1 7 GLU C C 4.411 -0.209 -2.545 1.00 . A A . 7 GLU C 1 1 5 2173 1 1 7 GLU CA C 5.290 -1.415 -2.229 1.00 . A A . 7 GLU CA 1 1 5 2174 1 1 7 GLU CB C 6.085 -1.821 -3.473 1.00 . A A . 7 GLU CB 1 1 5 2175 1 1 7 GLU CD C 7.879 -3.221 -2.377 1.00 . A A . 7 GLU CD 1 1 5 2176 1 1 7 GLU CG C 7.573 -1.995 -3.214 1.00 . A A . 7 GLU CG 1 1 5 2177 1 1 7 GLU H H 4.612 -2.858 -0.837 1.00 . A A . 7 GLU H 1 1 5 2178 1 1 7 GLU HA H 5.981 -1.146 -1.444 1.00 . A A . 7 GLU HA 1 1 5 2179 1 1 7 GLU HB3 H 5.960 -1.059 -4.228 1.00 . A A . 7 GLU HB3 1 1 5 2180 1 1 7 GLU HG3 H 7.940 -1.122 -2.695 1.00 . A A . 7 GLU HG3 1 1 5 2181 1 1 7 GLU N N 4.487 -2.535 -1.754 1.00 . A A . 7 GLU N 1 1 5 2182 1 1 7 GLU O O 3.194 -0.250 -2.362 1.00 . A A . 7 GLU O 1 1 5 2183 1 1 7 GLU OE1 O 7.499 -3.238 -1.187 1.00 . A A . 7 GLU OE1 1 1 5 2184 1 1 7 GLU OE2 O 8.500 -4.164 -2.911 1.00 . A A . 7 GLU OE2 1 1 5 2185 1 1 8 TYR C C 3.150 1.780 -4.305 1.00 . A A . 8 TYR C 1 1 5 2186 1 1 8 TYR CA C 4.309 2.081 -3.361 1.00 . A A . 8 TYR CA 1 1 5 2187 1 1 8 TYR CB C 5.254 3.099 -4.003 1.00 . A A . 8 TYR CB 1 1 5 2188 1 1 8 TYR CD1 C 7.000 1.800 -5.285 1.00 . A A . 8 TYR CD1 1 1 5 2189 1 1 8 TYR CD2 C 5.338 2.977 -6.525 1.00 . A A . 8 TYR CD2 1 1 5 2190 1 1 8 TYR CE1 C 7.572 1.359 -6.462 1.00 . A A . 8 TYR CE1 1 1 5 2191 1 1 8 TYR CE2 C 5.902 2.538 -7.707 1.00 . A A . 8 TYR CE2 1 1 5 2192 1 1 8 TYR CG C 5.875 2.616 -5.295 1.00 . A A . 8 TYR CG 1 1 5 2193 1 1 8 TYR CZ C 7.019 1.730 -7.671 1.00 . A A . 8 TYR CZ 1 1 5 2194 1 1 8 TYR H H 6.006 0.834 -3.146 1.00 . A A . 8 TYR H 1 1 5 2195 1 1 8 TYR HA H 3.916 2.498 -2.446 1.00 . A A . 8 TYR HA 1 1 5 2196 1 1 8 TYR HB3 H 6.053 3.323 -3.313 1.00 . A A . 8 TYR HB3 1 1 5 2197 1 1 8 TYR HD1 H 7.430 1.511 -4.337 1.00 . A A . 8 TYR HD1 1 1 5 2198 1 1 8 TYR HD2 H 4.463 3.610 -6.550 1.00 . A A . 8 TYR HD2 1 1 5 2199 1 1 8 TYR HE1 H 8.446 0.725 -6.435 1.00 . A A . 8 TYR HE1 1 1 5 2200 1 1 8 TYR HE2 H 5.471 2.829 -8.654 1.00 . A A . 8 TYR HE2 1 1 5 2201 1 1 8 TYR HH H 7.187 0.454 -9.099 1.00 . A A . 8 TYR HH 1 1 5 2202 1 1 8 TYR N N 5.034 0.862 -3.022 1.00 . A A . 8 TYR N 1 1 5 2203 1 1 8 TYR O O 3.342 1.213 -5.380 1.00 . A A . 8 TYR O 1 1 5 2204 1 1 8 TYR OH O 7.585 1.290 -8.846 1.00 . A A . 8 TYR OH 1 1 5 2205 1 1 9 GLU C C -0.418 2.768 -4.192 1.00 . A A . 9 GLU C 1 1 5 2206 1 1 9 GLU CA C 0.754 1.935 -4.701 1.00 . A A . 9 GLU CA 1 1 5 2207 1 1 9 GLU CB C 0.381 0.452 -4.692 1.00 . A A . 9 GLU CB 1 1 5 2208 1 1 9 GLU CD C -0.839 -1.053 -6.315 1.00 . A A . 9 GLU CD 1 1 5 2209 1 1 9 GLU CG C -0.933 0.149 -5.394 1.00 . A A . 9 GLU CG 1 1 5 2210 1 1 9 GLU H H 1.857 2.611 -3.025 1.00 . A A . 9 GLU H 1 1 5 2211 1 1 9 GLU HA H 0.977 2.234 -5.715 1.00 . A A . 9 GLU HA 1 1 5 2212 1 1 9 GLU HB3 H 0.301 0.119 -3.667 1.00 . A A . 9 GLU HB3 1 1 5 2213 1 1 9 GLU HG3 H -1.221 1.010 -5.978 1.00 . A A . 9 GLU HG3 1 1 5 2214 1 1 9 GLU N N 1.945 2.164 -3.893 1.00 . A A . 9 GLU N 1 1 5 2215 1 1 9 GLU O O -0.769 3.793 -4.778 1.00 . A A . 9 GLU O 1 1 5 2216 1 1 9 GLU OE1 O 0.021 -1.924 -6.066 1.00 . A A . 9 GLU OE1 1 1 5 2217 1 1 9 GLU OE2 O -1.624 -1.121 -7.283 1.00 . A A . 9 GLU OE2 1 1 5 2218 1 1 10 THR C C -2.713 2.260 -1.309 1.00 . A A . 10 THR C 1 1 5 2219 1 1 10 THR CA C -2.155 3.024 -2.505 1.00 . A A . 10 THR CA 1 1 5 2220 1 1 10 THR CB C -3.281 3.237 -3.534 1.00 . A A . 10 THR CB 1 1 5 2221 1 1 10 THR CG2 C -3.534 1.966 -4.330 1.00 . A A . 10 THR CG2 1 1 5 2222 1 1 10 THR H H -0.696 1.499 -2.673 1.00 . A A . 10 THR H 1 1 5 2223 1 1 10 THR HA H -1.810 3.992 -2.172 1.00 . A A . 10 THR HA 1 1 5 2224 1 1 10 THR HB H -2.979 4.019 -4.217 1.00 . A A . 10 THR HB 1 1 5 2225 1 1 10 THR HG1 H -4.891 4.362 -3.350 1.00 . A A . 10 THR HG1 1 1 5 2226 1 1 10 THR HG21 H -2.966 1.998 -5.249 1.00 . A A . 10 THR HG21 1 1 5 2227 1 1 10 THR HG22 H -4.586 1.889 -4.561 1.00 . A A . 10 THR HG22 1 1 5 2228 1 1 10 THR HG23 H -3.229 1.110 -3.748 1.00 . A A . 10 THR HG23 1 1 5 2229 1 1 10 THR N N -1.021 2.322 -3.094 1.00 . A A . 10 THR N 1 1 5 2230 1 1 10 THR O O -2.892 1.043 -1.366 1.00 . A A . 10 THR O 1 1 5 2231 1 1 10 THR OG1 O -4.483 3.637 -2.869 1.00 . A A . 10 THR OG1 1 1 5 2232 1 1 11 CYS C C -4.726 3.164 1.501 1.00 . A A . 11 CYS C 1 1 5 2233 1 1 11 CYS CA C -3.527 2.373 0.982 1.00 . A A . 11 CYS CA 1 1 5 2234 1 1 11 CYS CB C -2.448 2.294 2.062 1.00 . A A . 11 CYS CB 1 1 5 2235 1 1 11 CYS H H -2.825 3.950 -0.245 1.00 . A A . 11 CYS H 1 1 5 2236 1 1 11 CYS HA H -3.851 1.374 0.735 1.00 . A A . 11 CYS HA 1 1 5 2237 1 1 11 CYS HB3 H -1.747 1.515 1.804 1.00 . A A . 11 CYS HB3 1 1 5 2238 1 1 11 CYS N N -2.989 2.983 -0.228 1.00 . A A . 11 CYS N 1 1 5 2239 1 1 11 CYS O O -4.688 3.720 2.598 1.00 . A A . 11 CYS O 1 1 5 2240 1 1 11 CYS SG S -1.506 3.838 2.286 1.00 . A A . 11 CYS SG 1 1 5 2241 1 1 12 VAL C C -7.903 3.062 1.955 1.00 . A A . 12 VAL C 1 1 5 2242 1 1 12 VAL CA C -6.999 3.927 1.083 1.00 . A A . 12 VAL CA 1 1 5 2243 1 1 12 VAL CB C -7.789 4.387 -0.157 1.00 . A A . 12 VAL CB 1 1 5 2244 1 1 12 VAL CG1 C -8.613 5.625 0.165 1.00 . A A . 12 VAL CG1 1 1 5 2245 1 1 12 VAL CG2 C -6.846 4.652 -1.320 1.00 . A A . 12 VAL CG2 1 1 5 2246 1 1 12 VAL H H -5.760 2.743 -0.159 1.00 . A A . 12 VAL H 1 1 5 2247 1 1 12 VAL HA H -6.706 4.802 1.643 1.00 . A A . 12 VAL HA 1 1 5 2248 1 1 12 VAL HB H -8.466 3.595 -0.442 1.00 . A A . 12 VAL HB 1 1 5 2249 1 1 12 VAL HG11 H -9.664 5.379 0.120 1.00 . A A . 12 VAL HG11 1 1 5 2250 1 1 12 VAL HG12 H -8.366 5.974 1.156 1.00 . A A . 12 VAL HG12 1 1 5 2251 1 1 12 VAL HG13 H -8.395 6.399 -0.555 1.00 . A A . 12 VAL HG13 1 1 5 2252 1 1 12 VAL HG21 H -5.929 5.083 -0.950 1.00 . A A . 12 VAL HG21 1 1 5 2253 1 1 12 VAL HG22 H -6.630 3.723 -1.825 1.00 . A A . 12 VAL HG22 1 1 5 2254 1 1 12 VAL HG23 H -7.312 5.338 -2.013 1.00 . A A . 12 VAL HG23 1 1 5 2255 1 1 12 VAL N N -5.789 3.207 0.705 1.00 . A A . 12 VAL N 1 1 5 2256 1 1 12 VAL O O -7.686 1.857 2.088 1.00 . A A . 12 VAL O 1 1 5 2257 1 1 13 ARG C C -10.289 1.658 2.767 1.00 . A A . 13 ARG C 1 1 5 2258 1 1 13 ARG CA C -9.853 2.972 3.408 1.00 . A A . 13 ARG CA 1 1 5 2259 1 1 13 ARG CB C -11.078 3.843 3.696 1.00 . A A . 13 ARG CB 1 1 5 2260 1 1 13 ARG CD C -10.066 5.366 5.420 1.00 . A A . 13 ARG CD 1 1 5 2261 1 1 13 ARG CG C -11.149 4.339 5.131 1.00 . A A . 13 ARG CG 1 1 5 2262 1 1 13 ARG CZ C -9.536 4.965 7.787 1.00 . A A . 13 ARG CZ 1 1 5 2263 1 1 13 ARG H H -9.036 4.646 2.403 1.00 . A A . 13 ARG H 1 1 5 2264 1 1 13 ARG HA H -9.350 2.755 4.339 1.00 . A A . 13 ARG HA 1 1 5 2265 1 1 13 ARG HB3 H -11.968 3.268 3.492 1.00 . A A . 13 ARG HB3 1 1 5 2266 1 1 13 ARG HD3 H -10.537 6.298 5.693 1.00 . A A . 13 ARG HD3 1 1 5 2267 1 1 13 ARG HE H -8.291 4.626 6.267 1.00 . A A . 13 ARG HE 1 1 5 2268 1 1 13 ARG HG3 H -11.024 3.499 5.799 1.00 . A A . 13 ARG HG3 1 1 5 2269 1 1 13 ARG HH11 H -11.390 5.690 7.442 1.00 . A A . 13 ARG HH11 1 1 5 2270 1 1 13 ARG HH12 H -11.003 5.402 9.107 1.00 . A A . 13 ARG HH12 1 1 5 2271 1 1 13 ARG HH21 H -7.769 4.244 8.454 1.00 . A A . 13 ARG HH21 1 1 5 2272 1 1 13 ARG HH22 H -8.943 4.581 9.681 1.00 . A A . 13 ARG HH22 1 1 5 2273 1 1 13 ARG N N -8.916 3.685 2.547 1.00 . A A . 13 ARG N 1 1 5 2274 1 1 13 ARG NE N -9.186 4.942 6.506 1.00 . A A . 13 ARG NE 1 1 5 2275 1 1 13 ARG NH1 N -10.742 5.387 8.141 1.00 . A A . 13 ARG NH1 1 1 5 2276 1 1 13 ARG NH2 N -8.679 4.563 8.717 1.00 . A A . 13 ARG NH2 1 1 5 2277 1 1 13 ARG O O -10.085 0.575 3.314 1.00 . A A . 13 ARG O 1 1 5 2278 1 1 14 PRO C C -10.239 -0.259 0.286 1.00 . A A . 14 PRO C 1 1 5 2279 1 1 14 PRO CA C -11.383 0.585 0.838 1.00 . A A . 14 PRO CA 1 1 5 2280 1 1 14 PRO CB C -12.196 1.196 -0.306 1.00 . A A . 14 PRO CB 1 1 5 2281 1 1 14 PRO CD C -11.182 3.015 0.869 1.00 . A A . 14 PRO CD 1 1 5 2282 1 1 14 PRO CG C -11.619 2.557 -0.496 1.00 . A A . 14 PRO CG 1 1 5 2283 1 1 14 PRO HA H -12.025 -0.036 1.446 1.00 . A A . 14 PRO HA 1 1 5 2284 1 1 14 PRO HB3 H -13.238 1.245 -0.026 1.00 . A A . 14 PRO HB3 1 1 5 2285 1 1 14 PRO HD3 H -11.975 3.564 1.355 1.00 . A A . 14 PRO HD3 1 1 5 2286 1 1 14 PRO HG3 H -12.372 3.222 -0.890 1.00 . A A . 14 PRO HG3 1 1 5 2287 1 1 14 PRO N N -10.905 1.755 1.580 1.00 . A A . 14 PRO N 1 1 5 2288 1 1 14 PRO O O -10.235 -1.483 0.422 1.00 . A A . 14 PRO O 1 1 5 2289 1 1 15 ARG C C -6.990 -0.399 0.109 1.00 . A A . 15 ARG C 1 1 5 2290 1 1 15 ARG CA C -8.119 -0.287 -0.910 1.00 . A A . 15 ARG CA 1 1 5 2291 1 1 15 ARG CB C -7.625 0.450 -2.156 1.00 . A A . 15 ARG CB 1 1 5 2292 1 1 15 ARG CD C -8.411 0.802 -4.517 1.00 . A A . 15 ARG CD 1 1 5 2293 1 1 15 ARG CG C -8.026 -0.221 -3.460 1.00 . A A . 15 ARG CG 1 1 5 2294 1 1 15 ARG CZ C -10.345 -0.229 -5.633 1.00 . A A . 15 ARG CZ 1 1 5 2295 1 1 15 ARG H H -9.329 1.378 -0.413 1.00 . A A . 15 ARG H 1 1 5 2296 1 1 15 ARG HA H -8.434 -1.281 -1.191 1.00 . A A . 15 ARG HA 1 1 5 2297 1 1 15 ARG HB3 H -6.547 0.507 -2.122 1.00 . A A . 15 ARG HB3 1 1 5 2298 1 1 15 ARG HD3 H -7.822 0.621 -5.404 1.00 . A A . 15 ARG HD3 1 1 5 2299 1 1 15 ARG HE H -10.422 1.415 -4.505 1.00 . A A . 15 ARG HE 1 1 5 2300 1 1 15 ARG HG3 H -8.869 -0.870 -3.274 1.00 . A A . 15 ARG HG3 1 1 5 2301 1 1 15 ARG HH11 H -8.586 -1.178 -5.930 1.00 . A A . 15 ARG HH11 1 1 5 2302 1 1 15 ARG HH12 H -9.957 -1.894 -6.711 1.00 . A A . 15 ARG HH12 1 1 5 2303 1 1 15 ARG HH21 H -12.235 0.481 -5.529 1.00 . A A . 15 ARG HH21 1 1 5 2304 1 1 15 ARG HH22 H -12.032 -0.948 -6.482 1.00 . A A . 15 ARG HH22 1 1 5 2305 1 1 15 ARG N N -9.269 0.403 -0.337 1.00 . A A . 15 ARG N 1 1 5 2306 1 1 15 ARG NE N -9.828 0.723 -4.863 1.00 . A A . 15 ARG NE 1 1 5 2307 1 1 15 ARG NH1 N -9.565 -1.177 -6.133 1.00 . A A . 15 ARG NH1 1 1 5 2308 1 1 15 ARG NH2 N -11.644 -0.233 -5.903 1.00 . A A . 15 ARG NH2 1 1 5 2309 1 1 15 ARG O O -6.258 0.561 0.350 1.00 . A A . 15 ARG O 1 1 5 2310 1 1 16 LYS C C -4.860 -2.916 1.235 1.00 . A A . 16 LYS C 1 1 5 2311 1 1 16 LYS CA C -5.813 -1.819 1.699 1.00 . A A . 16 LYS CA 1 1 5 2312 1 1 16 LYS CB C -6.439 -2.206 3.041 1.00 . A A . 16 LYS CB 1 1 5 2313 1 1 16 LYS CD C -5.393 -1.230 5.105 1.00 . A A . 16 LYS CD 1 1 5 2314 1 1 16 LYS CE C -4.107 -0.527 4.701 1.00 . A A . 16 LYS CE 1 1 5 2315 1 1 16 LYS CG C -6.472 -1.069 4.047 1.00 . A A . 16 LYS CG 1 1 5 2316 1 1 16 LYS H H -7.467 -2.306 0.472 1.00 . A A . 16 LYS H 1 1 5 2317 1 1 16 LYS HA H -5.255 -0.903 1.823 1.00 . A A . 16 LYS HA 1 1 5 2318 1 1 16 LYS HB3 H -5.871 -3.020 3.467 1.00 . A A . 16 LYS HB3 1 1 5 2319 1 1 16 LYS HD3 H -5.190 -2.283 5.243 1.00 . A A . 16 LYS HD3 1 1 5 2320 1 1 16 LYS HE3 H -4.195 0.523 4.938 1.00 . A A . 16 LYS HE3 1 1 5 2321 1 1 16 LYS HG3 H -7.439 -1.057 4.530 1.00 . A A . 16 LYS HG3 1 1 5 2322 1 1 16 LYS HZ1 H -2.046 -0.748 4.964 1.00 . A A . 16 LYS HZ1 1 1 5 2323 1 1 16 LYS HZ2 H -2.941 -2.125 5.371 1.00 . A A . 16 LYS HZ2 1 1 5 2324 1 1 16 LYS HZ3 H -2.928 -0.788 6.406 1.00 . A A . 16 LYS HZ3 1 1 5 2325 1 1 16 LYS N N -6.853 -1.579 0.706 1.00 . A A . 16 LYS N 1 1 5 2326 1 1 16 LYS NZ N -2.922 -1.086 5.409 1.00 . A A . 16 LYS NZ 1 1 5 2327 1 1 16 LYS O O -5.288 -4.019 0.889 1.00 . A A . 16 LYS O 1 1 5 2328 1 1 17 CYS C C -2.723 -4.895 1.544 1.00 . A A . 17 CYS C 1 1 5 2329 1 1 17 CYS CA C -2.555 -3.568 0.809 1.00 . A A . 17 CYS CA 1 1 5 2330 1 1 17 CYS CB C -1.154 -3.007 1.063 1.00 . A A . 17 CYS CB 1 1 5 2331 1 1 17 CYS H H -3.288 -1.712 1.517 1.00 . A A . 17 CYS H 1 1 5 2332 1 1 17 CYS HA H -2.678 -3.739 -0.249 1.00 . A A . 17 CYS HA 1 1 5 2333 1 1 17 CYS HB3 H -0.447 -3.822 1.092 1.00 . A A . 17 CYS HB3 1 1 5 2334 1 1 17 CYS N N -3.568 -2.608 1.230 1.00 . A A . 17 CYS N 1 1 5 2335 1 1 17 CYS O O -2.777 -4.931 2.773 1.00 . A A . 17 CYS O 1 1 5 2336 1 1 17 CYS SG S -0.586 -1.825 -0.203 1.00 . A A . 17 CYS SG 1 1 5 2337 1 1 18 GLN C C -1.915 -7.568 2.433 1.00 . A A . 18 GLN C 1 1 5 2338 1 1 18 GLN CA C -2.969 -7.309 1.362 1.00 . A A . 18 GLN CA 1 1 5 2339 1 1 18 GLN CB C -2.879 -8.378 0.271 1.00 . A A . 18 GLN CB 1 1 5 2340 1 1 18 GLN CD C -4.056 -10.504 0.963 1.00 . A A . 18 GLN CD 1 1 5 2341 1 1 18 GLN CG C -4.133 -9.228 0.147 1.00 . A A . 18 GLN CG 1 1 5 2342 1 1 18 GLN H H -2.757 -5.886 -0.191 1.00 . A A . 18 GLN H 1 1 5 2343 1 1 18 GLN HA H -3.946 -7.354 1.817 1.00 . A A . 18 GLN HA 1 1 5 2344 1 1 18 GLN HB3 H -2.048 -9.032 0.493 1.00 . A A . 18 GLN HB3 1 1 5 2345 1 1 18 GLN HE21 H -3.809 -11.576 -0.694 1.00 . A A . 18 GLN HE21 1 1 5 2346 1 1 18 GLN HE22 H -3.825 -12.470 0.784 1.00 . A A . 18 GLN HE22 1 1 5 2347 1 1 18 GLN HG3 H -4.274 -9.489 -0.890 1.00 . A A . 18 GLN HG3 1 1 5 2348 1 1 18 GLN N N -2.806 -5.980 0.782 1.00 . A A . 18 GLN N 1 1 5 2349 1 1 18 GLN NE2 N -3.880 -11.631 0.283 1.00 . A A . 18 GLN NE2 1 1 5 2350 1 1 18 GLN O O -2.228 -7.821 3.597 1.00 . A A . 18 GLN O 1 1 5 2351 1 1 18 GLN OE1 O -4.154 -10.477 2.190 1.00 . A A . 18 GLN OE1 1 1 5 2352 1 1 19 PRO C C 0.648 -6.603 3.961 1.00 . A A . 19 PRO C 1 1 5 2353 1 1 19 PRO CA C 0.489 -7.730 2.946 1.00 . A A . 19 PRO CA 1 1 5 2354 1 1 19 PRO CB C 1.699 -7.781 2.009 1.00 . A A . 19 PRO CB 1 1 5 2355 1 1 19 PRO CD C -0.190 -7.208 0.662 1.00 . A A . 19 PRO CD 1 1 5 2356 1 1 19 PRO CG C 1.288 -6.988 0.816 1.00 . A A . 19 PRO CG 1 1 5 2357 1 1 19 PRO HA H 0.395 -8.672 3.467 1.00 . A A . 19 PRO HA 1 1 5 2358 1 1 19 PRO HB3 H 1.913 -8.805 1.747 1.00 . A A . 19 PRO HB3 1 1 5 2359 1 1 19 PRO HD3 H -0.382 -8.045 0.006 1.00 . A A . 19 PRO HD3 1 1 5 2360 1 1 19 PRO HG3 H 1.812 -7.343 -0.058 1.00 . A A . 19 PRO HG3 1 1 5 2361 1 1 19 PRO N N -0.636 -7.504 2.034 1.00 . A A . 19 PRO N 1 1 5 2362 1 1 19 PRO O O 0.013 -5.553 3.863 1.00 . A A . 19 PRO O 1 1 5 2363 1 1 20 PRO C C 2.536 -4.621 5.489 1.00 . A A . 20 PRO C 1 1 5 2364 1 1 20 PRO CA C 1.778 -5.837 6.011 1.00 . A A . 20 PRO CA 1 1 5 2365 1 1 20 PRO CB C 2.636 -6.610 7.016 1.00 . A A . 20 PRO CB 1 1 5 2366 1 1 20 PRO CD C 2.307 -8.052 5.139 1.00 . A A . 20 PRO CD 1 1 5 2367 1 1 20 PRO CG C 3.292 -7.679 6.212 1.00 . A A . 20 PRO CG 1 1 5 2368 1 1 20 PRO HA H 0.865 -5.513 6.488 1.00 . A A . 20 PRO HA 1 1 5 2369 1 1 20 PRO HB3 H 2.005 -7.027 7.787 1.00 . A A . 20 PRO HB3 1 1 5 2370 1 1 20 PRO HD3 H 1.682 -8.869 5.467 1.00 . A A . 20 PRO HD3 1 1 5 2371 1 1 20 PRO HG3 H 3.503 -8.532 6.839 1.00 . A A . 20 PRO HG3 1 1 5 2372 1 1 20 PRO N N 1.515 -6.823 4.960 1.00 . A A . 20 PRO N 1 1 5 2373 1 1 20 PRO O O 3.768 -4.596 5.491 1.00 . A A . 20 PRO O 1 1 5 2374 1 1 21 LEU C C 2.044 -1.192 5.392 1.00 . A A . 21 LEU C 1 1 5 2375 1 1 21 LEU CA C 2.397 -2.393 4.519 1.00 . A A . 21 LEU CA 1 1 5 2376 1 1 21 LEU CB C 1.931 -2.147 3.083 1.00 . A A . 21 LEU CB 1 1 5 2377 1 1 21 LEU CD1 C 4.067 -2.118 1.773 1.00 . A A . 21 LEU CD1 1 1 5 2378 1 1 21 LEU CD2 C 2.979 -4.298 2.335 1.00 . A A . 21 LEU CD2 1 1 5 2379 1 1 21 LEU CG C 2.744 -2.836 1.986 1.00 . A A . 21 LEU CG 1 1 5 2380 1 1 21 LEU H H 0.818 -3.691 5.068 1.00 . A A . 21 LEU H 1 1 5 2381 1 1 21 LEU HA H 3.468 -2.524 4.524 1.00 . A A . 21 LEU HA 1 1 5 2382 1 1 21 LEU HB3 H 1.966 -1.082 2.902 1.00 . A A . 21 LEU HB3 1 1 5 2383 1 1 21 LEU HD11 H 4.513 -1.894 2.729 1.00 . A A . 21 LEU HD11 1 1 5 2384 1 1 21 LEU HD12 H 3.895 -1.200 1.230 1.00 . A A . 21 LEU HD12 1 1 5 2385 1 1 21 LEU HD13 H 4.733 -2.752 1.204 1.00 . A A . 21 LEU HD13 1 1 5 2386 1 1 21 LEU HD21 H 3.843 -4.381 2.977 1.00 . A A . 21 LEU HD21 1 1 5 2387 1 1 21 LEU HD22 H 3.147 -4.862 1.429 1.00 . A A . 21 LEU HD22 1 1 5 2388 1 1 21 LEU HD23 H 2.111 -4.690 2.847 1.00 . A A . 21 LEU HD23 1 1 5 2389 1 1 21 LEU HG H 2.190 -2.798 1.059 1.00 . A A . 21 LEU HG 1 1 5 2390 1 1 21 LEU N N 1.794 -3.613 5.043 1.00 . A A . 21 LEU N 1 1 5 2391 1 1 21 LEU O O 1.316 -1.320 6.377 1.00 . A A . 21 LEU O 1 1 5 2392 1 1 22 LYS C C 2.166 2.391 4.828 1.00 . A A . 22 LYS C 1 1 5 2393 1 1 22 LYS CA C 2.302 1.198 5.770 1.00 . A A . 22 LYS CA 1 1 5 2394 1 1 22 LYS CB C 3.425 1.456 6.777 1.00 . A A . 22 LYS CB 1 1 5 2395 1 1 22 LYS CD C 3.883 3.515 8.141 1.00 . A A . 22 LYS CD 1 1 5 2396 1 1 22 LYS CE C 4.226 3.751 9.604 1.00 . A A . 22 LYS CE 1 1 5 2397 1 1 22 LYS CG C 2.994 2.295 7.967 1.00 . A A . 22 LYS CG 1 1 5 2398 1 1 22 LYS H H 3.137 0.011 4.229 1.00 . A A . 22 LYS H 1 1 5 2399 1 1 22 LYS HA H 1.374 1.069 6.305 1.00 . A A . 22 LYS HA 1 1 5 2400 1 1 22 LYS HB3 H 4.232 1.970 6.274 1.00 . A A . 22 LYS HB3 1 1 5 2401 1 1 22 LYS HD3 H 3.365 4.384 7.757 1.00 . A A . 22 LYS HD3 1 1 5 2402 1 1 22 LYS HE3 H 4.303 2.796 10.100 1.00 . A A . 22 LYS HE3 1 1 5 2403 1 1 22 LYS HG3 H 3.051 1.690 8.862 1.00 . A A . 22 LYS HG3 1 1 5 2404 1 1 22 LYS HZ1 H 6.313 3.839 9.597 1.00 . A A . 22 LYS HZ1 1 1 5 2405 1 1 22 LYS HZ2 H 5.587 4.874 10.721 1.00 . A A . 22 LYS HZ2 1 1 5 2406 1 1 22 LYS HZ3 H 5.567 5.264 9.075 1.00 . A A . 22 LYS HZ3 1 1 5 2407 1 1 22 LYS N N 2.564 -0.027 5.024 1.00 . A A . 22 LYS N 1 1 5 2408 1 1 22 LYS NZ N 5.514 4.483 9.760 1.00 . A A . 22 LYS NZ 1 1 5 2409 1 1 22 LYS O O 2.629 2.351 3.688 1.00 . A A . 22 LYS O 1 1 5 2410 1 1 23 CYS C C 2.342 5.733 4.899 1.00 . A A . 23 CYS C 1 1 5 2411 1 1 23 CYS CA C 1.331 4.656 4.516 1.00 . A A . 23 CYS CA 1 1 5 2412 1 1 23 CYS CB C -0.092 5.187 4.698 1.00 . A A . 23 CYS CB 1 1 5 2413 1 1 23 CYS H H 1.180 3.423 6.230 1.00 . A A . 23 CYS H 1 1 5 2414 1 1 23 CYS HA H 1.479 4.395 3.478 1.00 . A A . 23 CYS HA 1 1 5 2415 1 1 23 CYS HB3 H -0.250 6.013 4.020 1.00 . A A . 23 CYS HB3 1 1 5 2416 1 1 23 CYS N N 1.528 3.451 5.312 1.00 . A A . 23 CYS N 1 1 5 2417 1 1 23 CYS O O 3.186 5.525 5.769 1.00 . A A . 23 CYS O 1 1 5 2418 1 1 23 CYS SG S -1.392 3.951 4.380 1.00 . A A . 23 CYS SG 1 1 5 2419 1 1 24 ASN C C 2.381 9.306 4.652 1.00 . A A . 24 ASN C 1 1 5 2420 1 1 24 ASN CA C 3.152 7.996 4.517 1.00 . A A . 24 ASN CA 1 1 5 2421 1 1 24 ASN CB C 4.194 8.117 3.403 1.00 . A A . 24 ASN CB 1 1 5 2422 1 1 24 ASN CG C 3.670 7.630 2.065 1.00 . A A . 24 ASN CG 1 1 5 2423 1 1 24 ASN H H 1.553 6.992 3.561 1.00 . A A . 24 ASN H 1 1 5 2424 1 1 24 ASN HA H 3.656 7.792 5.449 1.00 . A A . 24 ASN HA 1 1 5 2425 1 1 24 ASN HB3 H 5.061 7.531 3.664 1.00 . A A . 24 ASN HB3 1 1 5 2426 1 1 24 ASN HD21 H 3.490 9.505 1.426 1.00 . A A . 24 ASN HD21 1 1 5 2427 1 1 24 ASN HD22 H 3.021 8.280 0.302 1.00 . A A . 24 ASN HD22 1 1 5 2428 1 1 24 ASN N N 2.247 6.886 4.245 1.00 . A A . 24 ASN N 1 1 5 2429 1 1 24 ASN ND2 N 3.363 8.566 1.175 1.00 . A A . 24 ASN ND2 1 1 5 2430 1 1 24 ASN O O 2.218 9.833 5.751 1.00 . A A . 24 ASN O 1 1 5 2431 1 1 24 ASN OD1 O 3.543 6.428 1.836 1.00 . A A . 24 ASN OD1 1 1 5 2432 1 1 25 LYS C C 0.718 11.435 2.097 1.00 . A A . 25 LYS C 1 1 5 2433 1 1 25 LYS CA C 1.152 11.072 3.515 1.00 . A A . 25 LYS CA 1 1 5 2434 1 1 25 LYS CB C 1.990 12.206 4.108 1.00 . A A . 25 LYS CB 1 1 5 2435 1 1 25 LYS CD C 3.792 13.651 3.119 1.00 . A A . 25 LYS CD 1 1 5 2436 1 1 25 LYS CE C 4.976 13.625 2.167 1.00 . A A . 25 LYS CE 1 1 5 2437 1 1 25 LYS CG C 3.412 12.253 3.577 1.00 . A A . 25 LYS CG 1 1 5 2438 1 1 25 LYS H H 2.069 9.359 2.678 1.00 . A A . 25 LYS H 1 1 5 2439 1 1 25 LYS HA H 0.271 10.931 4.122 1.00 . A A . 25 LYS HA 1 1 5 2440 1 1 25 LYS HB3 H 2.033 12.083 5.180 1.00 . A A . 25 LYS HB3 1 1 5 2441 1 1 25 LYS HD3 H 4.049 14.247 3.984 1.00 . A A . 25 LYS HD3 1 1 5 2442 1 1 25 LYS HE3 H 4.648 13.962 1.195 1.00 . A A . 25 LYS HE3 1 1 5 2443 1 1 25 LYS HG3 H 3.497 11.575 2.739 1.00 . A A . 25 LYS HG3 1 1 5 2444 1 1 25 LYS HZ1 H 6.985 14.198 2.211 1.00 . A A . 25 LYS HZ1 1 1 5 2445 1 1 25 LYS HZ2 H 6.167 14.448 3.671 1.00 . A A . 25 LYS HZ2 1 1 5 2446 1 1 25 LYS HZ3 H 5.900 15.487 2.364 1.00 . A A . 25 LYS HZ3 1 1 5 2447 1 1 25 LYS N N 1.907 9.825 3.524 1.00 . A A . 25 LYS N 1 1 5 2448 1 1 25 LYS NZ N 6.085 14.501 2.636 1.00 . A A . 25 LYS NZ 1 1 5 2449 1 1 25 LYS O O 0.654 12.610 1.739 1.00 . A A . 25 LYS O 1 1 5 2450 1 1 26 ALA C C -0.627 9.362 -0.664 1.00 . A A . 26 ALA C 1 1 5 2451 1 1 26 ALA CA C -0.012 10.629 -0.080 1.00 . A A . 26 ALA CA 1 1 5 2452 1 1 26 ALA CB C 1.158 11.093 -0.934 1.00 . A A . 26 ALA CB 1 1 5 2453 1 1 26 ALA H H 0.488 9.503 1.640 1.00 . A A . 26 ALA H 1 1 5 2454 1 1 26 ALA HA H -0.758 11.412 -0.079 1.00 . A A . 26 ALA HA 1 1 5 2455 1 1 26 ALA HB1 H 2.010 10.453 -0.753 1.00 . A A . 26 ALA HB1 1 1 5 2456 1 1 26 ALA HB2 H 0.885 11.044 -1.977 1.00 . A A . 26 ALA HB2 1 1 5 2457 1 1 26 ALA HB3 H 1.411 12.110 -0.676 1.00 . A A . 26 ALA HB3 1 1 5 2458 1 1 26 ALA N N 0.419 10.417 1.297 1.00 . A A . 26 ALA N 1 1 5 2459 1 1 26 ALA O O -0.589 9.145 -1.875 1.00 . A A . 26 ALA O 1 1 5 2460 1 1 27 GLN C C -0.810 6.401 -0.965 1.00 . A A . 27 GLN C 1 1 5 2461 1 1 27 GLN CA C -1.813 7.283 -0.227 1.00 . A A . 27 GLN CA 1 1 5 2462 1 1 27 GLN CB C -3.014 7.572 -1.128 1.00 . A A . 27 GLN CB 1 1 5 2463 1 1 27 GLN CD C -5.166 8.858 -1.447 1.00 . A A . 27 GLN CD 1 1 5 2464 1 1 27 GLN CG C -3.939 8.648 -0.582 1.00 . A A . 27 GLN CG 1 1 5 2465 1 1 27 GLN H H -1.190 8.758 1.156 1.00 . A A . 27 GLN H 1 1 5 2466 1 1 27 GLN HA H -2.152 6.759 0.654 1.00 . A A . 27 GLN HA 1 1 5 2467 1 1 27 GLN HB3 H -3.586 6.664 -1.248 1.00 . A A . 27 GLN HB3 1 1 5 2468 1 1 27 GLN HE21 H -6.305 9.047 0.171 1.00 . A A . 27 GLN HE21 1 1 5 2469 1 1 27 GLN HE22 H -7.123 9.189 -1.344 1.00 . A A . 27 GLN HE22 1 1 5 2470 1 1 27 GLN HG3 H -3.394 9.578 -0.525 1.00 . A A . 27 GLN HG3 1 1 5 2471 1 1 27 GLN N N -1.192 8.529 0.204 1.00 . A A . 27 GLN N 1 1 5 2472 1 1 27 GLN NE2 N -6.315 9.051 -0.809 1.00 . A A . 27 GLN NE2 1 1 5 2473 1 1 27 GLN O O -0.968 6.128 -2.156 1.00 . A A . 27 GLN O 1 1 5 2474 1 1 27 GLN OE1 O -5.082 8.847 -2.675 1.00 . A A . 27 GLN OE1 1 1 5 2475 1 1 28 ILE C C 1.714 4.048 0.151 1.00 . A A . 28 ILE C 1 1 5 2476 1 1 28 ILE CA C 1.248 5.111 -0.839 1.00 . A A . 28 ILE CA 1 1 5 2477 1 1 28 ILE CB C 2.465 5.934 -1.301 1.00 . A A . 28 ILE CB 1 1 5 2478 1 1 28 ILE CD1 C 3.147 8.116 -2.419 1.00 . A A . 28 ILE CD1 1 1 5 2479 1 1 28 ILE CG1 C 2.007 7.256 -1.920 1.00 . A A . 28 ILE CG1 1 1 5 2480 1 1 28 ILE CG2 C 3.298 5.138 -2.294 1.00 . A A . 28 ILE CG2 1 1 5 2481 1 1 28 ILE H H 0.291 6.213 0.692 1.00 . A A . 28 ILE H 1 1 5 2482 1 1 28 ILE HA H 0.821 4.620 -1.702 1.00 . A A . 28 ILE HA 1 1 5 2483 1 1 28 ILE HB H 3.079 6.142 -0.438 1.00 . A A . 28 ILE HB 1 1 5 2484 1 1 28 ILE HD11 H 4.071 7.789 -1.965 1.00 . A A . 28 ILE HD11 1 1 5 2485 1 1 28 ILE HD12 H 3.224 8.025 -3.493 1.00 . A A . 28 ILE HD12 1 1 5 2486 1 1 28 ILE HD13 H 2.962 9.147 -2.158 1.00 . A A . 28 ILE HD13 1 1 5 2487 1 1 28 ILE HG13 H 1.462 7.823 -1.179 1.00 . A A . 28 ILE HG13 1 1 5 2488 1 1 28 ILE HG21 H 4.297 5.010 -1.905 1.00 . A A . 28 ILE HG21 1 1 5 2489 1 1 28 ILE HG22 H 2.846 4.169 -2.447 1.00 . A A . 28 ILE HG22 1 1 5 2490 1 1 28 ILE HG23 H 3.342 5.668 -3.234 1.00 . A A . 28 ILE HG23 1 1 5 2491 1 1 28 ILE N N 0.221 5.961 -0.252 1.00 . A A . 28 ILE N 1 1 5 2492 1 1 28 ILE O O 2.081 4.358 1.285 1.00 . A A . 28 ILE O 1 1 5 2493 1 1 29 CYS C C 3.640 1.642 0.686 1.00 . A A . 29 CYS C 1 1 5 2494 1 1 29 CYS CA C 2.121 1.682 0.560 1.00 . A A . 29 CYS CA 1 1 5 2495 1 1 29 CYS CB C 1.610 0.357 -0.009 1.00 . A A . 29 CYS CB 1 1 5 2496 1 1 29 CYS H H 1.395 2.608 -1.201 1.00 . A A . 29 CYS H 1 1 5 2497 1 1 29 CYS HA H 1.694 1.832 1.540 1.00 . A A . 29 CYS HA 1 1 5 2498 1 1 29 CYS HB3 H 2.394 -0.380 0.058 1.00 . A A . 29 CYS HB3 1 1 5 2499 1 1 29 CYS N N 1.699 2.793 -0.286 1.00 . A A . 29 CYS N 1 1 5 2500 1 1 29 CYS O O 4.362 1.869 -0.287 1.00 . A A . 29 CYS O 1 1 5 2501 1 1 29 CYS SG S 0.148 -0.307 0.851 1.00 . A A . 29 CYS SG 1 1 5 2502 1 1 30 VAL C C 5.851 0.486 3.412 1.00 . A A . 30 VAL C 1 1 5 2503 1 1 30 VAL CA C 5.556 1.280 2.144 1.00 . A A . 30 VAL CA 1 1 5 2504 1 1 30 VAL CB C 6.174 2.685 2.275 1.00 . A A . 30 VAL CB 1 1 5 2505 1 1 30 VAL CG1 C 6.768 3.132 0.949 1.00 . A A . 30 VAL CG1 1 1 5 2506 1 1 30 VAL CG2 C 5.133 3.679 2.766 1.00 . A A . 30 VAL CG2 1 1 5 2507 1 1 30 VAL H H 3.497 1.180 2.625 1.00 . A A . 30 VAL H 1 1 5 2508 1 1 30 VAL HA H 6.019 0.782 1.304 1.00 . A A . 30 VAL HA 1 1 5 2509 1 1 30 VAL HB H 6.970 2.638 3.003 1.00 . A A . 30 VAL HB 1 1 5 2510 1 1 30 VAL HG11 H 5.977 3.477 0.298 1.00 . A A . 30 VAL HG11 1 1 5 2511 1 1 30 VAL HG12 H 7.470 3.935 1.121 1.00 . A A . 30 VAL HG12 1 1 5 2512 1 1 30 VAL HG13 H 7.278 2.301 0.484 1.00 . A A . 30 VAL HG13 1 1 5 2513 1 1 30 VAL HG21 H 4.707 3.327 3.693 1.00 . A A . 30 VAL HG21 1 1 5 2514 1 1 30 VAL HG22 H 5.603 4.639 2.928 1.00 . A A . 30 VAL HG22 1 1 5 2515 1 1 30 VAL HG23 H 4.353 3.781 2.026 1.00 . A A . 30 VAL HG23 1 1 5 2516 1 1 30 VAL N N 4.122 1.351 1.889 1.00 . A A . 30 VAL N 1 1 5 2517 1 1 30 VAL O O 4.935 0.040 4.104 1.00 . A A . 30 VAL O 1 1 5 2518 1 1 31 ASP C C 9.071 -0.508 4.979 1.00 . A A . 31 ASP C 1 1 5 2519 1 1 31 ASP CA C 7.550 -0.425 4.896 1.00 . A A . 31 ASP CA 1 1 5 2520 1 1 31 ASP CB C 6.949 -1.832 4.884 1.00 . A A . 31 ASP CB 1 1 5 2521 1 1 31 ASP CG C 5.930 -2.036 5.987 1.00 . A A . 31 ASP CG 1 1 5 2522 1 1 31 ASP H H 7.817 0.693 3.118 1.00 . A A . 31 ASP H 1 1 5 2523 1 1 31 ASP HA H 7.183 0.105 5.763 1.00 . A A . 31 ASP HA 1 1 5 2524 1 1 31 ASP HB3 H 7.742 -2.555 5.011 1.00 . A A . 31 ASP HB3 1 1 5 2525 1 1 31 ASP N N 7.133 0.313 3.710 1.00 . A A . 31 ASP N 1 1 5 2526 1 1 31 ASP O O 9.780 -0.345 3.986 1.00 . A A . 31 ASP O 1 1 5 2527 1 1 31 ASP OD1 O 5.319 -1.037 6.422 1.00 . A A . 31 ASP OD1 1 1 5 2528 1 1 31 ASP OD2 O 5.745 -3.194 6.418 1.00 . A A . 31 ASP OD2 1 1 5 2529 1 1 32 PRO C C 11.626 -2.130 5.802 1.00 . A A . 32 PRO C 1 1 5 2530 1 1 32 PRO CA C 11.026 -0.876 6.431 1.00 . A A . 32 PRO CA 1 1 5 2531 1 1 32 PRO CB C 11.127 -0.945 7.958 1.00 . A A . 32 PRO CB 1 1 5 2532 1 1 32 PRO CD C 8.798 -0.973 7.418 1.00 . A A . 32 PRO CD 1 1 5 2533 1 1 32 PRO CG C 9.813 -1.491 8.399 1.00 . A A . 32 PRO CG 1 1 5 2534 1 1 32 PRO HA H 11.556 -0.006 6.074 1.00 . A A . 32 PRO HA 1 1 5 2535 1 1 32 PRO HB3 H 11.297 0.044 8.355 1.00 . A A . 32 PRO HB3 1 1 5 2536 1 1 32 PRO HD3 H 8.378 -0.041 7.766 1.00 . A A . 32 PRO HD3 1 1 5 2537 1 1 32 PRO HG3 H 9.585 -1.139 9.395 1.00 . A A . 32 PRO HG3 1 1 5 2538 1 1 32 PRO N N 9.585 -0.767 6.190 1.00 . A A . 32 PRO N 1 1 5 2539 1 1 32 PRO O O 12.255 -2.940 6.482 1.00 . A A . 32 PRO O 1 1 5 2540 1 1 33 LYS C C 12.322 -3.059 2.343 1.00 . A A . 33 LYS C 1 1 5 2541 1 1 33 LYS CA C 11.949 -3.436 3.773 1.00 . A A . 33 LYS CA 1 1 5 2542 1 1 33 LYS CB C 10.918 -4.567 3.761 1.00 . A A . 33 LYS CB 1 1 5 2543 1 1 33 LYS CD C 10.180 -6.778 4.698 1.00 . A A . 33 LYS CD 1 1 5 2544 1 1 33 LYS CE C 10.356 -7.836 3.621 1.00 . A A . 33 LYS CE 1 1 5 2545 1 1 33 LYS CG C 11.291 -5.741 4.648 1.00 . A A . 33 LYS CG 1 1 5 2546 1 1 33 LYS H H 10.917 -1.603 4.008 1.00 . A A . 33 LYS H 1 1 5 2547 1 1 33 LYS HA H 12.836 -3.776 4.286 1.00 . A A . 33 LYS HA 1 1 5 2548 1 1 33 LYS HB3 H 10.810 -4.927 2.748 1.00 . A A . 33 LYS HB3 1 1 5 2549 1 1 33 LYS HD3 H 9.231 -6.282 4.551 1.00 . A A . 33 LYS HD3 1 1 5 2550 1 1 33 LYS HE3 H 10.926 -8.657 4.031 1.00 . A A . 33 LYS HE3 1 1 5 2551 1 1 33 LYS HG3 H 11.479 -5.379 5.649 1.00 . A A . 33 LYS HG3 1 1 5 2552 1 1 33 LYS HZ1 H 8.268 -7.894 3.643 1.00 . A A . 33 LYS HZ1 1 1 5 2553 1 1 33 LYS HZ2 H 8.991 -9.379 3.277 1.00 . A A . 33 LYS HZ2 1 1 5 2554 1 1 33 LYS HZ3 H 8.944 -8.151 2.114 1.00 . A A . 33 LYS HZ3 1 1 5 2555 1 1 33 LYS N N 11.427 -2.283 4.497 1.00 . A A . 33 LYS N 1 1 5 2556 1 1 33 LYS NZ N 9.049 -8.351 3.130 1.00 . A A . 33 LYS NZ 1 1 5 2557 1 1 33 LYS O O 13.408 -3.388 1.866 1.00 . A A . 33 LYS O 1 1 5 2558 1 1 34 LYS C C 10.647 -0.867 -0.127 1.00 . A A . 34 LYS C 1 1 5 2559 1 1 34 LYS CA C 11.651 -1.937 0.290 1.00 . A A . 34 LYS CA 1 1 5 2560 1 1 34 LYS CB C 11.560 -3.135 -0.659 1.00 . A A . 34 LYS CB 1 1 5 2561 1 1 34 LYS CD C 12.147 -2.399 -2.988 1.00 . A A . 34 LYS CD 1 1 5 2562 1 1 34 LYS CE C 12.745 -3.000 -4.251 1.00 . A A . 34 LYS CE 1 1 5 2563 1 1 34 LYS CG C 12.622 -3.131 -1.745 1.00 . A A . 34 LYS CG 1 1 5 2564 1 1 34 LYS H H 10.569 -2.130 2.099 1.00 . A A . 34 LYS H 1 1 5 2565 1 1 34 LYS HA H 12.645 -1.521 0.237 1.00 . A A . 34 LYS HA 1 1 5 2566 1 1 34 LYS HB3 H 10.589 -3.128 -1.134 1.00 . A A . 34 LYS HB3 1 1 5 2567 1 1 34 LYS HD3 H 12.441 -1.362 -2.920 1.00 . A A . 34 LYS HD3 1 1 5 2568 1 1 34 LYS HE3 H 12.248 -2.570 -5.109 1.00 . A A . 34 LYS HE3 1 1 5 2569 1 1 34 LYS HG3 H 12.858 -4.153 -2.007 1.00 . A A . 34 LYS HG3 1 1 5 2570 1 1 34 LYS HZ1 H 14.684 -3.538 -4.811 1.00 . A A . 34 LYS HZ1 1 1 5 2571 1 1 34 LYS HZ2 H 14.611 -2.598 -3.406 1.00 . A A . 34 LYS HZ2 1 1 5 2572 1 1 34 LYS HZ3 H 14.375 -1.879 -4.918 1.00 . A A . 34 LYS HZ3 1 1 5 2573 1 1 34 LYS N N 11.417 -2.363 1.665 1.00 . A A . 34 LYS N 1 1 5 2574 1 1 34 LYS NZ N 14.206 -2.735 -4.354 1.00 . A A . 34 LYS NZ 1 1 5 2575 1 1 34 LYS O O 9.465 -1.152 -0.320 1.00 . A A . 34 LYS O 1 1 5 2576 1 1 35 GLY C C 10.999 2.552 -1.401 1.00 . A A . 35 GLY C 1 1 5 2577 1 1 35 GLY CA C 10.255 1.458 -0.659 1.00 . A A . 35 GLY CA 1 1 5 2578 1 1 35 GLY H H 12.076 0.535 -0.098 1.00 . A A . 35 GLY H 1 1 5 2579 1 1 35 GLY HA2 H 9.475 1.071 -1.298 1.00 . A A . 35 GLY HA2 1 1 5 2580 1 1 35 GLY HA3 H 9.804 1.883 0.226 1.00 . A A . 35 GLY HA3 1 1 5 2581 1 1 35 GLY N N 11.124 0.366 -0.265 1.00 . A A . 35 GLY N 1 1 5 2582 1 1 35 GLY O O 11.089 2.527 -2.629 1.00 . A A . 35 GLY O 1 1 5 2583 1 1 36 TRP C C 13.682 4.195 -1.629 1.00 . A A . 36 TRP C 1 1 5 2584 1 1 36 TRP CA C 12.267 4.622 -1.251 1.00 . A A . 36 TRP CA 1 1 5 2585 1 1 36 TRP CB C 12.321 5.805 -0.282 1.00 . A A . 36 TRP CB 1 1 5 2586 1 1 36 TRP CD1 C 12.547 7.602 -2.095 1.00 . A A . 36 TRP CD1 1 1 5 2587 1 1 36 TRP CD2 C 13.903 7.893 -0.336 1.00 . A A . 36 TRP CD2 1 1 5 2588 1 1 36 TRP CE2 C 14.124 8.940 -1.253 1.00 . A A . 36 TRP CE2 1 1 5 2589 1 1 36 TRP CE3 C 14.643 7.868 0.849 1.00 . A A . 36 TRP CE3 1 1 5 2590 1 1 36 TRP CG C 12.890 7.049 -0.895 1.00 . A A . 36 TRP CG 1 1 5 2591 1 1 36 TRP CH2 C 15.766 9.899 0.149 1.00 . A A . 36 TRP CH2 1 1 5 2592 1 1 36 TRP CZ2 C 15.055 9.948 -1.020 1.00 . A A . 36 TRP CZ2 1 1 5 2593 1 1 36 TRP CZ3 C 15.567 8.869 1.078 1.00 . A A . 36 TRP CZ3 1 1 5 2594 1 1 36 TRP H H 11.423 3.479 0.318 1.00 . A A . 36 TRP H 1 1 5 2595 1 1 36 TRP HA H 11.744 4.926 -2.146 1.00 . A A . 36 TRP HA 1 1 5 2596 1 1 36 TRP HB3 H 12.935 5.539 0.566 1.00 . A A . 36 TRP HB3 1 1 5 2597 1 1 36 TRP HD1 H 11.804 7.194 -2.763 1.00 . A A . 36 TRP HD1 1 1 5 2598 1 1 36 TRP HE1 H 13.222 9.314 -3.109 1.00 . A A . 36 TRP HE1 1 1 5 2599 1 1 36 TRP HE3 H 14.503 7.083 1.577 1.00 . A A . 36 TRP HE3 1 1 5 2600 1 1 36 TRP HH2 H 16.498 10.659 0.370 1.00 . A A . 36 TRP HH2 1 1 5 2601 1 1 36 TRP HZ2 H 15.220 10.749 -1.725 1.00 . A A . 36 TRP HZ2 1 1 5 2602 1 1 36 TRP HZ3 H 16.148 8.866 1.989 1.00 . A A . 36 TRP HZ3 1 1 5 2603 1 1 36 TRP N N 11.530 3.514 -0.656 1.00 . A A . 36 TRP N 1 1 5 2604 1 1 36 TRP NE1 N 13.286 8.739 -2.317 1.00 . A A . 36 TRP NE1 1 1 5 2605 1 1 36 TRP O O 14.267 3.319 -0.991 1.00 . A A . 36 TRP O 1 1 6 2606 1 1 1 ASP C C -12.315 -7.001 -2.541 1.00 . A A . 1 ASP C 1 1 6 2607 1 1 1 ASP CA C -12.867 -7.757 -1.336 1.00 . A A . 1 ASP CA 1 1 6 2608 1 1 1 ASP CB C -13.587 -6.787 -0.398 1.00 . A A . 1 ASP CB 1 1 6 2609 1 1 1 ASP CG C -14.836 -7.393 0.212 1.00 . A A . 1 ASP CG 1 1 6 2610 1 1 1 ASP H1 H -10.967 -8.659 -1.097 1.00 . A A . 1 ASP H1 1 1 6 2611 1 1 1 ASP HA H -13.572 -8.497 -1.684 1.00 . A A . 1 ASP HA 1 1 6 2612 1 1 1 ASP HB3 H -13.871 -5.904 -0.951 1.00 . A A . 1 ASP HB3 1 1 6 2613 1 1 1 ASP N N -11.801 -8.452 -0.626 1.00 . A A . 1 ASP N 1 1 6 2614 1 1 1 ASP O O -12.680 -7.280 -3.683 1.00 . A A . 1 ASP O 1 1 6 2615 1 1 1 ASP OD1 O -14.704 -8.326 1.031 1.00 . A A . 1 ASP OD1 1 1 6 2616 1 1 1 ASP OD2 O -15.946 -6.934 -0.130 1.00 . A A . 1 ASP OD2 1 1 6 2617 1 1 2 PHE C C -9.375 -5.642 -3.560 1.00 . A A . 2 PHE C 1 1 6 2618 1 1 2 PHE CA C -10.831 -5.244 -3.341 1.00 . A A . 2 PHE CA 1 1 6 2619 1 1 2 PHE CB C -10.920 -3.755 -3.001 1.00 . A A . 2 PHE CB 1 1 6 2620 1 1 2 PHE CD1 C -13.417 -3.651 -3.217 1.00 . A A . 2 PHE CD1 1 1 6 2621 1 1 2 PHE CD2 C -12.119 -1.935 -4.245 1.00 . A A . 2 PHE CD2 1 1 6 2622 1 1 2 PHE CE1 C -14.576 -3.051 -3.673 1.00 . A A . 2 PHE CE1 1 1 6 2623 1 1 2 PHE CE2 C -13.274 -1.331 -4.703 1.00 . A A . 2 PHE CE2 1 1 6 2624 1 1 2 PHE CG C -12.177 -3.101 -3.498 1.00 . A A . 2 PHE CG 1 1 6 2625 1 1 2 PHE CZ C -14.504 -1.889 -4.416 1.00 . A A . 2 PHE CZ 1 1 6 2626 1 1 2 PHE H H -11.181 -5.867 -1.347 1.00 . A A . 2 PHE H 1 1 6 2627 1 1 2 PHE HA H -11.384 -5.431 -4.248 1.00 . A A . 2 PHE HA 1 1 6 2628 1 1 2 PHE HB3 H -10.079 -3.242 -3.444 1.00 . A A . 2 PHE HB3 1 1 6 2629 1 1 2 PHE HD1 H -13.475 -4.559 -2.635 1.00 . A A . 2 PHE HD1 1 1 6 2630 1 1 2 PHE HD2 H -11.156 -1.497 -4.469 1.00 . A A . 2 PHE HD2 1 1 6 2631 1 1 2 PHE HE1 H -15.537 -3.489 -3.447 1.00 . A A . 2 PHE HE1 1 1 6 2632 1 1 2 PHE HE2 H -13.214 -0.422 -5.284 1.00 . A A . 2 PHE HE2 1 1 6 2633 1 1 2 PHE HZ H -15.408 -1.419 -4.774 1.00 . A A . 2 PHE HZ 1 1 6 2634 1 1 2 PHE N N -11.433 -6.042 -2.278 1.00 . A A . 2 PHE N 1 1 6 2635 1 1 2 PHE O O -8.734 -6.250 -2.703 1.00 . A A . 2 PHE O 1 1 6 2636 1 1 3 PRO C C -6.446 -4.790 -4.290 1.00 . A A . 3 PRO C 1 1 6 2637 1 1 3 PRO CA C -7.451 -5.601 -5.101 1.00 . A A . 3 PRO CA 1 1 6 2638 1 1 3 PRO CB C -7.377 -5.219 -6.581 1.00 . A A . 3 PRO CB 1 1 6 2639 1 1 3 PRO CD C -9.543 -4.565 -5.808 1.00 . A A . 3 PRO CD 1 1 6 2640 1 1 3 PRO CG C -8.440 -4.191 -6.761 1.00 . A A . 3 PRO CG 1 1 6 2641 1 1 3 PRO HA H -7.238 -6.654 -4.988 1.00 . A A . 3 PRO HA 1 1 6 2642 1 1 3 PRO HB3 H -7.563 -6.090 -7.191 1.00 . A A . 3 PRO HB3 1 1 6 2643 1 1 3 PRO HD3 H -10.263 -5.205 -6.297 1.00 . A A . 3 PRO HD3 1 1 6 2644 1 1 3 PRO HG3 H -8.802 -4.212 -7.778 1.00 . A A . 3 PRO HG3 1 1 6 2645 1 1 3 PRO N N -8.838 -5.291 -4.739 1.00 . A A . 3 PRO N 1 1 6 2646 1 1 3 PRO O O -6.825 -3.943 -3.481 1.00 . A A . 3 PRO O 1 1 6 2647 1 1 4 LEU C C -2.793 -4.406 -4.584 1.00 . A A . 4 LEU C 1 1 6 2648 1 1 4 LEU CA C -4.102 -4.349 -3.803 1.00 . A A . 4 LEU CA 1 1 6 2649 1 1 4 LEU CB C -3.906 -4.949 -2.410 1.00 . A A . 4 LEU CB 1 1 6 2650 1 1 4 LEU CD1 C -5.437 -6.932 -2.330 1.00 . A A . 4 LEU CD1 1 1 6 2651 1 1 4 LEU CD2 C -3.214 -7.118 -3.460 1.00 . A A . 4 LEU CD2 1 1 6 2652 1 1 4 LEU CG C -3.987 -6.474 -2.319 1.00 . A A . 4 LEU CG 1 1 6 2653 1 1 4 LEU H H -4.923 -5.740 -5.170 1.00 . A A . 4 LEU H 1 1 6 2654 1 1 4 LEU HA H -4.402 -3.316 -3.702 1.00 . A A . 4 LEU HA 1 1 6 2655 1 1 4 LEU HB3 H -4.667 -4.537 -1.763 1.00 . A A . 4 LEU HB3 1 1 6 2656 1 1 4 LEU HD11 H -6.062 -6.160 -1.907 1.00 . A A . 4 LEU HD11 1 1 6 2657 1 1 4 LEU HD12 H -5.534 -7.835 -1.745 1.00 . A A . 4 LEU HD12 1 1 6 2658 1 1 4 LEU HD13 H -5.745 -7.128 -3.348 1.00 . A A . 4 LEU HD13 1 1 6 2659 1 1 4 LEU HD21 H -2.273 -6.605 -3.593 1.00 . A A . 4 LEU HD21 1 1 6 2660 1 1 4 LEU HD22 H -3.792 -7.051 -4.370 1.00 . A A . 4 LEU HD22 1 1 6 2661 1 1 4 LEU HD23 H -3.028 -8.157 -3.227 1.00 . A A . 4 LEU HD23 1 1 6 2662 1 1 4 LEU HG H -3.542 -6.797 -1.388 1.00 . A A . 4 LEU HG 1 1 6 2663 1 1 4 LEU N N -5.163 -5.054 -4.512 1.00 . A A . 4 LEU N 1 1 6 2664 1 1 4 LEU O O -2.735 -4.966 -5.678 1.00 . A A . 4 LEU O 1 1 6 2665 1 1 5 SER C C 0.674 -3.607 -3.625 1.00 . A A . 5 SER C 1 1 6 2666 1 1 5 SER CA C -0.434 -3.810 -4.654 1.00 . A A . 5 SER CA 1 1 6 2667 1 1 5 SER CB C -0.374 -2.703 -5.709 1.00 . A A . 5 SER CB 1 1 6 2668 1 1 5 SER H H -1.852 -3.395 -3.138 1.00 . A A . 5 SER H 1 1 6 2669 1 1 5 SER HA H -0.290 -4.765 -5.138 1.00 . A A . 5 SER HA 1 1 6 2670 1 1 5 SER HB3 H 0.638 -2.614 -6.076 1.00 . A A . 5 SER HB3 1 1 6 2671 1 1 5 SER HG H -1.193 -3.930 -6.998 1.00 . A A . 5 SER HG 1 1 6 2672 1 1 5 SER N N -1.743 -3.826 -4.012 1.00 . A A . 5 SER N 1 1 6 2673 1 1 5 SER O O 0.616 -2.693 -2.803 1.00 . A A . 5 SER O 1 1 6 2674 1 1 5 SER OG O -1.231 -2.992 -6.800 1.00 . A A . 5 SER OG 1 1 6 2675 1 1 6 LYS C C 3.627 -3.124 -3.000 1.00 . A A . 6 LYS C 1 1 6 2676 1 1 6 LYS CA C 2.808 -4.387 -2.751 1.00 . A A . 6 LYS CA 1 1 6 2677 1 1 6 LYS CB C 3.702 -5.622 -2.890 1.00 . A A . 6 LYS CB 1 1 6 2678 1 1 6 LYS CD C 3.705 -7.112 -4.912 1.00 . A A . 6 LYS CD 1 1 6 2679 1 1 6 LYS CE C 4.504 -8.323 -4.457 1.00 . A A . 6 LYS CE 1 1 6 2680 1 1 6 LYS CG C 4.237 -5.829 -4.297 1.00 . A A . 6 LYS CG 1 1 6 2681 1 1 6 LYS H H 1.674 -5.177 -4.355 1.00 . A A . 6 LYS H 1 1 6 2682 1 1 6 LYS HA H 2.410 -4.352 -1.748 1.00 . A A . 6 LYS HA 1 1 6 2683 1 1 6 LYS HB3 H 3.132 -6.497 -2.612 1.00 . A A . 6 LYS HB3 1 1 6 2684 1 1 6 LYS HD3 H 3.765 -7.037 -5.989 1.00 . A A . 6 LYS HD3 1 1 6 2685 1 1 6 LYS HE3 H 4.219 -8.566 -3.444 1.00 . A A . 6 LYS HE3 1 1 6 2686 1 1 6 LYS HG3 H 5.316 -5.880 -4.257 1.00 . A A . 6 LYS HG3 1 1 6 2687 1 1 6 LYS HZ1 H 3.322 -9.441 -5.767 1.00 . A A . 6 LYS HZ1 1 1 6 2688 1 1 6 LYS HZ2 H 4.306 -10.380 -4.761 1.00 . A A . 6 LYS HZ2 1 1 6 2689 1 1 6 LYS HZ3 H 4.981 -9.556 -6.074 1.00 . A A . 6 LYS HZ3 1 1 6 2690 1 1 6 LYS N N 1.685 -4.469 -3.676 1.00 . A A . 6 LYS N 1 1 6 2691 1 1 6 LYS NZ N 4.261 -9.508 -5.325 1.00 . A A . 6 LYS NZ 1 1 6 2692 1 1 6 LYS O O 3.657 -2.603 -4.114 1.00 . A A . 6 LYS O 1 1 6 2693 1 1 7 GLU C C 4.272 -0.249 -2.529 1.00 . A A . 7 GLU C 1 1 6 2694 1 1 7 GLU CA C 5.107 -1.437 -2.061 1.00 . A A . 7 GLU CA 1 1 6 2695 1 1 7 GLU CB C 6.270 -1.669 -3.028 1.00 . A A . 7 GLU CB 1 1 6 2696 1 1 7 GLU CD C 8.775 -1.891 -3.271 1.00 . A A . 7 GLU CD 1 1 6 2697 1 1 7 GLU CG C 7.632 -1.358 -2.430 1.00 . A A . 7 GLU CG 1 1 6 2698 1 1 7 GLU H H 4.225 -3.098 -1.091 1.00 . A A . 7 GLU H 1 1 6 2699 1 1 7 GLU HA H 5.505 -1.218 -1.082 1.00 . A A . 7 GLU HA 1 1 6 2700 1 1 7 GLU HB3 H 6.131 -1.042 -3.896 1.00 . A A . 7 GLU HB3 1 1 6 2701 1 1 7 GLU HG3 H 7.689 -1.804 -1.447 1.00 . A A . 7 GLU HG3 1 1 6 2702 1 1 7 GLU N N 4.289 -2.639 -1.954 1.00 . A A . 7 GLU N 1 1 6 2703 1 1 7 GLU O O 3.044 -0.322 -2.582 1.00 . A A . 7 GLU O 1 1 6 2704 1 1 7 GLU OE1 O 8.989 -3.122 -3.268 1.00 . A A . 7 GLU OE1 1 1 6 2705 1 1 7 GLU OE2 O 9.455 -1.080 -3.932 1.00 . A A . 7 GLU OE2 1 1 6 2706 1 1 8 TYR C C 3.292 1.728 -4.456 1.00 . A A . 8 TYR C 1 1 6 2707 1 1 8 TYR CA C 4.267 2.050 -3.327 1.00 . A A . 8 TYR CA 1 1 6 2708 1 1 8 TYR CB C 5.288 3.087 -3.802 1.00 . A A . 8 TYR CB 1 1 6 2709 1 1 8 TYR CD1 C 7.321 1.866 -4.669 1.00 . A A . 8 TYR CD1 1 1 6 2710 1 1 8 TYR CD2 C 5.850 2.868 -6.253 1.00 . A A . 8 TYR CD2 1 1 6 2711 1 1 8 TYR CE1 C 8.129 1.417 -5.695 1.00 . A A . 8 TYR CE1 1 1 6 2712 1 1 8 TYR CE2 C 6.652 2.423 -7.286 1.00 . A A . 8 TYR CE2 1 1 6 2713 1 1 8 TYR CG C 6.169 2.597 -4.929 1.00 . A A . 8 TYR CG 1 1 6 2714 1 1 8 TYR CZ C 7.790 1.698 -7.003 1.00 . A A . 8 TYR CZ 1 1 6 2715 1 1 8 TYR H H 5.925 0.842 -2.803 1.00 . A A . 8 TYR H 1 1 6 2716 1 1 8 TYR HA H 3.714 2.459 -2.495 1.00 . A A . 8 TYR HA 1 1 6 2717 1 1 8 TYR HB3 H 5.927 3.357 -2.974 1.00 . A A . 8 TYR HB3 1 1 6 2718 1 1 8 TYR HD1 H 7.584 1.646 -3.644 1.00 . A A . 8 TYR HD1 1 1 6 2719 1 1 8 TYR HD2 H 4.958 3.437 -6.472 1.00 . A A . 8 TYR HD2 1 1 6 2720 1 1 8 TYR HE1 H 9.020 0.849 -5.474 1.00 . A A . 8 TYR HE1 1 1 6 2721 1 1 8 TYR HE2 H 6.387 2.642 -8.310 1.00 . A A . 8 TYR HE2 1 1 6 2722 1 1 8 TYR HH H 9.221 1.939 -8.263 1.00 . A A . 8 TYR HH 1 1 6 2723 1 1 8 TYR N N 4.947 0.845 -2.867 1.00 . A A . 8 TYR N 1 1 6 2724 1 1 8 TYR O O 3.668 1.134 -5.466 1.00 . A A . 8 TYR O 1 1 6 2725 1 1 8 TYR OH O 8.592 1.253 -8.029 1.00 . A A . 8 TYR OH 1 1 6 2726 1 1 9 GLU C C -0.300 2.572 -4.896 1.00 . A A . 9 GLU C 1 1 6 2727 1 1 9 GLU CA C 1.005 1.880 -5.277 1.00 . A A . 9 GLU CA 1 1 6 2728 1 1 9 GLU CB C 0.770 0.376 -5.439 1.00 . A A . 9 GLU CB 1 1 6 2729 1 1 9 GLU CD C 0.393 -0.520 -7.770 1.00 . A A . 9 GLU CD 1 1 6 2730 1 1 9 GLU CG C 1.408 -0.208 -6.688 1.00 . A A . 9 GLU CG 1 1 6 2731 1 1 9 GLU H H 1.797 2.595 -3.448 1.00 . A A . 9 GLU H 1 1 6 2732 1 1 9 GLU HA H 1.353 2.284 -6.216 1.00 . A A . 9 GLU HA 1 1 6 2733 1 1 9 GLU HB3 H -0.294 0.194 -5.486 1.00 . A A . 9 GLU HB3 1 1 6 2734 1 1 9 GLU HG3 H 1.920 -1.121 -6.421 1.00 . A A . 9 GLU HG3 1 1 6 2735 1 1 9 GLU N N 2.035 2.125 -4.274 1.00 . A A . 9 GLU N 1 1 6 2736 1 1 9 GLU O O -0.789 3.441 -5.619 1.00 . A A . 9 GLU O 1 1 6 2737 1 1 9 GLU OE1 O -0.623 0.201 -7.855 1.00 . A A . 9 GLU OE1 1 1 6 2738 1 1 9 GLU OE2 O 0.614 -1.485 -8.531 1.00 . A A . 9 GLU OE2 1 1 6 2739 1 1 10 THR C C -2.524 2.153 -1.945 1.00 . A A . 10 THR C 1 1 6 2740 1 1 10 THR CA C -2.109 2.761 -3.278 1.00 . A A . 10 THR CA 1 1 6 2741 1 1 10 THR CB C -3.247 2.561 -4.297 1.00 . A A . 10 THR CB 1 1 6 2742 1 1 10 THR CG2 C -3.579 3.868 -5.002 1.00 . A A . 10 THR CG2 1 1 6 2743 1 1 10 THR H H -0.422 1.484 -3.224 1.00 . A A . 10 THR H 1 1 6 2744 1 1 10 THR HA H -1.955 3.822 -3.148 1.00 . A A . 10 THR HA 1 1 6 2745 1 1 10 THR HB H -4.126 2.219 -3.770 1.00 . A A . 10 THR HB 1 1 6 2746 1 1 10 THR HG1 H -2.263 0.948 -4.863 1.00 . A A . 10 THR HG1 1 1 6 2747 1 1 10 THR HG21 H -4.511 4.256 -4.619 1.00 . A A . 10 THR HG21 1 1 6 2748 1 1 10 THR HG22 H -3.672 3.690 -6.063 1.00 . A A . 10 THR HG22 1 1 6 2749 1 1 10 THR HG23 H -2.790 4.583 -4.824 1.00 . A A . 10 THR HG23 1 1 6 2750 1 1 10 THR N N -0.860 2.181 -3.756 1.00 . A A . 10 THR N 1 1 6 2751 1 1 10 THR O O -2.833 0.963 -1.862 1.00 . A A . 10 THR O 1 1 6 2752 1 1 10 THR OG1 O -2.870 1.574 -5.264 1.00 . A A . 10 THR OG1 1 1 6 2753 1 1 11 CYS C C -4.213 3.169 0.880 1.00 . A A . 11 CYS C 1 1 6 2754 1 1 11 CYS CA C -2.908 2.518 0.432 1.00 . A A . 11 CYS CA 1 1 6 2755 1 1 11 CYS CB C -1.797 2.833 1.436 1.00 . A A . 11 CYS CB 1 1 6 2756 1 1 11 CYS H H -2.274 3.913 -1.029 1.00 . A A . 11 CYS H 1 1 6 2757 1 1 11 CYS HA H -3.049 1.449 0.388 1.00 . A A . 11 CYS HA 1 1 6 2758 1 1 11 CYS HB3 H -0.849 2.522 1.020 1.00 . A A . 11 CYS HB3 1 1 6 2759 1 1 11 CYS N N -2.530 2.975 -0.901 1.00 . A A . 11 CYS N 1 1 6 2760 1 1 11 CYS O O -4.467 3.318 2.075 1.00 . A A . 11 CYS O 1 1 6 2761 1 1 11 CYS SG S -1.663 4.597 1.868 1.00 . A A . 11 CYS SG 1 1 6 2762 1 1 12 VAL C C -7.116 3.373 1.218 1.00 . A A . 12 VAL C 1 1 6 2763 1 1 12 VAL CA C -6.319 4.188 0.206 1.00 . A A . 12 VAL CA 1 1 6 2764 1 1 12 VAL CB C -7.162 4.368 -1.070 1.00 . A A . 12 VAL CB 1 1 6 2765 1 1 12 VAL CG1 C -7.902 3.082 -1.406 1.00 . A A . 12 VAL CG1 1 1 6 2766 1 1 12 VAL CG2 C -8.136 5.525 -0.906 1.00 . A A . 12 VAL CG2 1 1 6 2767 1 1 12 VAL H H -4.782 3.408 -1.022 1.00 . A A . 12 VAL H 1 1 6 2768 1 1 12 VAL HA H -6.120 5.165 0.622 1.00 . A A . 12 VAL HA 1 1 6 2769 1 1 12 VAL HB H -6.496 4.599 -1.888 1.00 . A A . 12 VAL HB 1 1 6 2770 1 1 12 VAL HG11 H -8.657 2.895 -0.658 1.00 . A A . 12 VAL HG11 1 1 6 2771 1 1 12 VAL HG12 H -8.370 3.178 -2.375 1.00 . A A . 12 VAL HG12 1 1 6 2772 1 1 12 VAL HG13 H -7.202 2.259 -1.424 1.00 . A A . 12 VAL HG13 1 1 6 2773 1 1 12 VAL HG21 H -9.141 5.179 -1.090 1.00 . A A . 12 VAL HG21 1 1 6 2774 1 1 12 VAL HG22 H -8.067 5.912 0.101 1.00 . A A . 12 VAL HG22 1 1 6 2775 1 1 12 VAL HG23 H -7.890 6.306 -1.610 1.00 . A A . 12 VAL HG23 1 1 6 2776 1 1 12 VAL N N -5.039 3.554 -0.087 1.00 . A A . 12 VAL N 1 1 6 2777 1 1 12 VAL O O -6.930 2.162 1.340 1.00 . A A . 12 VAL O 1 1 6 2778 1 1 13 ARG C C -9.503 2.143 2.365 1.00 . A A . 13 ARG C 1 1 6 2779 1 1 13 ARG CA C -8.829 3.383 2.946 1.00 . A A . 13 ARG CA 1 1 6 2780 1 1 13 ARG CB C -9.888 4.347 3.484 1.00 . A A . 13 ARG CB 1 1 6 2781 1 1 13 ARG CD C -10.746 4.277 5.844 1.00 . A A . 13 ARG CD 1 1 6 2782 1 1 13 ARG CG C -9.647 4.777 4.922 1.00 . A A . 13 ARG CG 1 1 6 2783 1 1 13 ARG CZ C -9.673 2.350 6.931 1.00 . A A . 13 ARG CZ 1 1 6 2784 1 1 13 ARG H H -8.107 5.010 1.801 1.00 . A A . 13 ARG H 1 1 6 2785 1 1 13 ARG HA H -8.186 3.080 3.759 1.00 . A A . 13 ARG HA 1 1 6 2786 1 1 13 ARG HB3 H -10.854 3.868 3.431 1.00 . A A . 13 ARG HB3 1 1 6 2787 1 1 13 ARG HD3 H -11.702 4.449 5.371 1.00 . A A . 13 ARG HD3 1 1 6 2788 1 1 13 ARG HE H -11.251 2.241 5.716 1.00 . A A . 13 ARG HE 1 1 6 2789 1 1 13 ARG HG3 H -9.615 5.856 4.964 1.00 . A A . 13 ARG HG3 1 1 6 2790 1 1 13 ARG HH11 H -8.835 4.139 7.353 1.00 . A A . 13 ARG HH11 1 1 6 2791 1 1 13 ARG HH12 H -8.089 2.773 8.112 1.00 . A A . 13 ARG HH12 1 1 6 2792 1 1 13 ARG HH21 H -10.277 0.434 6.709 1.00 . A A . 13 ARG HH21 1 1 6 2793 1 1 13 ARG HH22 H -8.909 0.666 7.745 1.00 . A A . 13 ARG HH22 1 1 6 2794 1 1 13 ARG N N -8.004 4.045 1.944 1.00 . A A . 13 ARG N 1 1 6 2795 1 1 13 ARG NE N -10.612 2.853 6.135 1.00 . A A . 13 ARG NE 1 1 6 2796 1 1 13 ARG NH1 N -8.794 3.153 7.512 1.00 . A A . 13 ARG NH1 1 1 6 2797 1 1 13 ARG NH2 N -9.615 1.042 7.146 1.00 . A A . 13 ARG NH2 1 1 6 2798 1 1 13 ARG O O -9.278 1.018 2.808 1.00 . A A . 13 ARG O 1 1 6 2799 1 1 14 PRO C C -10.154 0.375 -0.142 1.00 . A A . 14 PRO C 1 1 6 2800 1 1 14 PRO CA C -11.076 1.267 0.683 1.00 . A A . 14 PRO CA 1 1 6 2801 1 1 14 PRO CB C -12.063 2.002 -0.227 1.00 . A A . 14 PRO CB 1 1 6 2802 1 1 14 PRO CD C -10.670 3.670 0.767 1.00 . A A . 14 PRO CD 1 1 6 2803 1 1 14 PRO CG C -11.428 3.325 -0.484 1.00 . A A . 14 PRO CG 1 1 6 2804 1 1 14 PRO HA H -11.621 0.660 1.392 1.00 . A A . 14 PRO HA 1 1 6 2805 1 1 14 PRO HB3 H -13.011 2.111 0.277 1.00 . A A . 14 PRO HB3 1 1 6 2806 1 1 14 PRO HD3 H -11.289 4.247 1.437 1.00 . A A . 14 PRO HD3 1 1 6 2807 1 1 14 PRO HG3 H -12.190 4.066 -0.676 1.00 . A A . 14 PRO HG3 1 1 6 2808 1 1 14 PRO N N -10.352 2.354 1.347 1.00 . A A . 14 PRO N 1 1 6 2809 1 1 14 PRO O O -10.164 0.426 -1.372 1.00 . A A . 14 PRO O 1 1 6 2810 1 1 15 ARG C C -7.626 -2.148 0.888 1.00 . A A . 15 ARG C 1 1 6 2811 1 1 15 ARG CA C -8.430 -1.343 -0.127 1.00 . A A . 15 ARG CA 1 1 6 2812 1 1 15 ARG CB C -7.483 -0.553 -1.034 1.00 . A A . 15 ARG CB 1 1 6 2813 1 1 15 ARG CD C -7.184 -0.150 -3.496 1.00 . A A . 15 ARG CD 1 1 6 2814 1 1 15 ARG CG C -7.268 -1.195 -2.395 1.00 . A A . 15 ARG CG 1 1 6 2815 1 1 15 ARG CZ C -8.588 0.672 -5.339 1.00 . A A . 15 ARG CZ 1 1 6 2816 1 1 15 ARG H H -9.397 -0.435 1.521 1.00 . A A . 15 ARG H 1 1 6 2817 1 1 15 ARG HA H -9.009 -2.025 -0.733 1.00 . A A . 15 ARG HA 1 1 6 2818 1 1 15 ARG HB3 H -6.525 -0.467 -0.544 1.00 . A A . 15 ARG HB3 1 1 6 2819 1 1 15 ARG HD3 H -6.433 -0.455 -4.208 1.00 . A A . 15 ARG HD3 1 1 6 2820 1 1 15 ARG HE H -9.253 -0.383 -3.784 1.00 . A A . 15 ARG HE 1 1 6 2821 1 1 15 ARG HG3 H -8.093 -1.860 -2.604 1.00 . A A . 15 ARG HG3 1 1 6 2822 1 1 15 ARG HH11 H -6.629 1.143 -5.488 1.00 . A A . 15 ARG HH11 1 1 6 2823 1 1 15 ARG HH12 H -7.630 1.716 -6.781 1.00 . A A . 15 ARG HH12 1 1 6 2824 1 1 15 ARG HH21 H -10.581 0.366 -5.480 1.00 . A A . 15 ARG HH21 1 1 6 2825 1 1 15 ARG HH22 H -9.878 1.274 -6.776 1.00 . A A . 15 ARG HH22 1 1 6 2826 1 1 15 ARG N N -9.360 -0.440 0.542 1.00 . A A . 15 ARG N 1 1 6 2827 1 1 15 ARG NE N -8.457 0.015 -4.193 1.00 . A A . 15 ARG NE 1 1 6 2828 1 1 15 ARG NH1 N -7.528 1.223 -5.917 1.00 . A A . 15 ARG NH1 1 1 6 2829 1 1 15 ARG NH2 N -9.780 0.779 -5.912 1.00 . A A . 15 ARG NH2 1 1 6 2830 1 1 15 ARG O O -7.759 -3.368 0.976 1.00 . A A . 15 ARG O 1 1 6 2831 1 1 16 LYS C C -5.020 -3.121 2.028 1.00 . A A . 16 LYS C 1 1 6 2832 1 1 16 LYS CA C -5.962 -2.105 2.666 1.00 . A A . 16 LYS CA 1 1 6 2833 1 1 16 LYS CB C -6.844 -2.793 3.709 1.00 . A A . 16 LYS CB 1 1 6 2834 1 1 16 LYS CD C -5.444 -2.658 5.791 1.00 . A A . 16 LYS CD 1 1 6 2835 1 1 16 LYS CE C -4.911 -1.598 6.742 1.00 . A A . 16 LYS CE 1 1 6 2836 1 1 16 LYS CG C -6.718 -2.198 5.101 1.00 . A A . 16 LYS CG 1 1 6 2837 1 1 16 LYS H H -6.726 -0.484 1.537 1.00 . A A . 16 LYS H 1 1 6 2838 1 1 16 LYS HA H -5.373 -1.342 3.152 1.00 . A A . 16 LYS HA 1 1 6 2839 1 1 16 LYS HB3 H -6.570 -3.838 3.761 1.00 . A A . 16 LYS HB3 1 1 6 2840 1 1 16 LYS HD3 H -4.694 -2.866 5.040 1.00 . A A . 16 LYS HD3 1 1 6 2841 1 1 16 LYS HE3 H -5.640 -1.433 7.522 1.00 . A A . 16 LYS HE3 1 1 6 2842 1 1 16 LYS HG3 H -7.568 -2.506 5.693 1.00 . A A . 16 LYS HG3 1 1 6 2843 1 1 16 LYS HZ1 H -3.382 -1.367 8.146 1.00 . A A . 16 LYS HZ1 1 1 6 2844 1 1 16 LYS HZ2 H -2.858 -1.972 6.657 1.00 . A A . 16 LYS HZ2 1 1 6 2845 1 1 16 LYS HZ3 H -3.694 -2.977 7.730 1.00 . A A . 16 LYS HZ3 1 1 6 2846 1 1 16 LYS N N -6.789 -1.456 1.655 1.00 . A A . 16 LYS N 1 1 6 2847 1 1 16 LYS NZ N -3.621 -2.007 7.363 1.00 . A A . 16 LYS NZ 1 1 6 2848 1 1 16 LYS O O -5.431 -4.228 1.679 1.00 . A A . 16 LYS O 1 1 6 2849 1 1 17 CYS C C -2.779 -4.994 1.948 1.00 . A A . 17 CYS C 1 1 6 2850 1 1 17 CYS CA C -2.757 -3.618 1.287 1.00 . A A . 17 CYS CA 1 1 6 2851 1 1 17 CYS CB C -1.363 -3.001 1.418 1.00 . A A . 17 CYS CB 1 1 6 2852 1 1 17 CYS H H -3.490 -1.844 2.179 1.00 . A A . 17 CYS H 1 1 6 2853 1 1 17 CYS HA H -2.994 -3.731 0.240 1.00 . A A . 17 CYS HA 1 1 6 2854 1 1 17 CYS HB3 H -0.621 -3.775 1.294 1.00 . A A . 17 CYS HB3 1 1 6 2855 1 1 17 CYS N N -3.757 -2.739 1.881 1.00 . A A . 17 CYS N 1 1 6 2856 1 1 17 CYS O O -2.768 -5.104 3.173 1.00 . A A . 17 CYS O 1 1 6 2857 1 1 17 CYS SG S -1.010 -1.695 0.198 1.00 . A A . 17 CYS SG 1 1 6 2858 1 1 18 GLN C C -1.725 -7.631 2.650 1.00 . A A . 18 GLN C 1 1 6 2859 1 1 18 GLN CA C -2.837 -7.406 1.631 1.00 . A A . 18 GLN CA 1 1 6 2860 1 1 18 GLN CB C -2.696 -8.400 0.477 1.00 . A A . 18 GLN CB 1 1 6 2861 1 1 18 GLN CD C -4.439 -10.192 0.841 1.00 . A A . 18 GLN CD 1 1 6 2862 1 1 18 GLN CG C -4.019 -8.991 0.018 1.00 . A A . 18 GLN CG 1 1 6 2863 1 1 18 GLN H H -2.820 -5.886 0.158 1.00 . A A . 18 GLN H 1 1 6 2864 1 1 18 GLN HA H -3.789 -7.563 2.115 1.00 . A A . 18 GLN HA 1 1 6 2865 1 1 18 GLN HB3 H -2.055 -9.210 0.792 1.00 . A A . 18 GLN HB3 1 1 6 2866 1 1 18 GLN HE21 H -5.198 -11.066 -0.776 1.00 . A A . 18 GLN HE21 1 1 6 2867 1 1 18 GLN HE22 H -5.335 -11.962 0.695 1.00 . A A . 18 GLN HE22 1 1 6 2868 1 1 18 GLN HG3 H -3.925 -9.294 -1.014 1.00 . A A . 18 GLN HG3 1 1 6 2869 1 1 18 GLN N N -2.812 -6.038 1.126 1.00 . A A . 18 GLN N 1 1 6 2870 1 1 18 GLN NE2 N -5.053 -11.173 0.188 1.00 . A A . 18 GLN NE2 1 1 6 2871 1 1 18 GLN O O -1.970 -7.966 3.809 1.00 . A A . 18 GLN O 1 1 6 2872 1 1 18 GLN OE1 O -4.213 -10.241 2.050 1.00 . A A . 18 GLN OE1 1 1 6 2873 1 1 19 PRO C C 0.810 -6.534 4.135 1.00 . A A . 19 PRO C 1 1 6 2874 1 1 19 PRO CA C 0.704 -7.619 3.068 1.00 . A A . 19 PRO CA 1 1 6 2875 1 1 19 PRO CB C 1.876 -7.524 2.089 1.00 . A A . 19 PRO CB 1 1 6 2876 1 1 19 PRO CD C -0.106 -7.043 0.841 1.00 . A A . 19 PRO CD 1 1 6 2877 1 1 19 PRO CG C 1.356 -6.710 0.954 1.00 . A A . 19 PRO CG 1 1 6 2878 1 1 19 PRO HA H 0.706 -8.590 3.542 1.00 . A A . 19 PRO HA 1 1 6 2879 1 1 19 PRO HB3 H 2.161 -8.514 1.766 1.00 . A A . 19 PRO HB3 1 1 6 2880 1 1 19 PRO HD3 H -0.254 -7.859 0.149 1.00 . A A . 19 PRO HD3 1 1 6 2881 1 1 19 PRO HG3 H 1.873 -6.978 0.044 1.00 . A A . 19 PRO HG3 1 1 6 2882 1 1 19 PRO N N -0.471 -7.443 2.210 1.00 . A A . 19 PRO N 1 1 6 2883 1 1 19 PRO O O 0.084 -5.540 4.118 1.00 . A A . 19 PRO O 1 1 6 2884 1 1 20 PRO C C 2.591 -4.473 5.689 1.00 . A A . 20 PRO C 1 1 6 2885 1 1 20 PRO CA C 1.962 -5.774 6.176 1.00 . A A . 20 PRO CA 1 1 6 2886 1 1 20 PRO CB C 2.926 -6.518 7.104 1.00 . A A . 20 PRO CB 1 1 6 2887 1 1 20 PRO CD C 2.639 -7.889 5.166 1.00 . A A . 20 PRO CD 1 1 6 2888 1 1 20 PRO CG C 3.634 -7.484 6.218 1.00 . A A . 20 PRO CG 1 1 6 2889 1 1 20 PRO HA H 1.047 -5.555 6.706 1.00 . A A . 20 PRO HA 1 1 6 2890 1 1 20 PRO HB3 H 2.368 -7.026 7.876 1.00 . A A . 20 PRO HB3 1 1 6 2891 1 1 20 PRO HD3 H 2.100 -8.772 5.476 1.00 . A A . 20 PRO HD3 1 1 6 2892 1 1 20 PRO HG3 H 3.946 -8.346 6.790 1.00 . A A . 20 PRO HG3 1 1 6 2893 1 1 20 PRO N N 1.738 -6.726 5.084 1.00 . A A . 20 PRO N 1 1 6 2894 1 1 20 PRO O O 3.787 -4.242 5.870 1.00 . A A . 20 PRO O 1 1 6 2895 1 1 21 LEU C C 1.727 -1.188 5.405 1.00 . A A . 21 LEU C 1 1 6 2896 1 1 21 LEU CA C 2.253 -2.343 4.558 1.00 . A A . 21 LEU CA 1 1 6 2897 1 1 21 LEU CB C 1.820 -2.162 3.102 1.00 . A A . 21 LEU CB 1 1 6 2898 1 1 21 LEU CD1 C 3.964 -1.877 1.835 1.00 . A A . 21 LEU CD1 1 1 6 2899 1 1 21 LEU CD2 C 3.175 -4.169 2.450 1.00 . A A . 21 LEU CD2 1 1 6 2900 1 1 21 LEU CG C 2.748 -2.765 2.046 1.00 . A A . 21 LEU CG 1 1 6 2901 1 1 21 LEU H H 0.833 -3.862 4.957 1.00 . A A . 21 LEU H 1 1 6 2902 1 1 21 LEU HA H 3.331 -2.347 4.607 1.00 . A A . 21 LEU HA 1 1 6 2903 1 1 21 LEU HB3 H 1.743 -1.102 2.911 1.00 . A A . 21 LEU HB3 1 1 6 2904 1 1 21 LEU HD11 H 4.134 -1.283 2.721 1.00 . A A . 21 LEU HD11 1 1 6 2905 1 1 21 LEU HD12 H 3.791 -1.224 0.992 1.00 . A A . 21 LEU HD12 1 1 6 2906 1 1 21 LEU HD13 H 4.830 -2.492 1.642 1.00 . A A . 21 LEU HD13 1 1 6 2907 1 1 21 LEU HD21 H 2.305 -4.739 2.742 1.00 . A A . 21 LEU HD21 1 1 6 2908 1 1 21 LEU HD22 H 3.863 -4.110 3.280 1.00 . A A . 21 LEU HD22 1 1 6 2909 1 1 21 LEU HD23 H 3.659 -4.651 1.614 1.00 . A A . 21 LEU HD23 1 1 6 2910 1 1 21 LEU HG H 2.217 -2.832 1.107 1.00 . A A . 21 LEU HG 1 1 6 2911 1 1 21 LEU N N 1.777 -3.624 5.071 1.00 . A A . 21 LEU N 1 1 6 2912 1 1 21 LEU O O 1.016 -1.398 6.387 1.00 . A A . 21 LEU O 1 1 6 2913 1 1 22 LYS C C 1.778 2.467 4.863 1.00 . A A . 22 LYS C 1 1 6 2914 1 1 22 LYS CA C 1.639 1.221 5.734 1.00 . A A . 22 LYS CA 1 1 6 2915 1 1 22 LYS CB C 2.451 1.393 7.020 1.00 . A A . 22 LYS CB 1 1 6 2916 1 1 22 LYS CD C 2.210 1.228 9.514 1.00 . A A . 22 LYS CD 1 1 6 2917 1 1 22 LYS CE C 2.867 2.336 10.325 1.00 . A A . 22 LYS CE 1 1 6 2918 1 1 22 LYS CG C 1.606 1.762 8.227 1.00 . A A . 22 LYS CG 1 1 6 2919 1 1 22 LYS H H 2.647 0.135 4.221 1.00 . A A . 22 LYS H 1 1 6 2920 1 1 22 LYS HA H 0.598 1.090 5.989 1.00 . A A . 22 LYS HA 1 1 6 2921 1 1 22 LYS HB3 H 3.183 2.173 6.868 1.00 . A A . 22 LYS HB3 1 1 6 2922 1 1 22 LYS HD3 H 2.955 0.483 9.271 1.00 . A A . 22 LYS HD3 1 1 6 2923 1 1 22 LYS HE3 H 2.737 2.120 11.375 1.00 . A A . 22 LYS HE3 1 1 6 2924 1 1 22 LYS HG3 H 0.617 1.345 8.103 1.00 . A A . 22 LYS HG3 1 1 6 2925 1 1 22 LYS HZ1 H 4.472 3.091 9.224 1.00 . A A . 22 LYS HZ1 1 1 6 2926 1 1 22 LYS HZ2 H 4.713 1.517 9.794 1.00 . A A . 22 LYS HZ2 1 1 6 2927 1 1 22 LYS HZ3 H 4.825 2.829 10.857 1.00 . A A . 22 LYS HZ3 1 1 6 2928 1 1 22 LYS N N 2.078 0.032 5.014 1.00 . A A . 22 LYS N 1 1 6 2929 1 1 22 LYS NZ N 4.322 2.452 10.029 1.00 . A A . 22 LYS NZ 1 1 6 2930 1 1 22 LYS O O 2.662 2.544 4.010 1.00 . A A . 22 LYS O 1 1 6 2931 1 1 23 CYS C C 2.129 5.533 4.708 1.00 . A A . 23 CYS C 1 1 6 2932 1 1 23 CYS CA C 0.925 4.680 4.321 1.00 . A A . 23 CYS CA 1 1 6 2933 1 1 23 CYS CB C -0.367 5.469 4.548 1.00 . A A . 23 CYS CB 1 1 6 2934 1 1 23 CYS H H 0.218 3.318 5.778 1.00 . A A . 23 CYS H 1 1 6 2935 1 1 23 CYS HA H 1.002 4.426 3.274 1.00 . A A . 23 CYS HA 1 1 6 2936 1 1 23 CYS HB3 H -0.268 6.444 4.093 1.00 . A A . 23 CYS HB3 1 1 6 2937 1 1 23 CYS N N 0.900 3.439 5.084 1.00 . A A . 23 CYS N 1 1 6 2938 1 1 23 CYS O O 2.969 5.114 5.503 1.00 . A A . 23 CYS O 1 1 6 2939 1 1 23 CYS SG S -1.852 4.679 3.852 1.00 . A A . 23 CYS SG 1 1 6 2940 1 1 24 ASN C C 2.785 9.034 4.783 1.00 . A A . 24 ASN C 1 1 6 2941 1 1 24 ASN CA C 3.307 7.645 4.425 1.00 . A A . 24 ASN CA 1 1 6 2942 1 1 24 ASN CB C 4.246 7.735 3.220 1.00 . A A . 24 ASN CB 1 1 6 2943 1 1 24 ASN CG C 3.495 7.840 1.908 1.00 . A A . 24 ASN CG 1 1 6 2944 1 1 24 ASN H H 1.505 7.010 3.514 1.00 . A A . 24 ASN H 1 1 6 2945 1 1 24 ASN HA H 3.854 7.250 5.268 1.00 . A A . 24 ASN HA 1 1 6 2946 1 1 24 ASN HB3 H 4.869 6.854 3.190 1.00 . A A . 24 ASN HB3 1 1 6 2947 1 1 24 ASN HD21 H 4.125 9.712 1.668 1.00 . A A . 24 ASN HD21 1 1 6 2948 1 1 24 ASN HD22 H 3.109 9.094 0.414 1.00 . A A . 24 ASN HD22 1 1 6 2949 1 1 24 ASN N N 2.205 6.733 4.141 1.00 . A A . 24 ASN N 1 1 6 2950 1 1 24 ASN ND2 N 3.586 8.998 1.265 1.00 . A A . 24 ASN ND2 1 1 6 2951 1 1 24 ASN O O 3.072 9.559 5.859 1.00 . A A . 24 ASN O 1 1 6 2952 1 1 24 ASN OD1 O 2.841 6.891 1.477 1.00 . A A . 24 ASN OD1 1 1 6 2953 1 1 25 LYS C C 0.644 11.402 2.880 1.00 . A A . 25 LYS C 1 1 6 2954 1 1 25 LYS CA C 1.451 10.948 4.092 1.00 . A A . 25 LYS CA 1 1 6 2955 1 1 25 LYS CB C 2.564 11.958 4.385 1.00 . A A . 25 LYS CB 1 1 6 2956 1 1 25 LYS CD C 3.539 13.146 6.371 1.00 . A A . 25 LYS CD 1 1 6 2957 1 1 25 LYS CE C 3.428 14.460 7.128 1.00 . A A . 25 LYS CE 1 1 6 2958 1 1 25 LYS CG C 2.277 12.851 5.578 1.00 . A A . 25 LYS CG 1 1 6 2959 1 1 25 LYS H H 1.823 9.153 3.035 1.00 . A A . 25 LYS H 1 1 6 2960 1 1 25 LYS HA H 0.795 10.893 4.947 1.00 . A A . 25 LYS HA 1 1 6 2961 1 1 25 LYS HB3 H 2.701 12.586 3.516 1.00 . A A . 25 LYS HB3 1 1 6 2962 1 1 25 LYS HD3 H 4.377 13.202 5.691 1.00 . A A . 25 LYS HD3 1 1 6 2963 1 1 25 LYS HE3 H 2.458 14.508 7.600 1.00 . A A . 25 LYS HE3 1 1 6 2964 1 1 25 LYS HG3 H 1.564 12.357 6.223 1.00 . A A . 25 LYS HG3 1 1 6 2965 1 1 25 LYS HZ1 H 5.417 14.681 7.727 1.00 . A A . 25 LYS HZ1 1 1 6 2966 1 1 25 LYS HZ2 H 4.482 13.751 8.786 1.00 . A A . 25 LYS HZ2 1 1 6 2967 1 1 25 LYS HZ3 H 4.305 15.432 8.756 1.00 . A A . 25 LYS HZ3 1 1 6 2968 1 1 25 LYS N N 2.016 9.623 3.874 1.00 . A A . 25 LYS N 1 1 6 2969 1 1 25 LYS NZ N 4.482 14.590 8.172 1.00 . A A . 25 LYS NZ 1 1 6 2970 1 1 25 LYS O O 0.624 12.586 2.545 1.00 . A A . 25 LYS O 1 1 6 2971 1 1 26 ALA C C -1.770 9.602 0.723 1.00 . A A . 26 ALA C 1 1 6 2972 1 1 26 ALA CA C -0.832 10.758 1.056 1.00 . A A . 26 ALA CA 1 1 6 2973 1 1 26 ALA CB C 0.060 11.075 -0.135 1.00 . A A . 26 ALA CB 1 1 6 2974 1 1 26 ALA H H 0.035 9.528 2.545 1.00 . A A . 26 ALA H 1 1 6 2975 1 1 26 ALA HA H -1.423 11.636 1.277 1.00 . A A . 26 ALA HA 1 1 6 2976 1 1 26 ALA HB1 H 0.829 10.322 -0.219 1.00 . A A . 26 ALA HB1 1 1 6 2977 1 1 26 ALA HB2 H -0.534 11.086 -1.037 1.00 . A A . 26 ALA HB2 1 1 6 2978 1 1 26 ALA HB3 H 0.518 12.043 0.007 1.00 . A A . 26 ALA HB3 1 1 6 2979 1 1 26 ALA N N -0.021 10.455 2.229 1.00 . A A . 26 ALA N 1 1 6 2980 1 1 26 ALA O O -2.966 9.661 1.011 1.00 . A A . 26 ALA O 1 1 6 2981 1 1 27 GLN C C -1.137 6.332 -0.924 1.00 . A A . 27 GLN C 1 1 6 2982 1 1 27 GLN CA C -2.010 7.389 -0.256 1.00 . A A . 27 GLN CA 1 1 6 2983 1 1 27 GLN CB C -3.149 7.794 -1.194 1.00 . A A . 27 GLN CB 1 1 6 2984 1 1 27 GLN CD C -5.629 7.526 -1.593 1.00 . A A . 27 GLN CD 1 1 6 2985 1 1 27 GLN CG C -4.527 7.679 -0.564 1.00 . A A . 27 GLN CG 1 1 6 2986 1 1 27 GLN H H -0.262 8.570 -0.085 1.00 . A A . 27 GLN H 1 1 6 2987 1 1 27 GLN HA H -2.431 6.971 0.647 1.00 . A A . 27 GLN HA 1 1 6 2988 1 1 27 GLN HB3 H -3.123 7.159 -2.067 1.00 . A A . 27 GLN HB3 1 1 6 2989 1 1 27 GLN HE21 H -6.594 9.086 -0.827 1.00 . A A . 27 GLN HE21 1 1 6 2990 1 1 27 GLN HE22 H -7.352 8.325 -2.181 1.00 . A A . 27 GLN HE22 1 1 6 2991 1 1 27 GLN HG3 H -4.718 8.569 0.017 1.00 . A A . 27 GLN HG3 1 1 6 2992 1 1 27 GLN N N -1.221 8.556 0.117 1.00 . A A . 27 GLN N 1 1 6 2993 1 1 27 GLN NE2 N -6.626 8.400 -1.527 1.00 . A A . 27 GLN NE2 1 1 6 2994 1 1 27 GLN O O -1.583 5.626 -1.829 1.00 . A A . 27 GLN O 1 1 6 2995 1 1 27 GLN OE1 O -5.584 6.632 -2.439 1.00 . A A . 27 GLN OE1 1 1 6 2996 1 1 28 ILE C C 1.439 4.218 0.018 1.00 . A A . 28 ILE C 1 1 6 2997 1 1 28 ILE CA C 1.043 5.256 -1.026 1.00 . A A . 28 ILE CA 1 1 6 2998 1 1 28 ILE CB C 2.314 5.941 -1.561 1.00 . A A . 28 ILE CB 1 1 6 2999 1 1 28 ILE CD1 C 1.050 6.905 -3.548 1.00 . A A . 28 ILE CD1 1 1 6 3000 1 1 28 ILE CG1 C 1.949 7.189 -2.365 1.00 . A A . 28 ILE CG1 1 1 6 3001 1 1 28 ILE CG2 C 3.118 4.971 -2.415 1.00 . A A . 28 ILE CG2 1 1 6 3002 1 1 28 ILE H H 0.405 6.818 0.252 1.00 . A A . 28 ILE H 1 1 6 3003 1 1 28 ILE HA H 0.554 4.756 -1.849 1.00 . A A . 28 ILE HA 1 1 6 3004 1 1 28 ILE HB H 2.923 6.229 -0.717 1.00 . A A . 28 ILE HB 1 1 6 3005 1 1 28 ILE HD11 H 0.161 7.515 -3.481 1.00 . A A . 28 ILE HD11 1 1 6 3006 1 1 28 ILE HD12 H 1.576 7.138 -4.463 1.00 . A A . 28 ILE HD12 1 1 6 3007 1 1 28 ILE HD13 H 0.773 5.862 -3.547 1.00 . A A . 28 ILE HD13 1 1 6 3008 1 1 28 ILE HG13 H 2.854 7.648 -2.736 1.00 . A A . 28 ILE HG13 1 1 6 3009 1 1 28 ILE HG21 H 3.697 4.322 -1.774 1.00 . A A . 28 ILE HG21 1 1 6 3010 1 1 28 ILE HG22 H 2.445 4.377 -3.015 1.00 . A A . 28 ILE HG22 1 1 6 3011 1 1 28 ILE HG23 H 3.783 5.525 -3.060 1.00 . A A . 28 ILE HG23 1 1 6 3012 1 1 28 ILE N N 0.108 6.228 -0.472 1.00 . A A . 28 ILE N 1 1 6 3013 1 1 28 ILE O O 1.794 4.558 1.146 1.00 . A A . 28 ILE O 1 1 6 3014 1 1 29 CYS C C 3.246 1.735 0.673 1.00 . A A . 29 CYS C 1 1 6 3015 1 1 29 CYS CA C 1.730 1.856 0.534 1.00 . A A . 29 CYS CA 1 1 6 3016 1 1 29 CYS CB C 1.146 0.536 0.025 1.00 . A A . 29 CYS CB 1 1 6 3017 1 1 29 CYS H H 1.087 2.736 -1.280 1.00 . A A . 29 CYS H 1 1 6 3018 1 1 29 CYS HA H 1.309 2.077 1.502 1.00 . A A . 29 CYS HA 1 1 6 3019 1 1 29 CYS HB3 H 1.940 -0.192 -0.056 1.00 . A A . 29 CYS HB3 1 1 6 3020 1 1 29 CYS N N 1.377 2.946 -0.367 1.00 . A A . 29 CYS N 1 1 6 3021 1 1 29 CYS O O 3.979 1.809 -0.313 1.00 . A A . 29 CYS O 1 1 6 3022 1 1 29 CYS SG S -0.147 -0.166 1.096 1.00 . A A . 29 CYS SG 1 1 6 3023 1 1 30 VAL C C 5.381 0.920 3.596 1.00 . A A . 30 VAL C 1 1 6 3024 1 1 30 VAL CA C 5.134 1.414 2.175 1.00 . A A . 30 VAL CA 1 1 6 3025 1 1 30 VAL CB C 5.870 2.752 1.973 1.00 . A A . 30 VAL CB 1 1 6 3026 1 1 30 VAL CG1 C 6.565 2.780 0.621 1.00 . A A . 30 VAL CG1 1 1 6 3027 1 1 30 VAL CG2 C 4.904 3.918 2.110 1.00 . A A . 30 VAL CG2 1 1 6 3028 1 1 30 VAL H H 3.074 1.497 2.651 1.00 . A A . 30 VAL H 1 1 6 3029 1 1 30 VAL HA H 5.539 0.695 1.478 1.00 . A A . 30 VAL HA 1 1 6 3030 1 1 30 VAL HB H 6.624 2.844 2.742 1.00 . A A . 30 VAL HB 1 1 6 3031 1 1 30 VAL HG11 H 6.281 1.907 0.052 1.00 . A A . 30 VAL HG11 1 1 6 3032 1 1 30 VAL HG12 H 6.273 3.672 0.084 1.00 . A A . 30 VAL HG12 1 1 6 3033 1 1 30 VAL HG13 H 7.635 2.782 0.765 1.00 . A A . 30 VAL HG13 1 1 6 3034 1 1 30 VAL HG21 H 4.311 3.793 3.004 1.00 . A A . 30 VAL HG21 1 1 6 3035 1 1 30 VAL HG22 H 5.460 4.841 2.173 1.00 . A A . 30 VAL HG22 1 1 6 3036 1 1 30 VAL HG23 H 4.252 3.949 1.249 1.00 . A A . 30 VAL HG23 1 1 6 3037 1 1 30 VAL N N 3.707 1.548 1.905 1.00 . A A . 30 VAL N 1 1 6 3038 1 1 30 VAL O O 4.440 0.682 4.354 1.00 . A A . 30 VAL O 1 1 6 3039 1 1 31 ASP C C 8.539 0.297 5.451 1.00 . A A . 31 ASP C 1 1 6 3040 1 1 31 ASP CA C 7.024 0.302 5.281 1.00 . A A . 31 ASP CA 1 1 6 3041 1 1 31 ASP CB C 6.465 -1.101 5.529 1.00 . A A . 31 ASP CB 1 1 6 3042 1 1 31 ASP CG C 6.468 -1.954 4.277 1.00 . A A . 31 ASP CG 1 1 6 3043 1 1 31 ASP H H 7.358 0.973 3.301 1.00 . A A . 31 ASP H 1 1 6 3044 1 1 31 ASP HA H 6.596 0.982 6.002 1.00 . A A . 31 ASP HA 1 1 6 3045 1 1 31 ASP HB3 H 5.449 -1.018 5.886 1.00 . A A . 31 ASP HB3 1 1 6 3046 1 1 31 ASP N N 6.652 0.767 3.950 1.00 . A A . 31 ASP N 1 1 6 3047 1 1 31 ASP O O 9.297 0.285 4.481 1.00 . A A . 31 ASP O 1 1 6 3048 1 1 31 ASP OD1 O 7.410 -1.820 3.469 1.00 . A A . 31 ASP OD1 1 1 6 3049 1 1 31 ASP OD2 O 5.529 -2.759 4.106 1.00 . A A . 31 ASP OD2 1 1 6 3050 1 1 32 PRO C C 11.091 -1.026 6.706 1.00 . A A . 32 PRO C 1 1 6 3051 1 1 32 PRO CA C 10.423 0.304 7.041 1.00 . A A . 32 PRO CA 1 1 6 3052 1 1 32 PRO CB C 10.442 0.547 8.551 1.00 . A A . 32 PRO CB 1 1 6 3053 1 1 32 PRO CD C 8.148 0.321 7.918 1.00 . A A . 32 PRO CD 1 1 6 3054 1 1 32 PRO CG C 9.122 0.050 9.032 1.00 . A A . 32 PRO CG 1 1 6 3055 1 1 32 PRO HA H 10.946 1.104 6.538 1.00 . A A . 32 PRO HA 1 1 6 3056 1 1 32 PRO HB3 H 10.561 1.601 8.749 1.00 . A A . 32 PRO HB3 1 1 6 3057 1 1 32 PRO HD3 H 7.682 1.287 8.050 1.00 . A A . 32 PRO HD3 1 1 6 3058 1 1 32 PRO HG3 H 8.831 0.586 9.922 1.00 . A A . 32 PRO HG3 1 1 6 3059 1 1 32 PRO N N 8.994 0.306 6.714 1.00 . A A . 32 PRO N 1 1 6 3060 1 1 32 PRO O O 12.314 -1.103 6.580 1.00 . A A . 32 PRO O 1 1 6 3061 1 1 33 LYS C C 11.499 -3.395 4.889 1.00 . A A . 33 LYS C 1 1 6 3062 1 1 33 LYS CA C 10.795 -3.397 6.242 1.00 . A A . 33 LYS CA 1 1 6 3063 1 1 33 LYS CB C 9.655 -4.417 6.234 1.00 . A A . 33 LYS CB 1 1 6 3064 1 1 33 LYS CD C 8.383 -6.194 7.473 1.00 . A A . 33 LYS CD 1 1 6 3065 1 1 33 LYS CE C 8.776 -7.448 6.708 1.00 . A A . 33 LYS CE 1 1 6 3066 1 1 33 LYS CG C 9.527 -5.196 7.532 1.00 . A A . 33 LYS CG 1 1 6 3067 1 1 33 LYS H H 9.316 -1.945 6.676 1.00 . A A . 33 LYS H 1 1 6 3068 1 1 33 LYS HA H 11.508 -3.671 7.005 1.00 . A A . 33 LYS HA 1 1 6 3069 1 1 33 LYS HB3 H 9.824 -5.122 5.432 1.00 . A A . 33 LYS HB3 1 1 6 3070 1 1 33 LYS HD3 H 7.538 -5.732 6.982 1.00 . A A . 33 LYS HD3 1 1 6 3071 1 1 33 LYS HE3 H 9.502 -7.181 5.954 1.00 . A A . 33 LYS HE3 1 1 6 3072 1 1 33 LYS HG3 H 9.346 -4.502 8.341 1.00 . A A . 33 LYS HG3 1 1 6 3073 1 1 33 LYS HZ1 H 10.337 -8.219 7.862 1.00 . A A . 33 LYS HZ1 1 1 6 3074 1 1 33 LYS HZ2 H 9.385 -9.403 7.119 1.00 . A A . 33 LYS HZ2 1 1 6 3075 1 1 33 LYS HZ3 H 8.798 -8.571 8.469 1.00 . A A . 33 LYS HZ3 1 1 6 3076 1 1 33 LYS N N 10.283 -2.070 6.564 1.00 . A A . 33 LYS N 1 1 6 3077 1 1 33 LYS NZ N 9.366 -8.482 7.602 1.00 . A A . 33 LYS NZ 1 1 6 3078 1 1 33 LYS O O 12.605 -3.917 4.752 1.00 . A A . 33 LYS O 1 1 6 3079 1 1 34 LYS C C 10.522 -1.908 1.627 1.00 . A A . 34 LYS C 1 1 6 3080 1 1 34 LYS CA C 11.416 -2.730 2.549 1.00 . A A . 34 LYS CA 1 1 6 3081 1 1 34 LYS CB C 11.603 -4.136 1.975 1.00 . A A . 34 LYS CB 1 1 6 3082 1 1 34 LYS CD C 12.729 -5.440 0.146 1.00 . A A . 34 LYS CD 1 1 6 3083 1 1 34 LYS CE C 13.722 -5.227 -0.987 1.00 . A A . 34 LYS CE 1 1 6 3084 1 1 34 LYS CG C 12.021 -4.147 0.514 1.00 . A A . 34 LYS CG 1 1 6 3085 1 1 34 LYS H H 9.973 -2.404 4.062 1.00 . A A . 34 LYS H 1 1 6 3086 1 1 34 LYS HA H 12.380 -2.249 2.620 1.00 . A A . 34 LYS HA 1 1 6 3087 1 1 34 LYS HB3 H 10.672 -4.676 2.066 1.00 . A A . 34 LYS HB3 1 1 6 3088 1 1 34 LYS HD3 H 11.993 -6.168 -0.164 1.00 . A A . 34 LYS HD3 1 1 6 3089 1 1 34 LYS HE3 H 13.363 -4.429 -1.618 1.00 . A A . 34 LYS HE3 1 1 6 3090 1 1 34 LYS HG3 H 12.689 -3.316 0.334 1.00 . A A . 34 LYS HG3 1 1 6 3091 1 1 34 LYS HZ1 H 15.054 -4.771 0.557 1.00 . A A . 34 LYS HZ1 1 1 6 3092 1 1 34 LYS HZ2 H 15.390 -3.973 -0.896 1.00 . A A . 34 LYS HZ2 1 1 6 3093 1 1 34 LYS HZ3 H 15.758 -5.615 -0.730 1.00 . A A . 34 LYS HZ3 1 1 6 3094 1 1 34 LYS N N 10.852 -2.803 3.891 1.00 . A A . 34 LYS N 1 1 6 3095 1 1 34 LYS NZ N 15.076 -4.872 -0.478 1.00 . A A . 34 LYS NZ 1 1 6 3096 1 1 34 LYS O O 9.658 -2.450 0.939 1.00 . A A . 34 LYS O 1 1 6 3097 1 1 35 GLY C C 10.798 1.210 -0.065 1.00 . A A . 35 GLY C 1 1 6 3098 1 1 35 GLY CA C 9.944 0.278 0.772 1.00 . A A . 35 GLY CA 1 1 6 3099 1 1 35 GLY H H 11.441 -0.219 2.185 1.00 . A A . 35 GLY H 1 1 6 3100 1 1 35 GLY HA2 H 9.338 -0.326 0.114 1.00 . A A . 35 GLY HA2 1 1 6 3101 1 1 35 GLY HA3 H 9.294 0.872 1.399 1.00 . A A . 35 GLY HA3 1 1 6 3102 1 1 35 GLY N N 10.738 -0.596 1.615 1.00 . A A . 35 GLY N 1 1 6 3103 1 1 35 GLY O O 12.025 1.110 -0.059 1.00 . A A . 35 GLY O 1 1 6 3104 1 1 36 TRP C C 10.929 4.441 -0.970 1.00 . A A . 36 TRP C 1 1 6 3105 1 1 36 TRP CA C 10.859 3.070 -1.633 1.00 . A A . 36 TRP CA 1 1 6 3106 1 1 36 TRP CB C 10.173 3.182 -2.995 1.00 . A A . 36 TRP CB 1 1 6 3107 1 1 36 TRP CD1 C 11.906 2.721 -4.826 1.00 . A A . 36 TRP CD1 1 1 6 3108 1 1 36 TRP CD2 C 11.345 4.879 -4.611 1.00 . A A . 36 TRP CD2 1 1 6 3109 1 1 36 TRP CE2 C 12.298 4.763 -5.641 1.00 . A A . 36 TRP CE2 1 1 6 3110 1 1 36 TRP CE3 C 10.844 6.145 -4.297 1.00 . A A . 36 TRP CE3 1 1 6 3111 1 1 36 TRP CG C 11.109 3.562 -4.102 1.00 . A A . 36 TRP CG 1 1 6 3112 1 1 36 TRP CH2 C 12.249 7.092 -6.029 1.00 . A A . 36 TRP CH2 1 1 6 3113 1 1 36 TRP CZ2 C 12.757 5.864 -6.358 1.00 . A A . 36 TRP CZ2 1 1 6 3114 1 1 36 TRP CZ3 C 11.301 7.238 -5.007 1.00 . A A . 36 TRP CZ3 1 1 6 3115 1 1 36 TRP H H 9.170 2.148 -0.748 1.00 . A A . 36 TRP H 1 1 6 3116 1 1 36 TRP HA H 11.864 2.700 -1.775 1.00 . A A . 36 TRP HA 1 1 6 3117 1 1 36 TRP HB3 H 9.399 3.934 -2.938 1.00 . A A . 36 TRP HB3 1 1 6 3118 1 1 36 TRP HD1 H 11.956 1.653 -4.677 1.00 . A A . 36 TRP HD1 1 1 6 3119 1 1 36 TRP HE1 H 13.265 3.058 -6.391 1.00 . A A . 36 TRP HE1 1 1 6 3120 1 1 36 TRP HE3 H 10.112 6.278 -3.512 1.00 . A A . 36 TRP HE3 1 1 6 3121 1 1 36 TRP HH2 H 12.578 7.974 -6.558 1.00 . A A . 36 TRP HH2 1 1 6 3122 1 1 36 TRP HZ2 H 13.487 5.768 -7.149 1.00 . A A . 36 TRP HZ2 1 1 6 3123 1 1 36 TRP HZ3 H 10.926 8.224 -4.778 1.00 . A A . 36 TRP HZ3 1 1 6 3124 1 1 36 TRP N N 10.150 2.117 -0.786 1.00 . A A . 36 TRP N 1 1 6 3125 1 1 36 TRP NE1 N 12.624 3.437 -5.753 1.00 . A A . 36 TRP NE1 1 1 6 3126 1 1 36 TRP O O 11.656 5.325 -1.424 1.00 . A A . 36 TRP O 1 1 7 3127 1 1 1 ASP C C -10.701 -1.145 -7.240 1.00 . A A . 1 ASP C 1 1 7 3128 1 1 1 ASP CA C -11.863 -2.130 -7.150 1.00 . A A . 1 ASP CA 1 1 7 3129 1 1 1 ASP CB C -13.032 -1.493 -6.397 1.00 . A A . 1 ASP CB 1 1 7 3130 1 1 1 ASP CG C -14.348 -2.193 -6.672 1.00 . A A . 1 ASP CG 1 1 7 3131 1 1 1 ASP H1 H -10.576 -3.753 -6.709 1.00 . A A . 1 ASP H1 1 1 7 3132 1 1 1 ASP HA H -12.184 -2.380 -8.150 1.00 . A A . 1 ASP HA 1 1 7 3133 1 1 1 ASP HB3 H -13.124 -0.460 -6.700 1.00 . A A . 1 ASP HB3 1 1 7 3134 1 1 1 ASP N N -11.449 -3.363 -6.491 1.00 . A A . 1 ASP N 1 1 7 3135 1 1 1 ASP O O -10.350 -0.680 -8.324 1.00 . A A . 1 ASP O 1 1 7 3136 1 1 1 ASP OD1 O -14.536 -2.679 -7.807 1.00 . A A . 1 ASP OD1 1 1 7 3137 1 1 1 ASP OD2 O -15.191 -2.254 -5.753 1.00 . A A . 1 ASP OD2 1 1 7 3138 1 1 2 PHE C C -7.660 -0.639 -6.183 1.00 . A A . 2 PHE C 1 1 7 3139 1 1 2 PHE CA C -8.988 0.100 -6.040 1.00 . A A . 2 PHE CA 1 1 7 3140 1 1 2 PHE CB C -9.009 0.883 -4.726 1.00 . A A . 2 PHE CB 1 1 7 3141 1 1 2 PHE CD1 C -11.224 2.063 -4.708 1.00 . A A . 2 PHE CD1 1 1 7 3142 1 1 2 PHE CD2 C -9.244 3.374 -4.920 1.00 . A A . 2 PHE CD2 1 1 7 3143 1 1 2 PHE CE1 C -11.993 3.209 -4.764 1.00 . A A . 2 PHE CE1 1 1 7 3144 1 1 2 PHE CE2 C -10.008 4.525 -4.976 1.00 . A A . 2 PHE CE2 1 1 7 3145 1 1 2 PHE CG C -9.842 2.131 -4.786 1.00 . A A . 2 PHE CG 1 1 7 3146 1 1 2 PHE CZ C -11.384 4.442 -4.896 1.00 . A A . 2 PHE CZ 1 1 7 3147 1 1 2 PHE H H -10.434 -1.236 -5.260 1.00 . A A . 2 PHE H 1 1 7 3148 1 1 2 PHE HA H -9.093 0.790 -6.862 1.00 . A A . 2 PHE HA 1 1 7 3149 1 1 2 PHE HB3 H -8.000 1.168 -4.469 1.00 . A A . 2 PHE HB3 1 1 7 3150 1 1 2 PHE HD1 H -11.702 1.099 -4.604 1.00 . A A . 2 PHE HD1 1 1 7 3151 1 1 2 PHE HD2 H -8.167 3.439 -4.981 1.00 . A A . 2 PHE HD2 1 1 7 3152 1 1 2 PHE HE1 H -13.068 3.143 -4.701 1.00 . A A . 2 PHE HE1 1 1 7 3153 1 1 2 PHE HE2 H -9.528 5.486 -5.079 1.00 . A A . 2 PHE HE2 1 1 7 3154 1 1 2 PHE HZ H -11.983 5.340 -4.941 1.00 . A A . 2 PHE HZ 1 1 7 3155 1 1 2 PHE N N -10.108 -0.832 -6.092 1.00 . A A . 2 PHE N 1 1 7 3156 1 1 2 PHE O O -7.567 -1.848 -5.971 1.00 . A A . 2 PHE O 1 1 7 3157 1 1 3 PRO C C -4.630 -0.876 -5.414 1.00 . A A . 3 PRO C 1 1 7 3158 1 1 3 PRO CA C -5.265 -0.458 -6.735 1.00 . A A . 3 PRO CA 1 1 7 3159 1 1 3 PRO CB C -4.480 0.696 -7.365 1.00 . A A . 3 PRO CB 1 1 7 3160 1 1 3 PRO CD C -6.645 1.552 -6.825 1.00 . A A . 3 PRO CD 1 1 7 3161 1 1 3 PRO CG C -5.192 1.927 -6.921 1.00 . A A . 3 PRO CG 1 1 7 3162 1 1 3 PRO HA H -5.276 -1.300 -7.410 1.00 . A A . 3 PRO HA 1 1 7 3163 1 1 3 PRO HB3 H -4.492 0.598 -8.441 1.00 . A A . 3 PRO HB3 1 1 7 3164 1 1 3 PRO HD3 H -7.150 1.755 -7.757 1.00 . A A . 3 PRO HD3 1 1 7 3165 1 1 3 PRO HG3 H -5.056 2.712 -7.650 1.00 . A A . 3 PRO HG3 1 1 7 3166 1 1 3 PRO N N -6.607 0.105 -6.554 1.00 . A A . 3 PRO N 1 1 7 3167 1 1 3 PRO O O -4.284 -0.032 -4.584 1.00 . A A . 3 PRO O 1 1 7 3168 1 1 4 LEU C C -2.380 -2.925 -4.176 1.00 . A A . 4 LEU C 1 1 7 3169 1 1 4 LEU CA C -3.880 -2.711 -4.002 1.00 . A A . 4 LEU CA 1 1 7 3170 1 1 4 LEU CB C -4.554 -4.029 -3.612 1.00 . A A . 4 LEU CB 1 1 7 3171 1 1 4 LEU CD1 C -4.737 -5.142 -1.375 1.00 . A A . 4 LEU CD1 1 1 7 3172 1 1 4 LEU CD2 C -3.335 -6.176 -3.171 1.00 . A A . 4 LEU CD2 1 1 7 3173 1 1 4 LEU CG C -3.827 -4.869 -2.562 1.00 . A A . 4 LEU CG 1 1 7 3174 1 1 4 LEU H H -4.771 -2.804 -5.919 1.00 . A A . 4 LEU H 1 1 7 3175 1 1 4 LEU HA H -4.040 -1.989 -3.215 1.00 . A A . 4 LEU HA 1 1 7 3176 1 1 4 LEU HB3 H -4.649 -4.627 -4.508 1.00 . A A . 4 LEU HB3 1 1 7 3177 1 1 4 LEU HD11 H -5.765 -4.997 -1.668 1.00 . A A . 4 LEU HD11 1 1 7 3178 1 1 4 LEU HD12 H -4.492 -4.465 -0.571 1.00 . A A . 4 LEU HD12 1 1 7 3179 1 1 4 LEU HD13 H -4.598 -6.161 -1.041 1.00 . A A . 4 LEU HD13 1 1 7 3180 1 1 4 LEU HD21 H -2.302 -6.332 -2.900 1.00 . A A . 4 LEU HD21 1 1 7 3181 1 1 4 LEU HD22 H -3.422 -6.126 -4.246 1.00 . A A . 4 LEU HD22 1 1 7 3182 1 1 4 LEU HD23 H -3.934 -6.994 -2.798 1.00 . A A . 4 LEU HD23 1 1 7 3183 1 1 4 LEU HG H -2.966 -4.322 -2.204 1.00 . A A . 4 LEU HG 1 1 7 3184 1 1 4 LEU N N -4.476 -2.181 -5.223 1.00 . A A . 4 LEU N 1 1 7 3185 1 1 4 LEU O O -1.571 -2.126 -3.706 1.00 . A A . 4 LEU O 1 1 7 3186 1 1 5 SER C C 0.183 -4.263 -3.792 1.00 . A A . 5 SER C 1 1 7 3187 1 1 5 SER CA C -0.614 -4.329 -5.091 1.00 . A A . 5 SER CA 1 1 7 3188 1 1 5 SER CB C -0.016 -3.368 -6.119 1.00 . A A . 5 SER CB 1 1 7 3189 1 1 5 SER H H -2.710 -4.608 -5.204 1.00 . A A . 5 SER H 1 1 7 3190 1 1 5 SER HA H -0.565 -5.335 -5.479 1.00 . A A . 5 SER HA 1 1 7 3191 1 1 5 SER HB3 H 0.536 -2.593 -5.605 1.00 . A A . 5 SER HB3 1 1 7 3192 1 1 5 SER HG H 0.381 -4.326 -7.781 1.00 . A A . 5 SER HG 1 1 7 3193 1 1 5 SER N N -2.018 -4.009 -4.856 1.00 . A A . 5 SER N 1 1 7 3194 1 1 5 SER O O -0.386 -4.189 -2.702 1.00 . A A . 5 SER O 1 1 7 3195 1 1 5 SER OG O 0.863 -4.046 -7.000 1.00 . A A . 5 SER OG 1 1 7 3196 1 1 6 LYS C C 3.313 -3.026 -2.832 1.00 . A A . 6 LYS C 1 1 7 3197 1 1 6 LYS CA C 2.384 -4.233 -2.752 1.00 . A A . 6 LYS CA 1 1 7 3198 1 1 6 LYS CB C 3.209 -5.518 -2.646 1.00 . A A . 6 LYS CB 1 1 7 3199 1 1 6 LYS CD C 4.821 -7.086 -3.764 1.00 . A A . 6 LYS CD 1 1 7 3200 1 1 6 LYS CE C 6.256 -6.596 -3.896 1.00 . A A . 6 LYS CE 1 1 7 3201 1 1 6 LYS CG C 3.826 -5.955 -3.964 1.00 . A A . 6 LYS CG 1 1 7 3202 1 1 6 LYS H H 1.900 -4.350 -4.810 1.00 . A A . 6 LYS H 1 1 7 3203 1 1 6 LYS HA H 1.765 -4.138 -1.874 1.00 . A A . 6 LYS HA 1 1 7 3204 1 1 6 LYS HB3 H 2.569 -6.313 -2.292 1.00 . A A . 6 LYS HB3 1 1 7 3205 1 1 6 LYS HD3 H 4.641 -7.847 -4.509 1.00 . A A . 6 LYS HD3 1 1 7 3206 1 1 6 LYS HE3 H 6.484 -5.963 -3.052 1.00 . A A . 6 LYS HE3 1 1 7 3207 1 1 6 LYS HG3 H 4.337 -5.112 -4.409 1.00 . A A . 6 LYS HG3 1 1 7 3208 1 1 6 LYS HZ1 H 6.779 -8.567 -4.347 1.00 . A A . 6 LYS HZ1 1 1 7 3209 1 1 6 LYS HZ2 H 7.546 -7.952 -2.970 1.00 . A A . 6 LYS HZ2 1 1 7 3210 1 1 6 LYS HZ3 H 8.053 -7.466 -4.509 1.00 . A A . 6 LYS HZ3 1 1 7 3211 1 1 6 LYS N N 1.506 -4.290 -3.915 1.00 . A A . 6 LYS N 1 1 7 3212 1 1 6 LYS NZ N 7.226 -7.725 -3.934 1.00 . A A . 6 LYS NZ 1 1 7 3213 1 1 6 LYS O O 3.413 -2.376 -3.873 1.00 . A A . 6 LYS O 1 1 7 3214 1 1 7 GLU C C 4.237 -0.327 -2.167 1.00 . A A . 7 GLU C 1 1 7 3215 1 1 7 GLU CA C 4.912 -1.603 -1.673 1.00 . A A . 7 GLU CA 1 1 7 3216 1 1 7 GLU CB C 6.158 -1.892 -2.514 1.00 . A A . 7 GLU CB 1 1 7 3217 1 1 7 GLU CD C 8.678 -2.048 -2.572 1.00 . A A . 7 GLU CD 1 1 7 3218 1 1 7 GLU CG C 7.462 -1.585 -1.796 1.00 . A A . 7 GLU CG 1 1 7 3219 1 1 7 GLU H H 3.868 -3.287 -0.929 1.00 . A A . 7 GLU H 1 1 7 3220 1 1 7 GLU HA H 5.207 -1.465 -0.645 1.00 . A A . 7 GLU HA 1 1 7 3221 1 1 7 GLU HB3 H 6.117 -1.295 -3.412 1.00 . A A . 7 GLU HB3 1 1 7 3222 1 1 7 GLU HG3 H 7.455 -2.082 -0.837 1.00 . A A . 7 GLU HG3 1 1 7 3223 1 1 7 GLU N N 3.991 -2.732 -1.727 1.00 . A A . 7 GLU N 1 1 7 3224 1 1 7 GLU O O 3.015 -0.273 -2.312 1.00 . A A . 7 GLU O 1 1 7 3225 1 1 7 GLU OE1 O 8.639 -2.000 -3.820 1.00 . A A . 7 GLU OE1 1 1 7 3226 1 1 7 GLU OE2 O 9.670 -2.459 -1.934 1.00 . A A . 7 GLU OE2 1 1 7 3227 1 1 8 TYR C C 3.545 1.773 -4.052 1.00 . A A . 8 TYR C 1 1 7 3228 1 1 8 TYR CA C 4.522 1.977 -2.899 1.00 . A A . 8 TYR CA 1 1 7 3229 1 1 8 TYR CB C 5.672 2.884 -3.343 1.00 . A A . 8 TYR CB 1 1 7 3230 1 1 8 TYR CD1 C 7.508 1.366 -4.178 1.00 . A A . 8 TYR CD1 1 1 7 3231 1 1 8 TYR CD2 C 6.313 2.670 -5.776 1.00 . A A . 8 TYR CD2 1 1 7 3232 1 1 8 TYR CE1 C 8.281 0.826 -5.189 1.00 . A A . 8 TYR CE1 1 1 7 3233 1 1 8 TYR CE2 C 7.079 2.135 -6.793 1.00 . A A . 8 TYR CE2 1 1 7 3234 1 1 8 TYR CG C 6.513 2.296 -4.452 1.00 . A A . 8 TYR CG 1 1 7 3235 1 1 8 TYR CZ C 8.062 1.213 -6.494 1.00 . A A . 8 TYR CZ 1 1 7 3236 1 1 8 TYR H H 6.006 0.596 -2.289 1.00 . A A . 8 TYR H 1 1 7 3237 1 1 8 TYR HA H 4.001 2.448 -2.078 1.00 . A A . 8 TYR HA 1 1 7 3238 1 1 8 TYR HB3 H 6.318 3.073 -2.499 1.00 . A A . 8 TYR HB3 1 1 7 3239 1 1 8 TYR HD1 H 7.677 1.064 -3.154 1.00 . A A . 8 TYR HD1 1 1 7 3240 1 1 8 TYR HD2 H 5.544 3.393 -6.006 1.00 . A A . 8 TYR HD2 1 1 7 3241 1 1 8 TYR HE1 H 9.049 0.105 -4.955 1.00 . A A . 8 TYR HE1 1 1 7 3242 1 1 8 TYR HE2 H 6.909 2.439 -7.815 1.00 . A A . 8 TYR HE2 1 1 7 3243 1 1 8 TYR HH H 8.589 1.089 -8.339 1.00 . A A . 8 TYR HH 1 1 7 3244 1 1 8 TYR N N 5.042 0.699 -2.424 1.00 . A A . 8 TYR N 1 1 7 3245 1 1 8 TYR O O 3.910 1.247 -5.103 1.00 . A A . 8 TYR O 1 1 7 3246 1 1 8 TYR OH O 8.828 0.678 -7.504 1.00 . A A . 8 TYR OH 1 1 7 3247 1 1 9 GLU C C 0.041 2.891 -4.516 1.00 . A A . 9 GLU C 1 1 7 3248 1 1 9 GLU CA C 1.270 2.059 -4.869 1.00 . A A . 9 GLU CA 1 1 7 3249 1 1 9 GLU CB C 0.876 0.590 -5.035 1.00 . A A . 9 GLU CB 1 1 7 3250 1 1 9 GLU CD C -0.115 1.214 -7.274 1.00 . A A . 9 GLU CD 1 1 7 3251 1 1 9 GLU CG C -0.260 0.372 -6.021 1.00 . A A . 9 GLU CG 1 1 7 3252 1 1 9 GLU H H 2.071 2.606 -2.987 1.00 . A A . 9 GLU H 1 1 7 3253 1 1 9 GLU HA H 1.678 2.420 -5.801 1.00 . A A . 9 GLU HA 1 1 7 3254 1 1 9 GLU HB3 H 0.570 0.202 -4.075 1.00 . A A . 9 GLU HB3 1 1 7 3255 1 1 9 GLU HG3 H -1.192 0.628 -5.538 1.00 . A A . 9 GLU HG3 1 1 7 3256 1 1 9 GLU N N 2.302 2.195 -3.846 1.00 . A A . 9 GLU N 1 1 7 3257 1 1 9 GLU O O -0.185 3.960 -5.083 1.00 . A A . 9 GLU O 1 1 7 3258 1 1 9 GLU OE1 O 0.844 0.978 -8.037 1.00 . A A . 9 GLU OE1 1 1 7 3259 1 1 9 GLU OE2 O -0.959 2.109 -7.489 1.00 . A A . 9 GLU OE2 1 1 7 3260 1 1 10 THR C C -2.681 2.310 -2.047 1.00 . A A . 10 THR C 1 1 7 3261 1 1 10 THR CA C -1.962 3.085 -3.146 1.00 . A A . 10 THR CA 1 1 7 3262 1 1 10 THR CB C -2.931 3.305 -4.322 1.00 . A A . 10 THR CB 1 1 7 3263 1 1 10 THR CG2 C -2.938 4.765 -4.751 1.00 . A A . 10 THR CG2 1 1 7 3264 1 1 10 THR H H -0.521 1.534 -3.159 1.00 . A A . 10 THR H 1 1 7 3265 1 1 10 THR HA H -1.671 4.051 -2.759 1.00 . A A . 10 THR HA 1 1 7 3266 1 1 10 THR HB H -3.927 3.034 -4.004 1.00 . A A . 10 THR HB 1 1 7 3267 1 1 10 THR HG1 H -2.926 1.601 -5.316 1.00 . A A . 10 THR HG1 1 1 7 3268 1 1 10 THR HG21 H -3.933 5.041 -5.067 1.00 . A A . 10 THR HG21 1 1 7 3269 1 1 10 THR HG22 H -2.249 4.902 -5.572 1.00 . A A . 10 THR HG22 1 1 7 3270 1 1 10 THR HG23 H -2.638 5.385 -3.921 1.00 . A A . 10 THR HG23 1 1 7 3271 1 1 10 THR N N -0.754 2.391 -3.574 1.00 . A A . 10 THR N 1 1 7 3272 1 1 10 THR O O -3.086 1.164 -2.245 1.00 . A A . 10 THR O 1 1 7 3273 1 1 10 THR OG1 O -2.553 2.479 -5.429 1.00 . A A . 10 THR OG1 1 1 7 3274 1 1 11 CYS C C -4.693 3.153 0.709 1.00 . A A . 11 CYS C 1 1 7 3275 1 1 11 CYS CA C -3.510 2.311 0.241 1.00 . A A . 11 CYS CA 1 1 7 3276 1 1 11 CYS CB C -2.526 2.108 1.396 1.00 . A A . 11 CYS CB 1 1 7 3277 1 1 11 CYS H H -2.494 3.854 -0.791 1.00 . A A . 11 CYS H 1 1 7 3278 1 1 11 CYS HA H -3.873 1.349 -0.084 1.00 . A A . 11 CYS HA 1 1 7 3279 1 1 11 CYS HB3 H -1.828 1.328 1.130 1.00 . A A . 11 CYS HB3 1 1 7 3280 1 1 11 CYS N N -2.838 2.942 -0.889 1.00 . A A . 11 CYS N 1 1 7 3281 1 1 11 CYS O O -4.566 3.971 1.620 1.00 . A A . 11 CYS O 1 1 7 3282 1 1 11 CYS SG S -1.565 3.594 1.824 1.00 . A A . 11 CYS SG 1 1 7 3283 1 1 12 VAL C C -7.748 3.058 1.634 1.00 . A A . 12 VAL C 1 1 7 3284 1 1 12 VAL CA C -7.053 3.683 0.430 1.00 . A A . 12 VAL CA 1 1 7 3285 1 1 12 VAL CB C -8.042 3.736 -0.750 1.00 . A A . 12 VAL CB 1 1 7 3286 1 1 12 VAL CG1 C -8.900 4.989 -0.671 1.00 . A A . 12 VAL CG1 1 1 7 3287 1 1 12 VAL CG2 C -7.295 3.674 -2.074 1.00 . A A . 12 VAL CG2 1 1 7 3288 1 1 12 VAL H H -5.884 2.279 -0.640 1.00 . A A . 12 VAL H 1 1 7 3289 1 1 12 VAL HA H -6.766 4.695 0.677 1.00 . A A . 12 VAL HA 1 1 7 3290 1 1 12 VAL HB H -8.692 2.876 -0.687 1.00 . A A . 12 VAL HB 1 1 7 3291 1 1 12 VAL HG11 H -8.603 5.575 0.185 1.00 . A A . 12 VAL HG11 1 1 7 3292 1 1 12 VAL HG12 H -8.771 5.572 -1.571 1.00 . A A . 12 VAL HG12 1 1 7 3293 1 1 12 VAL HG13 H -9.939 4.707 -0.571 1.00 . A A . 12 VAL HG13 1 1 7 3294 1 1 12 VAL HG21 H -7.884 4.151 -2.843 1.00 . A A . 12 VAL HG21 1 1 7 3295 1 1 12 VAL HG22 H -6.347 4.183 -1.976 1.00 . A A . 12 VAL HG22 1 1 7 3296 1 1 12 VAL HG23 H -7.122 2.641 -2.342 1.00 . A A . 12 VAL HG23 1 1 7 3297 1 1 12 VAL N N -5.845 2.945 0.078 1.00 . A A . 12 VAL N 1 1 7 3298 1 1 12 VAL O O -7.438 1.934 2.028 1.00 . A A . 12 VAL O 1 1 7 3299 1 1 13 ARG C C -9.973 1.908 3.128 1.00 . A A . 13 ARG C 1 1 7 3300 1 1 13 ARG CA C -9.429 3.312 3.374 1.00 . A A . 13 ARG CA 1 1 7 3301 1 1 13 ARG CB C -10.580 4.264 3.705 1.00 . A A . 13 ARG CB 1 1 7 3302 1 1 13 ARG CD C -11.791 4.842 5.830 1.00 . A A . 13 ARG CD 1 1 7 3303 1 1 13 ARG CG C -10.468 4.900 5.081 1.00 . A A . 13 ARG CG 1 1 7 3304 1 1 13 ARG CZ C -11.537 2.988 7.426 1.00 . A A . 13 ARG CZ 1 1 7 3305 1 1 13 ARG H H -8.891 4.683 1.854 1.00 . A A . 13 ARG H 1 1 7 3306 1 1 13 ARG HA H -8.749 3.281 4.213 1.00 . A A . 13 ARG HA 1 1 7 3307 1 1 13 ARG HB3 H -11.509 3.717 3.659 1.00 . A A . 13 ARG HB3 1 1 7 3308 1 1 13 ARG HD3 H -12.581 5.147 5.161 1.00 . A A . 13 ARG HD3 1 1 7 3309 1 1 13 ARG HE H -12.711 2.952 5.813 1.00 . A A . 13 ARG HE 1 1 7 3310 1 1 13 ARG HG3 H -10.173 5.933 4.969 1.00 . A A . 13 ARG HG3 1 1 7 3311 1 1 13 ARG HH11 H -10.444 4.632 7.852 1.00 . A A . 13 ARG HH11 1 1 7 3312 1 1 13 ARG HH12 H -10.274 3.319 8.968 1.00 . A A . 13 ARG HH12 1 1 7 3313 1 1 13 ARG HH21 H -12.496 1.215 7.275 1.00 . A A . 13 ARG HH21 1 1 7 3314 1 1 13 ARG HH22 H -11.442 1.375 8.639 1.00 . A A . 13 ARG HH22 1 1 7 3315 1 1 13 ARG N N -8.690 3.794 2.215 1.00 . A A . 13 ARG N 1 1 7 3316 1 1 13 ARG NE N -12.081 3.499 6.326 1.00 . A A . 13 ARG NE 1 1 7 3317 1 1 13 ARG NH1 N -10.681 3.705 8.140 1.00 . A A . 13 ARG NH1 1 1 7 3318 1 1 13 ARG NH2 N -11.851 1.759 7.812 1.00 . A A . 13 ARG NH2 1 1 7 3319 1 1 13 ARG O O -9.653 0.958 3.844 1.00 . A A . 13 ARG O 1 1 7 3320 1 1 14 PRO C C -10.399 -0.493 1.156 1.00 . A A . 14 PRO C 1 1 7 3321 1 1 14 PRO CA C -11.418 0.488 1.728 1.00 . A A . 14 PRO CA 1 1 7 3322 1 1 14 PRO CB C -12.448 0.870 0.663 1.00 . A A . 14 PRO CB 1 1 7 3323 1 1 14 PRO CD C -11.238 2.861 1.198 1.00 . A A . 14 PRO CD 1 1 7 3324 1 1 14 PRO CG C -11.933 2.139 0.076 1.00 . A A . 14 PRO CG 1 1 7 3325 1 1 14 PRO HA H -11.920 0.032 2.569 1.00 . A A . 14 PRO HA 1 1 7 3326 1 1 14 PRO HB3 H -13.414 1.012 1.125 1.00 . A A . 14 PRO HB3 1 1 7 3327 1 1 14 PRO HD3 H -11.923 3.527 1.700 1.00 . A A . 14 PRO HD3 1 1 7 3328 1 1 14 PRO HG3 H -12.756 2.731 -0.297 1.00 . A A . 14 PRO HG3 1 1 7 3329 1 1 14 PRO N N -10.813 1.772 2.092 1.00 . A A . 14 PRO N 1 1 7 3330 1 1 14 PRO O O -10.336 -1.650 1.571 1.00 . A A . 14 PRO O 1 1 7 3331 1 1 15 ARG C C -7.708 -1.526 0.623 1.00 . A A . 15 ARG C 1 1 7 3332 1 1 15 ARG CA C -8.588 -0.856 -0.428 1.00 . A A . 15 ARG CA 1 1 7 3333 1 1 15 ARG CB C -7.724 -0.019 -1.374 1.00 . A A . 15 ARG CB 1 1 7 3334 1 1 15 ARG CD C -7.201 -1.803 -3.065 1.00 . A A . 15 ARG CD 1 1 7 3335 1 1 15 ARG CG C -6.627 -0.816 -2.061 1.00 . A A . 15 ARG CG 1 1 7 3336 1 1 15 ARG CZ C -8.563 -3.848 -2.984 1.00 . A A . 15 ARG CZ 1 1 7 3337 1 1 15 ARG H H -9.702 0.910 -0.087 1.00 . A A . 15 ARG H 1 1 7 3338 1 1 15 ARG HA H -9.094 -1.620 -0.998 1.00 . A A . 15 ARG HA 1 1 7 3339 1 1 15 ARG HB3 H -7.261 0.777 -0.810 1.00 . A A . 15 ARG HB3 1 1 7 3340 1 1 15 ARG HD3 H -6.426 -2.072 -3.768 1.00 . A A . 15 ARG HD3 1 1 7 3341 1 1 15 ARG HE H -7.365 -3.218 -1.518 1.00 . A A . 15 ARG HE 1 1 7 3342 1 1 15 ARG HG3 H -6.068 -1.359 -1.314 1.00 . A A . 15 ARG HG3 1 1 7 3343 1 1 15 ARG HH11 H -8.725 -2.787 -4.694 1.00 . A A . 15 ARG HH11 1 1 7 3344 1 1 15 ARG HH12 H -9.680 -4.230 -4.624 1.00 . A A . 15 ARG HH12 1 1 7 3345 1 1 15 ARG HH21 H -8.618 -5.121 -1.414 1.00 . A A . 15 ARG HH21 1 1 7 3346 1 1 15 ARG HH22 H -9.619 -5.557 -2.757 1.00 . A A . 15 ARG HH22 1 1 7 3347 1 1 15 ARG N N -9.604 -0.021 0.202 1.00 . A A . 15 ARG N 1 1 7 3348 1 1 15 ARG NE N -7.696 -3.016 -2.419 1.00 . A A . 15 ARG NE 1 1 7 3349 1 1 15 ARG NH1 N -9.028 -3.600 -4.200 1.00 . A A . 15 ARG NH1 1 1 7 3350 1 1 15 ARG NH2 N -8.966 -4.931 -2.331 1.00 . A A . 15 ARG NH2 1 1 7 3351 1 1 15 ARG O O -7.864 -2.713 0.913 1.00 . A A . 15 ARG O 1 1 7 3352 1 1 16 LYS C C -4.973 -2.362 1.632 1.00 . A A . 16 LYS C 1 1 7 3353 1 1 16 LYS CA C -5.878 -1.278 2.209 1.00 . A A . 16 LYS CA 1 1 7 3354 1 1 16 LYS CB C -6.673 -1.837 3.390 1.00 . A A . 16 LYS CB 1 1 7 3355 1 1 16 LYS CD C -6.854 -2.134 5.878 1.00 . A A . 16 LYS CD 1 1 7 3356 1 1 16 LYS CE C -6.684 -3.623 6.135 1.00 . A A . 16 LYS CE 1 1 7 3357 1 1 16 LYS CG C -5.979 -1.663 4.729 1.00 . A A . 16 LYS CG 1 1 7 3358 1 1 16 LYS H H -6.708 0.179 0.916 1.00 . A A . 16 LYS H 1 1 7 3359 1 1 16 LYS HA H -5.264 -0.459 2.554 1.00 . A A . 16 LYS HA 1 1 7 3360 1 1 16 LYS HB3 H -6.839 -2.892 3.229 1.00 . A A . 16 LYS HB3 1 1 7 3361 1 1 16 LYS HD3 H -7.889 -1.935 5.635 1.00 . A A . 16 LYS HD3 1 1 7 3362 1 1 16 LYS HE3 H -6.312 -3.762 7.138 1.00 . A A . 16 LYS HE3 1 1 7 3363 1 1 16 LYS HG3 H -5.747 -0.616 4.870 1.00 . A A . 16 LYS HG3 1 1 7 3364 1 1 16 LYS HZ1 H -8.614 -4.116 6.765 1.00 . A A . 16 LYS HZ1 1 1 7 3365 1 1 16 LYS HZ2 H -7.795 -5.387 6.004 1.00 . A A . 16 LYS HZ2 1 1 7 3366 1 1 16 LYS HZ3 H -8.421 -4.114 5.084 1.00 . A A . 16 LYS HZ3 1 1 7 3367 1 1 16 LYS N N -6.783 -0.760 1.190 1.00 . A A . 16 LYS N 1 1 7 3368 1 1 16 LYS NZ N -7.968 -4.362 5.987 1.00 . A A . 16 LYS NZ 1 1 7 3369 1 1 16 LYS O O -5.442 -3.424 1.224 1.00 . A A . 16 LYS O 1 1 7 3370 1 1 17 CYS C C -2.933 -4.431 1.661 1.00 . A A . 17 CYS C 1 1 7 3371 1 1 17 CYS CA C -2.702 -3.040 1.078 1.00 . A A . 17 CYS CA 1 1 7 3372 1 1 17 CYS CB C -1.279 -2.574 1.392 1.00 . A A . 17 CYS CB 1 1 7 3373 1 1 17 CYS H H -3.358 -1.224 1.944 1.00 . A A . 17 CYS H 1 1 7 3374 1 1 17 CYS HA H -2.828 -3.086 0.008 1.00 . A A . 17 CYS HA 1 1 7 3375 1 1 17 CYS HB3 H -0.631 -3.436 1.453 1.00 . A A . 17 CYS HB3 1 1 7 3376 1 1 17 CYS N N -3.674 -2.088 1.604 1.00 . A A . 17 CYS N 1 1 7 3377 1 1 17 CYS O O -3.291 -4.573 2.830 1.00 . A A . 17 CYS O 1 1 7 3378 1 1 17 CYS SG S -0.578 -1.438 0.153 1.00 . A A . 17 CYS SG 1 1 7 3379 1 1 18 GLN C C -1.836 -7.240 2.271 1.00 . A A . 18 GLN C 1 1 7 3380 1 1 18 GLN CA C -2.914 -6.833 1.272 1.00 . A A . 18 GLN CA 1 1 7 3381 1 1 18 GLN CB C -2.892 -7.776 0.068 1.00 . A A . 18 GLN CB 1 1 7 3382 1 1 18 GLN CD C -3.977 -10.058 0.078 1.00 . A A . 18 GLN CD 1 1 7 3383 1 1 18 GLN CG C -4.178 -8.566 -0.109 1.00 . A A . 18 GLN CG 1 1 7 3384 1 1 18 GLN H H -2.443 -5.276 -0.082 1.00 . A A . 18 GLN H 1 1 7 3385 1 1 18 GLN HA H -3.877 -6.900 1.753 1.00 . A A . 18 GLN HA 1 1 7 3386 1 1 18 GLN HB3 H -2.078 -8.476 0.189 1.00 . A A . 18 GLN HB3 1 1 7 3387 1 1 18 GLN HE21 H -5.655 -10.175 1.139 1.00 . A A . 18 GLN HE21 1 1 7 3388 1 1 18 GLN HE22 H -4.799 -11.660 0.921 1.00 . A A . 18 GLN HE22 1 1 7 3389 1 1 18 GLN HG3 H -4.559 -8.391 -1.104 1.00 . A A . 18 GLN HG3 1 1 7 3390 1 1 18 GLN N N -2.727 -5.453 0.839 1.00 . A A . 18 GLN N 1 1 7 3391 1 1 18 GLN NE2 N -4.903 -10.696 0.784 1.00 . A A . 18 GLN NE2 1 1 7 3392 1 1 18 GLN O O -2.119 -7.614 3.410 1.00 . A A . 18 GLN O 1 1 7 3393 1 1 18 GLN OE1 O -3.001 -10.630 -0.406 1.00 . A A . 18 GLN OE1 1 1 7 3394 1 1 19 PRO C C 0.803 -6.522 3.808 1.00 . A A . 19 PRO C 1 1 7 3395 1 1 19 PRO CA C 0.577 -7.524 2.680 1.00 . A A . 19 PRO CA 1 1 7 3396 1 1 19 PRO CB C 1.756 -7.500 1.703 1.00 . A A . 19 PRO CB 1 1 7 3397 1 1 19 PRO CD C -0.156 -6.729 0.494 1.00 . A A . 19 PRO CD 1 1 7 3398 1 1 19 PRO CG C 1.333 -6.567 0.621 1.00 . A A . 19 PRO CG 1 1 7 3399 1 1 19 PRO HA H 0.471 -8.514 3.095 1.00 . A A . 19 PRO HA 1 1 7 3400 1 1 19 PRO HB3 H 1.930 -8.495 1.320 1.00 . A A . 19 PRO HB3 1 1 7 3401 1 1 19 PRO HD3 H -0.393 -7.481 -0.245 1.00 . A A . 19 PRO HD3 1 1 7 3402 1 1 19 PRO HG3 H 1.818 -6.836 -0.306 1.00 . A A . 19 PRO HG3 1 1 7 3403 1 1 19 PRO N N -0.569 -7.166 1.838 1.00 . A A . 19 PRO N 1 1 7 3404 1 1 19 PRO O O 0.198 -5.450 3.848 1.00 . A A . 19 PRO O 1 1 7 3405 1 1 20 PRO C C 2.798 -4.779 5.485 1.00 . A A . 20 PRO C 1 1 7 3406 1 1 20 PRO CA C 2.017 -6.023 5.892 1.00 . A A . 20 PRO CA 1 1 7 3407 1 1 20 PRO CB C 2.878 -6.928 6.777 1.00 . A A . 20 PRO CB 1 1 7 3408 1 1 20 PRO CD C 2.448 -8.140 4.761 1.00 . A A . 20 PRO CD 1 1 7 3409 1 1 20 PRO CG C 3.476 -7.918 5.837 1.00 . A A . 20 PRO CG 1 1 7 3410 1 1 20 PRO HA H 1.129 -5.729 6.433 1.00 . A A . 20 PRO HA 1 1 7 3411 1 1 20 PRO HB3 H 2.257 -7.412 7.517 1.00 . A A . 20 PRO HB3 1 1 7 3412 1 1 20 PRO HD3 H 1.807 -8.971 5.018 1.00 . A A . 20 PRO HD3 1 1 7 3413 1 1 20 PRO HG3 H 3.678 -8.843 6.358 1.00 . A A . 20 PRO HG3 1 1 7 3414 1 1 20 PRO N N 1.693 -6.878 4.746 1.00 . A A . 20 PRO N 1 1 7 3415 1 1 20 PRO O O 4.021 -4.729 5.619 1.00 . A A . 20 PRO O 1 1 7 3416 1 1 21 LEU C C 2.237 -1.360 5.415 1.00 . A A . 21 LEU C 1 1 7 3417 1 1 21 LEU CA C 2.711 -2.529 4.559 1.00 . A A . 21 LEU CA 1 1 7 3418 1 1 21 LEU CB C 2.398 -2.257 3.085 1.00 . A A . 21 LEU CB 1 1 7 3419 1 1 21 LEU CD1 C 4.680 -2.280 2.049 1.00 . A A . 21 LEU CD1 1 1 7 3420 1 1 21 LEU CD2 C 3.438 -4.426 2.380 1.00 . A A . 21 LEU CD2 1 1 7 3421 1 1 21 LEU CG C 3.310 -2.942 2.068 1.00 . A A . 21 LEU CG 1 1 7 3422 1 1 21 LEU H H 1.113 -3.874 4.903 1.00 . A A . 21 LEU H 1 1 7 3423 1 1 21 LEU HA H 3.779 -2.637 4.677 1.00 . A A . 21 LEU HA 1 1 7 3424 1 1 21 LEU HB3 H 2.464 -1.190 2.926 1.00 . A A . 21 LEU HB3 1 1 7 3425 1 1 21 LEU HD11 H 5.373 -2.903 1.506 1.00 . A A . 21 LEU HD11 1 1 7 3426 1 1 21 LEU HD12 H 5.031 -2.149 3.062 1.00 . A A . 21 LEU HD12 1 1 7 3427 1 1 21 LEU HD13 H 4.607 -1.316 1.567 1.00 . A A . 21 LEU HD13 1 1 7 3428 1 1 21 LEU HD21 H 4.158 -4.567 3.172 1.00 . A A . 21 LEU HD21 1 1 7 3429 1 1 21 LEU HD22 H 3.768 -4.952 1.496 1.00 . A A . 21 LEU HD22 1 1 7 3430 1 1 21 LEU HD23 H 2.479 -4.812 2.692 1.00 . A A . 21 LEU HD23 1 1 7 3431 1 1 21 LEU HG H 2.878 -2.843 1.082 1.00 . A A . 21 LEU HG 1 1 7 3432 1 1 21 LEU N N 2.084 -3.775 4.986 1.00 . A A . 21 LEU N 1 1 7 3433 1 1 21 LEU O O 1.439 -1.534 6.337 1.00 . A A . 21 LEU O 1 1 7 3434 1 1 22 LYS C C 2.212 2.228 4.902 1.00 . A A . 22 LYS C 1 1 7 3435 1 1 22 LYS CA C 2.356 1.034 5.842 1.00 . A A . 22 LYS CA 1 1 7 3436 1 1 22 LYS CB C 3.399 1.342 6.918 1.00 . A A . 22 LYS CB 1 1 7 3437 1 1 22 LYS CD C 4.286 0.862 9.218 1.00 . A A . 22 LYS CD 1 1 7 3438 1 1 22 LYS CE C 3.677 0.956 10.609 1.00 . A A . 22 LYS CE 1 1 7 3439 1 1 22 LYS CG C 3.241 0.504 8.175 1.00 . A A . 22 LYS CG 1 1 7 3440 1 1 22 LYS H H 3.363 -0.091 4.357 1.00 . A A . 22 LYS H 1 1 7 3441 1 1 22 LYS HA H 1.404 0.847 6.317 1.00 . A A . 22 LYS HA 1 1 7 3442 1 1 22 LYS HB3 H 3.318 2.384 7.193 1.00 . A A . 22 LYS HB3 1 1 7 3443 1 1 22 LYS HD3 H 4.727 1.815 8.962 1.00 . A A . 22 LYS HD3 1 1 7 3444 1 1 22 LYS HE3 H 2.854 0.259 10.675 1.00 . A A . 22 LYS HE3 1 1 7 3445 1 1 22 LYS HG3 H 3.346 -0.540 7.917 1.00 . A A . 22 LYS HG3 1 1 7 3446 1 1 22 LYS HZ1 H 5.520 1.223 11.556 1.00 . A A . 22 LYS HZ1 1 1 7 3447 1 1 22 LYS HZ2 H 4.941 -0.365 11.617 1.00 . A A . 22 LYS HZ2 1 1 7 3448 1 1 22 LYS HZ3 H 4.259 0.821 12.610 1.00 . A A . 22 LYS HZ3 1 1 7 3449 1 1 22 LYS N N 2.731 -0.167 5.103 1.00 . A A . 22 LYS N 1 1 7 3450 1 1 22 LYS NZ N 4.670 0.637 11.672 1.00 . A A . 22 LYS NZ 1 1 7 3451 1 1 22 LYS O O 2.913 2.326 3.895 1.00 . A A . 22 LYS O 1 1 7 3452 1 1 23 CYS C C 1.936 5.482 4.896 1.00 . A A . 23 CYS C 1 1 7 3453 1 1 23 CYS CA C 1.064 4.320 4.427 1.00 . A A . 23 CYS CA 1 1 7 3454 1 1 23 CYS CB C -0.412 4.720 4.487 1.00 . A A . 23 CYS CB 1 1 7 3455 1 1 23 CYS H H 0.771 2.999 6.055 1.00 . A A . 23 CYS H 1 1 7 3456 1 1 23 CYS HA H 1.321 4.082 3.407 1.00 . A A . 23 CYS HA 1 1 7 3457 1 1 23 CYS HB3 H -0.566 5.591 3.867 1.00 . A A . 23 CYS HB3 1 1 7 3458 1 1 23 CYS N N 1.299 3.132 5.240 1.00 . A A . 23 CYS N 1 1 7 3459 1 1 23 CYS O O 2.805 5.313 5.751 1.00 . A A . 23 CYS O 1 1 7 3460 1 1 23 CYS SG S -1.558 3.422 3.921 1.00 . A A . 23 CYS SG 1 1 7 3461 1 1 24 ASN C C 1.561 9.080 4.736 1.00 . A A . 24 ASN C 1 1 7 3462 1 1 24 ASN CA C 2.461 7.849 4.688 1.00 . A A . 24 ASN CA 1 1 7 3463 1 1 24 ASN CB C 3.597 8.073 3.688 1.00 . A A . 24 ASN CB 1 1 7 3464 1 1 24 ASN CG C 3.486 7.168 2.475 1.00 . A A . 24 ASN CG 1 1 7 3465 1 1 24 ASN H H 0.991 6.731 3.653 1.00 . A A . 24 ASN H 1 1 7 3466 1 1 24 ASN HA H 2.884 7.689 5.668 1.00 . A A . 24 ASN HA 1 1 7 3467 1 1 24 ASN HB3 H 4.541 7.879 4.174 1.00 . A A . 24 ASN HB3 1 1 7 3468 1 1 24 ASN HD21 H 5.279 6.397 2.856 1.00 . A A . 24 ASN HD21 1 1 7 3469 1 1 24 ASN HD22 H 4.471 5.768 1.464 1.00 . A A . 24 ASN HD22 1 1 7 3470 1 1 24 ASN N N 1.698 6.660 4.329 1.00 . A A . 24 ASN N 1 1 7 3471 1 1 24 ASN ND2 N 4.516 6.363 2.242 1.00 . A A . 24 ASN ND2 1 1 7 3472 1 1 24 ASN O O 1.211 9.566 5.812 1.00 . A A . 24 ASN O 1 1 7 3473 1 1 24 ASN OD1 O 2.486 7.194 1.758 1.00 . A A . 24 ASN OD1 1 1 7 3474 1 1 25 LYS C C -0.247 10.895 2.062 1.00 . A A . 25 LYS C 1 1 7 3475 1 1 25 LYS CA C 0.327 10.753 3.468 1.00 . A A . 25 LYS CA 1 1 7 3476 1 1 25 LYS CB C 1.107 12.015 3.842 1.00 . A A . 25 LYS CB 1 1 7 3477 1 1 25 LYS CD C 3.414 13.003 3.733 1.00 . A A . 25 LYS CD 1 1 7 3478 1 1 25 LYS CE C 4.741 12.970 2.989 1.00 . A A . 25 LYS CE 1 1 7 3479 1 1 25 LYS CG C 2.332 12.252 2.975 1.00 . A A . 25 LYS CG 1 1 7 3480 1 1 25 LYS H H 1.500 9.149 2.738 1.00 . A A . 25 LYS H 1 1 7 3481 1 1 25 LYS HA H -0.487 10.623 4.164 1.00 . A A . 25 LYS HA 1 1 7 3482 1 1 25 LYS HB3 H 1.430 11.933 4.869 1.00 . A A . 25 LYS HB3 1 1 7 3483 1 1 25 LYS HD3 H 3.544 12.546 4.704 1.00 . A A . 25 LYS HD3 1 1 7 3484 1 1 25 LYS HE3 H 4.552 13.126 1.937 1.00 . A A . 25 LYS HE3 1 1 7 3485 1 1 25 LYS HG3 H 2.043 12.831 2.109 1.00 . A A . 25 LYS HG3 1 1 7 3486 1 1 25 LYS HZ1 H 5.797 13.945 4.505 1.00 . A A . 25 LYS HZ1 1 1 7 3487 1 1 25 LYS HZ2 H 5.300 14.965 3.250 1.00 . A A . 25 LYS HZ2 1 1 7 3488 1 1 25 LYS HZ3 H 6.604 13.913 3.018 1.00 . A A . 25 LYS HZ3 1 1 7 3489 1 1 25 LYS N N 1.189 9.580 3.562 1.00 . A A . 25 LYS N 1 1 7 3490 1 1 25 LYS NZ N 5.676 14.021 3.475 1.00 . A A . 25 LYS NZ 1 1 7 3491 1 1 25 LYS O O -1.405 11.272 1.889 1.00 . A A . 25 LYS O 1 1 7 3492 1 1 26 ALA C C -0.455 9.360 -0.807 1.00 . A A . 26 ALA C 1 1 7 3493 1 1 26 ALA CA C 0.143 10.678 -0.330 1.00 . A A . 26 ALA CA 1 1 7 3494 1 1 26 ALA CB C 1.311 11.081 -1.217 1.00 . A A . 26 ALA CB 1 1 7 3495 1 1 26 ALA H H 1.484 10.294 1.261 1.00 . A A . 26 ALA H 1 1 7 3496 1 1 26 ALA HA H -0.611 11.450 -0.398 1.00 . A A . 26 ALA HA 1 1 7 3497 1 1 26 ALA HB1 H 1.188 10.642 -2.196 1.00 . A A . 26 ALA HB1 1 1 7 3498 1 1 26 ALA HB2 H 1.342 12.157 -1.307 1.00 . A A . 26 ALA HB2 1 1 7 3499 1 1 26 ALA HB3 H 2.234 10.730 -0.779 1.00 . A A . 26 ALA HB3 1 1 7 3500 1 1 26 ALA N N 0.571 10.589 1.060 1.00 . A A . 26 ALA N 1 1 7 3501 1 1 26 ALA O O -0.556 9.112 -2.008 1.00 . A A . 26 ALA O 1 1 7 3502 1 1 27 GLN C C -0.411 6.311 -0.847 1.00 . A A . 27 GLN C 1 1 7 3503 1 1 27 GLN CA C -1.437 7.223 -0.183 1.00 . A A . 27 GLN CA 1 1 7 3504 1 1 27 GLN CB C -2.648 7.403 -1.101 1.00 . A A . 27 GLN CB 1 1 7 3505 1 1 27 GLN CD C -3.545 9.703 -1.639 1.00 . A A . 27 GLN CD 1 1 7 3506 1 1 27 GLN CG C -3.571 8.533 -0.676 1.00 . A A . 27 GLN CG 1 1 7 3507 1 1 27 GLN H H -0.743 8.772 1.081 1.00 . A A . 27 GLN H 1 1 7 3508 1 1 27 GLN HA H -1.762 6.766 0.740 1.00 . A A . 27 GLN HA 1 1 7 3509 1 1 27 GLN HB3 H -3.217 6.486 -1.111 1.00 . A A . 27 GLN HB3 1 1 7 3510 1 1 27 GLN HE21 H -4.847 8.783 -2.828 1.00 . A A . 27 GLN HE21 1 1 7 3511 1 1 27 GLN HE22 H -4.317 10.341 -3.357 1.00 . A A . 27 GLN HE22 1 1 7 3512 1 1 27 GLN HG3 H -3.265 8.882 0.300 1.00 . A A . 27 GLN HG3 1 1 7 3513 1 1 27 GLN N N -0.850 8.517 0.142 1.00 . A A . 27 GLN N 1 1 7 3514 1 1 27 GLN NE2 N -4.313 9.599 -2.718 1.00 . A A . 27 GLN NE2 1 1 7 3515 1 1 27 GLN O O -0.598 5.874 -1.984 1.00 . A A . 27 GLN O 1 1 7 3516 1 1 27 GLN OE1 O -2.843 10.689 -1.418 1.00 . A A . 27 GLN OE1 1 1 7 3517 1 1 28 ILE C C 2.131 4.111 0.370 1.00 . A A . 28 ILE C 1 1 7 3518 1 1 28 ILE CA C 1.727 5.167 -0.653 1.00 . A A . 28 ILE CA 1 1 7 3519 1 1 28 ILE CB C 2.973 5.981 -1.051 1.00 . A A . 28 ILE CB 1 1 7 3520 1 1 28 ILE CD1 C 1.804 7.103 -3.014 1.00 . A A . 28 ILE CD1 1 1 7 3521 1 1 28 ILE CG1 C 2.558 7.295 -1.716 1.00 . A A . 28 ILE CG1 1 1 7 3522 1 1 28 ILE CG2 C 3.863 5.168 -1.980 1.00 . A A . 28 ILE CG2 1 1 7 3523 1 1 28 ILE H H 0.764 6.405 0.767 1.00 . A A . 28 ILE H 1 1 7 3524 1 1 28 ILE HA H 1.348 4.672 -1.536 1.00 . A A . 28 ILE HA 1 1 7 3525 1 1 28 ILE HB H 3.533 6.200 -0.156 1.00 . A A . 28 ILE HB 1 1 7 3526 1 1 28 ILE HD11 H 1.417 6.096 -3.060 1.00 . A A . 28 ILE HD11 1 1 7 3527 1 1 28 ILE HD12 H 0.985 7.805 -3.061 1.00 . A A . 28 ILE HD12 1 1 7 3528 1 1 28 ILE HD13 H 2.471 7.270 -3.846 1.00 . A A . 28 ILE HD13 1 1 7 3529 1 1 28 ILE HG13 H 3.443 7.876 -1.929 1.00 . A A . 28 ILE HG13 1 1 7 3530 1 1 28 ILE HG21 H 4.285 5.817 -2.732 1.00 . A A . 28 ILE HG21 1 1 7 3531 1 1 28 ILE HG22 H 4.659 4.715 -1.408 1.00 . A A . 28 ILE HG22 1 1 7 3532 1 1 28 ILE HG23 H 3.276 4.397 -2.456 1.00 . A A . 28 ILE HG23 1 1 7 3533 1 1 28 ILE N N 0.672 6.027 -0.132 1.00 . A A . 28 ILE N 1 1 7 3534 1 1 28 ILE O O 2.453 4.430 1.515 1.00 . A A . 28 ILE O 1 1 7 3535 1 1 29 CYS C C 3.992 1.637 0.966 1.00 . A A . 29 CYS C 1 1 7 3536 1 1 29 CYS CA C 2.475 1.745 0.828 1.00 . A A . 29 CYS CA 1 1 7 3537 1 1 29 CYS CB C 1.907 0.430 0.291 1.00 . A A . 29 CYS CB 1 1 7 3538 1 1 29 CYS H H 1.844 2.657 -0.975 1.00 . A A . 29 CYS H 1 1 7 3539 1 1 29 CYS HA H 2.050 1.940 1.801 1.00 . A A . 29 CYS HA 1 1 7 3540 1 1 29 CYS HB3 H 2.678 -0.325 0.318 1.00 . A A . 29 CYS HB3 1 1 7 3541 1 1 29 CYS N N 2.111 2.850 -0.050 1.00 . A A . 29 CYS N 1 1 7 3542 1 1 29 CYS O O 4.732 1.886 0.015 1.00 . A A . 29 CYS O 1 1 7 3543 1 1 29 CYS SG S 0.479 -0.201 1.229 1.00 . A A . 29 CYS SG 1 1 7 3544 1 1 30 VAL C C 6.118 0.393 3.739 1.00 . A A . 30 VAL C 1 1 7 3545 1 1 30 VAL CA C 5.872 1.122 2.423 1.00 . A A . 30 VAL CA 1 1 7 3546 1 1 30 VAL CB C 6.574 2.493 2.470 1.00 . A A . 30 VAL CB 1 1 7 3547 1 1 30 VAL CG1 C 7.225 2.807 1.131 1.00 . A A . 30 VAL CG1 1 1 7 3548 1 1 30 VAL CG2 C 5.587 3.583 2.860 1.00 . A A . 30 VAL CG2 1 1 7 3549 1 1 30 VAL H H 3.807 1.080 2.878 1.00 . A A . 30 VAL H 1 1 7 3550 1 1 30 VAL HA H 6.306 0.548 1.617 1.00 . A A . 30 VAL HA 1 1 7 3551 1 1 30 VAL HB H 7.349 2.452 3.221 1.00 . A A . 30 VAL HB 1 1 7 3552 1 1 30 VAL HG11 H 7.024 2.003 0.437 1.00 . A A . 30 VAL HG11 1 1 7 3553 1 1 30 VAL HG12 H 6.822 3.730 0.742 1.00 . A A . 30 VAL HG12 1 1 7 3554 1 1 30 VAL HG13 H 8.292 2.907 1.265 1.00 . A A . 30 VAL HG13 1 1 7 3555 1 1 30 VAL HG21 H 6.117 4.513 3.006 1.00 . A A . 30 VAL HG21 1 1 7 3556 1 1 30 VAL HG22 H 4.856 3.703 2.075 1.00 . A A . 30 VAL HG22 1 1 7 3557 1 1 30 VAL HG23 H 5.088 3.306 3.777 1.00 . A A . 30 VAL HG23 1 1 7 3558 1 1 30 VAL N N 4.446 1.264 2.159 1.00 . A A . 30 VAL N 1 1 7 3559 1 1 30 VAL O O 5.178 0.053 4.457 1.00 . A A . 30 VAL O 1 1 7 3560 1 1 31 ASP C C 9.271 -0.713 5.367 1.00 . A A . 31 ASP C 1 1 7 3561 1 1 31 ASP CA C 7.758 -0.533 5.280 1.00 . A A . 31 ASP CA 1 1 7 3562 1 1 31 ASP CB C 7.065 -1.895 5.356 1.00 . A A . 31 ASP CB 1 1 7 3563 1 1 31 ASP CG C 6.024 -1.953 6.458 1.00 . A A . 31 ASP CG 1 1 7 3564 1 1 31 ASP H H 8.094 0.451 3.435 1.00 . A A . 31 ASP H 1 1 7 3565 1 1 31 ASP HA H 7.432 0.074 6.111 1.00 . A A . 31 ASP HA 1 1 7 3566 1 1 31 ASP HB3 H 7.805 -2.658 5.544 1.00 . A A . 31 ASP HB3 1 1 7 3567 1 1 31 ASP N N 7.388 0.155 4.048 1.00 . A A . 31 ASP N 1 1 7 3568 1 1 31 ASP O O 9.988 -0.653 4.368 1.00 . A A . 31 ASP O 1 1 7 3569 1 1 31 ASP OD1 O 5.507 -0.883 6.841 1.00 . A A . 31 ASP OD1 1 1 7 3570 1 1 31 ASP OD2 O 5.728 -3.068 6.935 1.00 . A A . 31 ASP OD2 1 1 7 3571 1 1 32 PRO C C 11.714 -2.455 6.280 1.00 . A A . 32 PRO C 1 1 7 3572 1 1 32 PRO CA C 11.201 -1.132 6.840 1.00 . A A . 32 PRO CA 1 1 7 3573 1 1 32 PRO CB C 11.302 -1.124 8.367 1.00 . A A . 32 PRO CB 1 1 7 3574 1 1 32 PRO CD C 8.975 -1.025 7.828 1.00 . A A . 32 PRO CD 1 1 7 3575 1 1 32 PRO CG C 9.955 -1.555 8.837 1.00 . A A . 32 PRO CG 1 1 7 3576 1 1 32 PRO HA H 11.787 -0.320 6.435 1.00 . A A . 32 PRO HA 1 1 7 3577 1 1 32 PRO HB3 H 11.539 -0.129 8.711 1.00 . A A . 32 PRO HB3 1 1 7 3578 1 1 32 PRO HD3 H 8.618 -0.050 8.125 1.00 . A A . 32 PRO HD3 1 1 7 3579 1 1 32 PRO HG3 H 9.754 -1.136 9.811 1.00 . A A . 32 PRO HG3 1 1 7 3580 1 1 32 PRO N N 9.770 -0.940 6.592 1.00 . A A . 32 PRO N 1 1 7 3581 1 1 32 PRO O O 12.854 -2.548 5.822 1.00 . A A . 32 PRO O 1 1 7 3582 1 1 33 LYS C C 11.159 -4.832 4.290 1.00 . A A . 33 LYS C 1 1 7 3583 1 1 33 LYS CA C 11.231 -4.795 5.813 1.00 . A A . 33 LYS CA 1 1 7 3584 1 1 33 LYS CB C 10.310 -5.864 6.405 1.00 . A A . 33 LYS CB 1 1 7 3585 1 1 33 LYS CD C 10.101 -7.841 7.941 1.00 . A A . 33 LYS CD 1 1 7 3586 1 1 33 LYS CE C 10.855 -8.755 8.894 1.00 . A A . 33 LYS CE 1 1 7 3587 1 1 33 LYS CG C 11.052 -6.967 7.139 1.00 . A A . 33 LYS CG 1 1 7 3588 1 1 33 LYS H H 9.971 -3.341 6.695 1.00 . A A . 33 LYS H 1 1 7 3589 1 1 33 LYS HA H 12.247 -4.997 6.119 1.00 . A A . 33 LYS HA 1 1 7 3590 1 1 33 LYS HB3 H 9.740 -6.313 5.604 1.00 . A A . 33 LYS HB3 1 1 7 3591 1 1 33 LYS HD3 H 9.521 -8.445 7.259 1.00 . A A . 33 LYS HD3 1 1 7 3592 1 1 33 LYS HE3 H 11.657 -9.235 8.353 1.00 . A A . 33 LYS HE3 1 1 7 3593 1 1 33 LYS HG3 H 11.769 -6.519 7.813 1.00 . A A . 33 LYS HG3 1 1 7 3594 1 1 33 LYS HZ1 H 11.117 -7.014 10.017 1.00 . A A . 33 LYS HZ1 1 1 7 3595 1 1 33 LYS HZ2 H 12.467 -8.033 10.009 1.00 . A A . 33 LYS HZ2 1 1 7 3596 1 1 33 LYS HZ3 H 11.114 -8.430 10.941 1.00 . A A . 33 LYS HZ3 1 1 7 3597 1 1 33 LYS N N 10.866 -3.476 6.318 1.00 . A A . 33 LYS N 1 1 7 3598 1 1 33 LYS NZ N 11.428 -8.005 10.046 1.00 . A A . 33 LYS NZ 1 1 7 3599 1 1 33 LYS O O 11.906 -5.565 3.641 1.00 . A A . 33 LYS O 1 1 7 3600 1 1 34 LYS C C 9.478 -2.646 1.856 1.00 . A A . 34 LYS C 1 1 7 3601 1 1 34 LYS CA C 10.088 -3.979 2.278 1.00 . A A . 34 LYS CA 1 1 7 3602 1 1 34 LYS CB C 9.202 -5.131 1.799 1.00 . A A . 34 LYS CB 1 1 7 3603 1 1 34 LYS CD C 8.855 -6.473 -0.296 1.00 . A A . 34 LYS CD 1 1 7 3604 1 1 34 LYS CE C 10.079 -6.734 -1.161 1.00 . A A . 34 LYS CE 1 1 7 3605 1 1 34 LYS CG C 8.890 -5.081 0.313 1.00 . A A . 34 LYS CG 1 1 7 3606 1 1 34 LYS H H 9.689 -3.478 4.296 1.00 . A A . 34 LYS H 1 1 7 3607 1 1 34 LYS HA H 11.063 -4.074 1.826 1.00 . A A . 34 LYS HA 1 1 7 3608 1 1 34 LYS HB3 H 8.268 -5.101 2.343 1.00 . A A . 34 LYS HB3 1 1 7 3609 1 1 34 LYS HD3 H 7.967 -6.567 -0.905 1.00 . A A . 34 LYS HD3 1 1 7 3610 1 1 34 LYS HE3 H 10.819 -5.977 -0.951 1.00 . A A . 34 LYS HE3 1 1 7 3611 1 1 34 LYS HG3 H 9.652 -4.500 -0.185 1.00 . A A . 34 LYS HG3 1 1 7 3612 1 1 34 LYS HZ1 H 10.300 -8.769 -1.578 1.00 . A A . 34 LYS HZ1 1 1 7 3613 1 1 34 LYS HZ2 H 10.426 -8.390 0.065 1.00 . A A . 34 LYS HZ2 1 1 7 3614 1 1 34 LYS HZ3 H 11.704 -8.035 -0.985 1.00 . A A . 34 LYS HZ3 1 1 7 3615 1 1 34 LYS N N 10.256 -4.039 3.725 1.00 . A A . 34 LYS N 1 1 7 3616 1 1 34 LYS NZ N 10.669 -8.076 -0.897 1.00 . A A . 34 LYS NZ 1 1 7 3617 1 1 34 LYS O O 8.261 -2.473 1.879 1.00 . A A . 34 LYS O 1 1 7 3618 1 1 35 GLY C C 10.804 0.268 0.063 1.00 . A A . 35 GLY C 1 1 7 3619 1 1 35 GLY CA C 9.861 -0.400 1.045 1.00 . A A . 35 GLY CA 1 1 7 3620 1 1 35 GLY H H 11.296 -1.899 1.470 1.00 . A A . 35 GLY H 1 1 7 3621 1 1 35 GLY HA2 H 8.894 -0.514 0.580 1.00 . A A . 35 GLY HA2 1 1 7 3622 1 1 35 GLY HA3 H 9.758 0.233 1.915 1.00 . A A . 35 GLY HA3 1 1 7 3623 1 1 35 GLY N N 10.334 -1.705 1.468 1.00 . A A . 35 GLY N 1 1 7 3624 1 1 35 GLY O O 10.810 -0.061 -1.123 1.00 . A A . 35 GLY O 1 1 7 3625 1 1 36 TRP C C 13.974 1.454 -0.026 1.00 . A A . 36 TRP C 1 1 7 3626 1 1 36 TRP CA C 12.548 1.928 -0.286 1.00 . A A . 36 TRP CA 1 1 7 3627 1 1 36 TRP CB C 12.445 3.433 -0.039 1.00 . A A . 36 TRP CB 1 1 7 3628 1 1 36 TRP CD1 C 12.140 4.571 -2.315 1.00 . A A . 36 TRP CD1 1 1 7 3629 1 1 36 TRP CD2 C 14.160 4.876 -1.397 1.00 . A A . 36 TRP CD2 1 1 7 3630 1 1 36 TRP CE2 C 14.123 5.547 -2.634 1.00 . A A . 36 TRP CE2 1 1 7 3631 1 1 36 TRP CE3 C 15.332 4.928 -0.636 1.00 . A A . 36 TRP CE3 1 1 7 3632 1 1 36 TRP CG C 12.881 4.259 -1.211 1.00 . A A . 36 TRP CG 1 1 7 3633 1 1 36 TRP CH2 C 16.347 6.294 -2.362 1.00 . A A . 36 TRP CH2 1 1 7 3634 1 1 36 TRP CZ2 C 15.212 6.259 -3.127 1.00 . A A . 36 TRP CZ2 1 1 7 3635 1 1 36 TRP CZ3 C 16.412 5.636 -1.127 1.00 . A A . 36 TRP CZ3 1 1 7 3636 1 1 36 TRP H H 11.547 1.428 1.511 1.00 . A A . 36 TRP H 1 1 7 3637 1 1 36 TRP HA H 12.296 1.723 -1.316 1.00 . A A . 36 TRP HA 1 1 7 3638 1 1 36 TRP HB3 H 13.067 3.695 0.805 1.00 . A A . 36 TRP HB3 1 1 7 3639 1 1 36 TRP HD1 H 11.122 4.249 -2.474 1.00 . A A . 36 TRP HD1 1 1 7 3640 1 1 36 TRP HE1 H 12.568 5.697 -4.035 1.00 . A A . 36 TRP HE1 1 1 7 3641 1 1 36 TRP HE3 H 15.400 4.428 0.318 1.00 . A A . 36 TRP HE3 1 1 7 3642 1 1 36 TRP HH2 H 17.215 6.834 -2.706 1.00 . A A . 36 TRP HH2 1 1 7 3643 1 1 36 TRP HZ2 H 15.178 6.773 -4.077 1.00 . A A . 36 TRP HZ2 1 1 7 3644 1 1 36 TRP HZ3 H 17.326 5.687 -0.553 1.00 . A A . 36 TRP HZ3 1 1 7 3645 1 1 36 TRP N N 11.599 1.210 0.558 1.00 . A A . 36 TRP N 1 1 7 3646 1 1 36 TRP NE1 N 12.880 5.346 -3.175 1.00 . A A . 36 TRP NE1 1 1 7 3647 1 1 36 TRP O O 14.749 2.129 0.651 1.00 . A A . 36 TRP O 1 1 8 3648 1 1 1 ASP C C -13.170 -5.139 -2.152 1.00 . A A . 1 ASP C 1 1 8 3649 1 1 1 ASP CA C -14.499 -5.450 -2.833 1.00 . A A . 1 ASP CA 1 1 8 3650 1 1 1 ASP CB C -14.972 -6.849 -2.439 1.00 . A A . 1 ASP CB 1 1 8 3651 1 1 1 ASP CG C -15.546 -6.893 -1.037 1.00 . A A . 1 ASP CG 1 1 8 3652 1 1 1 ASP H1 H -13.569 -4.943 -4.666 1.00 . A A . 1 ASP H1 1 1 8 3653 1 1 1 ASP HA H -15.233 -4.727 -2.510 1.00 . A A . 1 ASP HA 1 1 8 3654 1 1 1 ASP HB3 H -14.137 -7.532 -2.489 1.00 . A A . 1 ASP HB3 1 1 8 3655 1 1 1 ASP N N -14.377 -5.345 -4.283 1.00 . A A . 1 ASP N 1 1 8 3656 1 1 1 ASP O O -12.386 -6.040 -1.856 1.00 . A A . 1 ASP O 1 1 8 3657 1 1 1 ASP OD1 O -15.012 -6.189 -0.154 1.00 . A A . 1 ASP OD1 1 1 8 3658 1 1 1 ASP OD2 O -16.530 -7.632 -0.821 1.00 . A A . 1 ASP OD2 1 1 8 3659 1 1 2 PHE C C -10.469 -3.984 -1.992 1.00 . A A . 2 PHE C 1 1 8 3660 1 1 2 PHE CA C -11.687 -3.425 -1.262 1.00 . A A . 2 PHE CA 1 1 8 3661 1 1 2 PHE CB C -11.668 -3.871 0.201 1.00 . A A . 2 PHE CB 1 1 8 3662 1 1 2 PHE CD1 C -13.370 -2.175 0.924 1.00 . A A . 2 PHE CD1 1 1 8 3663 1 1 2 PHE CD2 C -13.591 -4.412 1.720 1.00 . A A . 2 PHE CD2 1 1 8 3664 1 1 2 PHE CE1 C -14.505 -1.811 1.625 1.00 . A A . 2 PHE CE1 1 1 8 3665 1 1 2 PHE CE2 C -14.725 -4.054 2.424 1.00 . A A . 2 PHE CE2 1 1 8 3666 1 1 2 PHE CG C -12.901 -3.478 0.964 1.00 . A A . 2 PHE CG 1 1 8 3667 1 1 2 PHE CZ C -15.184 -2.752 2.375 1.00 . A A . 2 PHE CZ 1 1 8 3668 1 1 2 PHE H H -13.586 -3.183 -2.167 1.00 . A A . 2 PHE H 1 1 8 3669 1 1 2 PHE HA H -11.652 -2.347 -1.302 1.00 . A A . 2 PHE HA 1 1 8 3670 1 1 2 PHE HB3 H -10.816 -3.428 0.694 1.00 . A A . 2 PHE HB3 1 1 8 3671 1 1 2 PHE HD1 H -12.841 -1.438 0.337 1.00 . A A . 2 PHE HD1 1 1 8 3672 1 1 2 PHE HD2 H -13.234 -5.432 1.758 1.00 . A A . 2 PHE HD2 1 1 8 3673 1 1 2 PHE HE1 H -14.860 -0.792 1.586 1.00 . A A . 2 PHE HE1 1 1 8 3674 1 1 2 PHE HE2 H -15.254 -4.791 3.009 1.00 . A A . 2 PHE HE2 1 1 8 3675 1 1 2 PHE HZ H -16.069 -2.469 2.925 1.00 . A A . 2 PHE HZ 1 1 8 3676 1 1 2 PHE N N -12.922 -3.856 -1.907 1.00 . A A . 2 PHE N 1 1 8 3677 1 1 2 PHE O O -9.796 -4.899 -1.518 1.00 . A A . 2 PHE O 1 1 8 3678 1 1 3 PRO C C -7.703 -3.465 -3.376 1.00 . A A . 3 PRO C 1 1 8 3679 1 1 3 PRO CA C -9.042 -3.848 -3.997 1.00 . A A . 3 PRO CA 1 1 8 3680 1 1 3 PRO CB C -9.256 -3.097 -5.313 1.00 . A A . 3 PRO CB 1 1 8 3681 1 1 3 PRO CD C -10.939 -2.327 -3.802 1.00 . A A . 3 PRO CD 1 1 8 3682 1 1 3 PRO CG C -10.057 -1.898 -4.940 1.00 . A A . 3 PRO CG 1 1 8 3683 1 1 3 PRO HA H -9.062 -4.912 -4.180 1.00 . A A . 3 PRO HA 1 1 8 3684 1 1 3 PRO HB3 H -9.788 -3.728 -6.009 1.00 . A A . 3 PRO HB3 1 1 8 3685 1 1 3 PRO HD3 H -11.889 -2.682 -4.174 1.00 . A A . 3 PRO HD3 1 1 8 3686 1 1 3 PRO HG3 H -10.657 -1.582 -5.782 1.00 . A A . 3 PRO HG3 1 1 8 3687 1 1 3 PRO N N -10.180 -3.422 -3.175 1.00 . A A . 3 PRO N 1 1 8 3688 1 1 3 PRO O O -7.244 -2.330 -3.515 1.00 . A A . 3 PRO O 1 1 8 3689 1 1 4 LEU C C -4.757 -3.703 -3.062 1.00 . A A . 4 LEU C 1 1 8 3690 1 1 4 LEU CA C -5.792 -4.180 -2.048 1.00 . A A . 4 LEU CA 1 1 8 3691 1 1 4 LEU CB C -5.300 -5.455 -1.362 1.00 . A A . 4 LEU CB 1 1 8 3692 1 1 4 LEU CD1 C -4.301 -7.749 -1.513 1.00 . A A . 4 LEU CD1 1 1 8 3693 1 1 4 LEU CD2 C -5.241 -6.660 -3.559 1.00 . A A . 4 LEU CD2 1 1 8 3694 1 1 4 LEU CG C -4.517 -6.431 -2.240 1.00 . A A . 4 LEU CG 1 1 8 3695 1 1 4 LEU H H -7.495 -5.302 -2.614 1.00 . A A . 4 LEU H 1 1 8 3696 1 1 4 LEU HA H -5.930 -3.410 -1.304 1.00 . A A . 4 LEU HA 1 1 8 3697 1 1 4 LEU HB3 H -6.163 -5.976 -0.975 1.00 . A A . 4 LEU HB3 1 1 8 3698 1 1 4 LEU HD11 H -3.253 -7.869 -1.287 1.00 . A A . 4 LEU HD11 1 1 8 3699 1 1 4 LEU HD12 H -4.630 -8.564 -2.140 1.00 . A A . 4 LEU HD12 1 1 8 3700 1 1 4 LEU HD13 H -4.871 -7.750 -0.594 1.00 . A A . 4 LEU HD13 1 1 8 3701 1 1 4 LEU HD21 H -4.966 -5.885 -4.259 1.00 . A A . 4 LEU HD21 1 1 8 3702 1 1 4 LEU HD22 H -6.307 -6.634 -3.393 1.00 . A A . 4 LEU HD22 1 1 8 3703 1 1 4 LEU HD23 H -4.962 -7.624 -3.960 1.00 . A A . 4 LEU HD23 1 1 8 3704 1 1 4 LEU HG H -3.545 -6.009 -2.459 1.00 . A A . 4 LEU HG 1 1 8 3705 1 1 4 LEU N N -7.080 -4.417 -2.690 1.00 . A A . 4 LEU N 1 1 8 3706 1 1 4 LEU O O -5.049 -3.587 -4.253 1.00 . A A . 4 LEU O 1 1 8 3707 1 1 5 SER C C -1.114 -3.160 -2.778 1.00 . A A . 5 SER C 1 1 8 3708 1 1 5 SER CA C -2.470 -2.965 -3.448 1.00 . A A . 5 SER CA 1 1 8 3709 1 1 5 SER CB C -2.671 -1.490 -3.800 1.00 . A A . 5 SER CB 1 1 8 3710 1 1 5 SER H H -3.377 -3.543 -1.625 1.00 . A A . 5 SER H 1 1 8 3711 1 1 5 SER HA H -2.498 -3.550 -4.356 1.00 . A A . 5 SER HA 1 1 8 3712 1 1 5 SER HB3 H -1.770 -1.106 -4.256 1.00 . A A . 5 SER HB3 1 1 8 3713 1 1 5 SER HG H -3.446 -0.843 -5.478 1.00 . A A . 5 SER HG 1 1 8 3714 1 1 5 SER N N -3.548 -3.431 -2.583 1.00 . A A . 5 SER N 1 1 8 3715 1 1 5 SER O O -0.925 -2.803 -1.614 1.00 . A A . 5 SER O 1 1 8 3716 1 1 5 SER OG O -3.749 -1.323 -4.703 1.00 . A A . 5 SER OG 1 1 8 3717 1 1 6 LYS C C 1.872 -2.659 -2.670 1.00 . A A . 6 LYS C 1 1 8 3718 1 1 6 LYS CA C 1.170 -3.973 -3.001 1.00 . A A . 6 LYS CA 1 1 8 3719 1 1 6 LYS CB C 1.998 -4.762 -4.018 1.00 . A A . 6 LYS CB 1 1 8 3720 1 1 6 LYS CD C 2.505 -7.222 -3.952 1.00 . A A . 6 LYS CD 1 1 8 3721 1 1 6 LYS CE C 3.645 -7.215 -4.959 1.00 . A A . 6 LYS CE 1 1 8 3722 1 1 6 LYS CG C 1.466 -6.162 -4.279 1.00 . A A . 6 LYS CG 1 1 8 3723 1 1 6 LYS H H -0.381 -3.993 -4.442 1.00 . A A . 6 LYS H 1 1 8 3724 1 1 6 LYS HA H 1.076 -4.555 -2.097 1.00 . A A . 6 LYS HA 1 1 8 3725 1 1 6 LYS HB3 H 3.011 -4.848 -3.652 1.00 . A A . 6 LYS HB3 1 1 8 3726 1 1 6 LYS HD3 H 2.031 -8.193 -3.965 1.00 . A A . 6 LYS HD3 1 1 8 3727 1 1 6 LYS HE3 H 4.260 -6.345 -4.780 1.00 . A A . 6 LYS HE3 1 1 8 3728 1 1 6 LYS HG3 H 1.196 -6.245 -5.322 1.00 . A A . 6 LYS HG3 1 1 8 3729 1 1 6 LYS HZ1 H 4.428 -8.828 -3.888 1.00 . A A . 6 LYS HZ1 1 1 8 3730 1 1 6 LYS HZ2 H 5.482 -8.204 -5.056 1.00 . A A . 6 LYS HZ2 1 1 8 3731 1 1 6 LYS HZ3 H 4.166 -9.156 -5.526 1.00 . A A . 6 LYS HZ3 1 1 8 3732 1 1 6 LYS N N -0.170 -3.731 -3.521 1.00 . A A . 6 LYS N 1 1 8 3733 1 1 6 LYS NZ N 4.489 -8.437 -4.849 1.00 . A A . 6 LYS NZ 1 1 8 3734 1 1 6 LYS O O 1.270 -1.588 -2.744 1.00 . A A . 6 LYS O 1 1 8 3735 1 1 7 GLU C C 3.791 -0.494 -3.040 1.00 . A A . 7 GLU C 1 1 8 3736 1 1 7 GLU CA C 3.929 -1.568 -1.964 1.00 . A A . 7 GLU CA 1 1 8 3737 1 1 7 GLU CB C 5.402 -1.938 -1.784 1.00 . A A . 7 GLU CB 1 1 8 3738 1 1 7 GLU CD C 7.378 -1.187 -0.400 1.00 . A A . 7 GLU CD 1 1 8 3739 1 1 7 GLU CG C 6.276 -0.771 -1.355 1.00 . A A . 7 GLU CG 1 1 8 3740 1 1 7 GLU H H 3.572 -3.632 -2.266 1.00 . A A . 7 GLU H 1 1 8 3741 1 1 7 GLU HA H 3.549 -1.178 -1.032 1.00 . A A . 7 GLU HA 1 1 8 3742 1 1 7 GLU HB3 H 5.782 -2.319 -2.721 1.00 . A A . 7 GLU HB3 1 1 8 3743 1 1 7 GLU HG3 H 5.655 -0.034 -0.866 1.00 . A A . 7 GLU HG3 1 1 8 3744 1 1 7 GLU N N 3.147 -2.750 -2.306 1.00 . A A . 7 GLU N 1 1 8 3745 1 1 7 GLU O O 3.606 -0.802 -4.218 1.00 . A A . 7 GLU O 1 1 8 3746 1 1 7 GLU OE1 O 7.620 -2.405 -0.270 1.00 . A A . 7 GLU OE1 1 1 8 3747 1 1 7 GLU OE2 O 7.997 -0.295 0.217 1.00 . A A . 7 GLU OE2 1 1 8 3748 1 1 8 TYR C C 2.375 1.925 -4.184 1.00 . A A . 8 TYR C 1 1 8 3749 1 1 8 TYR CA C 3.764 1.884 -3.553 1.00 . A A . 8 TYR CA 1 1 8 3750 1 1 8 TYR CB C 4.830 1.784 -4.645 1.00 . A A . 8 TYR CB 1 1 8 3751 1 1 8 TYR CD1 C 6.725 2.302 -3.058 1.00 . A A . 8 TYR CD1 1 1 8 3752 1 1 8 TYR CD2 C 7.040 0.562 -4.656 1.00 . A A . 8 TYR CD2 1 1 8 3753 1 1 8 TYR CE1 C 7.998 2.088 -2.567 1.00 . A A . 8 TYR CE1 1 1 8 3754 1 1 8 TYR CE2 C 8.314 0.339 -4.170 1.00 . A A . 8 TYR CE2 1 1 8 3755 1 1 8 TYR CG C 6.224 1.546 -4.110 1.00 . A A . 8 TYR CG 1 1 8 3756 1 1 8 TYR CZ C 8.788 1.106 -3.126 1.00 . A A . 8 TYR CZ 1 1 8 3757 1 1 8 TYR H H 4.029 0.946 -1.675 1.00 . A A . 8 TYR H 1 1 8 3758 1 1 8 TYR HA H 3.920 2.795 -2.994 1.00 . A A . 8 TYR HA 1 1 8 3759 1 1 8 TYR HB3 H 4.844 2.704 -5.210 1.00 . A A . 8 TYR HB3 1 1 8 3760 1 1 8 TYR HD1 H 6.103 3.071 -2.622 1.00 . A A . 8 TYR HD1 1 1 8 3761 1 1 8 TYR HD2 H 6.666 -0.037 -5.473 1.00 . A A . 8 TYR HD2 1 1 8 3762 1 1 8 TYR HE1 H 8.370 2.687 -1.749 1.00 . A A . 8 TYR HE1 1 1 8 3763 1 1 8 TYR HE2 H 8.934 -0.429 -4.607 1.00 . A A . 8 TYR HE2 1 1 8 3764 1 1 8 TYR HH H 10.469 0.172 -3.127 1.00 . A A . 8 TYR HH 1 1 8 3765 1 1 8 TYR N N 3.882 0.765 -2.626 1.00 . A A . 8 TYR N 1 1 8 3766 1 1 8 TYR O O 1.454 1.253 -3.725 1.00 . A A . 8 TYR O 1 1 8 3767 1 1 8 TYR OH O 10.057 0.889 -2.638 1.00 . A A . 8 TYR OH 1 1 8 3768 1 1 9 GLU C C -0.051 3.604 -5.080 1.00 . A A . 9 GLU C 1 1 8 3769 1 1 9 GLU CA C 0.961 2.848 -5.936 1.00 . A A . 9 GLU CA 1 1 8 3770 1 1 9 GLU CB C 0.410 1.467 -6.299 1.00 . A A . 9 GLU CB 1 1 8 3771 1 1 9 GLU CD C -0.242 -0.147 -8.128 1.00 . A A . 9 GLU CD 1 1 8 3772 1 1 9 GLU CG C 0.278 1.238 -7.794 1.00 . A A . 9 GLU CG 1 1 8 3773 1 1 9 GLU H H 3.009 3.229 -5.561 1.00 . A A . 9 GLU H 1 1 8 3774 1 1 9 GLU HA H 1.134 3.406 -6.845 1.00 . A A . 9 GLU HA 1 1 8 3775 1 1 9 GLU HB3 H -0.566 1.355 -5.850 1.00 . A A . 9 GLU HB3 1 1 8 3776 1 1 9 GLU HG3 H 1.248 1.361 -8.252 1.00 . A A . 9 GLU HG3 1 1 8 3777 1 1 9 GLU N N 2.237 2.720 -5.242 1.00 . A A . 9 GLU N 1 1 8 3778 1 1 9 GLU O O -0.332 4.779 -5.320 1.00 . A A . 9 GLU O 1 1 8 3779 1 1 9 GLU OE1 O -0.870 -0.774 -7.250 1.00 . A A . 9 GLU OE1 1 1 8 3780 1 1 9 GLU OE2 O -0.021 -0.603 -9.270 1.00 . A A . 9 GLU OE2 1 1 8 3781 1 1 10 THR C C -1.984 2.559 -2.080 1.00 . A A . 10 THR C 1 1 8 3782 1 1 10 THR CA C -1.580 3.524 -3.187 1.00 . A A . 10 THR CA 1 1 8 3783 1 1 10 THR CB C -2.840 3.962 -3.956 1.00 . A A . 10 THR CB 1 1 8 3784 1 1 10 THR CG2 C -3.627 2.753 -4.441 1.00 . A A . 10 THR CG2 1 1 8 3785 1 1 10 THR H H -0.333 1.987 -3.939 1.00 . A A . 10 THR H 1 1 8 3786 1 1 10 THR HA H -1.132 4.401 -2.743 1.00 . A A . 10 THR HA 1 1 8 3787 1 1 10 THR HB H -2.537 4.545 -4.814 1.00 . A A . 10 THR HB 1 1 8 3788 1 1 10 THR HG1 H -4.444 5.058 -3.607 1.00 . A A . 10 THR HG1 1 1 8 3789 1 1 10 THR HG21 H -4.049 2.965 -5.412 1.00 . A A . 10 THR HG21 1 1 8 3790 1 1 10 THR HG22 H -4.420 2.535 -3.742 1.00 . A A . 10 THR HG22 1 1 8 3791 1 1 10 THR HG23 H -2.967 1.902 -4.514 1.00 . A A . 10 THR HG23 1 1 8 3792 1 1 10 THR N N -0.598 2.920 -4.079 1.00 . A A . 10 THR N 1 1 8 3793 1 1 10 THR O O -1.530 1.414 -2.043 1.00 . A A . 10 THR O 1 1 8 3794 1 1 10 THR OG1 O -3.671 4.770 -3.114 1.00 . A A . 10 THR OG1 1 1 8 3795 1 1 11 CYS C C -4.437 2.898 0.687 1.00 . A A . 11 CYS C 1 1 8 3796 1 1 11 CYS CA C -3.304 2.205 -0.066 1.00 . A A . 11 CYS CA 1 1 8 3797 1 1 11 CYS CB C -2.150 1.904 0.892 1.00 . A A . 11 CYS CB 1 1 8 3798 1 1 11 CYS H H -3.165 3.948 -1.258 1.00 . A A . 11 CYS H 1 1 8 3799 1 1 11 CYS HA H -3.675 1.275 -0.472 1.00 . A A . 11 CYS HA 1 1 8 3800 1 1 11 CYS HB3 H -1.362 1.404 0.348 1.00 . A A . 11 CYS HB3 1 1 8 3801 1 1 11 CYS N N -2.839 3.026 -1.177 1.00 . A A . 11 CYS N 1 1 8 3802 1 1 11 CYS O O -4.478 2.885 1.917 1.00 . A A . 11 CYS O 1 1 8 3803 1 1 11 CYS SG S -1.432 3.381 1.679 1.00 . A A . 11 CYS SG 1 1 8 3804 1 1 12 VAL C C -7.370 3.239 1.323 1.00 . A A . 12 VAL C 1 1 8 3805 1 1 12 VAL CA C -6.488 4.199 0.533 1.00 . A A . 12 VAL CA 1 1 8 3806 1 1 12 VAL CB C -7.343 4.898 -0.540 1.00 . A A . 12 VAL CB 1 1 8 3807 1 1 12 VAL CG1 C -6.569 6.043 -1.177 1.00 . A A . 12 VAL CG1 1 1 8 3808 1 1 12 VAL CG2 C -7.796 3.900 -1.594 1.00 . A A . 12 VAL CG2 1 1 8 3809 1 1 12 VAL H H -5.267 3.477 -1.037 1.00 . A A . 12 VAL H 1 1 8 3810 1 1 12 VAL HA H -6.102 4.954 1.203 1.00 . A A . 12 VAL HA 1 1 8 3811 1 1 12 VAL HB H -8.220 5.309 -0.063 1.00 . A A . 12 VAL HB 1 1 8 3812 1 1 12 VAL HG11 H -6.667 6.928 -0.565 1.00 . A A . 12 VAL HG11 1 1 8 3813 1 1 12 VAL HG12 H -5.526 5.773 -1.256 1.00 . A A . 12 VAL HG12 1 1 8 3814 1 1 12 VAL HG13 H -6.966 6.242 -2.162 1.00 . A A . 12 VAL HG13 1 1 8 3815 1 1 12 VAL HG21 H -8.229 3.037 -1.111 1.00 . A A . 12 VAL HG21 1 1 8 3816 1 1 12 VAL HG22 H -8.533 4.362 -2.234 1.00 . A A . 12 VAL HG22 1 1 8 3817 1 1 12 VAL HG23 H -6.948 3.591 -2.188 1.00 . A A . 12 VAL HG23 1 1 8 3818 1 1 12 VAL N N -5.354 3.501 -0.062 1.00 . A A . 12 VAL N 1 1 8 3819 1 1 12 VAL O O -7.056 2.056 1.455 1.00 . A A . 12 VAL O 1 1 8 3820 1 1 13 ARG C C -9.759 1.660 1.884 1.00 . A A . 13 ARG C 1 1 8 3821 1 1 13 ARG CA C -9.405 2.946 2.626 1.00 . A A . 13 ARG CA 1 1 8 3822 1 1 13 ARG CB C -10.678 3.739 2.930 1.00 . A A . 13 ARG CB 1 1 8 3823 1 1 13 ARG CD C -9.803 5.378 4.622 1.00 . A A . 13 ARG CD 1 1 8 3824 1 1 13 ARG CG C -10.762 4.226 4.368 1.00 . A A . 13 ARG CG 1 1 8 3825 1 1 13 ARG CZ C -9.975 7.814 4.909 1.00 . A A . 13 ARG CZ 1 1 8 3826 1 1 13 ARG H H -8.673 4.707 1.709 1.00 . A A . 13 ARG H 1 1 8 3827 1 1 13 ARG HA H -8.921 2.687 3.556 1.00 . A A . 13 ARG HA 1 1 8 3828 1 1 13 ARG HB3 H -11.533 3.111 2.735 1.00 . A A . 13 ARG HB3 1 1 8 3829 1 1 13 ARG HD3 H -9.240 5.567 3.720 1.00 . A A . 13 ARG HD3 1 1 8 3830 1 1 13 ARG HE H -11.415 6.509 5.357 1.00 . A A . 13 ARG HE 1 1 8 3831 1 1 13 ARG HG3 H -10.515 3.410 5.030 1.00 . A A . 13 ARG HG3 1 1 8 3832 1 1 13 ARG HH11 H -8.214 7.168 4.158 1.00 . A A . 13 ARG HH11 1 1 8 3833 1 1 13 ARG HH12 H -8.348 8.883 4.366 1.00 . A A . 13 ARG HH12 1 1 8 3834 1 1 13 ARG HH21 H -11.605 8.765 5.635 1.00 . A A . 13 ARG HH21 1 1 8 3835 1 1 13 ARG HH22 H -10.277 9.790 5.206 1.00 . A A . 13 ARG HH22 1 1 8 3836 1 1 13 ARG N N -8.476 3.757 1.847 1.00 . A A . 13 ARG N 1 1 8 3837 1 1 13 ARG NE N -10.505 6.599 5.008 1.00 . A A . 13 ARG NE 1 1 8 3838 1 1 13 ARG NH1 N -8.744 7.968 4.440 1.00 . A A . 13 ARG NH1 1 1 8 3839 1 1 13 ARG NH2 N -10.677 8.877 5.281 1.00 . A A . 13 ARG NH2 1 1 8 3840 1 1 13 ARG O O -9.519 0.551 2.362 1.00 . A A . 13 ARG O 1 1 8 3841 1 1 14 PRO C C -9.544 -0.077 -0.718 1.00 . A A . 14 PRO C 1 1 8 3842 1 1 14 PRO CA C -10.743 0.674 -0.149 1.00 . A A . 14 PRO CA 1 1 8 3843 1 1 14 PRO CB C -11.549 1.326 -1.274 1.00 . A A . 14 PRO CB 1 1 8 3844 1 1 14 PRO CD C -10.659 3.103 0.053 1.00 . A A . 14 PRO CD 1 1 8 3845 1 1 14 PRO CG C -11.033 2.721 -1.352 1.00 . A A . 14 PRO CG 1 1 8 3846 1 1 14 PRO HA H -11.372 -0.015 0.395 1.00 . A A . 14 PRO HA 1 1 8 3847 1 1 14 PRO HB3 H -12.601 1.308 -1.025 1.00 . A A . 14 PRO HB3 1 1 8 3848 1 1 14 PRO HD3 H -11.491 3.581 0.548 1.00 . A A . 14 PRO HD3 1 1 8 3849 1 1 14 PRO HG3 H -11.804 3.378 -1.725 1.00 . A A . 14 PRO HG3 1 1 8 3850 1 1 14 PRO N N -10.343 1.811 0.685 1.00 . A A . 14 PRO N 1 1 8 3851 1 1 14 PRO O O -9.694 -1.144 -1.314 1.00 . A A . 14 PRO O 1 1 8 3852 1 1 15 ARG C C -6.240 -0.577 0.127 1.00 . A A . 15 ARG C 1 1 8 3853 1 1 15 ARG CA C -7.130 -0.128 -1.028 1.00 . A A . 15 ARG CA 1 1 8 3854 1 1 15 ARG CB C -6.369 0.851 -1.923 1.00 . A A . 15 ARG CB 1 1 8 3855 1 1 15 ARG CD C -6.303 0.292 -4.372 1.00 . A A . 15 ARG CD 1 1 8 3856 1 1 15 ARG CG C -5.586 0.175 -3.037 1.00 . A A . 15 ARG CG 1 1 8 3857 1 1 15 ARG CZ C -6.726 2.050 -6.038 1.00 . A A . 15 ARG CZ 1 1 8 3858 1 1 15 ARG H H -8.300 1.338 -0.049 1.00 . A A . 15 ARG H 1 1 8 3859 1 1 15 ARG HA H -7.407 -0.994 -1.611 1.00 . A A . 15 ARG HA 1 1 8 3860 1 1 15 ARG HB3 H -5.675 1.411 -1.313 1.00 . A A . 15 ARG HB3 1 1 8 3861 1 1 15 ARG HD3 H -7.279 -0.163 -4.282 1.00 . A A . 15 ARG HD3 1 1 8 3862 1 1 15 ARG HE H -6.373 2.374 -4.102 1.00 . A A . 15 ARG HE 1 1 8 3863 1 1 15 ARG HG3 H -5.461 -0.869 -2.794 1.00 . A A . 15 ARG HG3 1 1 8 3864 1 1 15 ARG HH11 H -6.757 0.165 -6.764 1.00 . A A . 15 ARG HH11 1 1 8 3865 1 1 15 ARG HH12 H -7.053 1.413 -7.928 1.00 . A A . 15 ARG HH12 1 1 8 3866 1 1 15 ARG HH21 H -6.761 4.028 -5.625 1.00 . A A . 15 ARG HH21 1 1 8 3867 1 1 15 ARG HH22 H -7.055 3.610 -7.279 1.00 . A A . 15 ARG HH22 1 1 8 3868 1 1 15 ARG N N -8.355 0.488 -0.532 1.00 . A A . 15 ARG N 1 1 8 3869 1 1 15 ARG NE N -6.464 1.681 -4.788 1.00 . A A . 15 ARG NE 1 1 8 3870 1 1 15 ARG NH1 N -6.855 1.135 -6.988 1.00 . A A . 15 ARG NH1 1 1 8 3871 1 1 15 ARG NH2 N -6.859 3.335 -6.338 1.00 . A A . 15 ARG NH2 1 1 8 3872 1 1 15 ARG O O -5.015 -0.482 0.054 1.00 . A A . 15 ARG O 1 1 8 3873 1 1 16 LYS C C -4.991 -2.459 1.959 1.00 . A A . 16 LYS C 1 1 8 3874 1 1 16 LYS CA C -6.131 -1.531 2.364 1.00 . A A . 16 LYS CA 1 1 8 3875 1 1 16 LYS CB C -7.074 -2.254 3.328 1.00 . A A . 16 LYS CB 1 1 8 3876 1 1 16 LYS CD C -8.408 -4.373 3.532 1.00 . A A . 16 LYS CD 1 1 8 3877 1 1 16 LYS CE C -7.614 -5.620 3.171 1.00 . A A . 16 LYS CE 1 1 8 3878 1 1 16 LYS CG C -8.040 -3.201 2.637 1.00 . A A . 16 LYS CG 1 1 8 3879 1 1 16 LYS H H -7.844 -1.116 1.191 1.00 . A A . 16 LYS H 1 1 8 3880 1 1 16 LYS HA H -5.717 -0.666 2.860 1.00 . A A . 16 LYS HA 1 1 8 3881 1 1 16 LYS HB3 H -7.650 -1.519 3.870 1.00 . A A . 16 LYS HB3 1 1 8 3882 1 1 16 LYS HD3 H -9.462 -4.584 3.420 1.00 . A A . 16 LYS HD3 1 1 8 3883 1 1 16 LYS HE3 H -7.277 -6.093 4.082 1.00 . A A . 16 LYS HE3 1 1 8 3884 1 1 16 LYS HG3 H -7.578 -3.578 1.736 1.00 . A A . 16 LYS HG3 1 1 8 3885 1 1 16 LYS HZ1 H -9.253 -6.897 2.954 1.00 . A A . 16 LYS HZ1 1 1 8 3886 1 1 16 LYS HZ2 H -7.860 -7.427 2.154 1.00 . A A . 16 LYS HZ2 1 1 8 3887 1 1 16 LYS HZ3 H -8.769 -6.153 1.514 1.00 . A A . 16 LYS HZ3 1 1 8 3888 1 1 16 LYS N N -6.865 -1.066 1.193 1.00 . A A . 16 LYS N 1 1 8 3889 1 1 16 LYS NZ N -8.431 -6.592 2.394 1.00 . A A . 16 LYS NZ 1 1 8 3890 1 1 16 LYS O O -5.153 -3.314 1.087 1.00 . A A . 16 LYS O 1 1 8 3891 1 1 17 CYS C C -2.782 -4.472 2.980 1.00 . A A . 17 CYS C 1 1 8 3892 1 1 17 CYS CA C -2.671 -3.108 2.304 1.00 . A A . 17 CYS CA 1 1 8 3893 1 1 17 CYS CB C -1.394 -2.402 2.765 1.00 . A A . 17 CYS CB 1 1 8 3894 1 1 17 CYS H H -3.771 -1.587 3.282 1.00 . A A . 17 CYS H 1 1 8 3895 1 1 17 CYS HA H -2.626 -3.253 1.236 1.00 . A A . 17 CYS HA 1 1 8 3896 1 1 17 CYS HB3 H -0.704 -3.137 3.149 1.00 . A A . 17 CYS HB3 1 1 8 3897 1 1 17 CYS N N -3.839 -2.286 2.597 1.00 . A A . 17 CYS N 1 1 8 3898 1 1 17 CYS O O -2.670 -4.581 4.201 1.00 . A A . 17 CYS O 1 1 8 3899 1 1 17 CYS SG S -0.544 -1.472 1.449 1.00 . A A . 17 CYS SG 1 1 8 3900 1 1 18 GLN C C -1.867 -7.283 3.438 1.00 . A A . 18 GLN C 1 1 8 3901 1 1 18 GLN CA C -3.133 -6.863 2.698 1.00 . A A . 18 GLN CA 1 1 8 3902 1 1 18 GLN CB C -3.422 -7.845 1.561 1.00 . A A . 18 GLN CB 1 1 8 3903 1 1 18 GLN CD C -3.589 -10.299 0.986 1.00 . A A . 18 GLN CD 1 1 8 3904 1 1 18 GLN CG C -2.880 -9.242 1.811 1.00 . A A . 18 GLN CG 1 1 8 3905 1 1 18 GLN H H -3.086 -5.356 1.213 1.00 . A A . 18 GLN H 1 1 8 3906 1 1 18 GLN HA H -3.960 -6.876 3.391 1.00 . A A . 18 GLN HA 1 1 8 3907 1 1 18 GLN HB3 H -2.975 -7.466 0.653 1.00 . A A . 18 GLN HB3 1 1 8 3908 1 1 18 GLN HE21 H -1.866 -11.237 0.662 1.00 . A A . 18 GLN HE21 1 1 8 3909 1 1 18 GLN HE22 H -3.261 -11.959 -0.058 1.00 . A A . 18 GLN HE22 1 1 8 3910 1 1 18 GLN HG3 H -3.003 -9.481 2.857 1.00 . A A . 18 GLN HG3 1 1 8 3911 1 1 18 GLN N N -3.005 -5.507 2.177 1.00 . A A . 18 GLN N 1 1 8 3912 1 1 18 GLN NE2 N -2.829 -11.262 0.477 1.00 . A A . 18 GLN NE2 1 1 8 3913 1 1 18 GLN O O -1.898 -7.648 4.614 1.00 . A A . 18 GLN O 1 1 8 3914 1 1 18 GLN OE1 O -4.807 -10.251 0.807 1.00 . A A . 18 GLN OE1 1 1 8 3915 1 1 19 PRO C C 1.055 -6.602 4.350 1.00 . A A . 19 PRO C 1 1 8 3916 1 1 19 PRO CA C 0.572 -7.604 3.306 1.00 . A A . 19 PRO CA 1 1 8 3917 1 1 19 PRO CB C 1.506 -7.605 2.093 1.00 . A A . 19 PRO CB 1 1 8 3918 1 1 19 PRO CD C -0.614 -6.808 1.330 1.00 . A A . 19 PRO CD 1 1 8 3919 1 1 19 PRO CG C 0.869 -6.671 1.124 1.00 . A A . 19 PRO CG 1 1 8 3920 1 1 19 PRO HA H 0.546 -8.592 3.743 1.00 . A A . 19 PRO HA 1 1 8 3921 1 1 19 PRO HB3 H 1.577 -8.604 1.689 1.00 . A A . 19 PRO HB3 1 1 8 3922 1 1 19 PRO HD3 H -1.019 -7.560 0.668 1.00 . A A . 19 PRO HD3 1 1 8 3923 1 1 19 PRO HG3 H 1.134 -6.951 0.116 1.00 . A A . 19 PRO HG3 1 1 8 3924 1 1 19 PRO N N -0.726 -7.232 2.736 1.00 . A A . 19 PRO N 1 1 8 3925 1 1 19 PRO O O 0.481 -5.528 4.526 1.00 . A A . 19 PRO O 1 1 8 3926 1 1 20 PRO C C 3.390 -4.863 5.514 1.00 . A A . 20 PRO C 1 1 8 3927 1 1 20 PRO CA C 2.722 -6.103 6.095 1.00 . A A . 20 PRO CA 1 1 8 3928 1 1 20 PRO CB C 3.761 -7.011 6.758 1.00 . A A . 20 PRO CB 1 1 8 3929 1 1 20 PRO CD C 2.873 -8.224 4.900 1.00 . A A . 20 PRO CD 1 1 8 3930 1 1 20 PRO CG C 4.122 -8.005 5.708 1.00 . A A . 20 PRO CG 1 1 8 3931 1 1 20 PRO HA H 1.984 -5.805 6.825 1.00 . A A . 20 PRO HA 1 1 8 3932 1 1 20 PRO HB3 H 3.327 -7.490 7.623 1.00 . A A . 20 PRO HB3 1 1 8 3933 1 1 20 PRO HD3 H 2.306 -9.052 5.301 1.00 . A A . 20 PRO HD3 1 1 8 3934 1 1 20 PRO HG3 H 4.436 -8.928 6.171 1.00 . A A . 20 PRO HG3 1 1 8 3935 1 1 20 PRO N N 2.136 -6.959 5.057 1.00 . A A . 20 PRO N 1 1 8 3936 1 1 20 PRO O O 4.614 -4.810 5.379 1.00 . A A . 20 PRO O 1 1 8 3937 1 1 21 LEU C C 2.849 -1.452 5.548 1.00 . A A . 21 LEU C 1 1 8 3938 1 1 21 LEU CA C 3.096 -2.625 4.604 1.00 . A A . 21 LEU CA 1 1 8 3939 1 1 21 LEU CB C 2.441 -2.350 3.248 1.00 . A A . 21 LEU CB 1 1 8 3940 1 1 21 LEU CD1 C 4.375 -2.390 1.655 1.00 . A A . 21 LEU CD1 1 1 8 3941 1 1 21 LEU CD2 C 3.286 -4.532 2.349 1.00 . A A . 21 LEU CD2 1 1 8 3942 1 1 21 LEU CG C 3.066 -3.056 2.045 1.00 . A A . 21 LEU CG 1 1 8 3943 1 1 21 LEU H H 1.616 -3.968 5.301 1.00 . A A . 21 LEU H 1 1 8 3944 1 1 21 LEU HA H 4.160 -2.740 4.463 1.00 . A A . 21 LEU HA 1 1 8 3945 1 1 21 LEU HB3 H 2.488 -1.285 3.069 1.00 . A A . 21 LEU HB3 1 1 8 3946 1 1 21 LEU HD11 H 4.177 -1.583 0.966 1.00 . A A . 21 LEU HD11 1 1 8 3947 1 1 21 LEU HD12 H 5.022 -3.115 1.183 1.00 . A A . 21 LEU HD12 1 1 8 3948 1 1 21 LEU HD13 H 4.857 -1.998 2.539 1.00 . A A . 21 LEU HD13 1 1 8 3949 1 1 21 LEU HD21 H 2.391 -4.946 2.789 1.00 . A A . 21 LEU HD21 1 1 8 3950 1 1 21 LEU HD22 H 4.109 -4.637 3.041 1.00 . A A . 21 LEU HD22 1 1 8 3951 1 1 21 LEU HD23 H 3.516 -5.057 1.433 1.00 . A A . 21 LEU HD23 1 1 8 3952 1 1 21 LEU HG H 2.391 -2.985 1.203 1.00 . A A . 21 LEU HG 1 1 8 3953 1 1 21 LEU N N 2.582 -3.867 5.171 1.00 . A A . 21 LEU N 1 1 8 3954 1 1 21 LEU O O 2.328 -1.627 6.649 1.00 . A A . 21 LEU O 1 1 8 3955 1 1 22 LYS C C 2.880 2.176 5.022 1.00 . A A . 22 LYS C 1 1 8 3956 1 1 22 LYS CA C 3.041 0.947 5.911 1.00 . A A . 22 LYS CA 1 1 8 3957 1 1 22 LYS CB C 4.230 1.141 6.855 1.00 . A A . 22 LYS CB 1 1 8 3958 1 1 22 LYS CD C 4.896 1.224 9.276 1.00 . A A . 22 LYS CD 1 1 8 3959 1 1 22 LYS CE C 4.595 0.714 10.677 1.00 . A A . 22 LYS CE 1 1 8 3960 1 1 22 LYS CG C 4.011 0.554 8.239 1.00 . A A . 22 LYS CG 1 1 8 3961 1 1 22 LYS H H 3.636 -0.180 4.220 1.00 . A A . 22 LYS H 1 1 8 3962 1 1 22 LYS HA H 2.144 0.822 6.498 1.00 . A A . 22 LYS HA 1 1 8 3963 1 1 22 LYS HB3 H 4.421 2.199 6.963 1.00 . A A . 22 LYS HB3 1 1 8 3964 1 1 22 LYS HD3 H 4.727 2.291 9.246 1.00 . A A . 22 LYS HD3 1 1 8 3965 1 1 22 LYS HE3 H 3.977 -0.167 10.601 1.00 . A A . 22 LYS HE3 1 1 8 3966 1 1 22 LYS HG3 H 4.238 -0.503 8.212 1.00 . A A . 22 LYS HG3 1 1 8 3967 1 1 22 LYS HZ1 H 6.637 0.933 11.062 1.00 . A A . 22 LYS HZ1 1 1 8 3968 1 1 22 LYS HZ2 H 6.057 -0.638 11.305 1.00 . A A . 22 LYS HZ2 1 1 8 3969 1 1 22 LYS HZ3 H 5.715 0.573 12.435 1.00 . A A . 22 LYS HZ3 1 1 8 3970 1 1 22 LYS N N 3.225 -0.256 5.108 1.00 . A A . 22 LYS N 1 1 8 3971 1 1 22 LYS NZ N 5.839 0.372 11.422 1.00 . A A . 22 LYS NZ 1 1 8 3972 1 1 22 LYS O O 3.779 2.522 4.254 1.00 . A A . 22 LYS O 1 1 8 3973 1 1 23 CYS C C 2.193 5.235 4.895 1.00 . A A . 23 CYS C 1 1 8 3974 1 1 23 CYS CA C 1.451 4.023 4.337 1.00 . A A . 23 CYS CA 1 1 8 3975 1 1 23 CYS CB C -0.053 4.302 4.309 1.00 . A A . 23 CYS CB 1 1 8 3976 1 1 23 CYS H H 1.052 2.508 5.760 1.00 . A A . 23 CYS H 1 1 8 3977 1 1 23 CYS HA H 1.793 3.839 3.330 1.00 . A A . 23 CYS HA 1 1 8 3978 1 1 23 CYS HB3 H -0.236 5.192 3.725 1.00 . A A . 23 CYS HB3 1 1 8 3979 1 1 23 CYS N N 1.730 2.832 5.131 1.00 . A A . 23 CYS N 1 1 8 3980 1 1 23 CYS O O 3.006 5.110 5.810 1.00 . A A . 23 CYS O 1 1 8 3981 1 1 23 CYS SG S -1.046 2.952 3.593 1.00 . A A . 23 CYS SG 1 1 8 3982 1 1 24 ASN C C 1.510 8.732 5.025 1.00 . A A . 24 ASN C 1 1 8 3983 1 1 24 ASN CA C 2.547 7.640 4.776 1.00 . A A . 24 ASN CA 1 1 8 3984 1 1 24 ASN CB C 3.562 8.113 3.732 1.00 . A A . 24 ASN CB 1 1 8 3985 1 1 24 ASN CG C 3.507 7.290 2.460 1.00 . A A . 24 ASN CG 1 1 8 3986 1 1 24 ASN H H 1.250 6.441 3.609 1.00 . A A . 24 ASN H 1 1 8 3987 1 1 24 ASN HA H 3.065 7.433 5.700 1.00 . A A . 24 ASN HA 1 1 8 3988 1 1 24 ASN HB3 H 4.555 8.039 4.146 1.00 . A A . 24 ASN HB3 1 1 8 3989 1 1 24 ASN HD21 H 5.395 6.722 2.719 1.00 . A A . 24 ASN HD21 1 1 8 3990 1 1 24 ASN HD22 H 4.610 6.098 1.312 1.00 . A A . 24 ASN HD22 1 1 8 3991 1 1 24 ASN N N 1.906 6.406 4.336 1.00 . A A . 24 ASN N 1 1 8 3992 1 1 24 ASN ND2 N 4.616 6.637 2.131 1.00 . A A . 24 ASN ND2 1 1 8 3993 1 1 24 ASN O O 1.205 9.063 6.172 1.00 . A A . 24 ASN O 1 1 8 3994 1 1 24 ASN OD1 O 2.482 7.243 1.781 1.00 . A A . 24 ASN OD1 1 1 8 3995 1 1 25 LYS C C -0.827 10.458 2.748 1.00 . A A . 25 LYS C 1 1 8 3996 1 1 25 LYS CA C -0.032 10.339 4.045 1.00 . A A . 25 LYS CA 1 1 8 3997 1 1 25 LYS CB C 0.633 11.677 4.372 1.00 . A A . 25 LYS CB 1 1 8 3998 1 1 25 LYS CD C 2.453 13.330 3.857 1.00 . A A . 25 LYS CD 1 1 8 3999 1 1 25 LYS CE C 3.907 13.407 3.415 1.00 . A A . 25 LYS CE 1 1 8 4000 1 1 25 LYS CG C 1.831 11.992 3.493 1.00 . A A . 25 LYS CG 1 1 8 4001 1 1 25 LYS H H 1.256 8.979 3.058 1.00 . A A . 25 LYS H 1 1 8 4002 1 1 25 LYS HA H -0.709 10.077 4.844 1.00 . A A . 25 LYS HA 1 1 8 4003 1 1 25 LYS HB3 H 0.964 11.659 5.401 1.00 . A A . 25 LYS HB3 1 1 8 4004 1 1 25 LYS HD3 H 2.404 13.460 4.929 1.00 . A A . 25 LYS HD3 1 1 8 4005 1 1 25 LYS HE3 H 4.319 12.409 3.407 1.00 . A A . 25 LYS HE3 1 1 8 4006 1 1 25 LYS HG3 H 1.510 12.023 2.462 1.00 . A A . 25 LYS HG3 1 1 8 4007 1 1 25 LYS HZ1 H 4.199 15.025 2.127 1.00 . A A . 25 LYS HZ1 1 1 8 4008 1 1 25 LYS HZ2 H 3.178 13.829 1.504 1.00 . A A . 25 LYS HZ2 1 1 8 4009 1 1 25 LYS HZ3 H 4.849 13.571 1.558 1.00 . A A . 25 LYS HZ3 1 1 8 4010 1 1 25 LYS N N 0.971 9.285 3.945 1.00 . A A . 25 LYS N 1 1 8 4011 1 1 25 LYS NZ N 4.043 14.000 2.056 1.00 . A A . 25 LYS NZ 1 1 8 4012 1 1 25 LYS O O -2.046 10.623 2.769 1.00 . A A . 25 LYS O 1 1 8 4013 1 1 26 ALA C C -1.120 9.085 -0.225 1.00 . A A . 26 ALA C 1 1 8 4014 1 1 26 ALA CA C -0.767 10.466 0.316 1.00 . A A . 26 ALA CA 1 1 8 4015 1 1 26 ALA CB C 0.135 11.203 -0.663 1.00 . A A . 26 ALA CB 1 1 8 4016 1 1 26 ALA H H 0.842 10.240 1.669 1.00 . A A . 26 ALA H 1 1 8 4017 1 1 26 ALA HA H -1.676 11.040 0.430 1.00 . A A . 26 ALA HA 1 1 8 4018 1 1 26 ALA HB1 H -0.163 10.966 -1.675 1.00 . A A . 26 ALA HB1 1 1 8 4019 1 1 26 ALA HB2 H 0.049 12.267 -0.502 1.00 . A A . 26 ALA HB2 1 1 8 4020 1 1 26 ALA HB3 H 1.159 10.896 -0.509 1.00 . A A . 26 ALA HB3 1 1 8 4021 1 1 26 ALA N N -0.127 10.372 1.621 1.00 . A A . 26 ALA N 1 1 8 4022 1 1 26 ALA O O -1.321 8.911 -1.426 1.00 . A A . 26 ALA O 1 1 8 4023 1 1 27 GLN C C -0.484 6.184 -0.685 1.00 . A A . 27 GLN C 1 1 8 4024 1 1 27 GLN CA C -1.523 6.739 0.283 1.00 . A A . 27 GLN CA 1 1 8 4025 1 1 27 GLN CB C -2.912 6.686 -0.355 1.00 . A A . 27 GLN CB 1 1 8 4026 1 1 27 GLN CD C -4.356 8.759 -0.398 1.00 . A A . 27 GLN CD 1 1 8 4027 1 1 27 GLN CG C -3.949 7.522 0.378 1.00 . A A . 27 GLN CG 1 1 8 4028 1 1 27 GLN H H -1.024 8.307 1.614 1.00 . A A . 27 GLN H 1 1 8 4029 1 1 27 GLN HA H -1.524 6.132 1.176 1.00 . A A . 27 GLN HA 1 1 8 4030 1 1 27 GLN HB3 H -3.251 5.662 -0.368 1.00 . A A . 27 GLN HB3 1 1 8 4031 1 1 27 GLN HE21 H -4.444 9.814 1.284 1.00 . A A . 27 GLN HE21 1 1 8 4032 1 1 27 GLN HE22 H -4.828 10.676 -0.163 1.00 . A A . 27 GLN HE22 1 1 8 4033 1 1 27 GLN HG3 H -3.540 7.829 1.328 1.00 . A A . 27 GLN HG3 1 1 8 4034 1 1 27 GLN N N -1.195 8.105 0.671 1.00 . A A . 27 GLN N 1 1 8 4035 1 1 27 GLN NE2 N -4.564 9.862 0.312 1.00 . A A . 27 GLN NE2 1 1 8 4036 1 1 27 GLN O O -0.548 6.435 -1.890 1.00 . A A . 27 GLN O 1 1 8 4037 1 1 27 GLN OE1 O -4.482 8.725 -1.623 1.00 . A A . 27 GLN OE1 1 1 8 4038 1 1 28 ILE C C 1.879 3.440 -0.484 1.00 . A A . 28 ILE C 1 1 8 4039 1 1 28 ILE CA C 1.524 4.841 -0.971 1.00 . A A . 28 ILE CA 1 1 8 4040 1 1 28 ILE CB C 2.795 5.710 -0.969 1.00 . A A . 28 ILE CB 1 1 8 4041 1 1 28 ILE CD1 C 2.040 7.310 -2.799 1.00 . A A . 28 ILE CD1 1 1 8 4042 1 1 28 ILE CG1 C 2.453 7.152 -1.352 1.00 . A A . 28 ILE CG1 1 1 8 4043 1 1 28 ILE CG2 C 3.833 5.135 -1.920 1.00 . A A . 28 ILE CG2 1 1 8 4044 1 1 28 ILE H H 0.470 5.267 0.813 1.00 . A A . 28 ILE H 1 1 8 4045 1 1 28 ILE HA H 1.160 4.775 -1.986 1.00 . A A . 28 ILE HA 1 1 8 4046 1 1 28 ILE HB H 3.210 5.699 0.027 1.00 . A A . 28 ILE HB 1 1 8 4047 1 1 28 ILE HD11 H 1.812 6.339 -3.216 1.00 . A A . 28 ILE HD11 1 1 8 4048 1 1 28 ILE HD12 H 1.165 7.940 -2.856 1.00 . A A . 28 ILE HD12 1 1 8 4049 1 1 28 ILE HD13 H 2.847 7.760 -3.357 1.00 . A A . 28 ILE HD13 1 1 8 4050 1 1 28 ILE HG13 H 3.320 7.776 -1.184 1.00 . A A . 28 ILE HG13 1 1 8 4051 1 1 28 ILE HG21 H 4.683 5.799 -1.969 1.00 . A A . 28 ILE HG21 1 1 8 4052 1 1 28 ILE HG22 H 4.153 4.168 -1.562 1.00 . A A . 28 ILE HG22 1 1 8 4053 1 1 28 ILE HG23 H 3.401 5.030 -2.904 1.00 . A A . 28 ILE HG23 1 1 8 4054 1 1 28 ILE N N 0.472 5.430 -0.153 1.00 . A A . 28 ILE N 1 1 8 4055 1 1 28 ILE O O 2.086 2.526 -1.283 1.00 . A A . 28 ILE O 1 1 8 4056 1 1 29 CYS C C 3.718 1.599 1.121 1.00 . A A . 29 CYS C 1 1 8 4057 1 1 29 CYS CA C 2.276 1.988 1.429 1.00 . A A . 29 CYS CA 1 1 8 4058 1 1 29 CYS CB C 1.323 0.907 0.916 1.00 . A A . 29 CYS CB 1 1 8 4059 1 1 29 CYS H H 1.772 4.044 1.420 1.00 . A A . 29 CYS H 1 1 8 4060 1 1 29 CYS HA H 2.161 2.078 2.499 1.00 . A A . 29 CYS HA 1 1 8 4061 1 1 29 CYS HB3 H 1.900 0.118 0.458 1.00 . A A . 29 CYS HB3 1 1 8 4062 1 1 29 CYS N N 1.947 3.278 0.834 1.00 . A A . 29 CYS N 1 1 8 4063 1 1 29 CYS O O 4.146 1.619 -0.033 1.00 . A A . 29 CYS O 1 1 8 4064 1 1 29 CYS SG S 0.282 0.157 2.208 1.00 . A A . 29 CYS SG 1 1 8 4065 1 1 30 VAL C C 6.308 -0.056 3.147 1.00 . A A . 30 VAL C 1 1 8 4066 1 1 30 VAL CA C 5.859 0.848 2.004 1.00 . A A . 30 VAL CA 1 1 8 4067 1 1 30 VAL CB C 6.787 2.075 1.942 1.00 . A A . 30 VAL CB 1 1 8 4068 1 1 30 VAL CG1 C 7.092 2.442 0.496 1.00 . A A . 30 VAL CG1 1 1 8 4069 1 1 30 VAL CG2 C 6.166 3.252 2.679 1.00 . A A . 30 VAL CG2 1 1 8 4070 1 1 30 VAL H H 4.069 1.248 3.059 1.00 . A A . 30 VAL H 1 1 8 4071 1 1 30 VAL HA H 5.949 0.307 1.073 1.00 . A A . 30 VAL HA 1 1 8 4072 1 1 30 VAL HB H 7.718 1.823 2.429 1.00 . A A . 30 VAL HB 1 1 8 4073 1 1 30 VAL HG11 H 6.542 1.787 -0.164 1.00 . A A . 30 VAL HG11 1 1 8 4074 1 1 30 VAL HG12 H 6.800 3.466 0.316 1.00 . A A . 30 VAL HG12 1 1 8 4075 1 1 30 VAL HG13 H 8.151 2.331 0.313 1.00 . A A . 30 VAL HG13 1 1 8 4076 1 1 30 VAL HG21 H 5.948 2.965 3.696 1.00 . A A . 30 VAL HG21 1 1 8 4077 1 1 30 VAL HG22 H 6.856 4.082 2.677 1.00 . A A . 30 VAL HG22 1 1 8 4078 1 1 30 VAL HG23 H 5.251 3.544 2.184 1.00 . A A . 30 VAL HG23 1 1 8 4079 1 1 30 VAL N N 4.465 1.244 2.162 1.00 . A A . 30 VAL N 1 1 8 4080 1 1 30 VAL O O 5.543 -0.329 4.073 1.00 . A A . 30 VAL O 1 1 8 4081 1 1 31 ASP C C 9.552 -1.748 3.796 1.00 . A A . 31 ASP C 1 1 8 4082 1 1 31 ASP CA C 8.102 -1.392 4.105 1.00 . A A . 31 ASP CA 1 1 8 4083 1 1 31 ASP CB C 7.266 -2.667 4.224 1.00 . A A . 31 ASP CB 1 1 8 4084 1 1 31 ASP CG C 7.200 -3.186 5.647 1.00 . A A . 31 ASP CG 1 1 8 4085 1 1 31 ASP H H 8.111 -0.267 2.312 1.00 . A A . 31 ASP H 1 1 8 4086 1 1 31 ASP HA H 8.066 -0.861 5.044 1.00 . A A . 31 ASP HA 1 1 8 4087 1 1 31 ASP HB3 H 7.700 -3.434 3.599 1.00 . A A . 31 ASP HB3 1 1 8 4088 1 1 31 ASP N N 7.550 -0.519 3.075 1.00 . A A . 31 ASP N 1 1 8 4089 1 1 31 ASP O O 9.865 -2.850 3.346 1.00 . A A . 31 ASP O 1 1 8 4090 1 1 31 ASP OD1 O 6.335 -2.711 6.411 1.00 . A A . 31 ASP OD1 1 1 8 4091 1 1 31 ASP OD2 O 8.013 -4.067 5.996 1.00 . A A . 31 ASP OD2 1 1 8 4092 1 1 32 PRO C C 12.524 -1.968 4.774 1.00 . A A . 32 PRO C 1 1 8 4093 1 1 32 PRO CA C 11.895 -0.981 3.797 1.00 . A A . 32 PRO CA 1 1 8 4094 1 1 32 PRO CB C 12.476 0.420 4.003 1.00 . A A . 32 PRO CB 1 1 8 4095 1 1 32 PRO CD C 10.160 0.546 4.579 1.00 . A A . 32 PRO CD 1 1 8 4096 1 1 32 PRO CG C 11.517 1.099 4.918 1.00 . A A . 32 PRO CG 1 1 8 4097 1 1 32 PRO HA H 12.085 -1.306 2.785 1.00 . A A . 32 PRO HA 1 1 8 4098 1 1 32 PRO HB3 H 12.544 0.930 3.054 1.00 . A A . 32 PRO HB3 1 1 8 4099 1 1 32 PRO HD3 H 9.678 1.160 3.833 1.00 . A A . 32 PRO HD3 1 1 8 4100 1 1 32 PRO HG3 H 11.539 2.165 4.748 1.00 . A A . 32 PRO HG3 1 1 8 4101 1 1 32 PRO N N 10.461 -0.792 4.042 1.00 . A A . 32 PRO N 1 1 8 4102 1 1 32 PRO O O 13.679 -2.364 4.614 1.00 . A A . 32 PRO O 1 1 8 4103 1 1 33 LYS C C 12.445 -4.690 6.178 1.00 . A A . 33 LYS C 1 1 8 4104 1 1 33 LYS CA C 12.240 -3.306 6.788 1.00 . A A . 33 LYS CA 1 1 8 4105 1 1 33 LYS CB C 11.253 -3.391 7.954 1.00 . A A . 33 LYS CB 1 1 8 4106 1 1 33 LYS CD C 10.757 -1.963 9.960 1.00 . A A . 33 LYS CD 1 1 8 4107 1 1 33 LYS CE C 9.725 -2.819 10.677 1.00 . A A . 33 LYS CE 1 1 8 4108 1 1 33 LYS CG C 11.795 -2.819 9.252 1.00 . A A . 33 LYS CG 1 1 8 4109 1 1 33 LYS H H 10.846 -2.012 5.859 1.00 . A A . 33 LYS H 1 1 8 4110 1 1 33 LYS HA H 13.188 -2.944 7.155 1.00 . A A . 33 LYS HA 1 1 8 4111 1 1 33 LYS HB3 H 11.000 -4.429 8.120 1.00 . A A . 33 LYS HB3 1 1 8 4112 1 1 33 LYS HD3 H 10.255 -1.344 9.230 1.00 . A A . 33 LYS HD3 1 1 8 4113 1 1 33 LYS HE3 H 10.066 -3.844 10.681 1.00 . A A . 33 LYS HE3 1 1 8 4114 1 1 33 LYS HG3 H 12.661 -2.210 9.033 1.00 . A A . 33 LYS HG3 1 1 8 4115 1 1 33 LYS HZ1 H 9.955 -3.046 12.740 1.00 . A A . 33 LYS HZ1 1 1 8 4116 1 1 33 LYS HZ2 H 8.496 -2.319 12.290 1.00 . A A . 33 LYS HZ2 1 1 8 4117 1 1 33 LYS HZ3 H 9.936 -1.435 12.225 1.00 . A A . 33 LYS HZ3 1 1 8 4118 1 1 33 LYS N N 11.758 -2.363 5.785 1.00 . A A . 33 LYS N 1 1 8 4119 1 1 33 LYS NZ N 9.513 -2.374 12.081 1.00 . A A . 33 LYS NZ 1 1 8 4120 1 1 33 LYS O O 13.221 -5.496 6.692 1.00 . A A . 33 LYS O 1 1 8 4121 1 1 34 LYS C C 11.138 -6.205 3.053 1.00 . A A . 34 LYS C 1 1 8 4122 1 1 34 LYS CA C 11.851 -6.242 4.400 1.00 . A A . 34 LYS CA 1 1 8 4123 1 1 34 LYS CB C 11.262 -7.354 5.270 1.00 . A A . 34 LYS CB 1 1 8 4124 1 1 34 LYS CD C 12.873 -9.226 5.732 1.00 . A A . 34 LYS CD 1 1 8 4125 1 1 34 LYS CE C 13.755 -10.214 4.983 1.00 . A A . 34 LYS CE 1 1 8 4126 1 1 34 LYS CG C 11.717 -8.746 4.869 1.00 . A A . 34 LYS CG 1 1 8 4127 1 1 34 LYS H H 11.143 -4.273 4.720 1.00 . A A . 34 LYS H 1 1 8 4128 1 1 34 LYS HA H 12.899 -6.444 4.234 1.00 . A A . 34 LYS HA 1 1 8 4129 1 1 34 LYS HB3 H 10.185 -7.317 5.200 1.00 . A A . 34 LYS HB3 1 1 8 4130 1 1 34 LYS HD3 H 12.477 -9.706 6.615 1.00 . A A . 34 LYS HD3 1 1 8 4131 1 1 34 LYS HE3 H 14.426 -9.663 4.340 1.00 . A A . 34 LYS HE3 1 1 8 4132 1 1 34 LYS HG3 H 12.034 -8.728 3.836 1.00 . A A . 34 LYS HG3 1 1 8 4133 1 1 34 LYS HZ1 H 14.017 -11.901 6.187 1.00 . A A . 34 LYS HZ1 1 1 8 4134 1 1 34 LYS HZ2 H 14.792 -10.515 6.771 1.00 . A A . 34 LYS HZ2 1 1 8 4135 1 1 34 LYS HZ3 H 15.440 -11.355 5.453 1.00 . A A . 34 LYS HZ3 1 1 8 4136 1 1 34 LYS N N 11.745 -4.957 5.081 1.00 . A A . 34 LYS N 1 1 8 4137 1 1 34 LYS NZ N 14.557 -11.056 5.913 1.00 . A A . 34 LYS NZ 1 1 8 4138 1 1 34 LYS O O 10.550 -7.196 2.622 1.00 . A A . 34 LYS O 1 1 8 4139 1 1 35 GLY C C 11.137 -3.773 0.281 1.00 . A A . 35 GLY C 1 1 8 4140 1 1 35 GLY CA C 10.552 -4.908 1.097 1.00 . A A . 35 GLY CA 1 1 8 4141 1 1 35 GLY H H 11.679 -4.296 2.781 1.00 . A A . 35 GLY H 1 1 8 4142 1 1 35 GLY HA2 H 10.665 -5.830 0.545 1.00 . A A . 35 GLY HA2 1 1 8 4143 1 1 35 GLY HA3 H 9.499 -4.721 1.251 1.00 . A A . 35 GLY HA3 1 1 8 4144 1 1 35 GLY N N 11.196 -5.053 2.389 1.00 . A A . 35 GLY N 1 1 8 4145 1 1 35 GLY O O 12.299 -3.825 -0.121 1.00 . A A . 35 GLY O 1 1 8 4146 1 1 36 TRP C C 11.360 -2.031 -2.078 1.00 . A A . 36 TRP C 1 1 8 4147 1 1 36 TRP CA C 10.776 -1.594 -0.739 1.00 . A A . 36 TRP CA 1 1 8 4148 1 1 36 TRP CB C 11.815 -0.795 0.049 1.00 . A A . 36 TRP CB 1 1 8 4149 1 1 36 TRP CD1 C 13.285 0.393 -1.684 1.00 . A A . 36 TRP CD1 1 1 8 4150 1 1 36 TRP CD2 C 11.950 1.761 -0.515 1.00 . A A . 36 TRP CD2 1 1 8 4151 1 1 36 TRP CE2 C 12.700 2.532 -1.426 1.00 . A A . 36 TRP CE2 1 1 8 4152 1 1 36 TRP CE3 C 11.042 2.407 0.326 1.00 . A A . 36 TRP CE3 1 1 8 4153 1 1 36 TRP CG C 12.340 0.395 -0.698 1.00 . A A . 36 TRP CG 1 1 8 4154 1 1 36 TRP CH2 C 11.669 4.521 -0.679 1.00 . A A . 36 TRP CH2 1 1 8 4155 1 1 36 TRP CZ2 C 12.566 3.915 -1.514 1.00 . A A . 36 TRP CZ2 1 1 8 4156 1 1 36 TRP CZ3 C 10.910 3.780 0.237 1.00 . A A . 36 TRP CZ3 1 1 8 4157 1 1 36 TRP H H 9.415 -2.764 0.385 1.00 . A A . 36 TRP H 1 1 8 4158 1 1 36 TRP HA H 9.916 -0.967 -0.922 1.00 . A A . 36 TRP HA 1 1 8 4159 1 1 36 TRP HB3 H 12.652 -1.438 0.283 1.00 . A A . 36 TRP HB3 1 1 8 4160 1 1 36 TRP HD1 H 13.778 -0.495 -2.051 1.00 . A A . 36 TRP HD1 1 1 8 4161 1 1 36 TRP HE1 H 14.138 1.932 -2.830 1.00 . A A . 36 TRP HE1 1 1 8 4162 1 1 36 TRP HE3 H 10.448 1.853 1.038 1.00 . A A . 36 TRP HE3 1 1 8 4163 1 1 36 TRP HH2 H 11.534 5.591 -0.714 1.00 . A A . 36 TRP HH2 1 1 8 4164 1 1 36 TRP HZ2 H 13.143 4.501 -2.215 1.00 . A A . 36 TRP HZ2 1 1 8 4165 1 1 36 TRP HZ3 H 10.213 4.296 0.880 1.00 . A A . 36 TRP HZ3 1 1 8 4166 1 1 36 TRP N N 10.330 -2.747 0.037 1.00 . A A . 36 TRP N 1 1 8 4167 1 1 36 TRP NE1 N 13.506 1.674 -2.126 1.00 . A A . 36 TRP NE1 1 1 8 4168 1 1 36 TRP O O 11.175 -3.171 -2.505 1.00 . A A . 36 TRP O 1 1 9 4169 1 1 1 ASP C C -10.163 -11.809 0.878 1.00 . A A . 1 ASP C 1 1 9 4170 1 1 1 ASP CA C -9.994 -13.055 1.742 1.00 . A A . 1 ASP CA 1 1 9 4171 1 1 1 ASP CB C -11.295 -13.861 1.755 1.00 . A A . 1 ASP CB 1 1 9 4172 1 1 1 ASP CG C -11.206 -15.087 2.642 1.00 . A A . 1 ASP CG 1 1 9 4173 1 1 1 ASP H1 H -9.862 -11.818 3.455 1.00 . A A . 1 ASP H1 1 1 9 4174 1 1 1 ASP HA H -9.208 -13.664 1.323 1.00 . A A . 1 ASP HA 1 1 9 4175 1 1 1 ASP HB3 H -11.522 -14.182 0.750 1.00 . A A . 1 ASP HB3 1 1 9 4176 1 1 1 ASP N N -9.607 -12.696 3.101 1.00 . A A . 1 ASP N 1 1 9 4177 1 1 1 ASP O O -10.958 -11.796 -0.062 1.00 . A A . 1 ASP O 1 1 9 4178 1 1 1 ASP OD1 O -10.197 -15.816 2.548 1.00 . A A . 1 ASP OD1 1 1 9 4179 1 1 1 ASP OD2 O -12.147 -15.318 3.431 1.00 . A A . 1 ASP OD2 1 1 9 4180 1 1 2 PHE C C -8.122 -9.169 -0.153 1.00 . A A . 2 PHE C 1 1 9 4181 1 1 2 PHE CA C -9.476 -9.512 0.458 1.00 . A A . 2 PHE CA 1 1 9 4182 1 1 2 PHE CB C -9.940 -8.375 1.371 1.00 . A A . 2 PHE CB 1 1 9 4183 1 1 2 PHE CD1 C -12.336 -9.056 1.673 1.00 . A A . 2 PHE CD1 1 1 9 4184 1 1 2 PHE CD2 C -10.986 -8.768 3.617 1.00 . A A . 2 PHE CD2 1 1 9 4185 1 1 2 PHE CE1 C -13.415 -9.392 2.468 1.00 . A A . 2 PHE CE1 1 1 9 4186 1 1 2 PHE CE2 C -12.062 -9.105 4.417 1.00 . A A . 2 PHE CE2 1 1 9 4187 1 1 2 PHE CG C -11.111 -8.741 2.238 1.00 . A A . 2 PHE CG 1 1 9 4188 1 1 2 PHE CZ C -13.279 -9.417 3.842 1.00 . A A . 2 PHE CZ 1 1 9 4189 1 1 2 PHE H H -8.794 -10.835 1.963 1.00 . A A . 2 PHE H 1 1 9 4190 1 1 2 PHE HA H -10.194 -9.639 -0.337 1.00 . A A . 2 PHE HA 1 1 9 4191 1 1 2 PHE HB3 H -10.225 -7.529 0.764 1.00 . A A . 2 PHE HB3 1 1 9 4192 1 1 2 PHE HD1 H -12.444 -9.036 0.597 1.00 . A A . 2 PHE HD1 1 1 9 4193 1 1 2 PHE HD2 H -10.036 -8.524 4.069 1.00 . A A . 2 PHE HD2 1 1 9 4194 1 1 2 PHE HE1 H -14.365 -9.636 2.014 1.00 . A A . 2 PHE HE1 1 1 9 4195 1 1 2 PHE HE2 H -11.952 -9.123 5.491 1.00 . A A . 2 PHE HE2 1 1 9 4196 1 1 2 PHE HZ H -14.119 -9.681 4.465 1.00 . A A . 2 PHE HZ 1 1 9 4197 1 1 2 PHE N N -9.410 -10.763 1.203 1.00 . A A . 2 PHE N 1 1 9 4198 1 1 2 PHE O O -7.408 -8.281 0.314 1.00 . A A . 2 PHE O 1 1 9 4199 1 1 3 PRO C C -6.449 -8.359 -2.679 1.00 . A A . 3 PRO C 1 1 9 4200 1 1 3 PRO CA C -6.484 -9.682 -1.922 1.00 . A A . 3 PRO CA 1 1 9 4201 1 1 3 PRO CB C -6.418 -10.858 -2.898 1.00 . A A . 3 PRO CB 1 1 9 4202 1 1 3 PRO CD C -8.557 -10.965 -1.833 1.00 . A A . 3 PRO CD 1 1 9 4203 1 1 3 PRO CG C -7.840 -11.241 -3.127 1.00 . A A . 3 PRO CG 1 1 9 4204 1 1 3 PRO HA H -5.646 -9.729 -1.242 1.00 . A A . 3 PRO HA 1 1 9 4205 1 1 3 PRO HB3 H -5.859 -11.669 -2.454 1.00 . A A . 3 PRO HB3 1 1 9 4206 1 1 3 PRO HD3 H -8.559 -11.845 -1.208 1.00 . A A . 3 PRO HD3 1 1 9 4207 1 1 3 PRO HG3 H -7.902 -12.291 -3.373 1.00 . A A . 3 PRO HG3 1 1 9 4208 1 1 3 PRO N N -7.755 -9.890 -1.223 1.00 . A A . 3 PRO N 1 1 9 4209 1 1 3 PRO O O -7.480 -7.869 -3.142 1.00 . A A . 3 PRO O 1 1 9 4210 1 1 4 LEU C C -3.623 -6.282 -3.857 1.00 . A A . 4 LEU C 1 1 9 4211 1 1 4 LEU CA C -5.088 -6.517 -3.505 1.00 . A A . 4 LEU CA 1 1 9 4212 1 1 4 LEU CB C -5.610 -5.363 -2.648 1.00 . A A . 4 LEU CB 1 1 9 4213 1 1 4 LEU CD1 C -4.705 -3.634 -1.074 1.00 . A A . 4 LEU CD1 1 1 9 4214 1 1 4 LEU CD2 C -5.630 -5.777 -0.176 1.00 . A A . 4 LEU CD2 1 1 9 4215 1 1 4 LEU CG C -4.878 -5.123 -1.326 1.00 . A A . 4 LEU CG 1 1 9 4216 1 1 4 LEU H H -4.473 -8.222 -2.411 1.00 . A A . 4 LEU H 1 1 9 4217 1 1 4 LEU HA H -5.662 -6.565 -4.418 1.00 . A A . 4 LEU HA 1 1 9 4218 1 1 4 LEU HB3 H -6.648 -5.563 -2.421 1.00 . A A . 4 LEU HB3 1 1 9 4219 1 1 4 LEU HD11 H -5.673 -3.177 -0.931 1.00 . A A . 4 LEU HD11 1 1 9 4220 1 1 4 LEU HD12 H -4.214 -3.180 -1.922 1.00 . A A . 4 LEU HD12 1 1 9 4221 1 1 4 LEU HD13 H -4.103 -3.486 -0.189 1.00 . A A . 4 LEU HD13 1 1 9 4222 1 1 4 LEU HD21 H -6.583 -5.288 -0.043 1.00 . A A . 4 LEU HD21 1 1 9 4223 1 1 4 LEU HD22 H -5.050 -5.685 0.732 1.00 . A A . 4 LEU HD22 1 1 9 4224 1 1 4 LEU HD23 H -5.788 -6.823 -0.396 1.00 . A A . 4 LEU HD23 1 1 9 4225 1 1 4 LEU HG H -3.894 -5.569 -1.380 1.00 . A A . 4 LEU HG 1 1 9 4226 1 1 4 LEU N N -5.257 -7.784 -2.802 1.00 . A A . 4 LEU N 1 1 9 4227 1 1 4 LEU O O -2.784 -7.168 -3.694 1.00 . A A . 4 LEU O 1 1 9 4228 1 1 5 SER C C -1.125 -4.386 -3.485 1.00 . A A . 5 SER C 1 1 9 4229 1 1 5 SER CA C -1.957 -4.729 -4.717 1.00 . A A . 5 SER CA 1 1 9 4230 1 1 5 SER CB C -1.963 -3.547 -5.689 1.00 . A A . 5 SER CB 1 1 9 4231 1 1 5 SER H H -4.034 -4.416 -4.447 1.00 . A A . 5 SER H 1 1 9 4232 1 1 5 SER HA H -1.518 -5.585 -5.207 1.00 . A A . 5 SER HA 1 1 9 4233 1 1 5 SER HB3 H -0.987 -3.452 -6.141 1.00 . A A . 5 SER HB3 1 1 9 4234 1 1 5 SER HG H -3.369 -2.901 -6.888 1.00 . A A . 5 SER HG 1 1 9 4235 1 1 5 SER N N -3.321 -5.081 -4.340 1.00 . A A . 5 SER N 1 1 9 4236 1 1 5 SER O O -1.550 -4.608 -2.351 1.00 . A A . 5 SER O 1 1 9 4237 1 1 5 SER OG O -2.925 -3.733 -6.712 1.00 . A A . 5 SER OG 1 1 9 4238 1 1 6 LYS C C 2.068 -2.545 -3.129 1.00 . A A . 6 LYS C 1 1 9 4239 1 1 6 LYS CA C 0.960 -3.465 -2.629 1.00 . A A . 6 LYS CA 1 1 9 4240 1 1 6 LYS CB C 1.571 -4.714 -1.988 1.00 . A A . 6 LYS CB 1 1 9 4241 1 1 6 LYS CD C 2.697 -6.883 -2.566 1.00 . A A . 6 LYS CD 1 1 9 4242 1 1 6 LYS CE C 3.939 -7.505 -3.186 1.00 . A A . 6 LYS CE 1 1 9 4243 1 1 6 LYS CG C 2.616 -5.394 -2.855 1.00 . A A . 6 LYS CG 1 1 9 4244 1 1 6 LYS H H 0.350 -3.688 -4.643 1.00 . A A . 6 LYS H 1 1 9 4245 1 1 6 LYS HA H 0.378 -2.939 -1.887 1.00 . A A . 6 LYS HA 1 1 9 4246 1 1 6 LYS HB3 H 0.781 -5.425 -1.788 1.00 . A A . 6 LYS HB3 1 1 9 4247 1 1 6 LYS HD3 H 1.821 -7.369 -2.973 1.00 . A A . 6 LYS HD3 1 1 9 4248 1 1 6 LYS HE3 H 4.561 -7.898 -2.395 1.00 . A A . 6 LYS HE3 1 1 9 4249 1 1 6 LYS HG3 H 3.580 -4.946 -2.661 1.00 . A A . 6 LYS HG3 1 1 9 4250 1 1 6 LYS HZ1 H 3.636 -8.263 -5.109 1.00 . A A . 6 LYS HZ1 1 1 9 4251 1 1 6 LYS HZ2 H 2.638 -8.959 -3.932 1.00 . A A . 6 LYS HZ2 1 1 9 4252 1 1 6 LYS HZ3 H 4.271 -9.391 -4.019 1.00 . A A . 6 LYS HZ3 1 1 9 4253 1 1 6 LYS N N 0.066 -3.841 -3.717 1.00 . A A . 6 LYS N 1 1 9 4254 1 1 6 LYS NZ N 3.598 -8.607 -4.128 1.00 . A A . 6 LYS NZ 1 1 9 4255 1 1 6 LYS O O 1.986 -2.002 -4.229 1.00 . A A . 6 LYS O 1 1 9 4256 1 1 7 GLU C C 3.807 -0.053 -2.712 1.00 . A A . 7 GLU C 1 1 9 4257 1 1 7 GLU CA C 4.228 -1.519 -2.674 1.00 . A A . 7 GLU CA 1 1 9 4258 1 1 7 GLU CB C 4.797 -1.934 -4.033 1.00 . A A . 7 GLU CB 1 1 9 4259 1 1 7 GLU CD C 6.854 -1.923 -5.498 1.00 . A A . 7 GLU CD 1 1 9 4260 1 1 7 GLU CG C 6.315 -1.940 -4.081 1.00 . A A . 7 GLU CG 1 1 9 4261 1 1 7 GLU H H 3.111 -2.834 -1.447 1.00 . A A . 7 GLU H 1 1 9 4262 1 1 7 GLU HA H 4.993 -1.641 -1.922 1.00 . A A . 7 GLU HA 1 1 9 4263 1 1 7 GLU HB3 H 4.437 -1.246 -4.784 1.00 . A A . 7 GLU HB3 1 1 9 4264 1 1 7 GLU HG3 H 6.675 -2.829 -3.585 1.00 . A A . 7 GLU HG3 1 1 9 4265 1 1 7 GLU N N 3.104 -2.374 -2.313 1.00 . A A . 7 GLU N 1 1 9 4266 1 1 7 GLU O O 2.821 0.337 -2.086 1.00 . A A . 7 GLU O 1 1 9 4267 1 1 7 GLU OE1 O 6.192 -2.494 -6.391 1.00 . A A . 7 GLU OE1 1 1 9 4268 1 1 7 GLU OE2 O 7.936 -1.340 -5.715 1.00 . A A . 7 GLU OE2 1 1 9 4269 1 1 8 TYR C C 2.810 2.403 -3.965 1.00 . A A . 8 TYR C 1 1 9 4270 1 1 8 TYR CA C 4.267 2.177 -3.569 1.00 . A A . 8 TYR CA 1 1 9 4271 1 1 8 TYR CB C 5.193 2.826 -4.600 1.00 . A A . 8 TYR CB 1 1 9 4272 1 1 8 TYR CD1 C 4.199 2.576 -6.907 1.00 . A A . 8 TYR CD1 1 1 9 4273 1 1 8 TYR CD2 C 6.014 1.154 -6.305 1.00 . A A . 8 TYR CD2 1 1 9 4274 1 1 8 TYR CE1 C 4.140 1.982 -8.153 1.00 . A A . 8 TYR CE1 1 1 9 4275 1 1 8 TYR CE2 C 5.965 0.556 -7.549 1.00 . A A . 8 TYR CE2 1 1 9 4276 1 1 8 TYR CG C 5.135 2.174 -5.962 1.00 . A A . 8 TYR CG 1 1 9 4277 1 1 8 TYR CZ C 5.026 0.973 -8.469 1.00 . A A . 8 TYR CZ 1 1 9 4278 1 1 8 TYR H H 5.333 0.384 -3.927 1.00 . A A . 8 TYR H 1 1 9 4279 1 1 8 TYR HA H 4.441 2.633 -2.606 1.00 . A A . 8 TYR HA 1 1 9 4280 1 1 8 TYR HB3 H 6.211 2.766 -4.246 1.00 . A A . 8 TYR HB3 1 1 9 4281 1 1 8 TYR HD1 H 3.506 3.367 -6.657 1.00 . A A . 8 TYR HD1 1 1 9 4282 1 1 8 TYR HD2 H 6.748 0.829 -5.581 1.00 . A A . 8 TYR HD2 1 1 9 4283 1 1 8 TYR HE1 H 3.406 2.309 -8.875 1.00 . A A . 8 TYR HE1 1 1 9 4284 1 1 8 TYR HE2 H 6.658 -0.235 -7.796 1.00 . A A . 8 TYR HE2 1 1 9 4285 1 1 8 TYR HH H 4.330 0.837 -10.257 1.00 . A A . 8 TYR HH 1 1 9 4286 1 1 8 TYR N N 4.560 0.754 -3.451 1.00 . A A . 8 TYR N 1 1 9 4287 1 1 8 TYR O O 2.258 3.480 -3.748 1.00 . A A . 8 TYR O 1 1 9 4288 1 1 8 TYR OH O 4.972 0.379 -9.710 1.00 . A A . 8 TYR OH 1 1 9 4289 1 1 9 GLU C C -0.054 2.121 -3.897 1.00 . A A . 9 GLU C 1 1 9 4290 1 1 9 GLU CA C 0.805 1.462 -4.972 1.00 . A A . 9 GLU CA 1 1 9 4291 1 1 9 GLU CB C 0.260 0.070 -5.292 1.00 . A A . 9 GLU CB 1 1 9 4292 1 1 9 GLU CD C -0.992 -0.151 -7.476 1.00 . A A . 9 GLU CD 1 1 9 4293 1 1 9 GLU CG C -1.095 0.089 -5.982 1.00 . A A . 9 GLU CG 1 1 9 4294 1 1 9 GLU H H 2.691 0.544 -4.692 1.00 . A A . 9 GLU H 1 1 9 4295 1 1 9 GLU HA H 0.768 2.067 -5.866 1.00 . A A . 9 GLU HA 1 1 9 4296 1 1 9 GLU HB3 H 0.162 -0.487 -4.371 1.00 . A A . 9 GLU HB3 1 1 9 4297 1 1 9 GLU HG3 H -1.554 1.053 -5.818 1.00 . A A . 9 GLU HG3 1 1 9 4298 1 1 9 GLU N N 2.196 1.377 -4.546 1.00 . A A . 9 GLU N 1 1 9 4299 1 1 9 GLU O O 0.120 1.868 -2.705 1.00 . A A . 9 GLU O 1 1 9 4300 1 1 9 GLU OE1 O -0.833 0.836 -8.225 1.00 . A A . 9 GLU OE1 1 1 9 4301 1 1 9 GLU OE2 O -1.071 -1.324 -7.895 1.00 . A A . 9 GLU OE2 1 1 9 4302 1 1 10 THR C C -2.500 2.699 -2.410 1.00 . A A . 10 THR C 1 1 9 4303 1 1 10 THR CA C -1.867 3.668 -3.403 1.00 . A A . 10 THR CA 1 1 9 4304 1 1 10 THR CB C -2.984 4.419 -4.152 1.00 . A A . 10 THR CB 1 1 9 4305 1 1 10 THR CG2 C -2.398 5.367 -5.187 1.00 . A A . 10 THR CG2 1 1 9 4306 1 1 10 THR H H -1.073 3.131 -5.289 1.00 . A A . 10 THR H 1 1 9 4307 1 1 10 THR HA H -1.278 4.391 -2.859 1.00 . A A . 10 THR HA 1 1 9 4308 1 1 10 THR HB H -3.551 4.997 -3.437 1.00 . A A . 10 THR HB 1 1 9 4309 1 1 10 THR HG1 H -3.435 3.142 -5.587 1.00 . A A . 10 THR HG1 1 1 9 4310 1 1 10 THR HG21 H -3.037 6.231 -5.286 1.00 . A A . 10 THR HG21 1 1 9 4311 1 1 10 THR HG22 H -2.326 4.862 -6.140 1.00 . A A . 10 THR HG22 1 1 9 4312 1 1 10 THR HG23 H -1.413 5.681 -4.872 1.00 . A A . 10 THR HG23 1 1 9 4313 1 1 10 THR N N -0.982 2.970 -4.327 1.00 . A A . 10 THR N 1 1 9 4314 1 1 10 THR O O -2.815 1.559 -2.754 1.00 . A A . 10 THR O 1 1 9 4315 1 1 10 THR OG1 O -3.858 3.484 -4.795 1.00 . A A . 10 THR OG1 1 1 9 4316 1 1 11 CYS C C -4.453 3.054 0.528 1.00 . A A . 11 CYS C 1 1 9 4317 1 1 11 CYS CA C -3.282 2.333 -0.134 1.00 . A A . 11 CYS CA 1 1 9 4318 1 1 11 CYS CB C -2.233 1.968 0.918 1.00 . A A . 11 CYS CB 1 1 9 4319 1 1 11 CYS H H -2.414 4.077 -0.963 1.00 . A A . 11 CYS H 1 1 9 4320 1 1 11 CYS HA H -3.646 1.428 -0.595 1.00 . A A . 11 CYS HA 1 1 9 4321 1 1 11 CYS HB3 H -1.463 1.369 0.455 1.00 . A A . 11 CYS HB3 1 1 9 4322 1 1 11 CYS N N -2.686 3.158 -1.177 1.00 . A A . 11 CYS N 1 1 9 4323 1 1 11 CYS O O -4.515 3.165 1.752 1.00 . A A . 11 CYS O 1 1 9 4324 1 1 11 CYS SG S -1.427 3.405 1.694 1.00 . A A . 11 CYS SG 1 1 9 4325 1 1 12 VAL C C -7.353 3.375 1.167 1.00 . A A . 12 VAL C 1 1 9 4326 1 1 12 VAL CA C -6.549 4.251 0.214 1.00 . A A . 12 VAL CA 1 1 9 4327 1 1 12 VAL CB C -7.464 4.715 -0.936 1.00 . A A . 12 VAL CB 1 1 9 4328 1 1 12 VAL CG1 C -6.764 5.767 -1.783 1.00 . A A . 12 VAL CG1 1 1 9 4329 1 1 12 VAL CG2 C -7.890 3.529 -1.787 1.00 . A A . 12 VAL CG2 1 1 9 4330 1 1 12 VAL H H -5.274 3.422 -1.258 1.00 . A A . 12 VAL H 1 1 9 4331 1 1 12 VAL HA H -6.205 5.125 0.747 1.00 . A A . 12 VAL HA 1 1 9 4332 1 1 12 VAL HB H -8.349 5.160 -0.507 1.00 . A A . 12 VAL HB 1 1 9 4333 1 1 12 VAL HG11 H -7.376 6.000 -2.643 1.00 . A A . 12 VAL HG11 1 1 9 4334 1 1 12 VAL HG12 H -6.611 6.660 -1.195 1.00 . A A . 12 VAL HG12 1 1 9 4335 1 1 12 VAL HG13 H -5.810 5.385 -2.115 1.00 . A A . 12 VAL HG13 1 1 9 4336 1 1 12 VAL HG21 H -8.601 3.857 -2.532 1.00 . A A . 12 VAL HG21 1 1 9 4337 1 1 12 VAL HG22 H -7.025 3.107 -2.276 1.00 . A A . 12 VAL HG22 1 1 9 4338 1 1 12 VAL HG23 H -8.349 2.780 -1.159 1.00 . A A . 12 VAL HG23 1 1 9 4339 1 1 12 VAL N N -5.379 3.542 -0.291 1.00 . A A . 12 VAL N 1 1 9 4340 1 1 12 VAL O O -6.963 2.247 1.470 1.00 . A A . 12 VAL O 1 1 9 4341 1 1 13 ARG C C -9.718 1.806 1.981 1.00 . A A . 13 ARG C 1 1 9 4342 1 1 13 ARG CA C -9.339 3.166 2.558 1.00 . A A . 13 ARG CA 1 1 9 4343 1 1 13 ARG CB C -10.604 3.973 2.861 1.00 . A A . 13 ARG CB 1 1 9 4344 1 1 13 ARG CD C -11.703 5.613 4.415 1.00 . A A . 13 ARG CD 1 1 9 4345 1 1 13 ARG CG C -10.649 4.526 4.275 1.00 . A A . 13 ARG CG 1 1 9 4346 1 1 13 ARG CZ C -13.488 4.561 5.736 1.00 . A A . 13 ARG CZ 1 1 9 4347 1 1 13 ARG H H -8.738 4.804 1.360 1.00 . A A . 13 ARG H 1 1 9 4348 1 1 13 ARG HA H -8.791 3.015 3.475 1.00 . A A . 13 ARG HA 1 1 9 4349 1 1 13 ARG HB3 H -11.464 3.336 2.719 1.00 . A A . 13 ARG HB3 1 1 9 4350 1 1 13 ARG HD3 H -11.689 6.226 3.526 1.00 . A A . 13 ARG HD3 1 1 9 4351 1 1 13 ARG HE H -13.637 5.057 3.810 1.00 . A A . 13 ARG HE 1 1 9 4352 1 1 13 ARG HG3 H -9.682 4.940 4.521 1.00 . A A . 13 ARG HG3 1 1 9 4353 1 1 13 ARG HH11 H -11.778 4.915 6.749 1.00 . A A . 13 ARG HH11 1 1 9 4354 1 1 13 ARG HH12 H -13.045 4.174 7.669 1.00 . A A . 13 ARG HH12 1 1 9 4355 1 1 13 ARG HH21 H -15.313 4.081 5.010 1.00 . A A . 13 ARG HH21 1 1 9 4356 1 1 13 ARG HH22 H -15.055 3.699 6.678 1.00 . A A . 13 ARG HH22 1 1 9 4357 1 1 13 ARG N N -8.479 3.901 1.638 1.00 . A A . 13 ARG N 1 1 9 4358 1 1 13 ARG NE N -13.042 5.059 4.588 1.00 . A A . 13 ARG NE 1 1 9 4359 1 1 13 ARG NH1 N -12.706 4.549 6.806 1.00 . A A . 13 ARG NH1 1 1 9 4360 1 1 13 ARG NH2 N -14.720 4.073 5.815 1.00 . A A . 13 ARG NH2 1 1 9 4361 1 1 13 ARG O O -9.444 0.758 2.566 1.00 . A A . 13 ARG O 1 1 9 4362 1 1 14 PRO C C -9.614 -0.208 -0.422 1.00 . A A . 14 PRO C 1 1 9 4363 1 1 14 PRO CA C -10.791 0.595 0.121 1.00 . A A . 14 PRO CA 1 1 9 4364 1 1 14 PRO CB C -11.659 1.115 -1.028 1.00 . A A . 14 PRO CB 1 1 9 4365 1 1 14 PRO CD C -10.720 3.032 0.049 1.00 . A A . 14 PRO CD 1 1 9 4366 1 1 14 PRO CG C -11.159 2.495 -1.285 1.00 . A A . 14 PRO CG 1 1 9 4367 1 1 14 PRO HA H -11.386 -0.032 0.768 1.00 . A A . 14 PRO HA 1 1 9 4368 1 1 14 PRO HB3 H -12.695 1.121 -0.726 1.00 . A A . 14 PRO HB3 1 1 9 4369 1 1 14 PRO HD3 H -11.532 3.558 0.530 1.00 . A A . 14 PRO HD3 1 1 9 4370 1 1 14 PRO HG3 H -11.955 3.103 -1.690 1.00 . A A . 14 PRO HG3 1 1 9 4371 1 1 14 PRO N N -10.362 1.820 0.804 1.00 . A A . 14 PRO N 1 1 9 4372 1 1 14 PRO O O -9.786 -1.327 -0.906 1.00 . A A . 14 PRO O 1 1 9 4373 1 1 15 ARG C C -6.308 -0.688 0.340 1.00 . A A . 15 ARG C 1 1 9 4374 1 1 15 ARG CA C -7.215 -0.294 -0.822 1.00 . A A . 15 ARG CA 1 1 9 4375 1 1 15 ARG CB C -6.458 0.619 -1.787 1.00 . A A . 15 ARG CB 1 1 9 4376 1 1 15 ARG CD C -6.166 -1.115 -3.583 1.00 . A A . 15 ARG CD 1 1 9 4377 1 1 15 ARG CG C -5.466 -0.119 -2.672 1.00 . A A . 15 ARG CG 1 1 9 4378 1 1 15 ARG CZ C -6.384 -1.583 -5.987 1.00 . A A . 15 ARG CZ 1 1 9 4379 1 1 15 ARG H H -8.347 1.263 0.059 1.00 . A A . 15 ARG H 1 1 9 4380 1 1 15 ARG HA H -7.517 -1.188 -1.346 1.00 . A A . 15 ARG HA 1 1 9 4381 1 1 15 ARG HB3 H -5.918 1.358 -1.216 1.00 . A A . 15 ARG HB3 1 1 9 4382 1 1 15 ARG HD3 H -7.229 -1.061 -3.404 1.00 . A A . 15 ARG HD3 1 1 9 4383 1 1 15 ARG HE H -5.352 -0.064 -5.211 1.00 . A A . 15 ARG HE 1 1 9 4384 1 1 15 ARG HG3 H -4.764 -0.649 -2.044 1.00 . A A . 15 ARG HG3 1 1 9 4385 1 1 15 ARG HH11 H -7.352 -2.880 -4.777 1.00 . A A . 15 ARG HH11 1 1 9 4386 1 1 15 ARG HH12 H -7.498 -3.199 -6.473 1.00 . A A . 15 ARG HH12 1 1 9 4387 1 1 15 ARG HH21 H -5.536 -0.473 -7.448 1.00 . A A . 15 ARG HH21 1 1 9 4388 1 1 15 ARG HH22 H -6.464 -1.830 -7.991 1.00 . A A . 15 ARG HH22 1 1 9 4389 1 1 15 ARG N N -8.420 0.369 -0.338 1.00 . A A . 15 ARG N 1 1 9 4390 1 1 15 ARG NE N -5.908 -0.840 -4.995 1.00 . A A . 15 ARG NE 1 1 9 4391 1 1 15 ARG NH1 N -7.140 -2.641 -5.724 1.00 . A A . 15 ARG NH1 1 1 9 4392 1 1 15 ARG NH2 N -6.105 -1.270 -7.245 1.00 . A A . 15 ARG NH2 1 1 9 4393 1 1 15 ARG O O -5.085 -0.573 0.254 1.00 . A A . 15 ARG O 1 1 9 4394 1 1 16 LYS C C -5.053 -2.541 2.232 1.00 . A A . 16 LYS C 1 1 9 4395 1 1 16 LYS CA C -6.163 -1.564 2.607 1.00 . A A . 16 LYS CA 1 1 9 4396 1 1 16 LYS CB C -7.097 -2.207 3.634 1.00 . A A . 16 LYS CB 1 1 9 4397 1 1 16 LYS CD C -5.533 -2.303 5.597 1.00 . A A . 16 LYS CD 1 1 9 4398 1 1 16 LYS CE C -4.495 -1.204 5.775 1.00 . A A . 16 LYS CE 1 1 9 4399 1 1 16 LYS CG C -6.842 -1.749 5.060 1.00 . A A . 16 LYS CG 1 1 9 4400 1 1 16 LYS H H -7.893 -1.221 1.436 1.00 . A A . 16 LYS H 1 1 9 4401 1 1 16 LYS HA H -5.717 -0.682 3.041 1.00 . A A . 16 LYS HA 1 1 9 4402 1 1 16 LYS HB3 H -6.972 -3.280 3.595 1.00 . A A . 16 LYS HB3 1 1 9 4403 1 1 16 LYS HD3 H -5.150 -3.038 4.903 1.00 . A A . 16 LYS HD3 1 1 9 4404 1 1 16 LYS HE3 H -4.362 -0.696 4.832 1.00 . A A . 16 LYS HE3 1 1 9 4405 1 1 16 LYS HG3 H -7.652 -2.091 5.688 1.00 . A A . 16 LYS HG3 1 1 9 4406 1 1 16 LYS HZ1 H -5.918 -0.329 7.030 1.00 . A A . 16 LYS HZ1 1 1 9 4407 1 1 16 LYS HZ2 H -4.754 0.754 6.454 1.00 . A A . 16 LYS HZ2 1 1 9 4408 1 1 16 LYS HZ3 H -4.354 -0.346 7.675 1.00 . A A . 16 LYS HZ3 1 1 9 4409 1 1 16 LYS N N -6.914 -1.152 1.427 1.00 . A A . 16 LYS N 1 1 9 4410 1 1 16 LYS NZ N -4.910 -0.213 6.806 1.00 . A A . 16 LYS NZ 1 1 9 4411 1 1 16 LYS O O -5.319 -3.645 1.756 1.00 . A A . 16 LYS O 1 1 9 4412 1 1 17 CYS C C -2.811 -4.354 2.754 1.00 . A A . 17 CYS C 1 1 9 4413 1 1 17 CYS CA C -2.658 -2.967 2.135 1.00 . A A . 17 CYS CA 1 1 9 4414 1 1 17 CYS CB C -1.371 -2.311 2.638 1.00 . A A . 17 CYS CB 1 1 9 4415 1 1 17 CYS H H -3.661 -1.238 2.832 1.00 . A A . 17 CYS H 1 1 9 4416 1 1 17 CYS HA H -2.605 -3.069 1.062 1.00 . A A . 17 CYS HA 1 1 9 4417 1 1 17 CYS HB3 H -0.767 -3.057 3.135 1.00 . A A . 17 CYS HB3 1 1 9 4418 1 1 17 CYS N N -3.809 -2.128 2.450 1.00 . A A . 17 CYS N 1 1 9 4419 1 1 17 CYS O O -2.817 -4.502 3.974 1.00 . A A . 17 CYS O 1 1 9 4420 1 1 17 CYS SG S -0.357 -1.561 1.324 1.00 . A A . 17 CYS SG 1 1 9 4421 1 1 18 GLN C C -1.872 -7.182 3.168 1.00 . A A . 18 GLN C 1 1 9 4422 1 1 18 GLN CA C -3.088 -6.740 2.363 1.00 . A A . 18 GLN CA 1 1 9 4423 1 1 18 GLN CB C -3.298 -7.680 1.174 1.00 . A A . 18 GLN CB 1 1 9 4424 1 1 18 GLN CD C -4.426 -9.847 1.815 1.00 . A A . 18 GLN CD 1 1 9 4425 1 1 18 GLN CG C -4.602 -8.458 1.236 1.00 . A A . 18 GLN CG 1 1 9 4426 1 1 18 GLN H H -2.924 -5.183 0.938 1.00 . A A . 18 GLN H 1 1 9 4427 1 1 18 GLN HA H -3.960 -6.780 2.999 1.00 . A A . 18 GLN HA 1 1 9 4428 1 1 18 GLN HB3 H -2.483 -8.388 1.143 1.00 . A A . 18 GLN HB3 1 1 9 4429 1 1 18 GLN HE21 H -5.696 -9.422 3.285 1.00 . A A . 18 GLN HE21 1 1 9 4430 1 1 18 GLN HE22 H -5.023 -11.014 3.310 1.00 . A A . 18 GLN HE22 1 1 9 4431 1 1 18 GLN HG3 H -5.000 -8.548 0.236 1.00 . A A . 18 GLN HG3 1 1 9 4432 1 1 18 GLN N N -2.936 -5.366 1.900 1.00 . A A . 18 GLN N 1 1 9 4433 1 1 18 GLN NE2 N -5.117 -10.123 2.916 1.00 . A A . 18 GLN NE2 1 1 9 4434 1 1 18 GLN O O -1.972 -7.558 4.337 1.00 . A A . 18 GLN O 1 1 9 4435 1 1 18 GLN OE1 O -3.677 -10.665 1.281 1.00 . A A . 18 GLN OE1 1 1 9 4436 1 1 19 PRO C C 1.003 -6.545 4.247 1.00 . A A . 19 PRO C 1 1 9 4437 1 1 19 PRO CA C 0.568 -7.531 3.169 1.00 . A A . 19 PRO CA 1 1 9 4438 1 1 19 PRO CB C 1.567 -7.533 2.010 1.00 . A A . 19 PRO CB 1 1 9 4439 1 1 19 PRO CD C -0.497 -6.703 1.138 1.00 . A A . 19 PRO CD 1 1 9 4440 1 1 19 PRO CG C 0.997 -6.582 1.016 1.00 . A A . 19 PRO CG 1 1 9 4441 1 1 19 PRO HA H 0.505 -8.523 3.595 1.00 . A A . 19 PRO HA 1 1 9 4442 1 1 19 PRO HB3 H 1.649 -8.529 1.602 1.00 . A A . 19 PRO HB3 1 1 9 4443 1 1 19 PRO HD3 H -0.874 -7.443 0.447 1.00 . A A . 19 PRO HD3 1 1 9 4444 1 1 19 PRO HG3 H 1.315 -6.857 0.022 1.00 . A A . 19 PRO HG3 1 1 9 4445 1 1 19 PRO N N -0.692 -7.139 2.531 1.00 . A A . 19 PRO N 1 1 9 4446 1 1 19 PRO O O 0.434 -5.464 4.401 1.00 . A A . 19 PRO O 1 1 9 4447 1 1 20 PRO C C 3.291 -4.848 5.561 1.00 . A A . 20 PRO C 1 1 9 4448 1 1 20 PRO CA C 2.573 -6.085 6.090 1.00 . A A . 20 PRO CA 1 1 9 4449 1 1 20 PRO CB C 3.560 -7.012 6.804 1.00 . A A . 20 PRO CB 1 1 9 4450 1 1 20 PRO CD C 2.764 -8.198 4.887 1.00 . A A . 20 PRO CD 1 1 9 4451 1 1 20 PRO CG C 3.967 -8.002 5.768 1.00 . A A . 20 PRO CG 1 1 9 4452 1 1 20 PRO HA H 1.799 -5.782 6.780 1.00 . A A . 20 PRO HA 1 1 9 4453 1 1 20 PRO HB3 H 3.070 -7.492 7.638 1.00 . A A . 20 PRO HB3 1 1 9 4454 1 1 20 PRO HD3 H 2.163 -9.021 5.246 1.00 . A A . 20 PRO HD3 1 1 9 4455 1 1 20 PRO HG3 H 4.242 -8.934 6.239 1.00 . A A . 20 PRO HG3 1 1 9 4456 1 1 20 PRO N N 2.037 -6.923 5.013 1.00 . A A . 20 PRO N 1 1 9 4457 1 1 20 PRO O O 4.521 -4.802 5.519 1.00 . A A . 20 PRO O 1 1 9 4458 1 1 21 LEU C C 2.784 -1.438 5.558 1.00 . A A . 21 LEU C 1 1 9 4459 1 1 21 LEU CA C 3.079 -2.610 4.627 1.00 . A A . 21 LEU CA 1 1 9 4460 1 1 21 LEU CB C 2.516 -2.324 3.235 1.00 . A A . 21 LEU CB 1 1 9 4461 1 1 21 LEU CD1 C 4.555 -2.379 1.779 1.00 . A A . 21 LEU CD1 1 1 9 4462 1 1 21 LEU CD2 C 3.390 -4.510 2.374 1.00 . A A . 21 LEU CD2 1 1 9 4463 1 1 21 LEU CG C 3.212 -3.030 2.070 1.00 . A A . 21 LEU CG 1 1 9 4464 1 1 21 LEU H H 1.543 -3.944 5.212 1.00 . A A . 21 LEU H 1 1 9 4465 1 1 21 LEU HA H 4.148 -2.737 4.556 1.00 . A A . 21 LEU HA 1 1 9 4466 1 1 21 LEU HB3 H 2.581 -1.259 3.064 1.00 . A A . 21 LEU HB3 1 1 9 4467 1 1 21 LEU HD11 H 4.654 -2.217 0.717 1.00 . A A . 21 LEU HD11 1 1 9 4468 1 1 21 LEU HD12 H 5.350 -3.025 2.121 1.00 . A A . 21 LEU HD12 1 1 9 4469 1 1 21 LEU HD13 H 4.615 -1.431 2.295 1.00 . A A . 21 LEU HD13 1 1 9 4470 1 1 21 LEU HD21 H 4.270 -4.649 2.984 1.00 . A A . 21 LEU HD21 1 1 9 4471 1 1 21 LEU HD22 H 3.502 -5.055 1.449 1.00 . A A . 21 LEU HD22 1 1 9 4472 1 1 21 LEU HD23 H 2.522 -4.876 2.904 1.00 . A A . 21 LEU HD23 1 1 9 4473 1 1 21 LEU HG H 2.599 -2.941 1.185 1.00 . A A . 21 LEU HG 1 1 9 4474 1 1 21 LEU N N 2.516 -3.848 5.155 1.00 . A A . 21 LEU N 1 1 9 4475 1 1 21 LEU O O 2.194 -1.611 6.625 1.00 . A A . 21 LEU O 1 1 9 4476 1 1 22 LYS C C 2.851 2.187 5.045 1.00 . A A . 22 LYS C 1 1 9 4477 1 1 22 LYS CA C 2.974 0.959 5.940 1.00 . A A . 22 LYS CA 1 1 9 4478 1 1 22 LYS CB C 4.118 1.154 6.938 1.00 . A A . 22 LYS CB 1 1 9 4479 1 1 22 LYS CD C 5.211 0.434 9.081 1.00 . A A . 22 LYS CD 1 1 9 4480 1 1 22 LYS CE C 4.646 0.472 10.493 1.00 . A A . 22 LYS CE 1 1 9 4481 1 1 22 LYS CG C 4.132 0.129 8.057 1.00 . A A . 22 LYS CG 1 1 9 4482 1 1 22 LYS H H 3.661 -0.170 4.286 1.00 . A A . 22 LYS H 1 1 9 4483 1 1 22 LYS HA H 2.051 0.831 6.485 1.00 . A A . 22 LYS HA 1 1 9 4484 1 1 22 LYS HB3 H 4.030 2.137 7.380 1.00 . A A . 22 LYS HB3 1 1 9 4485 1 1 22 LYS HD3 H 5.650 1.396 8.853 1.00 . A A . 22 LYS HD3 1 1 9 4486 1 1 22 LYS HE3 H 4.715 -0.517 10.922 1.00 . A A . 22 LYS HE3 1 1 9 4487 1 1 22 LYS HG3 H 4.316 -0.850 7.635 1.00 . A A . 22 LYS HG3 1 1 9 4488 1 1 22 LYS HZ1 H 4.774 2.233 11.611 1.00 . A A . 22 LYS HZ1 1 1 9 4489 1 1 22 LYS HZ2 H 6.225 1.788 10.863 1.00 . A A . 22 LYS HZ2 1 1 9 4490 1 1 22 LYS HZ3 H 5.692 0.956 12.235 1.00 . A A . 22 LYS HZ3 1 1 9 4491 1 1 22 LYS N N 3.196 -0.244 5.146 1.00 . A A . 22 LYS N 1 1 9 4492 1 1 22 LYS NZ N 5.386 1.429 11.362 1.00 . A A . 22 LYS NZ 1 1 9 4493 1 1 22 LYS O O 3.765 2.509 4.285 1.00 . A A . 22 LYS O 1 1 9 4494 1 1 23 CYS C C 2.234 5.261 4.901 1.00 . A A . 23 CYS C 1 1 9 4495 1 1 23 CYS CA C 1.472 4.065 4.339 1.00 . A A . 23 CYS CA 1 1 9 4496 1 1 23 CYS CB C -0.025 4.376 4.291 1.00 . A A . 23 CYS CB 1 1 9 4497 1 1 23 CYS H H 1.023 2.565 5.764 1.00 . A A . 23 CYS H 1 1 9 4498 1 1 23 CYS HA H 1.823 3.869 3.337 1.00 . A A . 23 CYS HA 1 1 9 4499 1 1 23 CYS HB3 H -0.182 5.263 3.695 1.00 . A A . 23 CYS HB3 1 1 9 4500 1 1 23 CYS N N 1.716 2.871 5.139 1.00 . A A . 23 CYS N 1 1 9 4501 1 1 23 CYS O O 3.046 5.119 5.815 1.00 . A A . 23 CYS O 1 1 9 4502 1 1 23 CYS SG S -1.040 3.042 3.579 1.00 . A A . 23 CYS SG 1 1 9 4503 1 1 24 ASN C C 1.609 8.767 5.048 1.00 . A A . 24 ASN C 1 1 9 4504 1 1 24 ASN CA C 2.627 7.661 4.793 1.00 . A A . 24 ASN CA 1 1 9 4505 1 1 24 ASN CB C 3.647 8.123 3.751 1.00 . A A . 24 ASN CB 1 1 9 4506 1 1 24 ASN CG C 3.110 8.030 2.335 1.00 . A A . 24 ASN CG 1 1 9 4507 1 1 24 ASN H H 1.309 6.489 3.622 1.00 . A A . 24 ASN H 1 1 9 4508 1 1 24 ASN HA H 3.143 7.441 5.715 1.00 . A A . 24 ASN HA 1 1 9 4509 1 1 24 ASN HB3 H 4.531 7.507 3.822 1.00 . A A . 24 ASN HB3 1 1 9 4510 1 1 24 ASN HD21 H 3.223 10.006 2.137 1.00 . A A . 24 ASN HD21 1 1 9 4511 1 1 24 ASN HD22 H 2.629 9.145 0.762 1.00 . A A . 24 ASN HD22 1 1 9 4512 1 1 24 ASN N N 1.967 6.439 4.347 1.00 . A A . 24 ASN N 1 1 9 4513 1 1 24 ASN ND2 N 2.974 9.176 1.678 1.00 . A A . 24 ASN ND2 1 1 9 4514 1 1 24 ASN O O 1.524 9.305 6.154 1.00 . A A . 24 ASN O 1 1 9 4515 1 1 24 ASN OD1 O 2.823 6.941 1.839 1.00 . A A . 24 ASN OD1 1 1 9 4516 1 1 25 LYS C C -0.907 10.339 2.808 1.00 . A A . 25 LYS C 1 1 9 4517 1 1 25 LYS CA C -0.178 10.144 4.133 1.00 . A A . 25 LYS CA 1 1 9 4518 1 1 25 LYS CB C 0.461 11.462 4.575 1.00 . A A . 25 LYS CB 1 1 9 4519 1 1 25 LYS CD C -0.095 13.514 3.235 1.00 . A A . 25 LYS CD 1 1 9 4520 1 1 25 LYS CE C 0.746 14.715 3.639 1.00 . A A . 25 LYS CE 1 1 9 4521 1 1 25 LYS CG C -0.462 12.661 4.439 1.00 . A A . 25 LYS CG 1 1 9 4522 1 1 25 LYS H H 0.952 8.638 3.165 1.00 . A A . 25 LYS H 1 1 9 4523 1 1 25 LYS HA H -0.892 9.832 4.880 1.00 . A A . 25 LYS HA 1 1 9 4524 1 1 25 LYS HB3 H 1.340 11.641 3.973 1.00 . A A . 25 LYS HB3 1 1 9 4525 1 1 25 LYS HD3 H -1.002 13.863 2.763 1.00 . A A . 25 LYS HD3 1 1 9 4526 1 1 25 LYS HE3 H 0.155 15.352 4.282 1.00 . A A . 25 LYS HE3 1 1 9 4527 1 1 25 LYS HG3 H -0.387 13.265 5.332 1.00 . A A . 25 LYS HG3 1 1 9 4528 1 1 25 LYS HZ1 H 2.387 13.457 3.928 1.00 . A A . 25 LYS HZ1 1 1 9 4529 1 1 25 LYS HZ2 H 1.762 14.107 5.359 1.00 . A A . 25 LYS HZ2 1 1 9 4530 1 1 25 LYS HZ3 H 2.686 15.074 4.323 1.00 . A A . 25 LYS HZ3 1 1 9 4531 1 1 25 LYS N N 0.837 9.103 4.021 1.00 . A A . 25 LYS N 1 1 9 4532 1 1 25 LYS NZ N 1.982 14.310 4.364 1.00 . A A . 25 LYS NZ 1 1 9 4533 1 1 25 LYS O O -2.122 10.528 2.779 1.00 . A A . 25 LYS O 1 1 9 4534 1 1 26 ALA C C -1.104 9.110 -0.227 1.00 . A A . 26 ALA C 1 1 9 4535 1 1 26 ALA CA C -0.732 10.457 0.383 1.00 . A A . 26 ALA CA 1 1 9 4536 1 1 26 ALA CB C 0.239 11.199 -0.523 1.00 . A A . 26 ALA CB 1 1 9 4537 1 1 26 ALA H H 0.807 10.135 1.799 1.00 . A A . 26 ALA H 1 1 9 4538 1 1 26 ALA HA H -1.626 11.056 0.480 1.00 . A A . 26 ALA HA 1 1 9 4539 1 1 26 ALA HB1 H -0.317 11.763 -1.259 1.00 . A A . 26 ALA HB1 1 1 9 4540 1 1 26 ALA HB2 H 0.840 11.874 0.069 1.00 . A A . 26 ALA HB2 1 1 9 4541 1 1 26 ALA HB3 H 0.880 10.488 -1.022 1.00 . A A . 26 ALA HB3 1 1 9 4542 1 1 26 ALA N N -0.156 10.289 1.712 1.00 . A A . 26 ALA N 1 1 9 4543 1 1 26 ALA O O -1.292 8.999 -1.439 1.00 . A A . 26 ALA O 1 1 9 4544 1 1 27 GLN C C -0.482 6.198 -0.772 1.00 . A A . 27 GLN C 1 1 9 4545 1 1 27 GLN CA C -1.555 6.750 0.160 1.00 . A A . 27 GLN CA 1 1 9 4546 1 1 27 GLN CB C -2.907 6.768 -0.554 1.00 . A A . 27 GLN CB 1 1 9 4547 1 1 27 GLN CD C -4.215 8.929 -0.592 1.00 . A A . 27 GLN CD 1 1 9 4548 1 1 27 GLN CG C -3.951 7.629 0.140 1.00 . A A . 27 GLN CG 1 1 9 4549 1 1 27 GLN H H -1.044 8.242 1.572 1.00 . A A . 27 GLN H 1 1 9 4550 1 1 27 GLN HA H -1.624 6.111 1.027 1.00 . A A . 27 GLN HA 1 1 9 4551 1 1 27 GLN HB3 H -3.285 5.758 -0.610 1.00 . A A . 27 GLN HB3 1 1 9 4552 1 1 27 GLN HE21 H -3.861 9.963 1.070 1.00 . A A . 27 GLN HE21 1 1 9 4553 1 1 27 GLN HE22 H -4.270 10.898 -0.325 1.00 . A A . 27 GLN HE22 1 1 9 4554 1 1 27 GLN HG3 H -3.605 7.856 1.137 1.00 . A A . 27 GLN HG3 1 1 9 4555 1 1 27 GLN N N -1.207 8.090 0.618 1.00 . A A . 27 GLN N 1 1 9 4556 1 1 27 GLN NE2 N -4.105 10.042 0.123 1.00 . A A . 27 GLN NE2 1 1 9 4557 1 1 27 GLN O O -0.560 6.362 -1.990 1.00 . A A . 27 GLN O 1 1 9 4558 1 1 27 GLN OE1 O -4.516 8.933 -1.785 1.00 . A A . 27 GLN OE1 1 1 9 4559 1 1 28 ILE C C 1.933 3.554 -0.500 1.00 . A A . 28 ILE C 1 1 9 4560 1 1 28 ILE CA C 1.607 4.968 -0.972 1.00 . A A . 28 ILE CA 1 1 9 4561 1 1 28 ILE CB C 2.881 5.830 -0.885 1.00 . A A . 28 ILE CB 1 1 9 4562 1 1 28 ILE CD1 C 1.955 7.693 -2.352 1.00 . A A . 28 ILE CD1 1 1 9 4563 1 1 28 ILE CG1 C 2.526 7.314 -1.003 1.00 . A A . 28 ILE CG1 1 1 9 4564 1 1 28 ILE CG2 C 3.868 5.428 -1.971 1.00 . A A . 28 ILE CG2 1 1 9 4565 1 1 28 ILE H H 0.525 5.447 0.783 1.00 . A A . 28 ILE H 1 1 9 4566 1 1 28 ILE HA H 1.293 4.928 -2.004 1.00 . A A . 28 ILE HA 1 1 9 4567 1 1 28 ILE HB H 3.344 5.653 0.073 1.00 . A A . 28 ILE HB 1 1 9 4568 1 1 28 ILE HD11 H 1.109 8.351 -2.212 1.00 . A A . 28 ILE HD11 1 1 9 4569 1 1 28 ILE HD12 H 2.710 8.200 -2.934 1.00 . A A . 28 ILE HD12 1 1 9 4570 1 1 28 ILE HD13 H 1.635 6.803 -2.872 1.00 . A A . 28 ILE HD13 1 1 9 4571 1 1 28 ILE HG13 H 3.417 7.903 -0.842 1.00 . A A . 28 ILE HG13 1 1 9 4572 1 1 28 ILE HG21 H 3.373 5.442 -2.931 1.00 . A A . 28 ILE HG21 1 1 9 4573 1 1 28 ILE HG22 H 4.693 6.124 -1.982 1.00 . A A . 28 ILE HG22 1 1 9 4574 1 1 28 ILE HG23 H 4.236 4.433 -1.772 1.00 . A A . 28 ILE HG23 1 1 9 4575 1 1 28 ILE N N 0.519 5.544 -0.192 1.00 . A A . 28 ILE N 1 1 9 4576 1 1 28 ILE O O 2.142 2.650 -1.310 1.00 . A A . 28 ILE O 1 1 9 4577 1 1 29 CYS C C 3.712 1.661 1.114 1.00 . A A . 29 CYS C 1 1 9 4578 1 1 29 CYS CA C 2.269 2.065 1.396 1.00 . A A . 29 CYS CA 1 1 9 4579 1 1 29 CYS CB C 1.313 1.007 0.842 1.00 . A A . 29 CYS CB 1 1 9 4580 1 1 29 CYS H H 1.794 4.129 1.410 1.00 . A A . 29 CYS H 1 1 9 4581 1 1 29 CYS HA H 2.131 2.139 2.464 1.00 . A A . 29 CYS HA 1 1 9 4582 1 1 29 CYS HB3 H 1.880 0.276 0.286 1.00 . A A . 29 CYS HB3 1 1 9 4583 1 1 29 CYS N N 1.971 3.368 0.815 1.00 . A A . 29 CYS N 1 1 9 4584 1 1 29 CYS O O 4.168 1.703 -0.029 1.00 . A A . 29 CYS O 1 1 9 4585 1 1 29 CYS SG S 0.366 0.119 2.120 1.00 . A A . 29 CYS SG 1 1 9 4586 1 1 30 VAL C C 6.299 0.127 3.279 1.00 . A A . 30 VAL C 1 1 9 4587 1 1 30 VAL CA C 5.818 0.854 2.028 1.00 . A A . 30 VAL CA 1 1 9 4588 1 1 30 VAL CB C 6.739 2.060 1.762 1.00 . A A . 30 VAL CB 1 1 9 4589 1 1 30 VAL CG1 C 7.000 2.214 0.272 1.00 . A A . 30 VAL CG1 1 1 9 4590 1 1 30 VAL CG2 C 6.134 3.330 2.341 1.00 . A A . 30 VAL CG2 1 1 9 4591 1 1 30 VAL H H 4.009 1.255 3.049 1.00 . A A . 30 VAL H 1 1 9 4592 1 1 30 VAL HA H 5.887 0.182 1.185 1.00 . A A . 30 VAL HA 1 1 9 4593 1 1 30 VAL HB H 7.685 1.881 2.253 1.00 . A A . 30 VAL HB 1 1 9 4594 1 1 30 VAL HG11 H 7.023 1.239 -0.192 1.00 . A A . 30 VAL HG11 1 1 9 4595 1 1 30 VAL HG12 H 6.213 2.806 -0.172 1.00 . A A . 30 VAL HG12 1 1 9 4596 1 1 30 VAL HG13 H 7.949 2.706 0.122 1.00 . A A . 30 VAL HG13 1 1 9 4597 1 1 30 VAL HG21 H 5.810 3.145 3.354 1.00 . A A . 30 VAL HG21 1 1 9 4598 1 1 30 VAL HG22 H 6.876 4.115 2.337 1.00 . A A . 30 VAL HG22 1 1 9 4599 1 1 30 VAL HG23 H 5.288 3.631 1.741 1.00 . A A . 30 VAL HG23 1 1 9 4600 1 1 30 VAL N N 4.427 1.268 2.163 1.00 . A A . 30 VAL N 1 1 9 4601 1 1 30 VAL O O 5.564 0.004 4.260 1.00 . A A . 30 VAL O 1 1 9 4602 1 1 31 ASP C C 9.528 -1.548 4.044 1.00 . A A . 31 ASP C 1 1 9 4603 1 1 31 ASP CA C 8.119 -1.064 4.371 1.00 . A A . 31 ASP CA 1 1 9 4604 1 1 31 ASP CB C 7.237 -2.251 4.761 1.00 . A A . 31 ASP CB 1 1 9 4605 1 1 31 ASP CG C 6.574 -2.061 6.111 1.00 . A A . 31 ASP CG 1 1 9 4606 1 1 31 ASP H H 8.076 -0.220 2.430 1.00 . A A . 31 ASP H 1 1 9 4607 1 1 31 ASP HA H 8.171 -0.378 5.204 1.00 . A A . 31 ASP HA 1 1 9 4608 1 1 31 ASP HB3 H 7.842 -3.144 4.799 1.00 . A A . 31 ASP HB3 1 1 9 4609 1 1 31 ASP N N 7.538 -0.351 3.240 1.00 . A A . 31 ASP N 1 1 9 4610 1 1 31 ASP O O 9.916 -1.664 2.882 1.00 . A A . 31 ASP O 1 1 9 4611 1 1 31 ASP OD1 O 6.402 -0.898 6.529 1.00 . A A . 31 ASP OD1 1 1 9 4612 1 1 31 ASP OD2 O 6.228 -3.077 6.751 1.00 . A A . 31 ASP OD2 1 1 9 4613 1 1 32 PRO C C 11.759 -3.726 4.376 1.00 . A A . 32 PRO C 1 1 9 4614 1 1 32 PRO CA C 11.692 -2.311 4.941 1.00 . A A . 32 PRO CA 1 1 9 4615 1 1 32 PRO CB C 12.237 -2.281 6.371 1.00 . A A . 32 PRO CB 1 1 9 4616 1 1 32 PRO CD C 9.917 -1.722 6.505 1.00 . A A . 32 PRO CD 1 1 9 4617 1 1 32 PRO CG C 11.033 -2.413 7.239 1.00 . A A . 32 PRO CG 1 1 9 4618 1 1 32 PRO HA H 12.274 -1.648 4.317 1.00 . A A . 32 PRO HA 1 1 9 4619 1 1 32 PRO HB3 H 12.747 -1.345 6.545 1.00 . A A . 32 PRO HB3 1 1 9 4620 1 1 32 PRO HD3 H 9.854 -0.685 6.804 1.00 . A A . 32 PRO HD3 1 1 9 4621 1 1 32 PRO HG3 H 11.211 -1.932 8.189 1.00 . A A . 32 PRO HG3 1 1 9 4622 1 1 32 PRO N N 10.313 -1.836 5.092 1.00 . A A . 32 PRO N 1 1 9 4623 1 1 32 PRO O O 12.787 -4.145 3.843 1.00 . A A . 32 PRO O 1 1 9 4624 1 1 33 LYS C C 10.596 -5.850 2.472 1.00 . A A . 33 LYS C 1 1 9 4625 1 1 33 LYS CA C 10.589 -5.827 3.997 1.00 . A A . 33 LYS CA 1 1 9 4626 1 1 33 LYS CB C 9.330 -6.522 4.522 1.00 . A A . 33 LYS CB 1 1 9 4627 1 1 33 LYS CD C 9.101 -7.531 6.811 1.00 . A A . 33 LYS CD 1 1 9 4628 1 1 33 LYS CE C 9.933 -8.301 7.824 1.00 . A A . 33 LYS CE 1 1 9 4629 1 1 33 LYS CG C 9.621 -7.729 5.397 1.00 . A A . 33 LYS CG 1 1 9 4630 1 1 33 LYS H H 9.869 -4.069 4.932 1.00 . A A . 33 LYS H 1 1 9 4631 1 1 33 LYS HA H 11.458 -6.356 4.357 1.00 . A A . 33 LYS HA 1 1 9 4632 1 1 33 LYS HB3 H 8.736 -6.848 3.680 1.00 . A A . 33 LYS HB3 1 1 9 4633 1 1 33 LYS HD3 H 8.078 -7.878 6.860 1.00 . A A . 33 LYS HD3 1 1 9 4634 1 1 33 LYS HE3 H 10.294 -9.207 7.360 1.00 . A A . 33 LYS HE3 1 1 9 4635 1 1 33 LYS HG3 H 10.690 -7.884 5.435 1.00 . A A . 33 LYS HG3 1 1 9 4636 1 1 33 LYS HZ1 H 11.985 -7.986 8.057 1.00 . A A . 33 LYS HZ1 1 1 9 4637 1 1 33 LYS HZ2 H 11.051 -7.396 9.339 1.00 . A A . 33 LYS HZ2 1 1 9 4638 1 1 33 LYS HZ3 H 11.091 -6.563 7.868 1.00 . A A . 33 LYS HZ3 1 1 9 4639 1 1 33 LYS N N 10.656 -4.459 4.497 1.00 . A A . 33 LYS N 1 1 9 4640 1 1 33 LYS NZ N 11.097 -7.507 8.305 1.00 . A A . 33 LYS NZ 1 1 9 4641 1 1 33 LYS O O 11.340 -6.613 1.855 1.00 . A A . 33 LYS O 1 1 9 4642 1 1 34 LYS C C 9.120 -3.579 -0.024 1.00 . A A . 34 LYS C 1 1 9 4643 1 1 34 LYS CA C 9.676 -4.930 0.415 1.00 . A A . 34 LYS CA 1 1 9 4644 1 1 34 LYS CB C 8.792 -6.057 -0.125 1.00 . A A . 34 LYS CB 1 1 9 4645 1 1 34 LYS CD C 9.952 -8.160 -0.862 1.00 . A A . 34 LYS CD 1 1 9 4646 1 1 34 LYS CE C 9.804 -9.196 -1.965 1.00 . A A . 34 LYS CE 1 1 9 4647 1 1 34 LYS CG C 9.408 -6.807 -1.293 1.00 . A A . 34 LYS CG 1 1 9 4648 1 1 34 LYS H H 9.195 -4.425 2.413 1.00 . A A . 34 LYS H 1 1 9 4649 1 1 34 LYS HA H 10.672 -5.043 0.015 1.00 . A A . 34 LYS HA 1 1 9 4650 1 1 34 LYS HB3 H 7.852 -5.635 -0.451 1.00 . A A . 34 LYS HB3 1 1 9 4651 1 1 34 LYS HD3 H 9.408 -8.494 0.011 1.00 . A A . 34 LYS HD3 1 1 9 4652 1 1 34 LYS HE3 H 9.882 -8.699 -2.921 1.00 . A A . 34 LYS HE3 1 1 9 4653 1 1 34 LYS HG3 H 10.217 -6.217 -1.701 1.00 . A A . 34 LYS HG3 1 1 9 4654 1 1 34 LYS HZ1 H 11.039 -10.647 -2.822 1.00 . A A . 34 LYS HZ1 1 1 9 4655 1 1 34 LYS HZ2 H 10.539 -11.016 -1.249 1.00 . A A . 34 LYS HZ2 1 1 9 4656 1 1 34 LYS HZ3 H 11.734 -9.847 -1.503 1.00 . A A . 34 LYS HZ3 1 1 9 4657 1 1 34 LYS N N 9.763 -5.008 1.867 1.00 . A A . 34 LYS N 1 1 9 4658 1 1 34 LYS NZ N 10.853 -10.250 -1.879 1.00 . A A . 34 LYS NZ 1 1 9 4659 1 1 34 LYS O O 7.916 -3.338 0.049 1.00 . A A . 34 LYS O 1 1 9 4660 1 1 35 GLY C C 10.755 -0.500 -1.311 1.00 . A A . 35 GLY C 1 1 9 4661 1 1 35 GLY CA C 9.585 -1.385 -0.927 1.00 . A A . 35 GLY CA 1 1 9 4662 1 1 35 GLY H H 10.954 -2.946 -0.518 1.00 . A A . 35 GLY H 1 1 9 4663 1 1 35 GLY HA2 H 8.936 -1.497 -1.783 1.00 . A A . 35 GLY HA2 1 1 9 4664 1 1 35 GLY HA3 H 9.034 -0.906 -0.131 1.00 . A A . 35 GLY HA3 1 1 9 4665 1 1 35 GLY N N 10.006 -2.700 -0.483 1.00 . A A . 35 GLY N 1 1 9 4666 1 1 35 GLY O O 11.754 -0.979 -1.846 1.00 . A A . 35 GLY O 1 1 9 4667 1 1 36 TRP C C 12.947 1.454 -0.561 1.00 . A A . 36 TRP C 1 1 9 4668 1 1 36 TRP CA C 11.684 1.748 -1.363 1.00 . A A . 36 TRP CA 1 1 9 4669 1 1 36 TRP CB C 11.211 3.177 -1.086 1.00 . A A . 36 TRP CB 1 1 9 4670 1 1 36 TRP CD1 C 12.807 4.271 -2.765 1.00 . A A . 36 TRP CD1 1 1 9 4671 1 1 36 TRP CD2 C 10.738 5.127 -2.770 1.00 . A A . 36 TRP CD2 1 1 9 4672 1 1 36 TRP CE2 C 11.509 5.812 -3.729 1.00 . A A . 36 TRP CE2 1 1 9 4673 1 1 36 TRP CE3 C 9.400 5.494 -2.595 1.00 . A A . 36 TRP CE3 1 1 9 4674 1 1 36 TRP CG C 11.586 4.146 -2.165 1.00 . A A . 36 TRP CG 1 1 9 4675 1 1 36 TRP CH2 C 9.674 7.178 -4.317 1.00 . A A . 36 TRP CH2 1 1 9 4676 1 1 36 TRP CZ2 C 10.986 6.840 -4.509 1.00 . A A . 36 TRP CZ2 1 1 9 4677 1 1 36 TRP CZ3 C 8.883 6.514 -3.369 1.00 . A A . 36 TRP CZ3 1 1 9 4678 1 1 36 TRP H H 9.807 1.117 -0.613 1.00 . A A . 36 TRP H 1 1 9 4679 1 1 36 TRP HA H 11.908 1.650 -2.415 1.00 . A A . 36 TRP HA 1 1 9 4680 1 1 36 TRP HB3 H 11.649 3.520 -0.160 1.00 . A A . 36 TRP HB3 1 1 9 4681 1 1 36 TRP HD1 H 13.668 3.667 -2.524 1.00 . A A . 36 TRP HD1 1 1 9 4682 1 1 36 TRP HE1 H 13.519 5.552 -4.271 1.00 . A A . 36 TRP HE1 1 1 9 4683 1 1 36 TRP HE3 H 8.774 4.994 -1.870 1.00 . A A . 36 TRP HE3 1 1 9 4684 1 1 36 TRP HH2 H 9.228 7.969 -4.899 1.00 . A A . 36 TRP HH2 1 1 9 4685 1 1 36 TRP HZ2 H 11.583 7.360 -5.244 1.00 . A A . 36 TRP HZ2 1 1 9 4686 1 1 36 TRP HZ3 H 7.852 6.811 -3.248 1.00 . A A . 36 TRP HZ3 1 1 9 4687 1 1 36 TRP N N 10.629 0.794 -1.040 1.00 . A A . 36 TRP N 1 1 9 4688 1 1 36 TRP NE1 N 12.767 5.272 -3.706 1.00 . A A . 36 TRP NE1 1 1 9 4689 1 1 36 TRP O O 12.985 1.656 0.653 1.00 . A A . 36 TRP O 1 1 10 4690 1 1 1 ASP C C -12.874 -5.187 -5.141 1.00 . A A . 1 ASP C 1 1 10 4691 1 1 1 ASP CA C -13.721 -6.434 -4.905 1.00 . A A . 1 ASP CA 1 1 10 4692 1 1 1 ASP CB C -14.748 -6.589 -6.028 1.00 . A A . 1 ASP CB 1 1 10 4693 1 1 1 ASP CG C -15.142 -8.035 -6.258 1.00 . A A . 1 ASP CG 1 1 10 4694 1 1 1 ASP H1 H -14.172 -5.640 -2.995 1.00 . A A . 1 ASP H1 1 1 10 4695 1 1 1 ASP HA H -13.073 -7.298 -4.901 1.00 . A A . 1 ASP HA 1 1 10 4696 1 1 1 ASP HB3 H -14.331 -6.197 -6.945 1.00 . A A . 1 ASP HB3 1 1 10 4697 1 1 1 ASP N N -14.390 -6.370 -3.612 1.00 . A A . 1 ASP N 1 1 10 4698 1 1 1 ASP O O -13.333 -4.218 -5.746 1.00 . A A . 1 ASP O 1 1 10 4699 1 1 1 ASP OD1 O -15.620 -8.678 -5.301 1.00 . A A . 1 ASP OD1 1 1 10 4700 1 1 1 ASP OD2 O -14.969 -8.523 -7.394 1.00 . A A . 1 ASP OD2 1 1 10 4701 1 1 2 PHE C C -9.461 -4.511 -5.556 1.00 . A A . 2 PHE C 1 1 10 4702 1 1 2 PHE CA C -10.726 -4.090 -4.815 1.00 . A A . 2 PHE CA 1 1 10 4703 1 1 2 PHE CB C -10.361 -3.509 -3.448 1.00 . A A . 2 PHE CB 1 1 10 4704 1 1 2 PHE CD1 C -8.866 -5.251 -2.434 1.00 . A A . 2 PHE CD1 1 1 10 4705 1 1 2 PHE CD2 C -10.983 -4.843 -1.415 1.00 . A A . 2 PHE CD2 1 1 10 4706 1 1 2 PHE CE1 C -8.589 -6.215 -1.482 1.00 . A A . 2 PHE CE1 1 1 10 4707 1 1 2 PHE CE2 C -10.711 -5.805 -0.460 1.00 . A A . 2 PHE CE2 1 1 10 4708 1 1 2 PHE CG C -10.064 -4.555 -2.411 1.00 . A A . 2 PHE CG 1 1 10 4709 1 1 2 PHE CZ C -9.514 -6.493 -0.495 1.00 . A A . 2 PHE CZ 1 1 10 4710 1 1 2 PHE H H -11.328 -6.020 -4.185 1.00 . A A . 2 PHE H 1 1 10 4711 1 1 2 PHE HA H -11.234 -3.334 -5.394 1.00 . A A . 2 PHE HA 1 1 10 4712 1 1 2 PHE HB3 H -11.182 -2.909 -3.088 1.00 . A A . 2 PHE HB3 1 1 10 4713 1 1 2 PHE HD1 H -8.141 -5.035 -3.207 1.00 . A A . 2 PHE HD1 1 1 10 4714 1 1 2 PHE HD2 H -11.920 -4.307 -1.387 1.00 . A A . 2 PHE HD2 1 1 10 4715 1 1 2 PHE HE1 H -7.652 -6.751 -1.512 1.00 . A A . 2 PHE HE1 1 1 10 4716 1 1 2 PHE HE2 H -11.436 -6.021 0.311 1.00 . A A . 2 PHE HE2 1 1 10 4717 1 1 2 PHE HZ H -9.300 -7.245 0.250 1.00 . A A . 2 PHE HZ 1 1 10 4718 1 1 2 PHE N N -11.637 -5.218 -4.658 1.00 . A A . 2 PHE N 1 1 10 4719 1 1 2 PHE O O -9.091 -5.685 -5.587 1.00 . A A . 2 PHE O 1 1 10 4720 1 1 3 PRO C C -6.379 -4.151 -6.014 1.00 . A A . 3 PRO C 1 1 10 4721 1 1 3 PRO CA C -7.546 -3.773 -6.921 1.00 . A A . 3 PRO CA 1 1 10 4722 1 1 3 PRO CB C -7.278 -2.431 -7.606 1.00 . A A . 3 PRO CB 1 1 10 4723 1 1 3 PRO CD C -9.163 -2.108 -6.172 1.00 . A A . 3 PRO CD 1 1 10 4724 1 1 3 PRO CG C -7.952 -1.424 -6.741 1.00 . A A . 3 PRO CG 1 1 10 4725 1 1 3 PRO HA H -7.682 -4.541 -7.669 1.00 . A A . 3 PRO HA 1 1 10 4726 1 1 3 PRO HB3 H -7.698 -2.441 -8.600 1.00 . A A . 3 PRO HB3 1 1 10 4727 1 1 3 PRO HD3 H -10.023 -1.944 -6.805 1.00 . A A . 3 PRO HD3 1 1 10 4728 1 1 3 PRO HG3 H -8.248 -0.570 -7.334 1.00 . A A . 3 PRO HG3 1 1 10 4729 1 1 3 PRO N N -8.781 -3.530 -6.168 1.00 . A A . 3 PRO N 1 1 10 4730 1 1 3 PRO O O -5.643 -5.098 -6.294 1.00 . A A . 3 PRO O 1 1 10 4731 1 1 4 LEU C C -3.777 -3.560 -4.660 1.00 . A A . 4 LEU C 1 1 10 4732 1 1 4 LEU CA C -5.138 -3.662 -3.978 1.00 . A A . 4 LEU CA 1 1 10 4733 1 1 4 LEU CB C -5.304 -5.046 -3.350 1.00 . A A . 4 LEU CB 1 1 10 4734 1 1 4 LEU CD1 C -4.425 -6.037 -1.221 1.00 . A A . 4 LEU CD1 1 1 10 4735 1 1 4 LEU CD2 C -3.499 -6.785 -3.421 1.00 . A A . 4 LEU CD2 1 1 10 4736 1 1 4 LEU CG C -4.074 -5.612 -2.639 1.00 . A A . 4 LEU CG 1 1 10 4737 1 1 4 LEU H H -6.834 -2.665 -4.757 1.00 . A A . 4 LEU H 1 1 10 4738 1 1 4 LEU HA H -5.195 -2.914 -3.202 1.00 . A A . 4 LEU HA 1 1 10 4739 1 1 4 LEU HB3 H -5.579 -5.735 -4.136 1.00 . A A . 4 LEU HB3 1 1 10 4740 1 1 4 LEU HD11 H -4.653 -7.092 -1.207 1.00 . A A . 4 LEU HD11 1 1 10 4741 1 1 4 LEU HD12 H -5.285 -5.478 -0.881 1.00 . A A . 4 LEU HD12 1 1 10 4742 1 1 4 LEU HD13 H -3.587 -5.839 -0.569 1.00 . A A . 4 LEU HD13 1 1 10 4743 1 1 4 LEU HD21 H -2.768 -6.422 -4.128 1.00 . A A . 4 LEU HD21 1 1 10 4744 1 1 4 LEU HD22 H -4.294 -7.288 -3.951 1.00 . A A . 4 LEU HD22 1 1 10 4745 1 1 4 LEU HD23 H -3.028 -7.477 -2.738 1.00 . A A . 4 LEU HD23 1 1 10 4746 1 1 4 LEU HG H -3.315 -4.845 -2.579 1.00 . A A . 4 LEU HG 1 1 10 4747 1 1 4 LEU N N -6.216 -3.405 -4.927 1.00 . A A . 4 LEU N 1 1 10 4748 1 1 4 LEU O O -3.362 -4.469 -5.378 1.00 . A A . 4 LEU O 1 1 10 4749 1 1 5 SER C C -0.664 -2.641 -4.056 1.00 . A A . 5 SER C 1 1 10 4750 1 1 5 SER CA C -1.773 -2.227 -5.020 1.00 . A A . 5 SER CA 1 1 10 4751 1 1 5 SER CB C -1.605 -0.756 -5.405 1.00 . A A . 5 SER CB 1 1 10 4752 1 1 5 SER H H -3.471 -1.760 -3.845 1.00 . A A . 5 SER H 1 1 10 4753 1 1 5 SER HA H -1.704 -2.833 -5.910 1.00 . A A . 5 SER HA 1 1 10 4754 1 1 5 SER HB3 H -0.622 -0.607 -5.828 1.00 . A A . 5 SER HB3 1 1 10 4755 1 1 5 SER HG H -3.405 -0.174 -5.912 1.00 . A A . 5 SER HG 1 1 10 4756 1 1 5 SER N N -3.086 -2.448 -4.427 1.00 . A A . 5 SER N 1 1 10 4757 1 1 5 SER O O -0.744 -2.386 -2.854 1.00 . A A . 5 SER O 1 1 10 4758 1 1 5 SER OG O -2.577 -0.363 -6.358 1.00 . A A . 5 SER OG 1 1 10 4759 1 1 6 LYS C C 2.616 -2.699 -3.789 1.00 . A A . 6 LYS C 1 1 10 4760 1 1 6 LYS CA C 1.494 -3.732 -3.783 1.00 . A A . 6 LYS CA 1 1 10 4761 1 1 6 LYS CB C 2.017 -5.073 -4.301 1.00 . A A . 6 LYS CB 1 1 10 4762 1 1 6 LYS CD C 1.703 -6.151 -6.548 1.00 . A A . 6 LYS CD 1 1 10 4763 1 1 6 LYS CE C 0.530 -5.609 -7.349 1.00 . A A . 6 LYS CE 1 1 10 4764 1 1 6 LYS CG C 2.403 -5.049 -5.770 1.00 . A A . 6 LYS CG 1 1 10 4765 1 1 6 LYS H H 0.373 -3.456 -5.558 1.00 . A A . 6 LYS H 1 1 10 4766 1 1 6 LYS HA H 1.144 -3.860 -2.770 1.00 . A A . 6 LYS HA 1 1 10 4767 1 1 6 LYS HB3 H 1.251 -5.823 -4.164 1.00 . A A . 6 LYS HB3 1 1 10 4768 1 1 6 LYS HD3 H 1.342 -6.896 -5.854 1.00 . A A . 6 LYS HD3 1 1 10 4769 1 1 6 LYS HE3 H 0.757 -4.599 -7.658 1.00 . A A . 6 LYS HE3 1 1 10 4770 1 1 6 LYS HG3 H 3.472 -5.183 -5.855 1.00 . A A . 6 LYS HG3 1 1 10 4771 1 1 6 LYS HZ1 H -0.032 -5.826 -9.349 1.00 . A A . 6 LYS HZ1 1 1 10 4772 1 1 6 LYS HZ2 H -0.514 -7.110 -8.359 1.00 . A A . 6 LYS HZ2 1 1 10 4773 1 1 6 LYS HZ3 H 1.104 -6.965 -8.829 1.00 . A A . 6 LYS HZ3 1 1 10 4774 1 1 6 LYS N N 0.368 -3.283 -4.592 1.00 . A A . 6 LYS N 1 1 10 4775 1 1 6 LYS NZ N 0.253 -6.435 -8.557 1.00 . A A . 6 LYS NZ 1 1 10 4776 1 1 6 LYS O O 2.775 -1.950 -4.752 1.00 . A A . 6 LYS O 1 1 10 4777 1 1 7 GLU C C 4.024 -0.296 -2.827 1.00 . A A . 7 GLU C 1 1 10 4778 1 1 7 GLU CA C 4.499 -1.727 -2.593 1.00 . A A . 7 GLU CA 1 1 10 4779 1 1 7 GLU CB C 5.603 -2.079 -3.591 1.00 . A A . 7 GLU CB 1 1 10 4780 1 1 7 GLU CD C 8.048 -2.598 -3.960 1.00 . A A . 7 GLU CD 1 1 10 4781 1 1 7 GLU CG C 6.972 -2.248 -2.952 1.00 . A A . 7 GLU CG 1 1 10 4782 1 1 7 GLU H H 3.215 -3.292 -1.975 1.00 . A A . 7 GLU H 1 1 10 4783 1 1 7 GLU HA H 4.895 -1.803 -1.591 1.00 . A A . 7 GLU HA 1 1 10 4784 1 1 7 GLU HB3 H 5.670 -1.292 -4.329 1.00 . A A . 7 GLU HB3 1 1 10 4785 1 1 7 GLU HG3 H 6.916 -3.037 -2.217 1.00 . A A . 7 GLU HG3 1 1 10 4786 1 1 7 GLU N N 3.392 -2.668 -2.709 1.00 . A A . 7 GLU N 1 1 10 4787 1 1 7 GLU O O 2.824 -0.031 -2.886 1.00 . A A . 7 GLU O 1 1 10 4788 1 1 7 GLU OE1 O 7.996 -3.713 -4.519 1.00 . A A . 7 GLU OE1 1 1 10 4789 1 1 7 GLU OE2 O 8.943 -1.758 -4.190 1.00 . A A . 7 GLU OE2 1 1 10 4790 1 1 8 TYR C C 3.678 2.185 -4.343 1.00 . A A . 8 TYR C 1 1 10 4791 1 1 8 TYR CA C 4.655 2.027 -3.182 1.00 . A A . 8 TYR CA 1 1 10 4792 1 1 8 TYR CB C 5.930 2.825 -3.461 1.00 . A A . 8 TYR CB 1 1 10 4793 1 1 8 TYR CD1 C 7.525 1.261 -4.639 1.00 . A A . 8 TYR CD1 1 1 10 4794 1 1 8 TYR CD2 C 6.534 3.021 -5.905 1.00 . A A . 8 TYR CD2 1 1 10 4795 1 1 8 TYR CE1 C 8.210 0.834 -5.760 1.00 . A A . 8 TYR CE1 1 1 10 4796 1 1 8 TYR CE2 C 7.214 2.599 -7.032 1.00 . A A . 8 TYR CE2 1 1 10 4797 1 1 8 TYR CG C 6.677 2.361 -4.692 1.00 . A A . 8 TYR CG 1 1 10 4798 1 1 8 TYR CZ C 8.051 1.506 -6.955 1.00 . A A . 8 TYR CZ 1 1 10 4799 1 1 8 TYR H H 5.914 0.351 -2.902 1.00 . A A . 8 TYR H 1 1 10 4800 1 1 8 TYR HA H 4.193 2.410 -2.284 1.00 . A A . 8 TYR HA 1 1 10 4801 1 1 8 TYR HB3 H 6.595 2.735 -2.616 1.00 . A A . 8 TYR HB3 1 1 10 4802 1 1 8 TYR HD1 H 7.648 0.737 -3.703 1.00 . A A . 8 TYR HD1 1 1 10 4803 1 1 8 TYR HD2 H 5.879 3.878 -5.963 1.00 . A A . 8 TYR HD2 1 1 10 4804 1 1 8 TYR HE1 H 8.866 -0.023 -5.700 1.00 . A A . 8 TYR HE1 1 1 10 4805 1 1 8 TYR HE2 H 7.091 3.126 -7.967 1.00 . A A . 8 TYR HE2 1 1 10 4806 1 1 8 TYR HH H 9.655 1.332 -7.999 1.00 . A A . 8 TYR HH 1 1 10 4807 1 1 8 TYR N N 4.975 0.623 -2.958 1.00 . A A . 8 TYR N 1 1 10 4808 1 1 8 TYR O O 3.963 1.775 -5.468 1.00 . A A . 8 TYR O 1 1 10 4809 1 1 8 TYR OH O 8.731 1.085 -8.073 1.00 . A A . 8 TYR OH 1 1 10 4810 1 1 9 GLU C C 0.332 3.795 -4.521 1.00 . A A . 9 GLU C 1 1 10 4811 1 1 9 GLU CA C 1.506 2.996 -5.082 1.00 . A A . 9 GLU CA 1 1 10 4812 1 1 9 GLU CB C 1.009 1.654 -5.626 1.00 . A A . 9 GLU CB 1 1 10 4813 1 1 9 GLU CD C 0.065 0.773 -7.796 1.00 . A A . 9 GLU CD 1 1 10 4814 1 1 9 GLU CG C -0.077 1.788 -6.680 1.00 . A A . 9 GLU CG 1 1 10 4815 1 1 9 GLU H H 2.356 3.089 -3.146 1.00 . A A . 9 GLU H 1 1 10 4816 1 1 9 GLU HA H 1.955 3.557 -5.888 1.00 . A A . 9 GLU HA 1 1 10 4817 1 1 9 GLU HB3 H 0.616 1.071 -4.807 1.00 . A A . 9 GLU HB3 1 1 10 4818 1 1 9 GLU HG3 H -0.027 2.780 -7.106 1.00 . A A . 9 GLU HG3 1 1 10 4819 1 1 9 GLU N N 2.525 2.784 -4.062 1.00 . A A . 9 GLU N 1 1 10 4820 1 1 9 GLU O O 0.176 4.980 -4.816 1.00 . A A . 9 GLU O 1 1 10 4821 1 1 9 GLU OE1 O 1.215 0.462 -8.171 1.00 . A A . 9 GLU OE1 1 1 10 4822 1 1 9 GLU OE2 O -0.973 0.291 -8.296 1.00 . A A . 9 GLU OE2 1 1 10 4823 1 1 10 THR C C -2.390 2.830 -2.179 1.00 . A A . 10 THR C 1 1 10 4824 1 1 10 THR CA C -1.652 3.783 -3.111 1.00 . A A . 10 THR CA 1 1 10 4825 1 1 10 THR CB C -2.630 4.292 -4.187 1.00 . A A . 10 THR CB 1 1 10 4826 1 1 10 THR CG2 C -2.564 5.808 -4.304 1.00 . A A . 10 THR CG2 1 1 10 4827 1 1 10 THR H H -0.314 2.193 -3.516 1.00 . A A . 10 THR H 1 1 10 4828 1 1 10 THR HA H -1.302 4.631 -2.541 1.00 . A A . 10 THR HA 1 1 10 4829 1 1 10 THR HB H -3.634 4.012 -3.900 1.00 . A A . 10 THR HB 1 1 10 4830 1 1 10 THR HG1 H -2.778 2.856 -5.530 1.00 . A A . 10 THR HG1 1 1 10 4831 1 1 10 THR HG21 H -3.469 6.239 -3.904 1.00 . A A . 10 THR HG21 1 1 10 4832 1 1 10 THR HG22 H -2.462 6.085 -5.343 1.00 . A A . 10 THR HG22 1 1 10 4833 1 1 10 THR HG23 H -1.714 6.175 -3.749 1.00 . A A . 10 THR HG23 1 1 10 4834 1 1 10 THR N N -0.492 3.136 -3.713 1.00 . A A . 10 THR N 1 1 10 4835 1 1 10 THR O O -2.621 1.668 -2.517 1.00 . A A . 10 THR O 1 1 10 4836 1 1 10 THR OG1 O -2.321 3.697 -5.452 1.00 . A A . 10 THR OG1 1 1 10 4837 1 1 11 CYS C C -4.705 3.260 0.497 1.00 . A A . 11 CYS C 1 1 10 4838 1 1 11 CYS CA C -3.474 2.522 -0.021 1.00 . A A . 11 CYS CA 1 1 10 4839 1 1 11 CYS CB C -2.550 2.166 1.145 1.00 . A A . 11 CYS CB 1 1 10 4840 1 1 11 CYS H H -2.549 4.262 -0.792 1.00 . A A . 11 CYS H 1 1 10 4841 1 1 11 CYS HA H -3.793 1.612 -0.507 1.00 . A A . 11 CYS HA 1 1 10 4842 1 1 11 CYS HB3 H -1.854 1.407 0.824 1.00 . A A . 11 CYS HB3 1 1 10 4843 1 1 11 CYS N N -2.760 3.329 -1.004 1.00 . A A . 11 CYS N 1 1 10 4844 1 1 11 CYS O O -4.627 4.015 1.466 1.00 . A A . 11 CYS O 1 1 10 4845 1 1 11 CYS SG S -1.584 3.572 1.783 1.00 . A A . 11 CYS SG 1 1 10 4846 1 1 12 VAL C C -7.864 2.810 1.227 1.00 . A A . 12 VAL C 1 1 10 4847 1 1 12 VAL CA C -7.090 3.675 0.240 1.00 . A A . 12 VAL CA 1 1 10 4848 1 1 12 VAL CB C -7.982 3.966 -0.981 1.00 . A A . 12 VAL CB 1 1 10 4849 1 1 12 VAL CG1 C -8.863 5.179 -0.723 1.00 . A A . 12 VAL CG1 1 1 10 4850 1 1 12 VAL CG2 C -7.132 4.171 -2.225 1.00 . A A . 12 VAL CG2 1 1 10 4851 1 1 12 VAL H H -5.841 2.422 -0.920 1.00 . A A . 12 VAL H 1 1 10 4852 1 1 12 VAL HA H -6.847 4.615 0.714 1.00 . A A . 12 VAL HA 1 1 10 4853 1 1 12 VAL HB H -8.623 3.113 -1.145 1.00 . A A . 12 VAL HB 1 1 10 4854 1 1 12 VAL HG11 H -8.627 5.595 0.247 1.00 . A A . 12 VAL HG11 1 1 10 4855 1 1 12 VAL HG12 H -8.687 5.923 -1.486 1.00 . A A . 12 VAL HG12 1 1 10 4856 1 1 12 VAL HG13 H -9.901 4.881 -0.741 1.00 . A A . 12 VAL HG13 1 1 10 4857 1 1 12 VAL HG21 H -6.214 4.671 -1.956 1.00 . A A . 12 VAL HG21 1 1 10 4858 1 1 12 VAL HG22 H -6.905 3.212 -2.667 1.00 . A A . 12 VAL HG22 1 1 10 4859 1 1 12 VAL HG23 H -7.674 4.776 -2.938 1.00 . A A . 12 VAL HG23 1 1 10 4860 1 1 12 VAL N N -5.842 3.034 -0.155 1.00 . A A . 12 VAL N 1 1 10 4861 1 1 12 VAL O O -7.543 1.637 1.426 1.00 . A A . 12 VAL O 1 1 10 4862 1 1 13 ARG C C -10.164 1.333 2.245 1.00 . A A . 13 ARG C 1 1 10 4863 1 1 13 ARG CA C -9.708 2.675 2.810 1.00 . A A . 13 ARG CA 1 1 10 4864 1 1 13 ARG CB C -10.925 3.516 3.202 1.00 . A A . 13 ARG CB 1 1 10 4865 1 1 13 ARG CD C -11.174 5.505 4.717 1.00 . A A . 13 ARG CD 1 1 10 4866 1 1 13 ARG CG C -10.882 4.016 4.637 1.00 . A A . 13 ARG CG 1 1 10 4867 1 1 13 ARG CZ C -9.044 6.482 5.460 1.00 . A A . 13 ARG CZ 1 1 10 4868 1 1 13 ARG H H -9.095 4.331 1.642 1.00 . A A . 13 ARG H 1 1 10 4869 1 1 13 ARG HA H -9.106 2.496 3.688 1.00 . A A . 13 ARG HA 1 1 10 4870 1 1 13 ARG HB3 H -11.816 2.918 3.079 1.00 . A A . 13 ARG HB3 1 1 10 4871 1 1 13 ARG HD3 H -11.591 5.725 5.688 1.00 . A A . 13 ARG HD3 1 1 10 4872 1 1 13 ARG HE H -9.849 6.743 3.653 1.00 . A A . 13 ARG HE 1 1 10 4873 1 1 13 ARG HG3 H -9.901 3.827 5.045 1.00 . A A . 13 ARG HG3 1 1 10 4874 1 1 13 ARG HH11 H -9.984 5.345 6.839 1.00 . A A . 13 ARG HH11 1 1 10 4875 1 1 13 ARG HH12 H -8.481 6.039 7.350 1.00 . A A . 13 ARG HH12 1 1 10 4876 1 1 13 ARG HH21 H -7.869 7.663 4.314 1.00 . A A . 13 ARG HH21 1 1 10 4877 1 1 13 ARG HH22 H -7.279 7.358 5.913 1.00 . A A . 13 ARG HH22 1 1 10 4878 1 1 13 ARG N N -8.888 3.394 1.842 1.00 . A A . 13 ARG N 1 1 10 4879 1 1 13 ARG NE N -9.970 6.310 4.524 1.00 . A A . 13 ARG NE 1 1 10 4880 1 1 13 ARG NH1 N -9.182 5.909 6.647 1.00 . A A . 13 ARG NH1 1 1 10 4881 1 1 13 ARG NH2 N -7.976 7.229 5.208 1.00 . A A . 13 ARG NH2 1 1 10 4882 1 1 13 ARG O O -9.864 0.269 2.787 1.00 . A A . 13 ARG O 1 1 10 4883 1 1 14 PRO C C -10.316 -0.638 -0.189 1.00 . A A . 14 PRO C 1 1 10 4884 1 1 14 PRO CA C -11.422 0.180 0.467 1.00 . A A . 14 PRO CA 1 1 10 4885 1 1 14 PRO CB C -12.375 0.738 -0.593 1.00 . A A . 14 PRO CB 1 1 10 4886 1 1 14 PRO CD C -11.304 2.616 0.429 1.00 . A A . 14 PRO CD 1 1 10 4887 1 1 14 PRO CG C -11.869 2.111 -0.870 1.00 . A A . 14 PRO CG 1 1 10 4888 1 1 14 PRO HA H -11.972 -0.447 1.154 1.00 . A A . 14 PRO HA 1 1 10 4889 1 1 14 PRO HB3 H -13.381 0.760 -0.202 1.00 . A A . 14 PRO HB3 1 1 10 4890 1 1 14 PRO HD3 H -12.059 3.150 0.987 1.00 . A A . 14 PRO HD3 1 1 10 4891 1 1 14 PRO HG3 H -12.684 2.743 -1.194 1.00 . A A . 14 PRO HG3 1 1 10 4892 1 1 14 PRO N N -10.908 1.382 1.130 1.00 . A A . 14 PRO N 1 1 10 4893 1 1 14 PRO O O -10.547 -1.755 -0.651 1.00 . A A . 14 PRO O 1 1 10 4894 1 1 15 ARG C C -6.820 -0.866 0.169 1.00 . A A . 15 ARG C 1 1 10 4895 1 1 15 ARG CA C -7.969 -0.752 -0.828 1.00 . A A . 15 ARG CA 1 1 10 4896 1 1 15 ARG CB C -7.504 -0.002 -2.077 1.00 . A A . 15 ARG CB 1 1 10 4897 1 1 15 ARG CD C -8.394 0.968 -4.217 1.00 . A A . 15 ARG CD 1 1 10 4898 1 1 15 ARG CG C -8.382 -0.240 -3.293 1.00 . A A . 15 ARG CG 1 1 10 4899 1 1 15 ARG CZ C -10.737 1.704 -4.325 1.00 . A A . 15 ARG CZ 1 1 10 4900 1 1 15 ARG H H -8.990 0.818 0.158 1.00 . A A . 15 ARG H 1 1 10 4901 1 1 15 ARG HA H -8.284 -1.745 -1.112 1.00 . A A . 15 ARG HA 1 1 10 4902 1 1 15 ARG HB3 H -6.500 -0.317 -2.317 1.00 . A A . 15 ARG HB3 1 1 10 4903 1 1 15 ARG HD3 H -8.501 0.624 -5.236 1.00 . A A . 15 ARG HD3 1 1 10 4904 1 1 15 ARG HE H -9.282 2.672 -3.364 1.00 . A A . 15 ARG HE 1 1 10 4905 1 1 15 ARG HG3 H -9.392 -0.439 -2.963 1.00 . A A . 15 ARG HG3 1 1 10 4906 1 1 15 ARG HH11 H -10.340 -0.017 -5.307 1.00 . A A . 15 ARG HH11 1 1 10 4907 1 1 15 ARG HH12 H -11.988 0.513 -5.376 1.00 . A A . 15 ARG HH12 1 1 10 4908 1 1 15 ARG HH21 H -11.450 3.379 -3.446 1.00 . A A . 15 ARG HH21 1 1 10 4909 1 1 15 ARG HH22 H -12.618 2.445 -4.318 1.00 . A A . 15 ARG HH22 1 1 10 4910 1 1 15 ARG N N -9.112 -0.075 -0.227 1.00 . A A . 15 ARG N 1 1 10 4911 1 1 15 ARG NE N -9.489 1.884 -3.908 1.00 . A A . 15 ARG NE 1 1 10 4912 1 1 15 ARG NH1 N -11.047 0.647 -5.064 1.00 . A A . 15 ARG NH1 1 1 10 4913 1 1 15 ARG NH2 N -11.679 2.581 -4.003 1.00 . A A . 15 ARG NH2 1 1 10 4914 1 1 15 ARG O O -5.650 -0.764 -0.202 1.00 . A A . 15 ARG O 1 1 10 4915 1 1 16 LYS C C -5.104 -2.246 2.109 1.00 . A A . 16 LYS C 1 1 10 4916 1 1 16 LYS CA C -6.157 -1.208 2.486 1.00 . A A . 16 LYS CA 1 1 10 4917 1 1 16 LYS CB C -6.822 -1.599 3.808 1.00 . A A . 16 LYS CB 1 1 10 4918 1 1 16 LYS CD C -6.353 -1.509 6.275 1.00 . A A . 16 LYS CD 1 1 10 4919 1 1 16 LYS CE C -5.300 -0.950 7.219 1.00 . A A . 16 LYS CE 1 1 10 4920 1 1 16 LYS CG C -6.413 -0.720 4.978 1.00 . A A . 16 LYS CG 1 1 10 4921 1 1 16 LYS H H -8.110 -1.152 1.670 1.00 . A A . 16 LYS H 1 1 10 4922 1 1 16 LYS HA H -5.675 -0.250 2.605 1.00 . A A . 16 LYS HA 1 1 10 4923 1 1 16 LYS HB3 H -6.557 -2.620 4.044 1.00 . A A . 16 LYS HB3 1 1 10 4924 1 1 16 LYS HD3 H -6.110 -2.538 6.049 1.00 . A A . 16 LYS HD3 1 1 10 4925 1 1 16 LYS HE3 H -4.917 -0.029 6.805 1.00 . A A . 16 LYS HE3 1 1 10 4926 1 1 16 LYS HG3 H -7.132 0.078 5.086 1.00 . A A . 16 LYS HG3 1 1 10 4927 1 1 16 LYS HZ1 H -6.486 0.150 8.542 1.00 . A A . 16 LYS HZ1 1 1 10 4928 1 1 16 LYS HZ2 H -5.087 -0.492 9.246 1.00 . A A . 16 LYS HZ2 1 1 10 4929 1 1 16 LYS HZ3 H -6.401 -1.500 8.907 1.00 . A A . 16 LYS HZ3 1 1 10 4930 1 1 16 LYS N N -7.160 -1.079 1.436 1.00 . A A . 16 LYS N 1 1 10 4931 1 1 16 LYS NZ N -5.858 -0.679 8.573 1.00 . A A . 16 LYS NZ 1 1 10 4932 1 1 16 LYS O O -5.410 -3.251 1.466 1.00 . A A . 16 LYS O 1 1 10 4933 1 1 17 CYS C C -2.945 -4.232 2.956 1.00 . A A . 17 CYS C 1 1 10 4934 1 1 17 CYS CA C -2.764 -2.907 2.220 1.00 . A A . 17 CYS CA 1 1 10 4935 1 1 17 CYS CB C -1.428 -2.272 2.610 1.00 . A A . 17 CYS CB 1 1 10 4936 1 1 17 CYS H H -3.681 -1.177 3.023 1.00 . A A . 17 CYS H 1 1 10 4937 1 1 17 CYS HA H -2.766 -3.097 1.157 1.00 . A A . 17 CYS HA 1 1 10 4938 1 1 17 CYS HB3 H -0.741 -3.051 2.903 1.00 . A A . 17 CYS HB3 1 1 10 4939 1 1 17 CYS N N -3.863 -1.995 2.513 1.00 . A A . 17 CYS N 1 1 10 4940 1 1 17 CYS O O -2.767 -4.307 4.171 1.00 . A A . 17 CYS O 1 1 10 4941 1 1 17 CYS SG S -0.644 -1.311 1.275 1.00 . A A . 17 CYS SG 1 1 10 4942 1 1 18 GLN C C -2.276 -7.037 3.584 1.00 . A A . 18 GLN C 1 1 10 4943 1 1 18 GLN CA C -3.503 -6.595 2.793 1.00 . A A . 18 GLN CA 1 1 10 4944 1 1 18 GLN CB C -3.814 -7.616 1.697 1.00 . A A . 18 GLN CB 1 1 10 4945 1 1 18 GLN CD C -3.916 -10.069 1.102 1.00 . A A . 18 GLN CD 1 1 10 4946 1 1 18 GLN CG C -3.313 -9.017 2.010 1.00 . A A . 18 GLN CG 1 1 10 4947 1 1 18 GLN H H -3.427 -5.151 1.247 1.00 . A A . 18 GLN H 1 1 10 4948 1 1 18 GLN HA H -4.347 -6.535 3.464 1.00 . A A . 18 GLN HA 1 1 10 4949 1 1 18 GLN HB3 H -3.352 -7.290 0.777 1.00 . A A . 18 GLN HB3 1 1 10 4950 1 1 18 GLN HE21 H -5.744 -9.591 1.719 1.00 . A A . 18 GLN HE21 1 1 10 4951 1 1 18 GLN HE22 H -5.655 -10.857 0.546 1.00 . A A . 18 GLN HE22 1 1 10 4952 1 1 18 GLN HG3 H -3.569 -9.255 3.032 1.00 . A A . 18 GLN HG3 1 1 10 4953 1 1 18 GLN N N -3.299 -5.274 2.211 1.00 . A A . 18 GLN N 1 1 10 4954 1 1 18 GLN NE2 N -5.238 -10.185 1.125 1.00 . A A . 18 GLN NE2 1 1 10 4955 1 1 18 GLN O O -2.348 -7.318 4.781 1.00 . A A . 18 GLN O 1 1 10 4956 1 1 18 GLN OE1 O -3.201 -10.770 0.385 1.00 . A A . 18 GLN OE1 1 1 10 4957 1 1 19 PRO C C 0.667 -6.469 4.503 1.00 . A A . 19 PRO C 1 1 10 4958 1 1 19 PRO CA C 0.141 -7.510 3.520 1.00 . A A . 19 PRO CA 1 1 10 4959 1 1 19 PRO CB C 1.091 -7.648 2.328 1.00 . A A . 19 PRO CB 1 1 10 4960 1 1 19 PRO CD C -0.966 -6.781 1.472 1.00 . A A . 19 PRO CD 1 1 10 4961 1 1 19 PRO CG C 0.526 -6.746 1.286 1.00 . A A . 19 PRO CG 1 1 10 4962 1 1 19 PRO HA H 0.048 -8.462 4.022 1.00 . A A . 19 PRO HA 1 1 10 4963 1 1 19 PRO HB3 H 1.107 -8.674 1.994 1.00 . A A . 19 PRO HB3 1 1 10 4964 1 1 19 PRO HD3 H -1.405 -7.551 0.855 1.00 . A A . 19 PRO HD3 1 1 10 4965 1 1 19 PRO HG3 H 0.789 -7.109 0.304 1.00 . A A . 19 PRO HG3 1 1 10 4966 1 1 19 PRO N N -1.124 -7.102 2.901 1.00 . A A . 19 PRO N 1 1 10 4967 1 1 19 PRO O O 0.168 -5.345 4.581 1.00 . A A . 19 PRO O 1 1 10 4968 1 1 20 PRO C C 3.090 -4.817 5.614 1.00 . A A . 20 PRO C 1 1 10 4969 1 1 20 PRO CA C 2.316 -5.960 6.261 1.00 . A A . 20 PRO CA 1 1 10 4970 1 1 20 PRO CB C 3.268 -6.886 7.022 1.00 . A A . 20 PRO CB 1 1 10 4971 1 1 20 PRO CD C 2.345 -8.171 5.230 1.00 . A A . 20 PRO CD 1 1 10 4972 1 1 20 PRO CG C 3.584 -7.979 6.060 1.00 . A A . 20 PRO CG 1 1 10 4973 1 1 20 PRO HA H 1.582 -5.556 6.943 1.00 . A A . 20 PRO HA 1 1 10 4974 1 1 20 PRO HB3 H 2.776 -7.267 7.905 1.00 . A A . 20 PRO HB3 1 1 10 4975 1 1 20 PRO HD3 H 1.708 -8.922 5.671 1.00 . A A . 20 PRO HD3 1 1 10 4976 1 1 20 PRO HG3 H 3.817 -8.886 6.600 1.00 . A A . 20 PRO HG3 1 1 10 4977 1 1 20 PRO N N 1.700 -6.847 5.270 1.00 . A A . 20 PRO N 1 1 10 4978 1 1 20 PRO O O 4.312 -4.883 5.473 1.00 . A A . 20 PRO O 1 1 10 4979 1 1 21 LEU C C 2.921 -1.390 5.499 1.00 . A A . 21 LEU C 1 1 10 4980 1 1 21 LEU CA C 2.993 -2.612 4.588 1.00 . A A . 21 LEU CA 1 1 10 4981 1 1 21 LEU CB C 2.308 -2.307 3.254 1.00 . A A . 21 LEU CB 1 1 10 4982 1 1 21 LEU CD1 C 4.159 -2.480 1.574 1.00 . A A . 21 LEU CD1 1 1 10 4983 1 1 21 LEU CD2 C 2.994 -4.547 2.364 1.00 . A A . 21 LEU CD2 1 1 10 4984 1 1 21 LEU CG C 2.837 -3.069 2.039 1.00 . A A . 21 LEU CG 1 1 10 4985 1 1 21 LEU H H 1.403 -3.776 5.359 1.00 . A A . 21 LEU H 1 1 10 4986 1 1 21 LEU HA H 4.029 -2.849 4.405 1.00 . A A . 21 LEU HA 1 1 10 4987 1 1 21 LEU HB3 H 2.422 -1.250 3.059 1.00 . A A . 21 LEU HB3 1 1 10 4988 1 1 21 LEU HD11 H 4.571 -1.858 2.355 1.00 . A A . 21 LEU HD11 1 1 10 4989 1 1 21 LEU HD12 H 3.997 -1.885 0.688 1.00 . A A . 21 LEU HD12 1 1 10 4990 1 1 21 LEU HD13 H 4.850 -3.280 1.348 1.00 . A A . 21 LEU HD13 1 1 10 4991 1 1 21 LEU HD21 H 3.198 -5.095 1.456 1.00 . A A . 21 LEU HD21 1 1 10 4992 1 1 21 LEU HD22 H 2.082 -4.916 2.810 1.00 . A A . 21 LEU HD22 1 1 10 4993 1 1 21 LEU HD23 H 3.813 -4.679 3.056 1.00 . A A . 21 LEU HD23 1 1 10 4994 1 1 21 LEU HG H 2.128 -2.977 1.228 1.00 . A A . 21 LEU HG 1 1 10 4995 1 1 21 LEU N N 2.372 -3.771 5.221 1.00 . A A . 21 LEU N 1 1 10 4996 1 1 21 LEU O O 2.391 -1.460 6.608 1.00 . A A . 21 LEU O 1 1 10 4997 1 1 22 LYS C C 3.289 2.176 4.878 1.00 . A A . 22 LYS C 1 1 10 4998 1 1 22 LYS CA C 3.454 0.967 5.793 1.00 . A A . 22 LYS CA 1 1 10 4999 1 1 22 LYS CB C 4.749 1.096 6.599 1.00 . A A . 22 LYS CB 1 1 10 5000 1 1 22 LYS CD C 5.832 1.434 8.840 1.00 . A A . 22 LYS CD 1 1 10 5001 1 1 22 LYS CE C 6.141 2.911 9.030 1.00 . A A . 22 LYS CE 1 1 10 5002 1 1 22 LYS CG C 4.523 1.231 8.094 1.00 . A A . 22 LYS CG 1 1 10 5003 1 1 22 LYS H H 3.867 -0.279 4.133 1.00 . A A . 22 LYS H 1 1 10 5004 1 1 22 LYS HA H 2.617 0.931 6.476 1.00 . A A . 22 LYS HA 1 1 10 5005 1 1 22 LYS HB3 H 5.285 1.969 6.257 1.00 . A A . 22 LYS HB3 1 1 10 5006 1 1 22 LYS HD3 H 6.632 0.978 8.275 1.00 . A A . 22 LYS HD3 1 1 10 5007 1 1 22 LYS HE3 H 5.558 3.481 8.323 1.00 . A A . 22 LYS HE3 1 1 10 5008 1 1 22 LYS HG3 H 4.048 0.332 8.461 1.00 . A A . 22 LYS HG3 1 1 10 5009 1 1 22 LYS HZ1 H 4.810 3.225 10.609 1.00 . A A . 22 LYS HZ1 1 1 10 5010 1 1 22 LYS HZ2 H 6.038 4.384 10.506 1.00 . A A . 22 LYS HZ2 1 1 10 5011 1 1 22 LYS HZ3 H 6.382 2.840 11.104 1.00 . A A . 22 LYS HZ3 1 1 10 5012 1 1 22 LYS N N 3.458 -0.271 5.025 1.00 . A A . 22 LYS N 1 1 10 5013 1 1 22 LYS NZ N 5.820 3.372 10.409 1.00 . A A . 22 LYS NZ 1 1 10 5014 1 1 22 LYS O O 4.147 2.452 4.037 1.00 . A A . 22 LYS O 1 1 10 5015 1 1 23 CYS C C 2.518 5.322 4.866 1.00 . A A . 23 CYS C 1 1 10 5016 1 1 23 CYS CA C 1.908 4.074 4.235 1.00 . A A . 23 CYS CA 1 1 10 5017 1 1 23 CYS CB C 0.398 4.260 4.067 1.00 . A A . 23 CYS CB 1 1 10 5018 1 1 23 CYS H H 1.538 2.623 5.733 1.00 . A A . 23 CYS H 1 1 10 5019 1 1 23 CYS HA H 2.353 3.921 3.265 1.00 . A A . 23 CYS HA 1 1 10 5020 1 1 23 CYS HB3 H 0.218 5.112 3.429 1.00 . A A . 23 CYS HB3 1 1 10 5021 1 1 23 CYS N N 2.184 2.894 5.046 1.00 . A A . 23 CYS N 1 1 10 5022 1 1 23 CYS O O 3.282 5.235 5.827 1.00 . A A . 23 CYS O 1 1 10 5023 1 1 23 CYS SG S -0.451 2.826 3.331 1.00 . A A . 23 CYS SG 1 1 10 5024 1 1 24 ASN C C 1.557 8.751 5.036 1.00 . A A . 24 ASN C 1 1 10 5025 1 1 24 ASN CA C 2.688 7.750 4.828 1.00 . A A . 24 ASN CA 1 1 10 5026 1 1 24 ASN CB C 3.725 8.328 3.862 1.00 . A A . 24 ASN CB 1 1 10 5027 1 1 24 ASN CG C 3.542 7.819 2.446 1.00 . A A . 24 ASN CG 1 1 10 5028 1 1 24 ASN H H 1.561 6.489 3.555 1.00 . A A . 24 ASN H 1 1 10 5029 1 1 24 ASN HA H 3.163 7.557 5.778 1.00 . A A . 24 ASN HA 1 1 10 5030 1 1 24 ASN HB3 H 4.714 8.056 4.199 1.00 . A A . 24 ASN HB3 1 1 10 5031 1 1 24 ASN HD21 H 2.814 9.581 1.880 1.00 . A A . 24 ASN HD21 1 1 10 5032 1 1 24 ASN HD22 H 2.908 8.376 0.646 1.00 . A A . 24 ASN HD22 1 1 10 5033 1 1 24 ASN N N 2.174 6.484 4.319 1.00 . A A . 24 ASN N 1 1 10 5034 1 1 24 ASN ND2 N 3.038 8.678 1.569 1.00 . A A . 24 ASN ND2 1 1 10 5035 1 1 24 ASN O O 1.299 9.189 6.158 1.00 . A A . 24 ASN O 1 1 10 5036 1 1 24 ASN OD1 O 3.852 6.667 2.143 1.00 . A A . 24 ASN OD1 1 1 10 5037 1 1 25 LYS C C -0.815 10.294 2.625 1.00 . A A . 25 LYS C 1 1 10 5038 1 1 25 LYS CA C -0.222 10.059 4.011 1.00 . A A . 25 LYS CA 1 1 10 5039 1 1 25 LYS CB C 0.250 11.387 4.607 1.00 . A A . 25 LYS CB 1 1 10 5040 1 1 25 LYS CD C -0.887 13.323 5.731 1.00 . A A . 25 LYS CD 1 1 10 5041 1 1 25 LYS CE C -1.140 13.908 7.111 1.00 . A A . 25 LYS CE 1 1 10 5042 1 1 25 LYS CG C -0.565 11.841 5.805 1.00 . A A . 25 LYS CG 1 1 10 5043 1 1 25 LYS H H 1.137 8.728 3.083 1.00 . A A . 25 LYS H 1 1 10 5044 1 1 25 LYS HA H -0.984 9.639 4.648 1.00 . A A . 25 LYS HA 1 1 10 5045 1 1 25 LYS HB3 H 0.189 12.152 3.846 1.00 . A A . 25 LYS HB3 1 1 10 5046 1 1 25 LYS HD3 H -1.772 13.460 5.124 1.00 . A A . 25 LYS HD3 1 1 10 5047 1 1 25 LYS HE3 H -1.248 13.098 7.817 1.00 . A A . 25 LYS HE3 1 1 10 5048 1 1 25 LYS HG3 H 0.000 11.649 6.707 1.00 . A A . 25 LYS HG3 1 1 10 5049 1 1 25 LYS HZ1 H -0.403 15.658 7.983 1.00 . A A . 25 LYS HZ1 1 1 10 5050 1 1 25 LYS HZ2 H 0.569 15.051 6.738 1.00 . A A . 25 LYS HZ2 1 1 10 5051 1 1 25 LYS HZ3 H 0.566 14.297 8.253 1.00 . A A . 25 LYS HZ3 1 1 10 5052 1 1 25 LYS N N 0.884 9.111 3.949 1.00 . A A . 25 LYS N 1 1 10 5053 1 1 25 LYS NZ N -0.024 14.791 7.553 1.00 . A A . 25 LYS NZ 1 1 10 5054 1 1 25 LYS O O -2.018 10.509 2.483 1.00 . A A . 25 LYS O 1 1 10 5055 1 1 26 ALA C C -0.726 9.130 -0.444 1.00 . A A . 26 ALA C 1 1 10 5056 1 1 26 ALA CA C -0.404 10.457 0.233 1.00 . A A . 26 ALA CA 1 1 10 5057 1 1 26 ALA CB C 0.659 11.210 -0.556 1.00 . A A . 26 ALA CB 1 1 10 5058 1 1 26 ALA H H 0.985 10.077 1.783 1.00 . A A . 26 ALA H 1 1 10 5059 1 1 26 ALA HA H -1.297 11.066 0.255 1.00 . A A . 26 ALA HA 1 1 10 5060 1 1 26 ALA HB1 H 1.558 10.613 -0.605 1.00 . A A . 26 ALA HB1 1 1 10 5061 1 1 26 ALA HB2 H 0.297 11.400 -1.556 1.00 . A A . 26 ALA HB2 1 1 10 5062 1 1 26 ALA HB3 H 0.874 12.147 -0.066 1.00 . A A . 26 ALA HB3 1 1 10 5063 1 1 26 ALA N N 0.037 10.252 1.607 1.00 . A A . 26 ALA N 1 1 10 5064 1 1 26 ALA O O -0.706 9.027 -1.671 1.00 . A A . 26 ALA O 1 1 10 5065 1 1 27 GLN C C -0.201 6.242 -0.998 1.00 . A A . 27 GLN C 1 1 10 5066 1 1 27 GLN CA C -1.349 6.794 -0.160 1.00 . A A . 27 GLN CA 1 1 10 5067 1 1 27 GLN CB C -2.626 6.856 -1.000 1.00 . A A . 27 GLN CB 1 1 10 5068 1 1 27 GLN CD C -5.147 7.015 -1.018 1.00 . A A . 27 GLN CD 1 1 10 5069 1 1 27 GLN CG C -3.901 6.852 -0.171 1.00 . A A . 27 GLN CG 1 1 10 5070 1 1 27 GLN H H -1.023 8.260 1.331 1.00 . A A . 27 GLN H 1 1 10 5071 1 1 27 GLN HA H -1.514 6.137 0.680 1.00 . A A . 27 GLN HA 1 1 10 5072 1 1 27 GLN HB3 H -2.650 6.000 -1.660 1.00 . A A . 27 GLN HB3 1 1 10 5073 1 1 27 GLN HE21 H -6.259 7.230 0.617 1.00 . A A . 27 GLN HE21 1 1 10 5074 1 1 27 GLN HE22 H -7.109 7.313 -0.885 1.00 . A A . 27 GLN HE22 1 1 10 5075 1 1 27 GLN HG3 H -3.855 7.667 0.537 1.00 . A A . 27 GLN HG3 1 1 10 5076 1 1 27 GLN N N -1.024 8.116 0.362 1.00 . A A . 27 GLN N 1 1 10 5077 1 1 27 GLN NE2 N -6.287 7.204 -0.363 1.00 . A A . 27 GLN NE2 1 1 10 5078 1 1 27 GLN O O -0.058 6.582 -2.173 1.00 . A A . 27 GLN O 1 1 10 5079 1 1 27 GLN OE1 O -5.087 6.970 -2.247 1.00 . A A . 27 GLN OE1 1 1 10 5080 1 1 28 ILE C C 2.008 3.371 -0.581 1.00 . A A . 28 ILE C 1 1 10 5081 1 1 28 ILE CA C 1.749 4.790 -1.078 1.00 . A A . 28 ILE CA 1 1 10 5082 1 1 28 ILE CB C 3.028 5.628 -0.890 1.00 . A A . 28 ILE CB 1 1 10 5083 1 1 28 ILE CD1 C 2.681 7.000 -3.006 1.00 . A A . 28 ILE CD1 1 1 10 5084 1 1 28 ILE CG1 C 2.847 7.018 -1.502 1.00 . A A . 28 ILE CG1 1 1 10 5085 1 1 28 ILE CG2 C 4.220 4.919 -1.515 1.00 . A A . 28 ILE CG2 1 1 10 5086 1 1 28 ILE H H 0.448 5.158 0.551 1.00 . A A . 28 ILE H 1 1 10 5087 1 1 28 ILE HA H 1.516 4.755 -2.132 1.00 . A A . 28 ILE HA 1 1 10 5088 1 1 28 ILE HB H 3.214 5.729 0.167 1.00 . A A . 28 ILE HB 1 1 10 5089 1 1 28 ILE HD11 H 2.558 5.980 -3.343 1.00 . A A . 28 ILE HD11 1 1 10 5090 1 1 28 ILE HD12 H 1.810 7.576 -3.280 1.00 . A A . 28 ILE HD12 1 1 10 5091 1 1 28 ILE HD13 H 3.557 7.427 -3.471 1.00 . A A . 28 ILE HD13 1 1 10 5092 1 1 28 ILE HG13 H 3.713 7.621 -1.270 1.00 . A A . 28 ILE HG13 1 1 10 5093 1 1 28 ILE HG21 H 4.020 4.731 -2.560 1.00 . A A . 28 ILE HG21 1 1 10 5094 1 1 28 ILE HG22 H 5.097 5.543 -1.426 1.00 . A A . 28 ILE HG22 1 1 10 5095 1 1 28 ILE HG23 H 4.391 3.983 -1.007 1.00 . A A . 28 ILE HG23 1 1 10 5096 1 1 28 ILE N N 0.614 5.390 -0.386 1.00 . A A . 28 ILE N 1 1 10 5097 1 1 28 ILE O O 2.089 2.431 -1.372 1.00 . A A . 28 ILE O 1 1 10 5098 1 1 29 CYS C C 3.763 1.397 0.956 1.00 . A A . 29 CYS C 1 1 10 5099 1 1 29 CYS CA C 2.380 1.919 1.337 1.00 . A A . 29 CYS CA 1 1 10 5100 1 1 29 CYS CB C 1.308 0.920 0.898 1.00 . A A . 29 CYS CB 1 1 10 5101 1 1 29 CYS H H 2.058 4.011 1.313 1.00 . A A . 29 CYS H 1 1 10 5102 1 1 29 CYS HA H 2.335 2.036 2.408 1.00 . A A . 29 CYS HA 1 1 10 5103 1 1 29 CYS HB3 H 1.787 0.068 0.441 1.00 . A A . 29 CYS HB3 1 1 10 5104 1 1 29 CYS N N 2.133 3.223 0.733 1.00 . A A . 29 CYS N 1 1 10 5105 1 1 29 CYS O O 4.109 1.329 -0.223 1.00 . A A . 29 CYS O 1 1 10 5106 1 1 29 CYS SG S 0.263 0.306 2.259 1.00 . A A . 29 CYS SG 1 1 10 5107 1 1 30 VAL C C 6.460 -0.116 3.002 1.00 . A A . 30 VAL C 1 1 10 5108 1 1 30 VAL CA C 5.892 0.513 1.736 1.00 . A A . 30 VAL CA 1 1 10 5109 1 1 30 VAL CB C 6.846 1.622 1.254 1.00 . A A . 30 VAL CB 1 1 10 5110 1 1 30 VAL CG1 C 7.043 1.541 -0.252 1.00 . A A . 30 VAL CG1 1 1 10 5111 1 1 30 VAL CG2 C 6.318 2.991 1.657 1.00 . A A . 30 VAL CG2 1 1 10 5112 1 1 30 VAL H H 4.215 1.107 2.882 1.00 . A A . 30 VAL H 1 1 10 5113 1 1 30 VAL HA H 5.833 -0.242 0.965 1.00 . A A . 30 VAL HA 1 1 10 5114 1 1 30 VAL HB H 7.805 1.476 1.729 1.00 . A A . 30 VAL HB 1 1 10 5115 1 1 30 VAL HG11 H 8.004 1.960 -0.513 1.00 . A A . 30 VAL HG11 1 1 10 5116 1 1 30 VAL HG12 H 7.002 0.507 -0.565 1.00 . A A . 30 VAL HG12 1 1 10 5117 1 1 30 VAL HG13 H 6.262 2.097 -0.747 1.00 . A A . 30 VAL HG13 1 1 10 5118 1 1 30 VAL HG21 H 7.109 3.721 1.574 1.00 . A A . 30 VAL HG21 1 1 10 5119 1 1 30 VAL HG22 H 5.503 3.267 1.005 1.00 . A A . 30 VAL HG22 1 1 10 5120 1 1 30 VAL HG23 H 5.966 2.955 2.677 1.00 . A A . 30 VAL HG23 1 1 10 5121 1 1 30 VAL N N 4.548 1.030 1.963 1.00 . A A . 30 VAL N 1 1 10 5122 1 1 30 VAL O O 5.797 -0.158 4.039 1.00 . A A . 30 VAL O 1 1 10 5123 1 1 31 ASP C C 9.793 -1.601 3.710 1.00 . A A . 31 ASP C 1 1 10 5124 1 1 31 ASP CA C 8.353 -1.230 4.052 1.00 . A A . 31 ASP CA 1 1 10 5125 1 1 31 ASP CB C 7.584 -2.475 4.493 1.00 . A A . 31 ASP CB 1 1 10 5126 1 1 31 ASP CG C 6.992 -3.236 3.321 1.00 . A A . 31 ASP CG 1 1 10 5127 1 1 31 ASP H H 8.171 -0.540 2.058 1.00 . A A . 31 ASP H 1 1 10 5128 1 1 31 ASP HA H 8.361 -0.518 4.863 1.00 . A A . 31 ASP HA 1 1 10 5129 1 1 31 ASP HB3 H 6.779 -2.180 5.151 1.00 . A A . 31 ASP HB3 1 1 10 5130 1 1 31 ASP N N 7.693 -0.604 2.913 1.00 . A A . 31 ASP N 1 1 10 5131 1 1 31 ASP O O 10.166 -1.731 2.544 1.00 . A A . 31 ASP O 1 1 10 5132 1 1 31 ASP OD1 O 7.628 -3.260 2.247 1.00 . A A . 31 ASP OD1 1 1 10 5133 1 1 31 ASP OD2 O 5.893 -3.807 3.480 1.00 . A A . 31 ASP OD2 1 1 10 5134 1 1 32 PRO C C 12.216 -3.559 4.076 1.00 . A A . 32 PRO C 1 1 10 5135 1 1 32 PRO CA C 12.035 -2.132 4.584 1.00 . A A . 32 PRO CA 1 1 10 5136 1 1 32 PRO CB C 12.604 -1.993 5.998 1.00 . A A . 32 PRO CB 1 1 10 5137 1 1 32 PRO CD C 10.246 -1.635 6.166 1.00 . A A . 32 PRO CD 1 1 10 5138 1 1 32 PRO CG C 11.434 -2.194 6.899 1.00 . A A . 32 PRO CG 1 1 10 5139 1 1 32 PRO HA H 12.543 -1.447 3.921 1.00 . A A . 32 PRO HA 1 1 10 5140 1 1 32 PRO HB3 H 13.032 -1.010 6.122 1.00 . A A . 32 PRO HB3 1 1 10 5141 1 1 32 PRO HD3 H 10.098 -0.598 6.425 1.00 . A A . 32 PRO HD3 1 1 10 5142 1 1 32 PRO HG3 H 11.588 -1.660 7.825 1.00 . A A . 32 PRO HG3 1 1 10 5143 1 1 32 PRO N N 10.622 -1.774 4.750 1.00 . A A . 32 PRO N 1 1 10 5144 1 1 32 PRO O O 12.905 -4.368 4.696 1.00 . A A . 32 PRO O 1 1 10 5145 1 1 33 LYS C C 11.553 -5.116 0.830 1.00 . A A . 33 LYS C 1 1 10 5146 1 1 33 LYS CA C 11.685 -5.189 2.348 1.00 . A A . 33 LYS CA 1 1 10 5147 1 1 33 LYS CB C 10.601 -6.104 2.921 1.00 . A A . 33 LYS CB 1 1 10 5148 1 1 33 LYS CD C 11.071 -8.515 2.394 1.00 . A A . 33 LYS CD 1 1 10 5149 1 1 33 LYS CE C 11.114 -9.900 3.020 1.00 . A A . 33 LYS CE 1 1 10 5150 1 1 33 LYS CG C 11.137 -7.424 3.450 1.00 . A A . 33 LYS CG 1 1 10 5151 1 1 33 LYS H H 11.057 -3.173 2.493 1.00 . A A . 33 LYS H 1 1 10 5152 1 1 33 LYS HA H 12.655 -5.595 2.592 1.00 . A A . 33 LYS HA 1 1 10 5153 1 1 33 LYS HB3 H 9.879 -6.317 2.147 1.00 . A A . 33 LYS HB3 1 1 10 5154 1 1 33 LYS HD3 H 11.912 -8.406 1.723 1.00 . A A . 33 LYS HD3 1 1 10 5155 1 1 33 LYS HE3 H 11.202 -9.794 4.091 1.00 . A A . 33 LYS HE3 1 1 10 5156 1 1 33 LYS HG3 H 10.548 -7.726 4.303 1.00 . A A . 33 LYS HG3 1 1 10 5157 1 1 33 LYS HZ1 H 10.011 -11.201 1.815 1.00 . A A . 33 LYS HZ1 1 1 10 5158 1 1 33 LYS HZ2 H 9.069 -10.052 2.625 1.00 . A A . 33 LYS HZ2 1 1 10 5159 1 1 33 LYS HZ3 H 9.703 -11.374 3.469 1.00 . A A . 33 LYS HZ3 1 1 10 5160 1 1 33 LYS N N 11.592 -3.861 2.942 1.00 . A A . 33 LYS N 1 1 10 5161 1 1 33 LYS NZ N 9.889 -10.687 2.710 1.00 . A A . 33 LYS NZ 1 1 10 5162 1 1 33 LYS O O 12.291 -5.777 0.099 1.00 . A A . 33 LYS O 1 1 10 5163 1 1 34 LYS C C 10.560 -2.692 -1.489 1.00 . A A . 34 LYS C 1 1 10 5164 1 1 34 LYS CA C 10.378 -4.147 -1.071 1.00 . A A . 34 LYS CA 1 1 10 5165 1 1 34 LYS CB C 8.972 -4.624 -1.440 1.00 . A A . 34 LYS CB 1 1 10 5166 1 1 34 LYS CD C 7.863 -6.258 0.113 1.00 . A A . 34 LYS CD 1 1 10 5167 1 1 34 LYS CE C 6.479 -6.783 -0.237 1.00 . A A . 34 LYS CE 1 1 10 5168 1 1 34 LYS CG C 8.726 -6.090 -1.127 1.00 . A A . 34 LYS CG 1 1 10 5169 1 1 34 LYS H H 10.049 -3.808 0.994 1.00 . A A . 34 LYS H 1 1 10 5170 1 1 34 LYS HA H 11.104 -4.752 -1.593 1.00 . A A . 34 LYS HA 1 1 10 5171 1 1 34 LYS HB3 H 8.821 -4.474 -2.499 1.00 . A A . 34 LYS HB3 1 1 10 5172 1 1 34 LYS HD3 H 7.761 -5.299 0.602 1.00 . A A . 34 LYS HD3 1 1 10 5173 1 1 34 LYS HE3 H 6.174 -7.489 0.523 1.00 . A A . 34 LYS HE3 1 1 10 5174 1 1 34 LYS HG3 H 9.675 -6.579 -0.962 1.00 . A A . 34 LYS HG3 1 1 10 5175 1 1 34 LYS HZ1 H 5.882 -4.862 -0.797 1.00 . A A . 34 LYS HZ1 1 1 10 5176 1 1 34 LYS HZ2 H 5.175 -5.408 0.641 1.00 . A A . 34 LYS HZ2 1 1 10 5177 1 1 34 LYS HZ3 H 4.638 -6.008 -0.847 1.00 . A A . 34 LYS HZ3 1 1 10 5178 1 1 34 LYS N N 10.607 -4.309 0.361 1.00 . A A . 34 LYS N 1 1 10 5179 1 1 34 LYS NZ N 5.473 -5.688 -0.316 1.00 . A A . 34 LYS NZ 1 1 10 5180 1 1 34 LYS O O 9.585 -1.964 -1.679 1.00 . A A . 34 LYS O 1 1 10 5181 1 1 35 GLY C C 11.702 0.100 -0.967 1.00 . A A . 35 GLY C 1 1 10 5182 1 1 35 GLY CA C 12.098 -0.907 -2.029 1.00 . A A . 35 GLY CA 1 1 10 5183 1 1 35 GLY H H 12.550 -2.897 -1.467 1.00 . A A . 35 GLY H 1 1 10 5184 1 1 35 GLY HA2 H 13.156 -0.813 -2.222 1.00 . A A . 35 GLY HA2 1 1 10 5185 1 1 35 GLY HA3 H 11.555 -0.687 -2.937 1.00 . A A . 35 GLY HA3 1 1 10 5186 1 1 35 GLY N N 11.813 -2.273 -1.632 1.00 . A A . 35 GLY N 1 1 10 5187 1 1 35 GLY O O 10.699 -0.079 -0.276 1.00 . A A . 35 GLY O 1 1 10 5188 1 1 36 TRP C C 12.715 3.556 -0.335 1.00 . A A . 36 TRP C 1 1 10 5189 1 1 36 TRP CA C 12.219 2.198 0.152 1.00 . A A . 36 TRP CA 1 1 10 5190 1 1 36 TRP CB C 12.879 1.849 1.486 1.00 . A A . 36 TRP CB 1 1 10 5191 1 1 36 TRP CD1 C 15.172 0.721 1.274 1.00 . A A . 36 TRP CD1 1 1 10 5192 1 1 36 TRP CD2 C 15.258 2.949 1.495 1.00 . A A . 36 TRP CD2 1 1 10 5193 1 1 36 TRP CE2 C 16.573 2.457 1.389 1.00 . A A . 36 TRP CE2 1 1 10 5194 1 1 36 TRP CE3 C 15.064 4.325 1.641 1.00 . A A . 36 TRP CE3 1 1 10 5195 1 1 36 TRP CG C 14.376 1.822 1.419 1.00 . A A . 36 TRP CG 1 1 10 5196 1 1 36 TRP CH2 C 17.466 4.636 1.570 1.00 . A A . 36 TRP CH2 1 1 10 5197 1 1 36 TRP CZ2 C 17.685 3.292 1.426 1.00 . A A . 36 TRP CZ2 1 1 10 5198 1 1 36 TRP CZ3 C 16.169 5.153 1.677 1.00 . A A . 36 TRP CZ3 1 1 10 5199 1 1 36 TRP H H 13.277 1.246 -1.416 1.00 . A A . 36 TRP H 1 1 10 5200 1 1 36 TRP HA H 11.149 2.247 0.292 1.00 . A A . 36 TRP HA 1 1 10 5201 1 1 36 TRP HB3 H 12.542 0.872 1.801 1.00 . A A . 36 TRP HB3 1 1 10 5202 1 1 36 TRP HD1 H 14.801 -0.288 1.190 1.00 . A A . 36 TRP HD1 1 1 10 5203 1 1 36 TRP HE1 H 17.256 0.486 1.162 1.00 . A A . 36 TRP HE1 1 1 10 5204 1 1 36 TRP HE3 H 14.071 4.743 1.726 1.00 . A A . 36 TRP HE3 1 1 10 5205 1 1 36 TRP HH2 H 18.299 5.320 1.603 1.00 . A A . 36 TRP HH2 1 1 10 5206 1 1 36 TRP HZ2 H 18.692 2.909 1.344 1.00 . A A . 36 TRP HZ2 1 1 10 5207 1 1 36 TRP HZ3 H 16.038 6.219 1.789 1.00 . A A . 36 TRP HZ3 1 1 10 5208 1 1 36 TRP N N 12.492 1.160 -0.835 1.00 . A A . 36 TRP N 1 1 10 5209 1 1 36 TRP NE1 N 16.494 1.096 1.257 1.00 . A A . 36 TRP NE1 1 1 10 5210 1 1 36 TRP O O 11.995 4.281 -1.023 1.00 . A A . 36 TRP O 1 1 stop_ save_
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