NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
470246 | 2ak0 | 6817 | cing | 4-filtered-FRED | STAR | entry | full | 89 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2ak0 # This FRED archive file contains, for PDB entry <2ak0>: # # - 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.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_2ak0 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2ak0 _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 2136.35 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 $Alpha_conotoxin_MII A . 1 1 stop_ save_ save_Alpha_conotoxin_MII _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Alpha conotoxin MII" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code GCCSNPVCHLEHSNLCGAGGAAG _Entity.Number_of_monomers 23 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 GLY . 1 1 2 CYS . 1 1 3 CYS . 1 1 4 SER . 1 1 5 ASN . 1 1 6 PRO . 1 1 7 VAL . 1 1 8 CYS . 1 1 9 HIS . 1 1 10 LEU . 1 1 11 GLU . 1 1 12 HIS . 1 1 13 SER . 1 1 14 ASN . 1 1 15 LEU . 1 1 16 CYS . 1 1 17 GLY . 1 1 18 ALA . 1 1 19 GLY . 1 1 20 GLY . 1 1 21 ALA . 1 1 22 ALA . 1 1 23 GLY . 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 GLY 1 1 1 1 CYS 2 2 1 1 CYS 3 3 1 1 SER 4 4 1 1 ASN 5 5 1 1 PRO 6 6 1 1 VAL 7 7 1 1 CYS 8 8 1 1 HIS 9 9 1 1 LEU 10 10 1 1 GLU 11 11 1 1 HIS 12 12 1 1 SER 13 13 1 1 ASN 14 14 1 1 LEU 15 15 1 1 CYS 16 16 1 1 GLY 17 17 1 1 ALA 18 18 1 1 GLY 19 19 1 1 GLY 20 20 1 1 ALA 21 21 1 1 ALA 22 22 1 1 GLY 23 23 1 1 stop_ save_ save_CNS/XPLOR_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 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 1 GLY HA2 . 1 . HA2 1 1 1 1 2 1 1 2 CYS H . 2 . HN 1 1 2 1 1 1 1 1 GLY HA2 . 1 . HA2 1 1 2 1 2 1 1 3 CYS H . 3 . HN 1 1 3 1 1 1 1 1 GLY HA3 . 1 . HA1 1 1 3 1 2 1 1 2 CYS H . 2 . HN 1 1 4 1 1 1 1 1 GLY HA3 . 1 . HA1 1 1 4 1 2 1 1 3 CYS H . 3 . HN 1 1 5 1 1 1 1 2 CYS H . 2 . HN 1 1 5 1 2 1 1 3 CYS H . 3 . HN 1 1 6 1 1 1 1 2 CYS HA . 2 . HA 1 1 6 1 2 1 1 3 CYS H . 3 . HN 1 1 7 1 1 1 1 2 CYS HA . 2 . HA 1 1 7 1 2 1 1 5 ASN HB2 . 5 . HB2 1 1 8 1 1 1 1 2 CYS HA . 2 . HA 1 1 8 1 2 1 1 8 CYS HB3 . 8 . HB1 1 1 9 1 1 1 1 2 CYS HB2 . 2 . HB2 1 1 9 1 2 1 1 3 CYS H . 3 . HN 1 1 10 1 1 1 1 2 CYS HB3 . 2 . HB1 1 1 10 1 2 1 1 3 CYS H . 3 . HN 1 1 11 1 1 1 1 3 CYS H . 3 . HN 1 1 11 1 2 1 1 4 SER H . 4 . HN 1 1 12 1 1 1 1 3 CYS HA . 3 . HA 1 1 12 1 2 1 1 5 ASN H . 5 . HN 1 1 13 1 1 1 1 3 CYS HB2 . 3 . HB2 1 1 13 1 2 1 1 4 SER H . 4 . HN 1 1 14 1 1 1 1 3 CYS HB3 . 3 . HB1 1 1 14 1 2 1 1 4 SER H . 4 . HN 1 1 15 1 1 1 1 3 CYS HB3 . 3 . HB1 1 1 15 1 2 1 1 16 CYS HB2 . 16 . HB2 1 1 16 1 1 1 1 4 SER H . 4 . HN 1 1 16 1 2 1 1 5 ASN H . 5 . HN 1 1 17 1 1 1 1 4 SER HA . 4 . HA 1 1 17 1 2 1 1 5 ASN H . 5 . HN 1 1 18 1 1 1 1 5 ASN HA . 5 . HA 1 1 18 1 2 1 1 6 PRO HD2 . 6 . HD2 1 1 19 1 1 1 1 5 ASN HA . 5 . HA 1 1 19 1 2 1 1 6 PRO HD3 . 6 . HD1 1 1 20 1 1 1 1 5 ASN HB2 . 5 . HB2 1 1 20 1 2 1 1 8 CYS H . 8 . HN 1 1 21 1 1 1 1 5 ASN HB2 . 5 . HB2 1 1 21 1 2 1 1 9 HIS H . 9 . HN 1 1 22 1 1 1 1 5 ASN HB3 . 5 . HB1 1 1 22 1 2 1 1 8 CYS H . 8 . HN 1 1 23 1 1 1 1 6 PRO HA . 6 . HA 1 1 23 1 2 1 1 9 HIS HB2 . 9 . HB2 1 1 24 1 1 1 1 6 PRO HA . 6 . HA 1 1 24 1 2 1 1 9 HIS HB3 . 9 . HB1 1 1 25 1 1 1 1 6 PRO HB2 . 6 . HB2 1 1 25 1 2 1 1 7 VAL H . 7 . HN 1 1 26 1 1 1 1 6 PRO HB3 . 6 . HB1 1 1 26 1 2 1 1 7 VAL H . 7 . HN 1 1 27 1 1 1 1 6 PRO HD2 . 6 . HD2 1 1 27 1 2 1 1 7 VAL H . 7 . HN 1 1 28 1 1 1 1 6 PRO HD3 . 6 . HD1 1 1 28 1 2 1 1 7 VAL H . 7 . HN 1 1 29 1 1 1 1 7 VAL H . 7 . HN 1 1 29 1 2 1 1 8 CYS H . 8 . HN 1 1 30 1 1 1 1 7 VAL HA . 7 . HA 1 1 30 1 2 1 1 9 HIS H . 9 . HN 1 1 31 1 1 1 1 7 VAL HA . 7 . HA 1 1 31 1 2 1 1 10 LEU H . 10 . HN 1 1 32 1 1 1 1 7 VAL HA . 7 . HA 1 1 32 1 2 1 1 10 LEU QB . 10 . HB# 1 1 33 1 1 1 1 7 VAL HB . 7 . HB 1 1 33 1 2 1 1 8 CYS H . 8 . HN 1 1 34 1 1 1 1 7 VAL QG . 7 . HG* 1 1 34 1 2 1 1 12 HIS HD1 . 12 . HD1 1 1 35 1 1 1 1 7 VAL MG1 . 7 . HG1# 1 1 35 1 2 1 1 8 CYS H . 8 . HN 1 1 36 1 1 1 1 7 VAL MG2 . 7 . HG2# 1 1 36 1 2 1 1 8 CYS H . 8 . HN 1 1 37 1 1 1 1 8 CYS H . 8 . HN 1 1 37 1 2 1 1 9 HIS H . 9 . HN 1 1 38 1 1 1 1 8 CYS HA . 8 . HA 1 1 38 1 2 1 1 11 GLU H . 11 . HN 1 1 39 1 1 1 1 8 CYS HA . 8 . HA 1 1 39 1 2 1 1 12 HIS HD2 . 12 . HD2 1 1 40 1 1 1 1 8 CYS HB2 . 8 . HB2 1 1 40 1 2 1 1 9 HIS H . 9 . HN 1 1 41 1 1 1 1 8 CYS HB3 . 8 . HB1 1 1 41 1 2 1 1 9 HIS H . 9 . HN 1 1 42 1 1 1 1 8 CYS HB3 . 8 . HB1 1 1 42 1 2 1 1 12 HIS HD2 . 12 . HD2 1 1 43 1 1 1 1 9 HIS H . 9 . HN 1 1 43 1 2 1 1 10 LEU H . 10 . HN 1 1 44 1 1 1 1 9 HIS HA . 9 . HA 1 1 44 1 2 1 1 12 HIS H . 12 . HN 1 1 45 1 1 1 1 9 HIS HB2 . 9 . HB2 1 1 45 1 2 1 1 10 LEU H . 10 . HN 1 1 46 1 1 1 1 9 HIS HB3 . 9 . HB1 1 1 46 1 2 1 1 10 LEU H . 10 . HN 1 1 47 1 1 1 1 10 LEU H . 10 . HN 1 1 47 1 2 1 1 11 GLU H . 11 . HN 1 1 48 1 1 1 1 10 LEU HA . 10 . HA 1 1 48 1 2 1 1 11 GLU H . 11 . HN 1 1 49 1 1 1 1 10 LEU QB . 10 . HB# 1 1 49 1 2 1 1 11 GLU H . 11 . HN 1 1 50 1 1 1 1 11 GLU H . 11 . HN 1 1 50 1 2 1 1 12 HIS H . 12 . HN 1 1 51 1 1 1 1 11 GLU HA . 11 . HA 1 1 51 1 2 1 1 12 HIS H . 12 . HN 1 1 52 1 1 1 1 11 GLU QB . 11 . HB# 1 1 52 1 2 1 1 12 HIS H . 12 . HN 1 1 53 1 1 1 1 11 GLU QB . 11 . HB# 1 1 53 1 2 1 1 12 HIS HD2 . 12 . HD2 1 1 54 1 1 1 1 11 GLU HB2 . 11 . HB2 1 1 54 1 2 1 1 12 HIS H . 12 . HN 1 1 55 1 1 1 1 11 GLU HB2 . 11 . HB2 1 1 55 1 2 1 1 12 HIS HD2 . 12 . HD2 1 1 56 1 1 1 1 11 GLU HB3 . 11 . HB1 1 1 56 1 2 1 1 12 HIS H . 12 . HN 1 1 57 1 1 1 1 11 GLU HB3 . 11 . HB1 1 1 57 1 2 1 1 12 HIS HD2 . 12 . HD2 1 1 58 1 1 1 1 11 GLU HG2 . 11 . HG2 1 1 58 1 2 1 1 12 HIS HD2 . 12 . HD2 1 1 59 1 1 1 1 11 GLU HG3 . 11 . HG1 1 1 59 1 2 1 1 12 HIS HD2 . 12 . HD2 1 1 60 1 1 1 1 12 HIS HA . 12 . HA 1 1 60 1 2 1 1 13 SER H . 13 . HN 1 1 61 1 1 1 1 12 HIS HA . 12 . HA 1 1 61 1 2 1 1 14 ASN H . 14 . HN 1 1 62 1 1 1 1 12 HIS HA . 12 . HA 1 1 62 1 2 1 1 15 LEU H . 15 . HN 1 1 63 1 1 1 1 12 HIS HB3 . 12 . HB1 1 1 63 1 2 1 1 15 LEU H . 15 . HN 1 1 64 1 1 1 1 12 HIS HB3 . 12 . HB1 1 1 64 1 2 1 1 15 LEU HB2 . 15 . HB2 1 1 65 1 1 1 1 12 HIS HB3 . 12 . HB1 1 1 65 1 2 1 1 15 LEU HB3 . 15 . HB1 1 1 66 1 1 1 1 12 HIS HB3 . 12 . HB1 1 1 66 1 2 1 1 15 LEU HG . 15 . HG 1 1 67 1 1 1 1 13 SER H . 13 . HN 1 1 67 1 2 1 1 14 ASN H . 14 . HN 1 1 68 1 1 1 1 13 SER HA . 13 . HA 1 1 68 1 2 1 1 16 CYS H . 16 . HN 1 1 69 1 1 1 1 13 SER QB . 13 . HB# 1 1 69 1 2 1 1 16 CYS H . 16 . HN 1 1 70 1 1 1 1 13 SER QB . 13 . HB# 1 1 70 1 2 1 1 16 CYS HB2 . 16 . HB2 1 1 71 1 1 1 1 13 SER HB2 . 13 . HB2 1 1 71 1 2 1 1 14 ASN H . 14 . HN 1 1 72 1 1 1 1 13 SER HB3 . 13 . HB1 1 1 72 1 2 1 1 14 ASN H . 14 . HN 1 1 73 1 1 1 1 14 ASN H . 14 . HN 1 1 73 1 2 1 1 15 LEU H . 15 . HN 1 1 74 1 1 1 1 14 ASN HA . 14 . HA 1 1 74 1 2 1 1 15 LEU H . 15 . HN 1 1 75 1 1 1 1 15 LEU H . 15 . HN 1 1 75 1 2 1 1 16 CYS H . 16 . HN 1 1 76 1 1 1 1 15 LEU HA . 15 . HA 1 1 76 1 2 1 1 16 CYS H . 16 . HN 1 1 77 1 1 1 1 15 LEU HB2 . 15 . HB2 1 1 77 1 2 1 1 16 CYS H . 16 . HN 1 1 78 1 1 1 1 15 LEU HB3 . 15 . HB1 1 1 78 1 2 1 1 16 CYS H . 16 . HN 1 1 79 1 1 1 1 16 CYS H . 16 . HN 1 1 79 1 2 1 1 17 GLY H . 17 . HN 1 1 80 1 1 1 1 16 CYS HB2 . 16 . HB2 1 1 80 1 2 1 1 17 GLY H . 17 . HN 1 1 81 1 1 1 1 16 CYS HB3 . 16 . HB1 1 1 81 1 2 1 1 17 GLY H . 17 . HN 1 1 82 1 1 1 1 17 GLY HA2 . 17 . HA2 1 1 82 1 2 1 1 18 ALA H . 18 . HN 1 1 83 1 1 1 1 17 GLY HA3 . 17 . HA1 1 1 83 1 2 1 1 18 ALA H . 18 . HN 1 1 84 1 1 1 1 18 ALA H . 18 . HN 1 1 84 1 2 1 1 19 GLY H . 19 . HN 1 1 85 1 1 1 1 18 ALA HA . 18 . HA 1 1 85 1 2 1 1 19 GLY H . 19 . HN 1 1 86 1 1 1 1 20 GLY HA2 . 20 . HA2 1 1 86 1 2 1 1 21 ALA H . 21 . HN 1 1 87 1 1 1 1 20 GLY HA3 . 20 . HA1 1 1 87 1 2 1 1 21 ALA H . 21 . HN 1 1 88 1 1 1 1 21 ALA HA . 21 . HA 1 1 88 1 2 1 1 22 ALA H . 22 . HN 1 1 89 1 1 1 1 22 ALA HA . 22 . HA 1 1 89 1 2 1 1 23 GLY H . 23 . HN 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 2.455 1.8 3.21 1 1 2 1 . . . . . 3.555 1.8 5.31 1 1 3 1 . . . . . 2.455 1.8 3.21 1 1 4 1 . . . . . 3.555 1.8 5.31 1 1 5 1 . . . . . 2.58 1.8 3.36 1 1 6 1 . . . . . 2.72 1.8 3.64 1 1 7 1 . . . . . 2.625 1.8 3.45 1 1 8 1 . . . . . 3.65 1.8 4.0 1 1 9 1 . . . . . 2.75 1.8 3.7 1 1 10 1 . . . . . 2.3 1.8 2.8 1 1 11 1 . . . . . 2.38 1.8 2.96 1 1 12 1 . . . . . 2.72 1.8 3.64 1 1 13 1 . . . . . 2.69 1.8 3.58 1 1 14 1 . . . . . 2.875 1.8 3.95 1 1 15 1 . . . . . 3.65 1.8 4.0 1 1 16 1 . . . . . 2.335 1.8 2.87 1 1 17 1 . . . . . 2.595 1.8 3.39 1 1 18 1 . . . . . 2.195 1.8 2.59 1 1 19 1 . . . . . 2.195 1.8 2.59 1 1 20 1 . . . . . 2.595 1.8 3.39 1 1 21 1 . . . . . 3.31 1.8 4.82 1 1 22 1 . . . . . 3.325 1.8 4.85 1 1 23 1 . . . . . 2.52 1.8 3.24 1 1 24 1 . . . . . 2.52 1.8 3.24 1 1 25 1 . . . . . 3.215 1.8 4.63 1 1 26 1 . . . . . 3.215 1.8 4.63 1 1 27 1 . . . . . 3.65 1.8 5.5 1 1 28 1 . . . . . 3.65 1.8 5.5 1 1 29 1 . . . . . 2.225 1.8 2.65 1 1 30 1 . . . . . 3.65 1.8 5.5 1 1 31 1 . . . . . 2.795 1.8 3.79 1 1 32 1 . . . . . 3.235 1.8 4.67 1 1 33 1 . . . . . 2.285 1.8 2.77 1 1 34 1 . . . . . 4.945 1.8 8.09 1 1 35 1 . . . . . 4.165 1.8 6.53 1 1 36 1 . . . . . 4.165 1.8 6.53 1 1 37 1 . . . . . 2.315 1.8 2.83 1 1 38 1 . . . . . 2.985 1.8 4.17 1 1 39 1 . . . . . 3.0 1.8 4.2 1 1 40 1 . . . . . 2.58 1.8 3.56 1 1 41 1 . . . . . 2.455 1.8 3.11 1 1 42 1 . . . . . 3.65 1.8 5.5 1 1 43 1 . . . . . 2.47 1.8 3.14 1 1 44 1 . . . . . 2.905 1.8 4.01 1 1 45 1 . . . . . 2.69 1.8 3.58 1 1 46 1 . . . . . 2.69 1.8 3.58 1 1 47 1 . . . . . 2.44 1.8 3.08 1 1 48 1 . . . . . 2.69 1.8 3.58 1 1 49 1 . . . . . 3.02 1.8 4.24 1 1 50 1 . . . . . 2.335 1.8 2.87 1 1 51 1 . . . . . 2.64 1.8 3.48 1 1 52 1 . . . . . 2.71 1.8 3.62 1 1 53 1 . . . . . 2.945 1.8 4.09 1 1 54 1 . . . . . 2.845 1.8 3.89 1 1 55 1 . . . . . 3.155 1.8 4.51 1 1 56 1 . . . . . 2.845 1.8 3.89 1 1 57 1 . . . . . 3.155 1.8 4.51 1 1 58 1 . . . . . 3.65 1.8 5.5 1 1 59 1 . . . . . 3.65 1.8 5.5 1 1 60 1 . . . . . 2.365 1.8 2.93 1 1 61 1 . . . . . 2.765 1.8 3.73 1 1 62 1 . . . . . 3.17 1.8 4.54 1 1 63 1 . . . . . 2.89 1.8 3.98 1 1 64 1 . . . . . 3.015 1.8 4.23 1 1 65 1 . . . . . 3.015 1.8 4.23 1 1 66 1 . . . . . 3.325 1.8 4.85 1 1 67 1 . . . . . 2.47 1.8 3.14 1 1 68 1 . . . . . 3.28 1.8 4.76 1 1 69 1 . . . . . 3.5 1.8 5.2 1 1 70 1 . . . . . 4.09 1.8 6.38 1 1 71 1 . . . . . 2.92 1.8 4.04 1 1 72 1 . . . . . 2.92 1.8 4.04 1 1 73 1 . . . . . 2.41 1.8 3.02 1 1 74 1 . . . . . 2.625 1.8 3.45 1 1 75 1 . . . . . 2.75 1.8 3.7 1 1 76 1 . . . . . 2.625 1.8 3.45 1 1 77 1 . . . . . 2.92 1.8 4.04 1 1 78 1 . . . . . 2.675 1.8 3.55 1 1 79 1 . . . . . 2.485 1.8 3.17 1 1 80 1 . . . . . 2.955 1.8 4.11 1 1 81 1 . . . . . 3.26 1.8 4.72 1 1 82 1 . . . . . 2.52 1.8 3.34 1 1 83 1 . . . . . 2.52 1.8 3.34 1 1 84 1 . . . . . 2.705 1.8 3.61 1 1 85 1 . . . . . 2.455 1.8 3.11 1 1 86 1 . . . . . 2.47 1.8 3.14 1 1 87 1 . . . . . 2.47 1.8 3.14 1 1 88 1 . . . . . 2.3 1.8 2.8 1 1 89 1 . . . . . 2.285 1.8 2.77 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 GLY C C 6.153 2.498 6.529 1.00 . A A . 1 GLY C 1 1 1 2 1 1 1 GLY CA C 6.419 3.954 6.857 1.00 . A A . 1 GLY CA 1 1 1 3 1 1 1 GLY H1 H 7.369 5.267 5.498 1.00 . A A . 1 GLY H1 1 1 1 4 1 1 1 GLY HA2 H 7.334 4.022 7.425 1.00 . A A . 1 GLY HA2 1 1 1 5 1 1 1 GLY HA3 H 5.605 4.331 7.459 1.00 . A A . 1 GLY HA3 1 1 1 6 1 1 1 GLY N N 6.540 4.776 5.668 1.00 . A A . 1 GLY N 1 1 1 7 1 1 1 GLY O O 6.953 1.841 5.868 1.00 . A A . 1 GLY O 1 1 1 8 1 1 2 CYS C C 4.025 0.465 5.365 1.00 . A A . 2 CYS C 1 1 1 9 1 1 2 CYS CA C 4.645 0.614 6.755 1.00 . A A . 2 CYS CA 1 1 1 10 1 1 2 CYS CB C 3.656 0.140 7.828 1.00 . A A . 2 CYS CB 1 1 1 11 1 1 2 CYS H H 4.431 2.572 7.521 1.00 . A A . 2 CYS H 1 1 1 12 1 1 2 CYS HA H 5.537 0.008 6.805 1.00 . A A . 2 CYS HA 1 1 1 13 1 1 2 CYS HB2 H 3.941 0.568 8.778 1.00 . A A . 2 CYS HB2 1 1 1 14 1 1 2 CYS HB3 H 2.666 0.487 7.569 1.00 . A A . 2 CYS HB3 1 1 1 15 1 1 2 CYS N N 5.025 1.997 6.999 1.00 . A A . 2 CYS N 1 1 1 16 1 1 2 CYS O O 4.264 -0.522 4.674 1.00 . A A . 2 CYS O 1 1 1 17 1 1 2 CYS SG S 3.573 -1.671 8.043 1.00 . A A . 2 CYS SG 1 1 1 18 1 1 3 CYS C C 3.482 1.322 2.494 1.00 . A A . 3 CYS C 1 1 1 19 1 1 3 CYS CA C 2.527 1.435 3.683 1.00 . A A . 3 CYS CA 1 1 1 20 1 1 3 CYS CB C 1.658 2.685 3.539 1.00 . A A . 3 CYS CB 1 1 1 21 1 1 3 CYS H H 3.065 2.204 5.579 1.00 . A A . 3 CYS H 1 1 1 22 1 1 3 CYS HA H 1.881 0.571 3.676 1.00 . A A . 3 CYS HA 1 1 1 23 1 1 3 CYS HB2 H 2.296 3.556 3.516 1.00 . A A . 3 CYS HB2 1 1 1 24 1 1 3 CYS HB3 H 1.107 2.625 2.612 1.00 . A A . 3 CYS HB3 1 1 1 25 1 1 3 CYS N N 3.217 1.447 4.975 1.00 . A A . 3 CYS N 1 1 1 26 1 1 3 CYS O O 3.115 0.766 1.458 1.00 . A A . 3 CYS O 1 1 1 27 1 1 3 CYS SG S 0.455 2.913 4.890 1.00 . A A . 3 CYS SG 1 1 1 28 1 1 4 SER C C 6.126 0.337 1.306 1.00 . A A . 4 SER C 1 1 1 29 1 1 4 SER CA C 5.678 1.778 1.557 1.00 . A A . 4 SER CA 1 1 1 30 1 1 4 SER CB C 6.876 2.671 1.878 1.00 . A A . 4 SER CB 1 1 1 31 1 1 4 SER H H 4.943 2.277 3.480 1.00 . A A . 4 SER H 1 1 1 32 1 1 4 SER HA H 5.201 2.147 0.661 1.00 . A A . 4 SER HA 1 1 1 33 1 1 4 SER HB2 H 7.742 2.319 1.336 1.00 . A A . 4 SER HB2 1 1 1 34 1 1 4 SER HB3 H 6.656 3.686 1.582 1.00 . A A . 4 SER HB3 1 1 1 35 1 1 4 SER HG H 7.725 1.893 3.464 1.00 . A A . 4 SER HG 1 1 1 36 1 1 4 SER N N 4.696 1.843 2.634 1.00 . A A . 4 SER N 1 1 1 37 1 1 4 SER O O 6.664 0.017 0.247 1.00 . A A . 4 SER O 1 1 1 38 1 1 4 SER OG O 7.167 2.651 3.263 1.00 . A A . 4 SER OG 1 1 1 39 1 1 5 ASN C C 5.094 -2.697 1.489 1.00 . A A . 5 ASN C 1 1 1 40 1 1 5 ASN CA C 6.233 -1.938 2.153 1.00 . A A . 5 ASN CA 1 1 1 41 1 1 5 ASN CB C 6.536 -2.543 3.528 1.00 . A A . 5 ASN CB 1 1 1 42 1 1 5 ASN CG C 7.838 -2.035 4.113 1.00 . A A . 5 ASN CG 1 1 1 43 1 1 5 ASN H H 5.421 -0.223 3.090 1.00 . A A . 5 ASN H 1 1 1 44 1 1 5 ASN HA H 7.113 -2.007 1.532 1.00 . A A . 5 ASN HA 1 1 1 45 1 1 5 ASN HB2 H 5.736 -2.290 4.210 1.00 . A A . 5 ASN HB2 1 1 1 46 1 1 5 ASN HB3 H 6.597 -3.618 3.436 1.00 . A A . 5 ASN HB3 1 1 1 47 1 1 5 ASN HD21 H 6.867 -1.203 5.630 1.00 . A A . 5 ASN HD21 1 1 1 48 1 1 5 ASN HD22 H 8.581 -1.005 5.636 1.00 . A A . 5 ASN HD22 1 1 1 49 1 1 5 ASN N N 5.876 -0.532 2.277 1.00 . A A . 5 ASN N 1 1 1 50 1 1 5 ASN ND2 N 7.753 -1.346 5.241 1.00 . A A . 5 ASN ND2 1 1 1 51 1 1 5 ASN O O 3.947 -2.598 1.918 1.00 . A A . 5 ASN O 1 1 1 52 1 1 5 ASN OD1 O 8.909 -2.260 3.557 1.00 . A A . 5 ASN OD1 1 1 1 53 1 1 6 PRO C C 3.505 -5.100 0.528 1.00 . A A . 6 PRO C 1 1 1 54 1 1 6 PRO CA C 4.397 -4.214 -0.342 1.00 . A A . 6 PRO CA 1 1 1 55 1 1 6 PRO CB C 5.250 -5.075 -1.275 1.00 . A A . 6 PRO CB 1 1 1 56 1 1 6 PRO CD C 6.749 -3.585 -0.160 1.00 . A A . 6 PRO CD 1 1 1 57 1 1 6 PRO CG C 6.504 -4.295 -1.462 1.00 . A A . 6 PRO CG 1 1 1 58 1 1 6 PRO HA H 3.773 -3.560 -0.934 1.00 . A A . 6 PRO HA 1 1 1 59 1 1 6 PRO HB2 H 5.444 -6.031 -0.809 1.00 . A A . 6 PRO HB2 1 1 1 60 1 1 6 PRO HB3 H 4.732 -5.222 -2.210 1.00 . A A . 6 PRO HB3 1 1 1 61 1 1 6 PRO HD2 H 7.383 -4.180 0.481 1.00 . A A . 6 PRO HD2 1 1 1 62 1 1 6 PRO HD3 H 7.191 -2.616 -0.336 1.00 . A A . 6 PRO HD3 1 1 1 63 1 1 6 PRO HG2 H 7.322 -4.964 -1.685 1.00 . A A . 6 PRO HG2 1 1 1 64 1 1 6 PRO HG3 H 6.374 -3.580 -2.261 1.00 . A A . 6 PRO HG3 1 1 1 65 1 1 6 PRO N N 5.397 -3.448 0.418 1.00 . A A . 6 PRO N 1 1 1 66 1 1 6 PRO O O 2.291 -5.142 0.336 1.00 . A A . 6 PRO O 1 1 1 67 1 1 7 VAL C C 2.367 -5.912 3.209 1.00 . A A . 7 VAL C 1 1 1 68 1 1 7 VAL CA C 3.366 -6.693 2.363 1.00 . A A . 7 VAL CA 1 1 1 69 1 1 7 VAL CB C 4.313 -7.479 3.295 1.00 . A A . 7 VAL CB 1 1 1 70 1 1 7 VAL CG1 C 3.530 -8.435 4.185 1.00 . A A . 7 VAL CG1 1 1 1 71 1 1 7 VAL CG2 C 5.357 -8.234 2.484 1.00 . A A . 7 VAL CG2 1 1 1 72 1 1 7 VAL H H 5.079 -5.728 1.583 1.00 . A A . 7 VAL H 1 1 1 73 1 1 7 VAL HA H 2.827 -7.401 1.750 1.00 . A A . 7 VAL HA 1 1 1 74 1 1 7 VAL HB H 4.827 -6.773 3.930 1.00 . A A . 7 VAL HB 1 1 1 75 1 1 7 VAL HG11 H 2.826 -7.875 4.781 1.00 . A A . 7 VAL HG11 1 1 1 76 1 1 7 VAL HG12 H 4.212 -8.964 4.834 1.00 . A A . 7 VAL HG12 1 1 1 77 1 1 7 VAL HG13 H 2.996 -9.145 3.569 1.00 . A A . 7 VAL HG13 1 1 1 78 1 1 7 VAL HG21 H 6.329 -8.098 2.933 1.00 . A A . 7 VAL HG21 1 1 1 79 1 1 7 VAL HG22 H 5.371 -7.853 1.473 1.00 . A A . 7 VAL HG22 1 1 1 80 1 1 7 VAL HG23 H 5.111 -9.285 2.469 1.00 . A A . 7 VAL HG23 1 1 1 81 1 1 7 VAL N N 4.110 -5.805 1.477 1.00 . A A . 7 VAL N 1 1 1 82 1 1 7 VAL O O 1.193 -6.267 3.298 1.00 . A A . 7 VAL O 1 1 1 83 1 1 8 CYS C C 0.954 -3.288 3.817 1.00 . A A . 8 CYS C 1 1 1 84 1 1 8 CYS CA C 1.995 -4.004 4.660 1.00 . A A . 8 CYS CA 1 1 1 85 1 1 8 CYS CB C 2.834 -2.977 5.408 1.00 . A A . 8 CYS CB 1 1 1 86 1 1 8 CYS H H 3.787 -4.604 3.704 1.00 . A A . 8 CYS H 1 1 1 87 1 1 8 CYS HA H 1.495 -4.641 5.374 1.00 . A A . 8 CYS HA 1 1 1 88 1 1 8 CYS HB2 H 3.752 -3.437 5.726 1.00 . A A . 8 CYS HB2 1 1 1 89 1 1 8 CYS HB3 H 3.059 -2.166 4.736 1.00 . A A . 8 CYS HB3 1 1 1 90 1 1 8 CYS N N 2.843 -4.840 3.821 1.00 . A A . 8 CYS N 1 1 1 91 1 1 8 CYS O O -0.191 -3.144 4.227 1.00 . A A . 8 CYS O 1 1 1 92 1 1 8 CYS SG S 2.021 -2.259 6.873 1.00 . A A . 8 CYS SG 1 1 1 93 1 1 9 HIS C C -0.681 -2.997 1.310 1.00 . A A . 9 HIS C 1 1 1 94 1 1 9 HIS CA C 0.485 -2.115 1.729 1.00 . A A . 9 HIS CA 1 1 1 95 1 1 9 HIS CB C 1.251 -1.656 0.489 1.00 . A A . 9 HIS CB 1 1 1 96 1 1 9 HIS CD2 C -0.570 0.136 -0.009 1.00 . A A . 9 HIS CD2 1 1 1 97 1 1 9 HIS CE1 C 0.345 1.036 -1.785 1.00 . A A . 9 HIS CE1 1 1 1 98 1 1 9 HIS CG C 0.594 -0.520 -0.243 1.00 . A A . 9 HIS CG 1 1 1 99 1 1 9 HIS H H 2.312 -2.973 2.388 1.00 . A A . 9 HIS H 1 1 1 100 1 1 9 HIS HA H 0.100 -1.250 2.248 1.00 . A A . 9 HIS HA 1 1 1 101 1 1 9 HIS HB2 H 2.237 -1.340 0.784 1.00 . A A . 9 HIS HB2 1 1 1 102 1 1 9 HIS HB3 H 1.336 -2.486 -0.196 1.00 . A A . 9 HIS HB3 1 1 1 103 1 1 9 HIS HD1 H 1.994 -0.178 -1.783 1.00 . A A . 9 HIS HD1 1 1 1 104 1 1 9 HIS HD2 H -1.266 -0.061 0.794 1.00 . A A . 9 HIS HD2 1 1 1 105 1 1 9 HIS HE1 H 0.519 1.668 -2.643 1.00 . A A . 9 HIS HE1 1 1 1 106 1 1 9 HIS HE2 H -1.511 1.639 -1.146 1.00 . A A . 9 HIS HE2 1 1 1 107 1 1 9 HIS N N 1.370 -2.831 2.644 1.00 . A A . 9 HIS N 1 1 1 108 1 1 9 HIS ND1 N 1.141 0.069 -1.364 1.00 . A A . 9 HIS ND1 1 1 1 109 1 1 9 HIS NE2 N -0.699 1.097 -0.981 1.00 . A A . 9 HIS NE2 1 1 1 110 1 1 9 HIS O O -1.805 -2.526 1.183 1.00 . A A . 9 HIS O 1 1 1 111 1 1 10 LEU C C -2.478 -5.366 1.780 1.00 . A A . 10 LEU C 1 1 1 112 1 1 10 LEU CA C -1.423 -5.228 0.685 1.00 . A A . 10 LEU CA 1 1 1 113 1 1 10 LEU CB C -0.791 -6.590 0.383 1.00 . A A . 10 LEU CB 1 1 1 114 1 1 10 LEU CD1 C -2.368 -7.241 -1.458 1.00 . A A . 10 LEU CD1 1 1 1 115 1 1 10 LEU CD2 C -1.046 -8.997 -0.265 1.00 . A A . 10 LEU CD2 1 1 1 116 1 1 10 LEU CG C -1.759 -7.660 -0.129 1.00 . A A . 10 LEU CG 1 1 1 117 1 1 10 LEU H H 0.530 -4.580 1.203 1.00 . A A . 10 LEU H 1 1 1 118 1 1 10 LEU HA H -1.895 -4.850 -0.210 1.00 . A A . 10 LEU HA 1 1 1 119 1 1 10 LEU HB2 H -0.020 -6.448 -0.360 1.00 . A A . 10 LEU HB2 1 1 1 120 1 1 10 LEU HB3 H -0.332 -6.958 1.288 1.00 . A A . 10 LEU HB3 1 1 1 121 1 1 10 LEU HD11 H -2.769 -8.109 -1.960 1.00 . A A . 10 LEU HD11 1 1 1 122 1 1 10 LEU HD12 H -1.607 -6.788 -2.077 1.00 . A A . 10 LEU HD12 1 1 1 123 1 1 10 LEU HD13 H -3.159 -6.528 -1.283 1.00 . A A . 10 LEU HD13 1 1 1 124 1 1 10 LEU HD21 H -0.844 -9.193 -1.307 1.00 . A A . 10 LEU HD21 1 1 1 125 1 1 10 LEU HD22 H -1.673 -9.781 0.134 1.00 . A A . 10 LEU HD22 1 1 1 126 1 1 10 LEU HD23 H -0.115 -8.967 0.282 1.00 . A A . 10 LEU HD23 1 1 1 127 1 1 10 LEU HG H -2.562 -7.779 0.583 1.00 . A A . 10 LEU HG 1 1 1 128 1 1 10 LEU N N -0.397 -4.272 1.090 1.00 . A A . 10 LEU N 1 1 1 129 1 1 10 LEU O O -3.676 -5.257 1.522 1.00 . A A . 10 LEU O 1 1 1 130 1 1 11 GLU C C -3.595 -4.400 4.446 1.00 . A A . 11 GLU C 1 1 1 131 1 1 11 GLU CA C -2.899 -5.728 4.154 1.00 . A A . 11 GLU CA 1 1 1 132 1 1 11 GLU CB C -2.090 -6.178 5.377 1.00 . A A . 11 GLU CB 1 1 1 133 1 1 11 GLU CD C -3.877 -7.484 6.609 1.00 . A A . 11 GLU CD 1 1 1 134 1 1 11 GLU CG C -2.907 -6.320 6.653 1.00 . A A . 11 GLU CG 1 1 1 135 1 1 11 GLU H H -1.045 -5.654 3.140 1.00 . A A . 11 GLU H 1 1 1 136 1 1 11 GLU HA H -3.641 -6.473 3.922 1.00 . A A . 11 GLU HA 1 1 1 137 1 1 11 GLU HB2 H -1.640 -7.135 5.159 1.00 . A A . 11 GLU HB2 1 1 1 138 1 1 11 GLU HB3 H -1.305 -5.458 5.557 1.00 . A A . 11 GLU HB3 1 1 1 139 1 1 11 GLU HG2 H -2.231 -6.468 7.481 1.00 . A A . 11 GLU HG2 1 1 1 140 1 1 11 GLU HG3 H -3.467 -5.409 6.807 1.00 . A A . 11 GLU HG3 1 1 1 141 1 1 11 GLU N N -2.013 -5.589 3.004 1.00 . A A . 11 GLU N 1 1 1 142 1 1 11 GLU O O -4.810 -4.329 4.623 1.00 . A A . 11 GLU O 1 1 1 143 1 1 11 GLU OE1 O -4.763 -7.488 5.732 1.00 . A A . 11 GLU OE1 1 1 1 144 1 1 11 GLU OE2 O -3.749 -8.388 7.457 1.00 . A A . 11 GLU OE2 1 1 1 145 1 1 12 HIS C C -3.726 -1.340 3.416 1.00 . A A . 12 HIS C 1 1 1 146 1 1 12 HIS CA C -3.327 -2.001 4.728 1.00 . A A . 12 HIS CA 1 1 1 147 1 1 12 HIS CB C -2.288 -1.120 5.444 1.00 . A A . 12 HIS CB 1 1 1 148 1 1 12 HIS CD2 C -1.663 -2.933 7.208 1.00 . A A . 12 HIS CD2 1 1 1 149 1 1 12 HIS CE1 C -0.864 -1.605 8.756 1.00 . A A . 12 HIS CE1 1 1 1 150 1 1 12 HIS CG C -1.773 -1.663 6.747 1.00 . A A . 12 HIS CG 1 1 1 151 1 1 12 HIS H H -1.847 -3.456 4.304 1.00 . A A . 12 HIS H 1 1 1 152 1 1 12 HIS HA H -4.204 -2.095 5.351 1.00 . A A . 12 HIS HA 1 1 1 153 1 1 12 HIS HB2 H -1.439 -0.986 4.793 1.00 . A A . 12 HIS HB2 1 1 1 154 1 1 12 HIS HB3 H -2.730 -0.155 5.643 1.00 . A A . 12 HIS HB3 1 1 1 155 1 1 12 HIS HD1 H -1.189 0.122 7.705 1.00 . A A . 12 HIS HD1 1 1 1 156 1 1 12 HIS HD2 H -1.932 -3.831 6.675 1.00 . A A . 12 HIS HD2 1 1 1 157 1 1 12 HIS HE1 H -0.426 -1.243 9.674 1.00 . A A . 12 HIS HE1 1 1 1 158 1 1 12 HIS HE2 H -0.789 -3.639 8.981 1.00 . A A . 12 HIS HE2 1 1 1 159 1 1 12 HIS N N -2.809 -3.337 4.473 1.00 . A A . 12 HIS N 1 1 1 160 1 1 12 HIS ND1 N -1.261 -0.855 7.742 1.00 . A A . 12 HIS ND1 1 1 1 161 1 1 12 HIS NE2 N -1.099 -2.868 8.458 1.00 . A A . 12 HIS NE2 1 1 1 162 1 1 12 HIS O O -3.470 -0.155 3.200 1.00 . A A . 12 HIS O 1 1 1 163 1 1 13 SER C C -5.810 -0.526 1.377 1.00 . A A . 13 SER C 1 1 1 164 1 1 13 SER CA C -4.765 -1.621 1.242 1.00 . A A . 13 SER CA 1 1 1 165 1 1 13 SER CB C -5.308 -2.777 0.413 1.00 . A A . 13 SER CB 1 1 1 166 1 1 13 SER H H -4.510 -3.057 2.769 1.00 . A A . 13 SER H 1 1 1 167 1 1 13 SER HA H -3.897 -1.214 0.745 1.00 . A A . 13 SER HA 1 1 1 168 1 1 13 SER HB2 H -5.961 -2.390 -0.353 1.00 . A A . 13 SER HB2 1 1 1 169 1 1 13 SER HB3 H -4.485 -3.306 -0.044 1.00 . A A . 13 SER HB3 1 1 1 170 1 1 13 SER HG H -5.511 -4.480 1.370 1.00 . A A . 13 SER HG 1 1 1 171 1 1 13 SER N N -4.342 -2.115 2.541 1.00 . A A . 13 SER N 1 1 1 172 1 1 13 SER O O -5.711 0.517 0.738 1.00 . A A . 13 SER O 1 1 1 173 1 1 13 SER OG O -6.038 -3.679 1.229 1.00 . A A . 13 SER OG 1 1 1 174 1 1 14 ASN C C -7.413 1.296 3.399 1.00 . A A . 14 ASN C 1 1 1 175 1 1 14 ASN CA C -7.867 0.206 2.430 1.00 . A A . 14 ASN CA 1 1 1 176 1 1 14 ASN CB C -9.147 -0.484 2.927 1.00 . A A . 14 ASN CB 1 1 1 177 1 1 14 ASN CG C -8.965 -1.227 4.237 1.00 . A A . 14 ASN CG 1 1 1 178 1 1 14 ASN H H -6.826 -1.621 2.697 1.00 . A A . 14 ASN H 1 1 1 179 1 1 14 ASN HA H -8.075 0.670 1.477 1.00 . A A . 14 ASN HA 1 1 1 180 1 1 14 ASN HB2 H -9.915 0.260 3.067 1.00 . A A . 14 ASN HB2 1 1 1 181 1 1 14 ASN HB3 H -9.475 -1.191 2.178 1.00 . A A . 14 ASN HB3 1 1 1 182 1 1 14 ASN HD21 H -8.978 -2.972 3.285 1.00 . A A . 14 ASN HD21 1 1 1 183 1 1 14 ASN HD22 H -8.787 -3.053 5.000 1.00 . A A . 14 ASN HD22 1 1 1 184 1 1 14 ASN N N -6.806 -0.767 2.213 1.00 . A A . 14 ASN N 1 1 1 185 1 1 14 ASN ND2 N -8.904 -2.550 4.167 1.00 . A A . 14 ASN ND2 1 1 1 186 1 1 14 ASN O O -7.959 2.397 3.404 1.00 . A A . 14 ASN O 1 1 1 187 1 1 14 ASN OD1 O -8.871 -0.624 5.300 1.00 . A A . 14 ASN OD1 1 1 1 188 1 1 15 LEU C C -4.997 2.983 4.518 1.00 . A A . 15 LEU C 1 1 1 189 1 1 15 LEU CA C -5.884 1.935 5.185 1.00 . A A . 15 LEU CA 1 1 1 190 1 1 15 LEU CB C -5.076 1.231 6.287 1.00 . A A . 15 LEU CB 1 1 1 191 1 1 15 LEU CD1 C -7.160 1.042 7.692 1.00 . A A . 15 LEU CD1 1 1 1 192 1 1 15 LEU CD2 C -6.146 -1.018 6.679 1.00 . A A . 15 LEU CD2 1 1 1 193 1 1 15 LEU CG C -5.869 0.356 7.270 1.00 . A A . 15 LEU CG 1 1 1 194 1 1 15 LEU H H -6.015 0.089 4.158 1.00 . A A . 15 LEU H 1 1 1 195 1 1 15 LEU HA H -6.721 2.437 5.634 1.00 . A A . 15 LEU HA 1 1 1 196 1 1 15 LEU HB2 H -4.337 0.606 5.810 1.00 . A A . 15 LEU HB2 1 1 1 197 1 1 15 LEU HB3 H -4.560 1.988 6.858 1.00 . A A . 15 LEU HB3 1 1 1 198 1 1 15 LEU HD11 H -7.981 0.345 7.608 1.00 . A A . 15 LEU HD11 1 1 1 199 1 1 15 LEU HD12 H -7.343 1.891 7.051 1.00 . A A . 15 LEU HD12 1 1 1 200 1 1 15 LEU HD13 H -7.073 1.375 8.715 1.00 . A A . 15 LEU HD13 1 1 1 201 1 1 15 LEU HD21 H -5.893 -1.779 7.403 1.00 . A A . 15 LEU HD21 1 1 1 202 1 1 15 LEU HD22 H -5.550 -1.154 5.790 1.00 . A A . 15 LEU HD22 1 1 1 203 1 1 15 LEU HD23 H -7.193 -1.096 6.427 1.00 . A A . 15 LEU HD23 1 1 1 204 1 1 15 LEU HG H -5.272 0.216 8.161 1.00 . A A . 15 LEU HG 1 1 1 205 1 1 15 LEU N N -6.410 0.981 4.213 1.00 . A A . 15 LEU N 1 1 1 206 1 1 15 LEU O O -5.133 4.177 4.770 1.00 . A A . 15 LEU O 1 1 1 207 1 1 16 CYS C C -3.688 3.873 1.663 1.00 . A A . 16 CYS C 1 1 1 208 1 1 16 CYS CA C -3.143 3.426 3.017 1.00 . A A . 16 CYS CA 1 1 1 209 1 1 16 CYS CB C -1.783 2.749 2.825 1.00 . A A . 16 CYS CB 1 1 1 210 1 1 16 CYS H H -3.999 1.555 3.541 1.00 . A A . 16 CYS H 1 1 1 211 1 1 16 CYS HA H -3.015 4.297 3.643 1.00 . A A . 16 CYS HA 1 1 1 212 1 1 16 CYS HB2 H -1.856 2.039 2.014 1.00 . A A . 16 CYS HB2 1 1 1 213 1 1 16 CYS HB3 H -1.050 3.501 2.570 1.00 . A A . 16 CYS HB3 1 1 1 214 1 1 16 CYS N N -4.071 2.524 3.690 1.00 . A A . 16 CYS N 1 1 1 215 1 1 16 CYS O O -3.486 5.013 1.239 1.00 . A A . 16 CYS O 1 1 1 216 1 1 16 CYS SG S -1.169 1.850 4.291 1.00 . A A . 16 CYS SG 1 1 1 217 1 1 17 GLY C C -3.811 3.494 -1.346 1.00 . A A . 17 GLY C 1 1 1 218 1 1 17 GLY CA C -4.908 3.277 -0.326 1.00 . A A . 17 GLY CA 1 1 1 219 1 1 17 GLY H H -4.492 2.066 1.353 1.00 . A A . 17 GLY H 1 1 1 220 1 1 17 GLY HA2 H -5.539 2.463 -0.652 1.00 . A A . 17 GLY HA2 1 1 1 221 1 1 17 GLY HA3 H -5.502 4.177 -0.253 1.00 . A A . 17 GLY HA3 1 1 1 222 1 1 17 GLY N N -4.367 2.963 0.977 1.00 . A A . 17 GLY N 1 1 1 223 1 1 17 GLY O O -2.901 2.669 -1.479 1.00 . A A . 17 GLY O 1 1 1 224 1 1 18 ALA C C -2.466 6.403 -2.907 1.00 . A A . 18 ALA C 1 1 1 225 1 1 18 ALA CA C -2.891 4.948 -3.059 1.00 . A A . 18 ALA CA 1 1 1 226 1 1 18 ALA CB C -3.441 4.688 -4.455 1.00 . A A . 18 ALA CB 1 1 1 227 1 1 18 ALA H H -4.626 5.229 -1.890 1.00 . A A . 18 ALA H 1 1 1 228 1 1 18 ALA HA H -2.031 4.311 -2.908 1.00 . A A . 18 ALA HA 1 1 1 229 1 1 18 ALA HB1 H -2.626 4.469 -5.128 1.00 . A A . 18 ALA HB1 1 1 1 230 1 1 18 ALA HB2 H -3.969 5.563 -4.803 1.00 . A A . 18 ALA HB2 1 1 1 231 1 1 18 ALA HB3 H -4.118 3.847 -4.425 1.00 . A A . 18 ALA HB3 1 1 1 232 1 1 18 ALA N N -3.885 4.609 -2.053 1.00 . A A . 18 ALA N 1 1 1 233 1 1 18 ALA O O -2.372 7.142 -3.883 1.00 . A A . 18 ALA O 1 1 1 234 1 1 19 GLY C C -1.621 8.430 0.077 1.00 . A A . 19 GLY C 1 1 1 235 1 1 19 GLY CA C -1.804 8.169 -1.401 1.00 . A A . 19 GLY CA 1 1 1 236 1 1 19 GLY H H -2.308 6.170 -0.926 1.00 . A A . 19 GLY H 1 1 1 237 1 1 19 GLY HA2 H -0.872 8.360 -1.911 1.00 . A A . 19 GLY HA2 1 1 1 238 1 1 19 GLY HA3 H -2.558 8.841 -1.786 1.00 . A A . 19 GLY HA3 1 1 1 239 1 1 19 GLY N N -2.215 6.805 -1.667 1.00 . A A . 19 GLY N 1 1 1 240 1 1 19 GLY O O -0.677 9.107 0.484 1.00 . A A . 19 GLY O 1 1 1 241 1 1 20 GLY C C -1.263 7.341 2.917 1.00 . A A . 20 GLY C 1 1 1 242 1 1 20 GLY CA C -2.444 8.071 2.316 1.00 . A A . 20 GLY CA 1 1 1 243 1 1 20 GLY H H -3.253 7.355 0.503 1.00 . A A . 20 GLY H 1 1 1 244 1 1 20 GLY HA2 H -2.351 9.125 2.531 1.00 . A A . 20 GLY HA2 1 1 1 245 1 1 20 GLY HA3 H -3.351 7.699 2.770 1.00 . A A . 20 GLY HA3 1 1 1 246 1 1 20 GLY N N -2.526 7.889 0.883 1.00 . A A . 20 GLY N 1 1 1 247 1 1 20 GLY O O -1.064 6.154 2.649 1.00 . A A . 20 GLY O 1 1 1 248 1 1 21 ALA C C 1.656 6.887 3.360 1.00 . A A . 21 ALA C 1 1 1 249 1 1 21 ALA CA C 0.696 7.498 4.378 1.00 . A A . 21 ALA CA 1 1 1 250 1 1 21 ALA CB C 0.290 6.471 5.428 1.00 . A A . 21 ALA CB 1 1 1 251 1 1 21 ALA H H -0.708 8.996 3.882 1.00 . A A . 21 ALA H 1 1 1 252 1 1 21 ALA HA H 1.203 8.307 4.885 1.00 . A A . 21 ALA HA 1 1 1 253 1 1 21 ALA HB1 H -0.075 6.980 6.309 1.00 . A A . 21 ALA HB1 1 1 1 254 1 1 21 ALA HB2 H 1.145 5.867 5.692 1.00 . A A . 21 ALA HB2 1 1 1 255 1 1 21 ALA HB3 H -0.489 5.837 5.030 1.00 . A A . 21 ALA HB3 1 1 1 256 1 1 21 ALA N N -0.483 8.059 3.724 1.00 . A A . 21 ALA N 1 1 1 257 1 1 21 ALA O O 1.940 5.691 3.398 1.00 . A A . 21 ALA O 1 1 1 258 1 1 22 ALA C C 4.465 6.975 1.964 1.00 . A A . 22 ALA C 1 1 1 259 1 1 22 ALA CA C 3.071 7.277 1.401 1.00 . A A . 22 ALA CA 1 1 1 260 1 1 22 ALA CB C 3.156 8.327 0.302 1.00 . A A . 22 ALA CB 1 1 1 261 1 1 22 ALA H H 1.872 8.658 2.466 1.00 . A A . 22 ALA H 1 1 1 262 1 1 22 ALA HA H 2.670 6.374 0.967 1.00 . A A . 22 ALA HA 1 1 1 263 1 1 22 ALA HB1 H 2.349 8.179 -0.400 1.00 . A A . 22 ALA HB1 1 1 1 264 1 1 22 ALA HB2 H 4.102 8.236 -0.211 1.00 . A A . 22 ALA HB2 1 1 1 265 1 1 22 ALA HB3 H 3.076 9.312 0.738 1.00 . A A . 22 ALA HB3 1 1 1 266 1 1 22 ALA N N 2.146 7.719 2.444 1.00 . A A . 22 ALA N 1 1 1 267 1 1 22 ALA O O 5.471 7.495 1.483 1.00 . A A . 22 ALA O 1 1 1 268 1 1 23 GLY C C 5.538 4.873 4.804 1.00 . A A . 23 GLY C 1 1 1 269 1 1 23 GLY CA C 5.763 5.758 3.599 1.00 . A A . 23 GLY CA 1 1 1 270 1 1 23 GLY H H 3.671 5.745 3.320 1.00 . A A . 23 GLY H 1 1 1 271 1 1 23 GLY HA2 H 6.370 5.230 2.878 1.00 . A A . 23 GLY HA2 1 1 1 272 1 1 23 GLY HA3 H 6.283 6.652 3.913 1.00 . A A . 23 GLY HA3 1 1 1 273 1 1 23 GLY N N 4.512 6.130 2.982 1.00 . A A . 23 GLY N 1 1 1 274 1 1 23 GLY O O 4.461 4.287 4.951 1.00 . A A . 23 GLY O 1 1 2 275 1 1 1 GLY C C 5.681 2.204 6.319 1.00 . A A . 1 GLY C 1 1 2 276 1 1 1 GLY CA C 6.197 3.559 6.761 1.00 . A A . 1 GLY CA 1 1 2 277 1 1 1 GLY H1 H 6.527 4.089 4.732 1.00 . A A . 1 GLY H1 1 1 2 278 1 1 1 GLY HA2 H 7.008 3.410 7.459 1.00 . A A . 1 GLY HA2 1 1 2 279 1 1 1 GLY HA3 H 5.401 4.087 7.264 1.00 . A A . 1 GLY HA3 1 1 2 280 1 1 1 GLY N N 6.673 4.374 5.664 1.00 . A A . 1 GLY N 1 1 2 281 1 1 1 GLY O O 6.260 1.564 5.446 1.00 . A A . 1 GLY O 1 1 2 282 1 1 2 CYS C C 3.621 0.334 5.164 1.00 . A A . 2 CYS C 1 1 2 283 1 1 2 CYS CA C 3.972 0.479 6.640 1.00 . A A . 2 CYS CA 1 1 2 284 1 1 2 CYS CB C 2.710 0.311 7.493 1.00 . A A . 2 CYS CB 1 1 2 285 1 1 2 CYS H H 4.187 2.337 7.631 1.00 . A A . 2 CYS H 1 1 2 286 1 1 2 CYS HA H 4.677 -0.295 6.906 1.00 . A A . 2 CYS HA 1 1 2 287 1 1 2 CYS HB2 H 2.993 -0.045 8.465 1.00 . A A . 2 CYS HB2 1 1 2 288 1 1 2 CYS HB3 H 2.231 1.274 7.599 1.00 . A A . 2 CYS HB3 1 1 2 289 1 1 2 CYS N N 4.589 1.772 6.938 1.00 . A A . 2 CYS N 1 1 2 290 1 1 2 CYS O O 4.069 -0.598 4.501 1.00 . A A . 2 CYS O 1 1 2 291 1 1 2 CYS SG S 1.469 -0.850 6.823 1.00 . A A . 2 CYS SG 1 1 2 292 1 1 3 CYS C C 3.506 1.240 2.274 1.00 . A A . 3 CYS C 1 1 2 293 1 1 3 CYS CA C 2.356 1.215 3.277 1.00 . A A . 3 CYS CA 1 1 2 294 1 1 3 CYS CB C 1.398 2.368 3.016 1.00 . A A . 3 CYS CB 1 1 2 295 1 1 3 CYS H H 2.469 1.949 5.260 1.00 . A A . 3 CYS H 1 1 2 296 1 1 3 CYS HA H 1.819 0.290 3.139 1.00 . A A . 3 CYS HA 1 1 2 297 1 1 3 CYS HB2 H 1.896 3.299 3.238 1.00 . A A . 3 CYS HB2 1 1 2 298 1 1 3 CYS HB3 H 1.108 2.356 1.976 1.00 . A A . 3 CYS HB3 1 1 2 299 1 1 3 CYS N N 2.804 1.245 4.668 1.00 . A A . 3 CYS N 1 1 2 300 1 1 3 CYS O O 3.339 0.822 1.130 1.00 . A A . 3 CYS O 1 1 2 301 1 1 3 CYS SG S -0.117 2.292 4.021 1.00 . A A . 3 CYS SG 1 1 2 302 1 1 4 SER C C 6.293 0.333 1.515 1.00 . A A . 4 SER C 1 1 2 303 1 1 4 SER CA C 5.833 1.755 1.830 1.00 . A A . 4 SER CA 1 1 2 304 1 1 4 SER CB C 6.951 2.559 2.489 1.00 . A A . 4 SER CB 1 1 2 305 1 1 4 SER H H 4.752 2.021 3.625 1.00 . A A . 4 SER H 1 1 2 306 1 1 4 SER HA H 5.542 2.237 0.911 1.00 . A A . 4 SER HA 1 1 2 307 1 1 4 SER HB2 H 7.308 2.031 3.362 1.00 . A A . 4 SER HB2 1 1 2 308 1 1 4 SER HB3 H 7.762 2.691 1.789 1.00 . A A . 4 SER HB3 1 1 2 309 1 1 4 SER HG H 6.384 4.399 2.107 1.00 . A A . 4 SER HG 1 1 2 310 1 1 4 SER N N 4.668 1.711 2.701 1.00 . A A . 4 SER N 1 1 2 311 1 1 4 SER O O 6.883 0.070 0.469 1.00 . A A . 4 SER O 1 1 2 312 1 1 4 SER OG O 6.475 3.835 2.888 1.00 . A A . 4 SER OG 1 1 2 313 1 1 5 ASN C C 5.179 -2.686 1.511 1.00 . A A . 5 ASN C 1 1 2 314 1 1 5 ASN CA C 6.309 -1.987 2.250 1.00 . A A . 5 ASN CA 1 1 2 315 1 1 5 ASN CB C 6.543 -2.657 3.608 1.00 . A A . 5 ASN CB 1 1 2 316 1 1 5 ASN CG C 7.909 -2.347 4.183 1.00 . A A . 5 ASN CG 1 1 2 317 1 1 5 ASN H H 5.470 -0.305 3.217 1.00 . A A . 5 ASN H 1 1 2 318 1 1 5 ASN HA H 7.211 -2.049 1.660 1.00 . A A . 5 ASN HA 1 1 2 319 1 1 5 ASN HB2 H 5.794 -2.310 4.306 1.00 . A A . 5 ASN HB2 1 1 2 320 1 1 5 ASN HB3 H 6.454 -3.728 3.493 1.00 . A A . 5 ASN HB3 1 1 2 321 1 1 5 ASN HD21 H 7.086 -1.382 5.708 1.00 . A A . 5 ASN HD21 1 1 2 322 1 1 5 ASN HD22 H 8.811 -1.442 5.699 1.00 . A A . 5 ASN HD22 1 1 2 323 1 1 5 ASN N N 5.976 -0.582 2.421 1.00 . A A . 5 ASN N 1 1 2 324 1 1 5 ASN ND2 N 7.937 -1.655 5.310 1.00 . A A . 5 ASN ND2 1 1 2 325 1 1 5 ASN O O 4.016 -2.544 1.882 1.00 . A A . 5 ASN O 1 1 2 326 1 1 5 ASN OD1 O 8.931 -2.727 3.618 1.00 . A A . 5 ASN OD1 1 1 2 327 1 1 6 PRO C C 3.566 -5.032 0.445 1.00 . A A . 6 PRO C 1 1 2 328 1 1 6 PRO CA C 4.503 -4.140 -0.371 1.00 . A A . 6 PRO CA 1 1 2 329 1 1 6 PRO CB C 5.349 -4.991 -1.332 1.00 . A A . 6 PRO CB 1 1 2 330 1 1 6 PRO CD C 6.860 -3.632 -0.071 1.00 . A A . 6 PRO CD 1 1 2 331 1 1 6 PRO CG C 6.744 -4.936 -0.803 1.00 . A A . 6 PRO CG 1 1 2 332 1 1 6 PRO HA H 3.909 -3.442 -0.942 1.00 . A A . 6 PRO HA 1 1 2 333 1 1 6 PRO HB2 H 4.973 -6.004 -1.342 1.00 . A A . 6 PRO HB2 1 1 2 334 1 1 6 PRO HB3 H 5.290 -4.575 -2.327 1.00 . A A . 6 PRO HB3 1 1 2 335 1 1 6 PRO HD2 H 7.575 -3.710 0.735 1.00 . A A . 6 PRO HD2 1 1 2 336 1 1 6 PRO HD3 H 7.135 -2.838 -0.750 1.00 . A A . 6 PRO HD3 1 1 2 337 1 1 6 PRO HG2 H 6.914 -5.761 -0.127 1.00 . A A . 6 PRO HG2 1 1 2 338 1 1 6 PRO HG3 H 7.449 -4.971 -1.621 1.00 . A A . 6 PRO HG3 1 1 2 339 1 1 6 PRO N N 5.500 -3.434 0.446 1.00 . A A . 6 PRO N 1 1 2 340 1 1 6 PRO O O 2.355 -5.030 0.226 1.00 . A A . 6 PRO O 1 1 2 341 1 1 7 VAL C C 2.365 -5.909 3.092 1.00 . A A . 7 VAL C 1 1 2 342 1 1 7 VAL CA C 3.338 -6.688 2.215 1.00 . A A . 7 VAL CA 1 1 2 343 1 1 7 VAL CB C 4.243 -7.557 3.115 1.00 . A A . 7 VAL CB 1 1 2 344 1 1 7 VAL CG1 C 3.410 -8.478 3.996 1.00 . A A . 7 VAL CG1 1 1 2 345 1 1 7 VAL CG2 C 5.221 -8.360 2.271 1.00 . A A . 7 VAL CG2 1 1 2 346 1 1 7 VAL H H 5.097 -5.746 1.510 1.00 . A A . 7 VAL H 1 1 2 347 1 1 7 VAL HA H 2.778 -7.342 1.564 1.00 . A A . 7 VAL HA 1 1 2 348 1 1 7 VAL HB H 4.811 -6.900 3.758 1.00 . A A . 7 VAL HB 1 1 2 349 1 1 7 VAL HG11 H 2.891 -9.196 3.377 1.00 . A A . 7 VAL HG11 1 1 2 350 1 1 7 VAL HG12 H 2.688 -7.892 4.548 1.00 . A A . 7 VAL HG12 1 1 2 351 1 1 7 VAL HG13 H 4.056 -8.997 4.688 1.00 . A A . 7 VAL HG13 1 1 2 352 1 1 7 VAL HG21 H 4.676 -8.935 1.537 1.00 . A A . 7 VAL HG21 1 1 2 353 1 1 7 VAL HG22 H 5.782 -9.029 2.908 1.00 . A A . 7 VAL HG22 1 1 2 354 1 1 7 VAL HG23 H 5.901 -7.687 1.769 1.00 . A A . 7 VAL HG23 1 1 2 355 1 1 7 VAL N N 4.129 -5.790 1.380 1.00 . A A . 7 VAL N 1 1 2 356 1 1 7 VAL O O 1.174 -6.213 3.142 1.00 . A A . 7 VAL O 1 1 2 357 1 1 8 CYS C C 1.041 -3.282 3.850 1.00 . A A . 8 CYS C 1 1 2 358 1 1 8 CYS CA C 2.062 -4.080 4.657 1.00 . A A . 8 CYS CA 1 1 2 359 1 1 8 CYS CB C 2.941 -3.138 5.472 1.00 . A A . 8 CYS CB 1 1 2 360 1 1 8 CYS H H 3.837 -4.707 3.688 1.00 . A A . 8 CYS H 1 1 2 361 1 1 8 CYS HA H 1.533 -4.740 5.329 1.00 . A A . 8 CYS HA 1 1 2 362 1 1 8 CYS HB2 H 3.903 -3.598 5.623 1.00 . A A . 8 CYS HB2 1 1 2 363 1 1 8 CYS HB3 H 3.069 -2.223 4.917 1.00 . A A . 8 CYS HB3 1 1 2 364 1 1 8 CYS N N 2.880 -4.902 3.776 1.00 . A A . 8 CYS N 1 1 2 365 1 1 8 CYS O O -0.086 -3.084 4.290 1.00 . A A . 8 CYS O 1 1 2 366 1 1 8 CYS SG S 2.266 -2.694 7.109 1.00 . A A . 8 CYS SG 1 1 2 367 1 1 9 HIS C C -0.617 -2.889 1.355 1.00 . A A . 9 HIS C 1 1 2 368 1 1 9 HIS CA C 0.576 -2.051 1.790 1.00 . A A . 9 HIS CA 1 1 2 369 1 1 9 HIS CB C 1.342 -1.573 0.554 1.00 . A A . 9 HIS CB 1 1 2 370 1 1 9 HIS CD2 C -0.558 0.106 -0.053 1.00 . A A . 9 HIS CD2 1 1 2 371 1 1 9 HIS CE1 C 0.443 1.132 -1.710 1.00 . A A . 9 HIS CE1 1 1 2 372 1 1 9 HIS CG C 0.670 -0.454 -0.196 1.00 . A A . 9 HIS CG 1 1 2 373 1 1 9 HIS H H 2.372 -3.019 2.380 1.00 . A A . 9 HIS H 1 1 2 374 1 1 9 HIS HA H 0.222 -1.194 2.342 1.00 . A A . 9 HIS HA 1 1 2 375 1 1 9 HIS HB2 H 2.319 -1.235 0.856 1.00 . A A . 9 HIS HB2 1 1 2 376 1 1 9 HIS HB3 H 1.456 -2.404 -0.127 1.00 . A A . 9 HIS HB3 1 1 2 377 1 1 9 HIS HD1 H 2.176 0.049 -1.583 1.00 . A A . 9 HIS HD1 1 1 2 378 1 1 9 HIS HD2 H -1.306 -0.170 0.677 1.00 . A A . 9 HIS HD2 1 1 2 379 1 1 9 HIS HE1 H 0.645 1.804 -2.530 1.00 . A A . 9 HIS HE1 1 1 2 380 1 1 9 HIS HE2 H -1.517 1.534 -1.262 1.00 . A A . 9 HIS HE2 1 1 2 381 1 1 9 HIS N N 1.450 -2.828 2.669 1.00 . A A . 9 HIS N 1 1 2 382 1 1 9 HIS ND1 N 1.270 0.214 -1.242 1.00 . A A . 9 HIS ND1 1 1 2 383 1 1 9 HIS NE2 N -0.675 1.088 -1.008 1.00 . A A . 9 HIS NE2 1 1 2 384 1 1 9 HIS O O -1.743 -2.404 1.316 1.00 . A A . 9 HIS O 1 1 2 385 1 1 10 LEU C C -2.392 -5.304 1.729 1.00 . A A . 10 LEU C 1 1 2 386 1 1 10 LEU CA C -1.402 -5.062 0.593 1.00 . A A . 10 LEU CA 1 1 2 387 1 1 10 LEU CB C -0.789 -6.390 0.134 1.00 . A A . 10 LEU CB 1 1 2 388 1 1 10 LEU CD1 C -2.482 -6.931 -1.637 1.00 . A A . 10 LEU CD1 1 1 2 389 1 1 10 LEU CD2 C -1.082 -8.753 -0.648 1.00 . A A . 10 LEU CD2 1 1 2 390 1 1 10 LEU CG C -1.786 -7.431 -0.381 1.00 . A A . 10 LEU CG 1 1 2 391 1 1 10 LEU H H 0.574 -4.465 1.075 1.00 . A A . 10 LEU H 1 1 2 392 1 1 10 LEU HA H -1.924 -4.607 -0.236 1.00 . A A . 10 LEU HA 1 1 2 393 1 1 10 LEU HB2 H -0.082 -6.179 -0.655 1.00 . A A . 10 LEU HB2 1 1 2 394 1 1 10 LEU HB3 H -0.252 -6.820 0.967 1.00 . A A . 10 LEU HB3 1 1 2 395 1 1 10 LEU HD11 H -2.054 -5.983 -1.933 1.00 . A A . 10 LEU HD11 1 1 2 396 1 1 10 LEU HD12 H -3.535 -6.804 -1.439 1.00 . A A . 10 LEU HD12 1 1 2 397 1 1 10 LEU HD13 H -2.349 -7.649 -2.433 1.00 . A A . 10 LEU HD13 1 1 2 398 1 1 10 LEU HD21 H -0.656 -9.126 0.271 1.00 . A A . 10 LEU HD21 1 1 2 399 1 1 10 LEU HD22 H -0.296 -8.601 -1.374 1.00 . A A . 10 LEU HD22 1 1 2 400 1 1 10 LEU HD23 H -1.794 -9.468 -1.033 1.00 . A A . 10 LEU HD23 1 1 2 401 1 1 10 LEU HG H -2.541 -7.599 0.373 1.00 . A A . 10 LEU HG 1 1 2 402 1 1 10 LEU N N -0.354 -4.145 1.026 1.00 . A A . 10 LEU N 1 1 2 403 1 1 10 LEU O O -3.606 -5.232 1.538 1.00 . A A . 10 LEU O 1 1 2 404 1 1 11 GLU C C -3.432 -4.561 4.493 1.00 . A A . 11 GLU C 1 1 2 405 1 1 11 GLU CA C -2.662 -5.822 4.098 1.00 . A A . 11 GLU CA 1 1 2 406 1 1 11 GLU CB C -1.750 -6.271 5.244 1.00 . A A . 11 GLU CB 1 1 2 407 1 1 11 GLU CD C -3.419 -7.758 6.423 1.00 . A A . 11 GLU CD 1 1 2 408 1 1 11 GLU CG C -2.475 -6.581 6.544 1.00 . A A . 11 GLU CG 1 1 2 409 1 1 11 GLU H H -0.877 -5.610 2.989 1.00 . A A . 11 GLU H 1 1 2 410 1 1 11 GLU HA H -3.363 -6.606 3.871 1.00 . A A . 11 GLU HA 1 1 2 411 1 1 11 GLU HB2 H -1.221 -7.161 4.936 1.00 . A A . 11 GLU HB2 1 1 2 412 1 1 11 GLU HB3 H -1.030 -5.489 5.438 1.00 . A A . 11 GLU HB3 1 1 2 413 1 1 11 GLU HG2 H -1.742 -6.804 7.305 1.00 . A A . 11 GLU HG2 1 1 2 414 1 1 11 GLU HG3 H -3.044 -5.711 6.839 1.00 . A A . 11 GLU HG3 1 1 2 415 1 1 11 GLU N N -1.854 -5.576 2.910 1.00 . A A . 11 GLU N 1 1 2 416 1 1 11 GLU O O -4.641 -4.587 4.708 1.00 . A A . 11 GLU O 1 1 2 417 1 1 11 GLU OE1 O -2.958 -8.845 6.022 1.00 . A A . 11 GLU OE1 1 1 2 418 1 1 11 GLU OE2 O -4.611 -7.594 6.746 1.00 . A A . 11 GLU OE2 1 1 2 419 1 1 12 HIS C C -3.716 -1.396 3.688 1.00 . A A . 12 HIS C 1 1 2 420 1 1 12 HIS CA C -3.323 -2.171 4.940 1.00 . A A . 12 HIS CA 1 1 2 421 1 1 12 HIS CB C -2.365 -1.324 5.798 1.00 . A A . 12 HIS CB 1 1 2 422 1 1 12 HIS CD2 C -1.684 -3.311 7.339 1.00 . A A . 12 HIS CD2 1 1 2 423 1 1 12 HIS CE1 C -1.049 -2.159 9.087 1.00 . A A . 12 HIS CE1 1 1 2 424 1 1 12 HIS CG C -1.866 -2.002 7.046 1.00 . A A . 12 HIS CG 1 1 2 425 1 1 12 HIS H H -1.757 -3.488 4.378 1.00 . A A . 12 HIS H 1 1 2 426 1 1 12 HIS HA H -4.215 -2.381 5.513 1.00 . A A . 12 HIS HA 1 1 2 427 1 1 12 HIS HB2 H -1.505 -1.062 5.202 1.00 . A A . 12 HIS HB2 1 1 2 428 1 1 12 HIS HB3 H -2.875 -0.418 6.095 1.00 . A A . 12 HIS HB3 1 1 2 429 1 1 12 HIS HD1 H -1.449 -0.332 8.259 1.00 . A A . 12 HIS HD1 1 1 2 430 1 1 12 HIS HD2 H -1.871 -4.144 6.678 1.00 . A A . 12 HIS HD2 1 1 2 431 1 1 12 HIS HE1 H -0.674 -1.898 10.067 1.00 . A A . 12 HIS HE1 1 1 2 432 1 1 12 HIS HE2 H -1.077 -4.205 9.136 1.00 . A A . 12 HIS HE2 1 1 2 433 1 1 12 HIS N N -2.718 -3.449 4.575 1.00 . A A . 12 HIS N 1 1 2 434 1 1 12 HIS ND1 N -1.454 -1.306 8.164 1.00 . A A . 12 HIS ND1 1 1 2 435 1 1 12 HIS NE2 N -1.179 -3.381 8.613 1.00 . A A . 12 HIS NE2 1 1 2 436 1 1 12 HIS O O -3.501 -0.184 3.596 1.00 . A A . 12 HIS O 1 1 2 437 1 1 13 SER C C -5.852 -0.533 1.672 1.00 . A A . 13 SER C 1 1 2 438 1 1 13 SER CA C -4.702 -1.507 1.467 1.00 . A A . 13 SER CA 1 1 2 439 1 1 13 SER CB C -5.103 -2.606 0.489 1.00 . A A . 13 SER CB 1 1 2 440 1 1 13 SER H H -4.421 -3.069 2.862 1.00 . A A . 13 SER H 1 1 2 441 1 1 13 SER HA H -3.859 -0.969 1.061 1.00 . A A . 13 SER HA 1 1 2 442 1 1 13 SER HB2 H -5.707 -2.180 -0.298 1.00 . A A . 13 SER HB2 1 1 2 443 1 1 13 SER HB3 H -4.215 -3.048 0.065 1.00 . A A . 13 SER HB3 1 1 2 444 1 1 13 SER HG H -5.283 -4.387 1.296 1.00 . A A . 13 SER HG 1 1 2 445 1 1 13 SER N N -4.283 -2.105 2.726 1.00 . A A . 13 SER N 1 1 2 446 1 1 13 SER O O -5.931 0.494 1.007 1.00 . A A . 13 SER O 1 1 2 447 1 1 13 SER OG O -5.850 -3.617 1.144 1.00 . A A . 13 SER OG 1 1 2 448 1 1 14 ASN C C -7.491 1.289 3.538 1.00 . A A . 14 ASN C 1 1 2 449 1 1 14 ASN CA C -7.897 -0.036 2.893 1.00 . A A . 14 ASN CA 1 1 2 450 1 1 14 ASN CB C -8.859 -0.787 3.821 1.00 . A A . 14 ASN CB 1 1 2 451 1 1 14 ASN CG C -8.286 -1.001 5.212 1.00 . A A . 14 ASN CG 1 1 2 452 1 1 14 ASN H H -6.612 -1.710 3.082 1.00 . A A . 14 ASN H 1 1 2 453 1 1 14 ASN HA H -8.404 0.173 1.963 1.00 . A A . 14 ASN HA 1 1 2 454 1 1 14 ASN HB2 H -9.773 -0.221 3.913 1.00 . A A . 14 ASN HB2 1 1 2 455 1 1 14 ASN HB3 H -9.081 -1.753 3.391 1.00 . A A . 14 ASN HB3 1 1 2 456 1 1 14 ASN HD21 H -9.886 -0.159 6.030 1.00 . A A . 14 ASN HD21 1 1 2 457 1 1 14 ASN HD22 H -8.678 -0.711 7.135 1.00 . A A . 14 ASN HD22 1 1 2 458 1 1 14 ASN N N -6.737 -0.868 2.590 1.00 . A A . 14 ASN N 1 1 2 459 1 1 14 ASN ND2 N -9.024 -0.581 6.228 1.00 . A A . 14 ASN ND2 1 1 2 460 1 1 14 ASN O O -8.255 2.250 3.524 1.00 . A A . 14 ASN O 1 1 2 461 1 1 14 ASN OD1 O -7.192 -1.541 5.374 1.00 . A A . 14 ASN OD1 1 1 2 462 1 1 15 LEU C C -5.184 3.528 3.848 1.00 . A A . 15 LEU C 1 1 2 463 1 1 15 LEU CA C -5.825 2.525 4.805 1.00 . A A . 15 LEU CA 1 1 2 464 1 1 15 LEU CB C -4.832 2.151 5.907 1.00 . A A . 15 LEU CB 1 1 2 465 1 1 15 LEU CD1 C -4.333 0.967 8.060 1.00 . A A . 15 LEU CD1 1 1 2 466 1 1 15 LEU CD2 C -6.596 1.959 7.681 1.00 . A A . 15 LEU CD2 1 1 2 467 1 1 15 LEU CG C -5.404 1.277 7.027 1.00 . A A . 15 LEU CG 1 1 2 468 1 1 15 LEU H H -5.745 0.519 4.129 1.00 . A A . 15 LEU H 1 1 2 469 1 1 15 LEU HA H -6.677 2.996 5.261 1.00 . A A . 15 LEU HA 1 1 2 470 1 1 15 LEU HB2 H -4.005 1.623 5.454 1.00 . A A . 15 LEU HB2 1 1 2 471 1 1 15 LEU HB3 H -4.457 3.061 6.350 1.00 . A A . 15 LEU HB3 1 1 2 472 1 1 15 LEU HD11 H -3.578 0.334 7.618 1.00 . A A . 15 LEU HD11 1 1 2 473 1 1 15 LEU HD12 H -4.782 0.458 8.901 1.00 . A A . 15 LEU HD12 1 1 2 474 1 1 15 LEU HD13 H -3.881 1.888 8.396 1.00 . A A . 15 LEU HD13 1 1 2 475 1 1 15 LEU HD21 H -7.496 1.403 7.463 1.00 . A A . 15 LEU HD21 1 1 2 476 1 1 15 LEU HD22 H -6.692 2.964 7.296 1.00 . A A . 15 LEU HD22 1 1 2 477 1 1 15 LEU HD23 H -6.447 1.998 8.750 1.00 . A A . 15 LEU HD23 1 1 2 478 1 1 15 LEU HG H -5.743 0.341 6.606 1.00 . A A . 15 LEU HG 1 1 2 479 1 1 15 LEU N N -6.302 1.324 4.130 1.00 . A A . 15 LEU N 1 1 2 480 1 1 15 LEU O O -5.545 4.702 3.838 1.00 . A A . 15 LEU O 1 1 2 481 1 1 16 CYS C C -4.121 3.950 0.748 1.00 . A A . 16 CYS C 1 1 2 482 1 1 16 CYS CA C -3.515 3.965 2.144 1.00 . A A . 16 CYS CA 1 1 2 483 1 1 16 CYS CB C -2.031 3.604 2.069 1.00 . A A . 16 CYS CB 1 1 2 484 1 1 16 CYS H H -3.954 2.135 3.137 1.00 . A A . 16 CYS H 1 1 2 485 1 1 16 CYS HA H -3.599 4.967 2.537 1.00 . A A . 16 CYS HA 1 1 2 486 1 1 16 CYS HB2 H -1.936 2.541 1.902 1.00 . A A . 16 CYS HB2 1 1 2 487 1 1 16 CYS HB3 H -1.583 4.133 1.241 1.00 . A A . 16 CYS HB3 1 1 2 488 1 1 16 CYS N N -4.216 3.075 3.071 1.00 . A A . 16 CYS N 1 1 2 489 1 1 16 CYS O O -4.031 4.935 0.015 1.00 . A A . 16 CYS O 1 1 2 490 1 1 16 CYS SG S -1.084 4.016 3.571 1.00 . A A . 16 CYS SG 1 1 2 491 1 1 17 GLY C C -4.267 2.798 -2.040 1.00 . A A . 17 GLY C 1 1 2 492 1 1 17 GLY CA C -5.309 2.714 -0.944 1.00 . A A . 17 GLY CA 1 1 2 493 1 1 17 GLY H H -4.756 2.070 0.991 1.00 . A A . 17 GLY H 1 1 2 494 1 1 17 GLY HA2 H -5.820 1.765 -1.016 1.00 . A A . 17 GLY HA2 1 1 2 495 1 1 17 GLY HA3 H -6.025 3.510 -1.079 1.00 . A A . 17 GLY HA3 1 1 2 496 1 1 17 GLY N N -4.718 2.830 0.372 1.00 . A A . 17 GLY N 1 1 2 497 1 1 17 GLY O O -3.178 2.221 -1.921 1.00 . A A . 17 GLY O 1 1 2 498 1 1 18 ALA C C -2.739 4.886 -3.986 1.00 . A A . 18 ALA C 1 1 2 499 1 1 18 ALA CA C -3.679 3.706 -4.220 1.00 . A A . 18 ALA CA 1 1 2 500 1 1 18 ALA CB C -4.469 3.896 -5.507 1.00 . A A . 18 ALA CB 1 1 2 501 1 1 18 ALA H H -5.463 3.972 -3.120 1.00 . A A . 18 ALA H 1 1 2 502 1 1 18 ALA HA H -3.092 2.805 -4.317 1.00 . A A . 18 ALA HA 1 1 2 503 1 1 18 ALA HB1 H -3.915 3.482 -6.335 1.00 . A A . 18 ALA HB1 1 1 2 504 1 1 18 ALA HB2 H -4.634 4.951 -5.675 1.00 . A A . 18 ALA HB2 1 1 2 505 1 1 18 ALA HB3 H -5.421 3.393 -5.422 1.00 . A A . 18 ALA HB3 1 1 2 506 1 1 18 ALA N N -4.589 3.529 -3.097 1.00 . A A . 18 ALA N 1 1 2 507 1 1 18 ALA O O -2.475 5.674 -4.891 1.00 . A A . 18 ALA O 1 1 2 508 1 1 19 GLY C C -0.723 5.914 -1.062 1.00 . A A . 19 GLY C 1 1 2 509 1 1 19 GLY CA C -1.333 6.082 -2.436 1.00 . A A . 19 GLY CA 1 1 2 510 1 1 19 GLY H H -2.481 4.346 -2.080 1.00 . A A . 19 GLY H 1 1 2 511 1 1 19 GLY HA2 H -0.540 6.110 -3.170 1.00 . A A . 19 GLY HA2 1 1 2 512 1 1 19 GLY HA3 H -1.875 7.015 -2.469 1.00 . A A . 19 GLY HA3 1 1 2 513 1 1 19 GLY N N -2.236 5.001 -2.766 1.00 . A A . 19 GLY N 1 1 2 514 1 1 19 GLY O O -0.443 4.790 -0.632 1.00 . A A . 19 GLY O 1 1 2 515 1 1 20 GLY C C 1.522 6.567 0.905 1.00 . A A . 20 GLY C 1 1 2 516 1 1 20 GLY CA C 0.072 6.995 0.952 1.00 . A A . 20 GLY CA 1 1 2 517 1 1 20 GLY H H -0.757 7.891 -0.773 1.00 . A A . 20 GLY H 1 1 2 518 1 1 20 GLY HA2 H 0.007 7.979 1.393 1.00 . A A . 20 GLY HA2 1 1 2 519 1 1 20 GLY HA3 H -0.481 6.296 1.564 1.00 . A A . 20 GLY HA3 1 1 2 520 1 1 20 GLY N N -0.516 7.031 -0.373 1.00 . A A . 20 GLY N 1 1 2 521 1 1 20 GLY O O 2.292 7.080 0.095 1.00 . A A . 20 GLY O 1 1 2 522 1 1 21 ALA C C 4.276 6.182 2.107 1.00 . A A . 21 ALA C 1 1 2 523 1 1 21 ALA CA C 3.249 5.087 1.826 1.00 . A A . 21 ALA CA 1 1 2 524 1 1 21 ALA CB C 3.589 4.355 0.533 1.00 . A A . 21 ALA CB 1 1 2 525 1 1 21 ALA H H 1.207 5.251 2.371 1.00 . A A . 21 ALA H 1 1 2 526 1 1 21 ALA HA H 3.285 4.368 2.632 1.00 . A A . 21 ALA HA 1 1 2 527 1 1 21 ALA HB1 H 3.680 3.297 0.730 1.00 . A A . 21 ALA HB1 1 1 2 528 1 1 21 ALA HB2 H 4.525 4.730 0.143 1.00 . A A . 21 ALA HB2 1 1 2 529 1 1 21 ALA HB3 H 2.805 4.521 -0.191 1.00 . A A . 21 ALA HB3 1 1 2 530 1 1 21 ALA N N 1.884 5.617 1.766 1.00 . A A . 21 ALA N 1 1 2 531 1 1 21 ALA O O 5.371 6.180 1.543 1.00 . A A . 21 ALA O 1 1 2 532 1 1 22 ALA C C 5.907 7.767 4.314 1.00 . A A . 22 ALA C 1 1 2 533 1 1 22 ALA CA C 4.803 8.211 3.351 1.00 . A A . 22 ALA CA 1 1 2 534 1 1 22 ALA CB C 3.997 9.353 3.954 1.00 . A A . 22 ALA CB 1 1 2 535 1 1 22 ALA H H 3.038 7.051 3.406 1.00 . A A . 22 ALA H 1 1 2 536 1 1 22 ALA HA H 5.263 8.575 2.444 1.00 . A A . 22 ALA HA 1 1 2 537 1 1 22 ALA HB1 H 3.579 9.956 3.162 1.00 . A A . 22 ALA HB1 1 1 2 538 1 1 22 ALA HB2 H 4.641 9.962 4.570 1.00 . A A . 22 ALA HB2 1 1 2 539 1 1 22 ALA HB3 H 3.197 8.949 4.559 1.00 . A A . 22 ALA HB3 1 1 2 540 1 1 22 ALA N N 3.919 7.108 2.988 1.00 . A A . 22 ALA N 1 1 2 541 1 1 22 ALA O O 6.033 8.301 5.413 1.00 . A A . 22 ALA O 1 1 2 542 1 1 23 GLY C C 7.321 5.505 5.910 1.00 . A A . 23 GLY C 1 1 2 543 1 1 23 GLY CA C 7.795 6.300 4.709 1.00 . A A . 23 GLY CA 1 1 2 544 1 1 23 GLY H H 6.555 6.414 2.993 1.00 . A A . 23 GLY H 1 1 2 545 1 1 23 GLY HA2 H 8.427 5.668 4.104 1.00 . A A . 23 GLY HA2 1 1 2 546 1 1 23 GLY HA3 H 8.375 7.142 5.058 1.00 . A A . 23 GLY HA3 1 1 2 547 1 1 23 GLY N N 6.705 6.794 3.886 1.00 . A A . 23 GLY N 1 1 2 548 1 1 23 GLY O O 7.543 5.904 7.051 1.00 . A A . 23 GLY O 1 1 3 549 1 1 1 GLY C C 5.015 2.478 6.297 1.00 . A A . 1 GLY C 1 1 3 550 1 1 1 GLY CA C 5.386 3.881 6.725 1.00 . A A . 1 GLY CA 1 1 3 551 1 1 1 GLY H1 H 6.742 4.049 5.111 1.00 . A A . 1 GLY H1 1 1 3 552 1 1 1 GLY HA2 H 5.952 3.829 7.644 1.00 . A A . 1 GLY HA2 1 1 3 553 1 1 1 GLY HA3 H 4.481 4.443 6.902 1.00 . A A . 1 GLY HA3 1 1 3 554 1 1 1 GLY N N 6.176 4.566 5.726 1.00 . A A . 1 GLY N 1 1 3 555 1 1 1 GLY O O 5.814 1.778 5.676 1.00 . A A . 1 GLY O 1 1 3 556 1 1 2 CYS C C 3.217 0.580 4.765 1.00 . A A . 2 CYS C 1 1 3 557 1 1 2 CYS CA C 3.291 0.750 6.275 1.00 . A A . 2 CYS CA 1 1 3 558 1 1 2 CYS CB C 1.901 0.559 6.883 1.00 . A A . 2 CYS CB 1 1 3 559 1 1 2 CYS H H 3.211 2.689 7.115 1.00 . A A . 2 CYS H 1 1 3 560 1 1 2 CYS HA H 3.964 0.011 6.684 1.00 . A A . 2 CYS HA 1 1 3 561 1 1 2 CYS HB2 H 1.993 0.508 7.951 1.00 . A A . 2 CYS HB2 1 1 3 562 1 1 2 CYS HB3 H 1.289 1.411 6.625 1.00 . A A . 2 CYS HB3 1 1 3 563 1 1 2 CYS N N 3.796 2.075 6.625 1.00 . A A . 2 CYS N 1 1 3 564 1 1 2 CYS O O 3.628 -0.439 4.217 1.00 . A A . 2 CYS O 1 1 3 565 1 1 2 CYS SG S 1.018 -0.939 6.330 1.00 . A A . 2 CYS SG 1 1 3 566 1 1 3 CYS C C 3.797 1.390 1.913 1.00 . A A . 3 CYS C 1 1 3 567 1 1 3 CYS CA C 2.488 1.593 2.666 1.00 . A A . 3 CYS CA 1 1 3 568 1 1 3 CYS CB C 1.835 2.902 2.247 1.00 . A A . 3 CYS CB 1 1 3 569 1 1 3 CYS H H 2.350 2.359 4.631 1.00 . A A . 3 CYS H 1 1 3 570 1 1 3 CYS HA H 1.829 0.779 2.421 1.00 . A A . 3 CYS HA 1 1 3 571 1 1 3 CYS HB2 H 2.583 3.680 2.206 1.00 . A A . 3 CYS HB2 1 1 3 572 1 1 3 CYS HB3 H 1.391 2.778 1.273 1.00 . A A . 3 CYS HB3 1 1 3 573 1 1 3 CYS N N 2.669 1.589 4.114 1.00 . A A . 3 CYS N 1 1 3 574 1 1 3 CYS O O 3.802 0.813 0.826 1.00 . A A . 3 CYS O 1 1 3 575 1 1 3 CYS SG S 0.527 3.440 3.390 1.00 . A A . 3 CYS SG 1 1 3 576 1 1 4 SER C C 6.578 0.244 1.733 1.00 . A A . 4 SER C 1 1 3 577 1 1 4 SER CA C 6.209 1.718 1.880 1.00 . A A . 4 SER CA 1 1 3 578 1 1 4 SER CB C 7.255 2.443 2.725 1.00 . A A . 4 SER CB 1 1 3 579 1 1 4 SER H H 4.818 2.306 3.357 1.00 . A A . 4 SER H 1 1 3 580 1 1 4 SER HA H 6.169 2.168 0.902 1.00 . A A . 4 SER HA 1 1 3 581 1 1 4 SER HB2 H 7.388 1.918 3.659 1.00 . A A . 4 SER HB2 1 1 3 582 1 1 4 SER HB3 H 8.193 2.470 2.189 1.00 . A A . 4 SER HB3 1 1 3 583 1 1 4 SER HG H 7.253 4.369 2.363 1.00 . A A . 4 SER HG 1 1 3 584 1 1 4 SER N N 4.893 1.858 2.492 1.00 . A A . 4 SER N 1 1 3 585 1 1 4 SER O O 7.350 -0.133 0.853 1.00 . A A . 4 SER O 1 1 3 586 1 1 4 SER OG O 6.847 3.773 3.002 1.00 . A A . 4 SER OG 1 1 3 587 1 1 5 ASN C C 5.148 -2.687 1.728 1.00 . A A . 5 ASN C 1 1 3 588 1 1 5 ASN CA C 6.235 -2.016 2.549 1.00 . A A . 5 ASN CA 1 1 3 589 1 1 5 ASN CB C 6.261 -2.602 3.963 1.00 . A A . 5 ASN CB 1 1 3 590 1 1 5 ASN CG C 7.539 -2.273 4.707 1.00 . A A . 5 ASN CG 1 1 3 591 1 1 5 ASN H H 5.365 -0.218 3.246 1.00 . A A . 5 ASN H 1 1 3 592 1 1 5 ASN HA H 7.190 -2.185 2.075 1.00 . A A . 5 ASN HA 1 1 3 593 1 1 5 ASN HB2 H 5.429 -2.206 4.525 1.00 . A A . 5 ASN HB2 1 1 3 594 1 1 5 ASN HB3 H 6.168 -3.676 3.902 1.00 . A A . 5 ASN HB3 1 1 3 595 1 1 5 ASN HD21 H 6.536 -1.169 6.017 1.00 . A A . 5 ASN HD21 1 1 3 596 1 1 5 ASN HD22 H 8.241 -1.267 6.265 1.00 . A A . 5 ASN HD22 1 1 3 597 1 1 5 ASN N N 5.996 -0.582 2.588 1.00 . A A . 5 ASN N 1 1 3 598 1 1 5 ASN ND2 N 7.427 -1.491 5.770 1.00 . A A . 5 ASN ND2 1 1 3 599 1 1 5 ASN O O 3.967 -2.538 2.026 1.00 . A A . 5 ASN O 1 1 3 600 1 1 5 ASN OD1 O 8.620 -2.716 4.329 1.00 . A A . 5 ASN OD1 1 1 3 601 1 1 6 PRO C C 3.607 -5.015 0.542 1.00 . A A . 6 PRO C 1 1 3 602 1 1 6 PRO CA C 4.569 -4.096 -0.210 1.00 . A A . 6 PRO CA 1 1 3 603 1 1 6 PRO CB C 5.455 -4.910 -1.166 1.00 . A A . 6 PRO CB 1 1 3 604 1 1 6 PRO CD C 6.912 -3.629 0.235 1.00 . A A . 6 PRO CD 1 1 3 605 1 1 6 PRO CG C 6.819 -4.900 -0.557 1.00 . A A . 6 PRO CG 1 1 3 606 1 1 6 PRO HA H 3.993 -3.378 -0.777 1.00 . A A . 6 PRO HA 1 1 3 607 1 1 6 PRO HB2 H 5.069 -5.915 -1.246 1.00 . A A . 6 PRO HB2 1 1 3 608 1 1 6 PRO HB3 H 5.457 -4.443 -2.140 1.00 . A A . 6 PRO HB3 1 1 3 609 1 1 6 PRO HD2 H 7.570 -3.757 1.083 1.00 . A A . 6 PRO HD2 1 1 3 610 1 1 6 PRO HD3 H 7.248 -2.816 -0.389 1.00 . A A . 6 PRO HD3 1 1 3 611 1 1 6 PRO HG2 H 6.939 -5.755 0.091 1.00 . A A . 6 PRO HG2 1 1 3 612 1 1 6 PRO HG3 H 7.569 -4.911 -1.335 1.00 . A A . 6 PRO HG3 1 1 3 613 1 1 6 PRO N N 5.525 -3.419 0.672 1.00 . A A . 6 PRO N 1 1 3 614 1 1 6 PRO O O 2.402 -4.989 0.298 1.00 . A A . 6 PRO O 1 1 3 615 1 1 7 VAL C C 2.334 -5.971 3.118 1.00 . A A . 7 VAL C 1 1 3 616 1 1 7 VAL CA C 3.320 -6.736 2.241 1.00 . A A . 7 VAL CA 1 1 3 617 1 1 7 VAL CB C 4.191 -7.649 3.130 1.00 . A A . 7 VAL CB 1 1 3 618 1 1 7 VAL CG1 C 3.326 -8.633 3.909 1.00 . A A . 7 VAL CG1 1 1 3 619 1 1 7 VAL CG2 C 5.222 -8.389 2.291 1.00 . A A . 7 VAL CG2 1 1 3 620 1 1 7 VAL H H 5.104 -5.785 1.615 1.00 . A A . 7 VAL H 1 1 3 621 1 1 7 VAL HA H 2.766 -7.358 1.552 1.00 . A A . 7 VAL HA 1 1 3 622 1 1 7 VAL HB H 4.717 -7.029 3.841 1.00 . A A . 7 VAL HB 1 1 3 623 1 1 7 VAL HG11 H 2.545 -8.094 4.424 1.00 . A A . 7 VAL HG11 1 1 3 624 1 1 7 VAL HG12 H 3.937 -9.158 4.628 1.00 . A A . 7 VAL HG12 1 1 3 625 1 1 7 VAL HG13 H 2.885 -9.342 3.225 1.00 . A A . 7 VAL HG13 1 1 3 626 1 1 7 VAL HG21 H 4.797 -8.625 1.326 1.00 . A A . 7 VAL HG21 1 1 3 627 1 1 7 VAL HG22 H 5.507 -9.302 2.792 1.00 . A A . 7 VAL HG22 1 1 3 628 1 1 7 VAL HG23 H 6.093 -7.765 2.158 1.00 . A A . 7 VAL HG23 1 1 3 629 1 1 7 VAL N N 4.139 -5.815 1.459 1.00 . A A . 7 VAL N 1 1 3 630 1 1 7 VAL O O 1.139 -6.264 3.131 1.00 . A A . 7 VAL O 1 1 3 631 1 1 8 CYS C C 0.985 -3.404 3.903 1.00 . A A . 8 CYS C 1 1 3 632 1 1 8 CYS CA C 2.028 -4.159 4.717 1.00 . A A . 8 CYS CA 1 1 3 633 1 1 8 CYS CB C 2.913 -3.173 5.485 1.00 . A A . 8 CYS CB 1 1 3 634 1 1 8 CYS H H 3.808 -4.799 3.767 1.00 . A A . 8 CYS H 1 1 3 635 1 1 8 CYS HA H 1.527 -4.811 5.418 1.00 . A A . 8 CYS HA 1 1 3 636 1 1 8 CYS HB2 H 3.823 -3.671 5.771 1.00 . A A . 8 CYS HB2 1 1 3 637 1 1 8 CYS HB3 H 3.156 -2.345 4.835 1.00 . A A . 8 CYS HB3 1 1 3 638 1 1 8 CYS N N 2.850 -4.984 3.836 1.00 . A A . 8 CYS N 1 1 3 639 1 1 8 CYS O O -0.173 -3.288 4.301 1.00 . A A . 8 CYS O 1 1 3 640 1 1 8 CYS SG S 2.157 -2.483 6.997 1.00 . A A . 8 CYS SG 1 1 3 641 1 1 9 HIS C C -0.641 -2.976 1.416 1.00 . A A . 9 HIS C 1 1 3 642 1 1 9 HIS CA C 0.549 -2.144 1.858 1.00 . A A . 9 HIS CA 1 1 3 643 1 1 9 HIS CB C 1.322 -1.691 0.622 1.00 . A A . 9 HIS CB 1 1 3 644 1 1 9 HIS CD2 C 0.245 -0.841 -1.581 1.00 . A A . 9 HIS CD2 1 1 3 645 1 1 9 HIS CE1 C -0.673 0.991 -0.806 1.00 . A A . 9 HIS CE1 1 1 3 646 1 1 9 HIS CG C 0.540 -0.766 -0.262 1.00 . A A . 9 HIS CG 1 1 3 647 1 1 9 HIS H H 2.360 -3.026 2.507 1.00 . A A . 9 HIS H 1 1 3 648 1 1 9 HIS HA H 0.192 -1.274 2.388 1.00 . A A . 9 HIS HA 1 1 3 649 1 1 9 HIS HB2 H 2.221 -1.190 0.928 1.00 . A A . 9 HIS HB2 1 1 3 650 1 1 9 HIS HB3 H 1.585 -2.560 0.037 1.00 . A A . 9 HIS HB3 1 1 3 651 1 1 9 HIS HD1 H -0.029 0.724 1.118 1.00 . A A . 9 HIS HD1 1 1 3 652 1 1 9 HIS HD2 H 0.548 -1.625 -2.261 1.00 . A A . 9 HIS HD2 1 1 3 653 1 1 9 HIS HE1 H -1.222 1.919 -0.744 1.00 . A A . 9 HIS HE1 1 1 3 654 1 1 9 HIS HE2 H -1.011 0.385 -2.730 1.00 . A A . 9 HIS HE2 1 1 3 655 1 1 9 HIS N N 1.417 -2.895 2.755 1.00 . A A . 9 HIS N 1 1 3 656 1 1 9 HIS ND1 N -0.050 0.395 0.194 1.00 . A A . 9 HIS ND1 1 1 3 657 1 1 9 HIS NE2 N -0.509 0.263 -1.895 1.00 . A A . 9 HIS NE2 1 1 3 658 1 1 9 HIS O O -1.768 -2.504 1.437 1.00 . A A . 9 HIS O 1 1 3 659 1 1 10 LEU C C -2.417 -5.412 1.640 1.00 . A A . 10 LEU C 1 1 3 660 1 1 10 LEU CA C -1.421 -5.102 0.527 1.00 . A A . 10 LEU CA 1 1 3 661 1 1 10 LEU CB C -0.816 -6.402 -0.009 1.00 . A A . 10 LEU CB 1 1 3 662 1 1 10 LEU CD1 C 0.652 -7.589 -1.657 1.00 . A A . 10 LEU CD1 1 1 3 663 1 1 10 LEU CD2 C -0.742 -5.654 -2.403 1.00 . A A . 10 LEU CD2 1 1 3 664 1 1 10 LEU CG C 0.060 -6.248 -1.255 1.00 . A A . 10 LEU CG 1 1 3 665 1 1 10 LEU H H 0.565 -4.506 0.990 1.00 . A A . 10 LEU H 1 1 3 666 1 1 10 LEU HA H -1.945 -4.604 -0.276 1.00 . A A . 10 LEU HA 1 1 3 667 1 1 10 LEU HB2 H -0.216 -6.844 0.773 1.00 . A A . 10 LEU HB2 1 1 3 668 1 1 10 LEU HB3 H -1.623 -7.079 -0.246 1.00 . A A . 10 LEU HB3 1 1 3 669 1 1 10 LEU HD11 H 1.459 -7.431 -2.357 1.00 . A A . 10 LEU HD11 1 1 3 670 1 1 10 LEU HD12 H -0.112 -8.196 -2.119 1.00 . A A . 10 LEU HD12 1 1 3 671 1 1 10 LEU HD13 H 1.031 -8.094 -0.780 1.00 . A A . 10 LEU HD13 1 1 3 672 1 1 10 LEU HD21 H -1.401 -6.407 -2.810 1.00 . A A . 10 LEU HD21 1 1 3 673 1 1 10 LEU HD22 H -0.068 -5.311 -3.174 1.00 . A A . 10 LEU HD22 1 1 3 674 1 1 10 LEU HD23 H -1.327 -4.822 -2.041 1.00 . A A . 10 LEU HD23 1 1 3 675 1 1 10 LEU HG H 0.876 -5.576 -1.032 1.00 . A A . 10 LEU HG 1 1 3 676 1 1 10 LEU N N -0.370 -4.202 0.997 1.00 . A A . 10 LEU N 1 1 3 677 1 1 10 LEU O O -3.630 -5.320 1.443 1.00 . A A . 10 LEU O 1 1 3 678 1 1 11 GLU C C -3.552 -4.894 4.400 1.00 . A A . 11 GLU C 1 1 3 679 1 1 11 GLU CA C -2.733 -6.102 3.954 1.00 . A A . 11 GLU CA 1 1 3 680 1 1 11 GLU CB C -1.859 -6.570 5.120 1.00 . A A . 11 GLU CB 1 1 3 681 1 1 11 GLU CD C -1.859 -6.991 7.612 1.00 . A A . 11 GLU CD 1 1 3 682 1 1 11 GLU CG C -2.653 -7.054 6.323 1.00 . A A . 11 GLU CG 1 1 3 683 1 1 11 GLU H H -0.920 -5.827 2.896 1.00 . A A . 11 GLU H 1 1 3 684 1 1 11 GLU HA H -3.401 -6.898 3.670 1.00 . A A . 11 GLU HA 1 1 3 685 1 1 11 GLU HB2 H -1.227 -7.377 4.783 1.00 . A A . 11 GLU HB2 1 1 3 686 1 1 11 GLU HB3 H -1.235 -5.748 5.437 1.00 . A A . 11 GLU HB3 1 1 3 687 1 1 11 GLU HG2 H -3.531 -6.436 6.430 1.00 . A A . 11 GLU HG2 1 1 3 688 1 1 11 GLU HG3 H -2.954 -8.077 6.152 1.00 . A A . 11 GLU HG3 1 1 3 689 1 1 11 GLU N N -1.897 -5.776 2.805 1.00 . A A . 11 GLU N 1 1 3 690 1 1 11 GLU O O -4.735 -5.003 4.724 1.00 . A A . 11 GLU O 1 1 3 691 1 1 11 GLU OE1 O -0.671 -6.607 7.568 1.00 . A A . 11 GLU OE1 1 1 3 692 1 1 11 GLU OE2 O -2.434 -7.282 8.678 1.00 . A A . 11 GLU OE2 1 1 3 693 1 1 12 HIS C C -3.793 -1.570 3.707 1.00 . A A . 12 HIS C 1 1 3 694 1 1 12 HIS CA C -3.544 -2.516 4.879 1.00 . A A . 12 HIS CA 1 1 3 695 1 1 12 HIS CB C -2.665 -1.840 5.938 1.00 . A A . 12 HIS CB 1 1 3 696 1 1 12 HIS CD2 C -1.158 -3.415 7.346 1.00 . A A . 12 HIS CD2 1 1 3 697 1 1 12 HIS CE1 C -2.596 -3.946 8.900 1.00 . A A . 12 HIS CE1 1 1 3 698 1 1 12 HIS CG C -2.303 -2.749 7.078 1.00 . A A . 12 HIS CG 1 1 3 699 1 1 12 HIS H H -1.952 -3.729 4.187 1.00 . A A . 12 HIS H 1 1 3 700 1 1 12 HIS HA H -4.491 -2.776 5.325 1.00 . A A . 12 HIS HA 1 1 3 701 1 1 12 HIS HB2 H -1.748 -1.504 5.477 1.00 . A A . 12 HIS HB2 1 1 3 702 1 1 12 HIS HB3 H -3.192 -0.989 6.344 1.00 . A A . 12 HIS HB3 1 1 3 703 1 1 12 HIS HD1 H -4.111 -2.798 8.152 1.00 . A A . 12 HIS HD1 1 1 3 704 1 1 12 HIS HD2 H -0.250 -3.384 6.759 1.00 . A A . 12 HIS HD2 1 1 3 705 1 1 12 HIS HE1 H -3.049 -4.388 9.774 1.00 . A A . 12 HIS HE1 1 1 3 706 1 1 12 HIS HE2 H -0.858 -4.987 8.687 1.00 . A A . 12 HIS HE2 1 1 3 707 1 1 12 HIS N N -2.903 -3.746 4.440 1.00 . A A . 12 HIS N 1 1 3 708 1 1 12 HIS ND1 N -3.187 -3.104 8.072 1.00 . A A . 12 HIS ND1 1 1 3 709 1 1 12 HIS NE2 N -1.361 -4.157 8.483 1.00 . A A . 12 HIS NE2 1 1 3 710 1 1 12 HIS O O -3.501 -0.376 3.791 1.00 . A A . 12 HIS O 1 1 3 711 1 1 13 SER C C -5.598 -0.190 1.722 1.00 . A A . 13 SER C 1 1 3 712 1 1 13 SER CA C -4.612 -1.318 1.424 1.00 . A A . 13 SER CA 1 1 3 713 1 1 13 SER CB C -5.160 -2.213 0.309 1.00 . A A . 13 SER CB 1 1 3 714 1 1 13 SER H H -4.532 -3.070 2.613 1.00 . A A . 13 SER H 1 1 3 715 1 1 13 SER HA H -3.681 -0.883 1.093 1.00 . A A . 13 SER HA 1 1 3 716 1 1 13 SER HB2 H -6.022 -2.752 0.672 1.00 . A A . 13 SER HB2 1 1 3 717 1 1 13 SER HB3 H -5.448 -1.600 -0.533 1.00 . A A . 13 SER HB3 1 1 3 718 1 1 13 SER HG H -4.202 -3.924 0.458 1.00 . A A . 13 SER HG 1 1 3 719 1 1 13 SER N N -4.329 -2.111 2.619 1.00 . A A . 13 SER N 1 1 3 720 1 1 13 SER O O -5.382 0.954 1.321 1.00 . A A . 13 SER O 1 1 3 721 1 1 13 SER OG O -4.186 -3.149 -0.122 1.00 . A A . 13 SER OG 1 1 3 722 1 1 14 ASN C C -7.151 1.554 3.661 1.00 . A A . 14 ASN C 1 1 3 723 1 1 14 ASN CA C -7.709 0.451 2.771 1.00 . A A . 14 ASN CA 1 1 3 724 1 1 14 ASN CB C -8.885 -0.231 3.479 1.00 . A A . 14 ASN CB 1 1 3 725 1 1 14 ASN CG C -9.553 -1.290 2.624 1.00 . A A . 14 ASN CG 1 1 3 726 1 1 14 ASN H H -6.791 -1.456 2.702 1.00 . A A . 14 ASN H 1 1 3 727 1 1 14 ASN HA H -8.064 0.896 1.856 1.00 . A A . 14 ASN HA 1 1 3 728 1 1 14 ASN HB2 H -8.525 -0.702 4.382 1.00 . A A . 14 ASN HB2 1 1 3 729 1 1 14 ASN HB3 H -9.621 0.514 3.738 1.00 . A A . 14 ASN HB3 1 1 3 730 1 1 14 ASN HD21 H -11.249 -0.256 2.614 1.00 . A A . 14 ASN HD21 1 1 3 731 1 1 14 ASN HD22 H -11.270 -1.746 1.742 1.00 . A A . 14 ASN HD22 1 1 3 732 1 1 14 ASN N N -6.677 -0.523 2.420 1.00 . A A . 14 ASN N 1 1 3 733 1 1 14 ASN ND2 N -10.818 -1.075 2.293 1.00 . A A . 14 ASN ND2 1 1 3 734 1 1 14 ASN O O -7.576 2.704 3.581 1.00 . A A . 14 ASN O 1 1 3 735 1 1 14 ASN OD1 O -8.940 -2.292 2.263 1.00 . A A . 14 ASN OD1 1 1 3 736 1 1 15 LEU C C -4.731 3.158 4.674 1.00 . A A . 15 LEU C 1 1 3 737 1 1 15 LEU CA C -5.586 2.147 5.425 1.00 . A A . 15 LEU CA 1 1 3 738 1 1 15 LEU CB C -4.742 1.424 6.475 1.00 . A A . 15 LEU CB 1 1 3 739 1 1 15 LEU CD1 C -4.604 -0.006 8.530 1.00 . A A . 15 LEU CD1 1 1 3 740 1 1 15 LEU CD2 C -6.592 1.464 8.173 1.00 . A A . 15 LEU CD2 1 1 3 741 1 1 15 LEU CG C -5.536 0.602 7.496 1.00 . A A . 15 LEU CG 1 1 3 742 1 1 15 LEU H H -5.910 0.260 4.526 1.00 . A A . 15 LEU H 1 1 3 743 1 1 15 LEU HA H -6.381 2.677 5.925 1.00 . A A . 15 LEU HA 1 1 3 744 1 1 15 LEU HB2 H -4.062 0.760 5.962 1.00 . A A . 15 LEU HB2 1 1 3 745 1 1 15 LEU HB3 H -4.164 2.160 7.010 1.00 . A A . 15 LEU HB3 1 1 3 746 1 1 15 LEU HD11 H -3.932 0.754 8.901 1.00 . A A . 15 LEU HD11 1 1 3 747 1 1 15 LEU HD12 H -4.031 -0.802 8.075 1.00 . A A . 15 LEU HD12 1 1 3 748 1 1 15 LEU HD13 H -5.185 -0.405 9.349 1.00 . A A . 15 LEU HD13 1 1 3 749 1 1 15 LEU HD21 H -6.204 1.840 9.108 1.00 . A A . 15 LEU HD21 1 1 3 750 1 1 15 LEU HD22 H -7.474 0.870 8.362 1.00 . A A . 15 LEU HD22 1 1 3 751 1 1 15 LEU HD23 H -6.847 2.293 7.530 1.00 . A A . 15 LEU HD23 1 1 3 752 1 1 15 LEU HG H -6.039 -0.205 6.984 1.00 . A A . 15 LEU HG 1 1 3 753 1 1 15 LEU N N -6.203 1.192 4.513 1.00 . A A . 15 LEU N 1 1 3 754 1 1 15 LEU O O -4.708 4.337 5.013 1.00 . A A . 15 LEU O 1 1 3 755 1 1 16 CYS C C -3.962 4.372 1.838 1.00 . A A . 16 CYS C 1 1 3 756 1 1 16 CYS CA C -3.170 3.549 2.852 1.00 . A A . 16 CYS CA 1 1 3 757 1 1 16 CYS CB C -2.115 2.722 2.127 1.00 . A A . 16 CYS CB 1 1 3 758 1 1 16 CYS H H -4.097 1.735 3.437 1.00 . A A . 16 CYS H 1 1 3 759 1 1 16 CYS HA H -2.671 4.228 3.527 1.00 . A A . 16 CYS HA 1 1 3 760 1 1 16 CYS HB2 H -2.601 1.923 1.593 1.00 . A A . 16 CYS HB2 1 1 3 761 1 1 16 CYS HB3 H -1.595 3.354 1.423 1.00 . A A . 16 CYS HB3 1 1 3 762 1 1 16 CYS N N -4.033 2.687 3.655 1.00 . A A . 16 CYS N 1 1 3 763 1 1 16 CYS O O -3.493 4.622 0.726 1.00 . A A . 16 CYS O 1 1 3 764 1 1 16 CYS SG S -0.872 1.979 3.226 1.00 . A A . 16 CYS SG 1 1 3 765 1 1 17 GLY C C -5.638 7.098 1.498 1.00 . A A . 17 GLY C 1 1 3 766 1 1 17 GLY CA C -5.974 5.626 1.366 1.00 . A A . 17 GLY CA 1 1 3 767 1 1 17 GLY H H -5.453 4.595 3.140 1.00 . A A . 17 GLY H 1 1 3 768 1 1 17 GLY HA2 H -5.821 5.320 0.341 1.00 . A A . 17 GLY HA2 1 1 3 769 1 1 17 GLY HA3 H -7.007 5.480 1.629 1.00 . A A . 17 GLY HA3 1 1 3 770 1 1 17 GLY N N -5.146 4.812 2.236 1.00 . A A . 17 GLY N 1 1 3 771 1 1 17 GLY O O -6.464 7.967 1.218 1.00 . A A . 17 GLY O 1 1 3 772 1 1 18 ALA C C -2.411 8.631 2.386 1.00 . A A . 18 ALA C 1 1 3 773 1 1 18 ALA CA C -3.904 8.703 2.115 1.00 . A A . 18 ALA CA 1 1 3 774 1 1 18 ALA CB C -4.620 9.400 3.266 1.00 . A A . 18 ALA CB 1 1 3 775 1 1 18 ALA H H -3.819 6.611 2.118 1.00 . A A . 18 ALA H 1 1 3 776 1 1 18 ALA HA H -4.077 9.264 1.208 1.00 . A A . 18 ALA HA 1 1 3 777 1 1 18 ALA HB1 H -5.644 9.062 3.311 1.00 . A A . 18 ALA HB1 1 1 3 778 1 1 18 ALA HB2 H -4.600 10.468 3.108 1.00 . A A . 18 ALA HB2 1 1 3 779 1 1 18 ALA HB3 H -4.121 9.164 4.195 1.00 . A A . 18 ALA HB3 1 1 3 780 1 1 18 ALA N N -4.413 7.359 1.925 1.00 . A A . 18 ALA N 1 1 3 781 1 1 18 ALA O O -1.976 8.059 3.386 1.00 . A A . 18 ALA O 1 1 3 782 1 1 19 GLY C C 0.290 10.034 2.770 1.00 . A A . 19 GLY C 1 1 3 783 1 1 19 GLY CA C -0.192 9.172 1.621 1.00 . A A . 19 GLY CA 1 1 3 784 1 1 19 GLY H H -2.043 9.608 0.701 1.00 . A A . 19 GLY H 1 1 3 785 1 1 19 GLY HA2 H 0.130 8.155 1.788 1.00 . A A . 19 GLY HA2 1 1 3 786 1 1 19 GLY HA3 H 0.253 9.532 0.705 1.00 . A A . 19 GLY HA3 1 1 3 787 1 1 19 GLY N N -1.634 9.190 1.480 1.00 . A A . 19 GLY N 1 1 3 788 1 1 19 GLY O O -0.031 11.219 2.841 1.00 . A A . 19 GLY O 1 1 3 789 1 1 20 GLY C C 2.870 10.891 4.479 1.00 . A A . 20 GLY C 1 1 3 790 1 1 20 GLY CA C 1.583 10.161 4.810 1.00 . A A . 20 GLY CA 1 1 3 791 1 1 20 GLY H H 1.277 8.487 3.556 1.00 . A A . 20 GLY H 1 1 3 792 1 1 20 GLY HA2 H 0.845 10.879 5.134 1.00 . A A . 20 GLY HA2 1 1 3 793 1 1 20 GLY HA3 H 1.773 9.465 5.613 1.00 . A A . 20 GLY HA3 1 1 3 794 1 1 20 GLY N N 1.061 9.432 3.670 1.00 . A A . 20 GLY N 1 1 3 795 1 1 20 GLY O O 2.997 11.487 3.412 1.00 . A A . 20 GLY O 1 1 3 796 1 1 21 ALA C C 6.037 10.676 4.271 1.00 . A A . 21 ALA C 1 1 3 797 1 1 21 ALA CA C 5.126 11.492 5.191 1.00 . A A . 21 ALA CA 1 1 3 798 1 1 21 ALA CB C 5.801 11.733 6.534 1.00 . A A . 21 ALA CB 1 1 3 799 1 1 21 ALA H H 3.680 10.335 6.217 1.00 . A A . 21 ALA H 1 1 3 800 1 1 21 ALA HA H 4.940 12.453 4.733 1.00 . A A . 21 ALA HA 1 1 3 801 1 1 21 ALA HB1 H 5.100 11.533 7.331 1.00 . A A . 21 ALA HB1 1 1 3 802 1 1 21 ALA HB2 H 6.130 12.759 6.592 1.00 . A A . 21 ALA HB2 1 1 3 803 1 1 21 ALA HB3 H 6.653 11.076 6.631 1.00 . A A . 21 ALA HB3 1 1 3 804 1 1 21 ALA N N 3.835 10.835 5.390 1.00 . A A . 21 ALA N 1 1 3 805 1 1 21 ALA O O 7.232 10.540 4.533 1.00 . A A . 21 ALA O 1 1 3 806 1 1 22 ALA C C 6.953 8.198 2.846 1.00 . A A . 22 ALA C 1 1 3 807 1 1 22 ALA CA C 6.179 9.348 2.202 1.00 . A A . 22 ALA CA 1 1 3 808 1 1 22 ALA CB C 7.111 10.231 1.381 1.00 . A A . 22 ALA CB 1 1 3 809 1 1 22 ALA H H 4.498 10.316 3.054 1.00 . A A . 22 ALA H 1 1 3 810 1 1 22 ALA HA H 5.446 8.928 1.531 1.00 . A A . 22 ALA HA 1 1 3 811 1 1 22 ALA HB1 H 7.877 9.621 0.926 1.00 . A A . 22 ALA HB1 1 1 3 812 1 1 22 ALA HB2 H 7.573 10.965 2.027 1.00 . A A . 22 ALA HB2 1 1 3 813 1 1 22 ALA HB3 H 6.545 10.734 0.611 1.00 . A A . 22 ALA HB3 1 1 3 814 1 1 22 ALA N N 5.455 10.149 3.193 1.00 . A A . 22 ALA N 1 1 3 815 1 1 22 ALA O O 8.057 7.861 2.423 1.00 . A A . 22 ALA O 1 1 3 816 1 1 23 GLY C C 6.145 5.887 5.622 1.00 . A A . 23 GLY C 1 1 3 817 1 1 23 GLY CA C 7.011 6.493 4.542 1.00 . A A . 23 GLY CA 1 1 3 818 1 1 23 GLY H H 5.481 7.899 4.159 1.00 . A A . 23 GLY H 1 1 3 819 1 1 23 GLY HA2 H 7.251 5.729 3.817 1.00 . A A . 23 GLY HA2 1 1 3 820 1 1 23 GLY HA3 H 7.928 6.851 4.990 1.00 . A A . 23 GLY HA3 1 1 3 821 1 1 23 GLY N N 6.362 7.593 3.865 1.00 . A A . 23 GLY N 1 1 3 822 1 1 23 GLY O O 5.451 6.602 6.345 1.00 . A A . 23 GLY O 1 1 4 823 1 1 1 GLY C C 5.567 2.936 6.307 1.00 . A A . 1 GLY C 1 1 4 824 1 1 1 GLY CA C 5.654 4.407 6.667 1.00 . A A . 1 GLY CA 1 1 4 825 1 1 1 GLY H1 H 6.459 5.884 5.385 1.00 . A A . 1 GLY H1 1 1 4 826 1 1 1 GLY HA2 H 6.541 4.569 7.260 1.00 . A A . 1 GLY HA2 1 1 4 827 1 1 1 GLY HA3 H 4.788 4.675 7.253 1.00 . A A . 1 GLY HA3 1 1 4 828 1 1 1 GLY N N 5.711 5.264 5.496 1.00 . A A . 1 GLY N 1 1 4 829 1 1 1 GLY O O 6.350 2.440 5.498 1.00 . A A . 1 GLY O 1 1 4 830 1 1 2 CYS C C 3.902 0.597 5.235 1.00 . A A . 2 CYS C 1 1 4 831 1 1 2 CYS CA C 4.392 0.825 6.662 1.00 . A A . 2 CYS CA 1 1 4 832 1 1 2 CYS CB C 3.367 0.285 7.664 1.00 . A A . 2 CYS CB 1 1 4 833 1 1 2 CYS H H 4.017 2.713 7.536 1.00 . A A . 2 CYS H 1 1 4 834 1 1 2 CYS HA H 5.330 0.307 6.796 1.00 . A A . 2 CYS HA 1 1 4 835 1 1 2 CYS HB2 H 3.515 0.775 8.612 1.00 . A A . 2 CYS HB2 1 1 4 836 1 1 2 CYS HB3 H 2.374 0.511 7.303 1.00 . A A . 2 CYS HB3 1 1 4 837 1 1 2 CYS N N 4.607 2.248 6.907 1.00 . A A . 2 CYS N 1 1 4 838 1 1 2 CYS O O 4.199 -0.423 4.620 1.00 . A A . 2 CYS O 1 1 4 839 1 1 2 CYS SG S 3.454 -1.512 7.952 1.00 . A A . 2 CYS SG 1 1 4 840 1 1 3 CYS C C 3.701 1.343 2.315 1.00 . A A . 3 CYS C 1 1 4 841 1 1 3 CYS CA C 2.603 1.491 3.366 1.00 . A A . 3 CYS CA 1 1 4 842 1 1 3 CYS CB C 1.758 2.730 3.079 1.00 . A A . 3 CYS CB 1 1 4 843 1 1 3 CYS H H 2.954 2.353 5.266 1.00 . A A . 3 CYS H 1 1 4 844 1 1 3 CYS HA H 1.968 0.620 3.320 1.00 . A A . 3 CYS HA 1 1 4 845 1 1 3 CYS HB2 H 2.387 3.606 3.134 1.00 . A A . 3 CYS HB2 1 1 4 846 1 1 3 CYS HB3 H 1.343 2.651 2.085 1.00 . A A . 3 CYS HB3 1 1 4 847 1 1 3 CYS N N 3.150 1.563 4.719 1.00 . A A . 3 CYS N 1 1 4 848 1 1 3 CYS O O 3.458 0.806 1.232 1.00 . A A . 3 CYS O 1 1 4 849 1 1 3 CYS SG S 0.377 2.958 4.246 1.00 . A A . 3 CYS SG 1 1 4 850 1 1 4 SER C C 6.394 0.249 1.483 1.00 . A A . 4 SER C 1 1 4 851 1 1 4 SER CA C 6.044 1.713 1.738 1.00 . A A . 4 SER CA 1 1 4 852 1 1 4 SER CB C 7.254 2.429 2.336 1.00 . A A . 4 SER CB 1 1 4 853 1 1 4 SER H H 5.030 2.217 3.524 1.00 . A A . 4 SER H 1 1 4 854 1 1 4 SER HA H 5.775 2.180 0.806 1.00 . A A . 4 SER HA 1 1 4 855 1 1 4 SER HB2 H 7.776 1.757 3.001 1.00 . A A . 4 SER HB2 1 1 4 856 1 1 4 SER HB3 H 7.917 2.735 1.540 1.00 . A A . 4 SER HB3 1 1 4 857 1 1 4 SER HG H 6.859 3.364 4.009 1.00 . A A . 4 SER HG 1 1 4 858 1 1 4 SER N N 4.903 1.807 2.644 1.00 . A A . 4 SER N 1 1 4 859 1 1 4 SER O O 6.982 -0.102 0.463 1.00 . A A . 4 SER O 1 1 4 860 1 1 4 SER OG O 6.858 3.576 3.067 1.00 . A A . 4 SER OG 1 1 4 861 1 1 5 ASN C C 5.113 -2.706 1.600 1.00 . A A . 5 ASN C 1 1 4 862 1 1 5 ASN CA C 6.270 -2.028 2.321 1.00 . A A . 5 ASN CA 1 1 4 863 1 1 5 ASN CB C 6.469 -2.641 3.711 1.00 . A A . 5 ASN CB 1 1 4 864 1 1 5 ASN CG C 7.837 -2.343 4.304 1.00 . A A . 5 ASN CG 1 1 4 865 1 1 5 ASN H H 5.537 -0.257 3.213 1.00 . A A . 5 ASN H 1 1 4 866 1 1 5 ASN HA H 7.171 -2.162 1.741 1.00 . A A . 5 ASN HA 1 1 4 867 1 1 5 ASN HB2 H 5.721 -2.242 4.383 1.00 . A A . 5 ASN HB2 1 1 4 868 1 1 5 ASN HB3 H 6.352 -3.713 3.644 1.00 . A A . 5 ASN HB3 1 1 4 869 1 1 5 ASN HD21 H 8.344 -1.250 2.722 1.00 . A A . 5 ASN HD21 1 1 4 870 1 1 5 ASN HD22 H 9.539 -1.381 3.962 1.00 . A A . 5 ASN HD22 1 1 4 871 1 1 5 ASN N N 6.016 -0.601 2.426 1.00 . A A . 5 ASN N 1 1 4 872 1 1 5 ASN ND2 N 8.655 -1.581 3.589 1.00 . A A . 5 ASN ND2 1 1 4 873 1 1 5 ASN O O 3.958 -2.554 1.990 1.00 . A A . 5 ASN O 1 1 4 874 1 1 5 ASN OD1 O 8.156 -2.795 5.400 1.00 . A A . 5 ASN OD1 1 1 4 875 1 1 6 PRO C C 3.467 -5.033 0.535 1.00 . A A . 6 PRO C 1 1 4 876 1 1 6 PRO CA C 4.397 -4.142 -0.287 1.00 . A A . 6 PRO CA 1 1 4 877 1 1 6 PRO CB C 5.229 -4.990 -1.251 1.00 . A A . 6 PRO CB 1 1 4 878 1 1 6 PRO CD C 6.771 -3.651 -0.014 1.00 . A A . 6 PRO CD 1 1 4 879 1 1 6 PRO CG C 6.526 -4.270 -1.362 1.00 . A A . 6 PRO CG 1 1 4 880 1 1 6 PRO HA H 3.802 -3.439 -0.851 1.00 . A A . 6 PRO HA 1 1 4 881 1 1 6 PRO HB2 H 5.360 -5.981 -0.840 1.00 . A A . 6 PRO HB2 1 1 4 882 1 1 6 PRO HB3 H 4.729 -5.051 -2.206 1.00 . A A . 6 PRO HB3 1 1 4 883 1 1 6 PRO HD2 H 7.336 -4.325 0.613 1.00 . A A . 6 PRO HD2 1 1 4 884 1 1 6 PRO HD3 H 7.286 -2.708 -0.120 1.00 . A A . 6 PRO HD3 1 1 4 885 1 1 6 PRO HG2 H 7.315 -4.968 -1.603 1.00 . A A . 6 PRO HG2 1 1 4 886 1 1 6 PRO HG3 H 6.457 -3.503 -2.118 1.00 . A A . 6 PRO HG3 1 1 4 887 1 1 6 PRO N N 5.412 -3.450 0.523 1.00 . A A . 6 PRO N 1 1 4 888 1 1 6 PRO O O 2.256 -5.034 0.322 1.00 . A A . 6 PRO O 1 1 4 889 1 1 7 VAL C C 2.258 -5.893 3.152 1.00 . A A . 7 VAL C 1 1 4 890 1 1 7 VAL CA C 3.253 -6.683 2.311 1.00 . A A . 7 VAL CA 1 1 4 891 1 1 7 VAL CB C 4.158 -7.518 3.245 1.00 . A A . 7 VAL CB 1 1 4 892 1 1 7 VAL CG1 C 3.330 -8.503 4.060 1.00 . A A . 7 VAL CG1 1 1 4 893 1 1 7 VAL CG2 C 5.227 -8.247 2.445 1.00 . A A . 7 VAL CG2 1 1 4 894 1 1 7 VAL H H 5.006 -5.740 1.594 1.00 . A A . 7 VAL H 1 1 4 895 1 1 7 VAL HA H 2.710 -7.360 1.667 1.00 . A A . 7 VAL HA 1 1 4 896 1 1 7 VAL HB H 4.650 -6.844 3.930 1.00 . A A . 7 VAL HB 1 1 4 897 1 1 7 VAL HG11 H 3.812 -9.469 4.054 1.00 . A A . 7 VAL HG11 1 1 4 898 1 1 7 VAL HG12 H 2.345 -8.590 3.626 1.00 . A A . 7 VAL HG12 1 1 4 899 1 1 7 VAL HG13 H 3.246 -8.147 5.075 1.00 . A A . 7 VAL HG13 1 1 4 900 1 1 7 VAL HG21 H 4.795 -8.633 1.534 1.00 . A A . 7 VAL HG21 1 1 4 901 1 1 7 VAL HG22 H 5.620 -9.064 3.032 1.00 . A A . 7 VAL HG22 1 1 4 902 1 1 7 VAL HG23 H 6.025 -7.561 2.203 1.00 . A A . 7 VAL HG23 1 1 4 903 1 1 7 VAL N N 4.038 -5.787 1.468 1.00 . A A . 7 VAL N 1 1 4 904 1 1 7 VAL O O 1.071 -6.211 3.193 1.00 . A A . 7 VAL O 1 1 4 905 1 1 8 CYS C C 0.887 -3.279 3.797 1.00 . A A . 8 CYS C 1 1 4 906 1 1 8 CYS CA C 1.914 -4.010 4.645 1.00 . A A . 8 CYS CA 1 1 4 907 1 1 8 CYS CB C 2.758 -2.996 5.404 1.00 . A A . 8 CYS CB 1 1 4 908 1 1 8 CYS H H 3.708 -4.649 3.722 1.00 . A A . 8 CYS H 1 1 4 909 1 1 8 CYS HA H 1.400 -4.644 5.352 1.00 . A A . 8 CYS HA 1 1 4 910 1 1 8 CYS HB2 H 3.661 -3.471 5.744 1.00 . A A . 8 CYS HB2 1 1 4 911 1 1 8 CYS HB3 H 3.013 -2.190 4.734 1.00 . A A . 8 CYS HB3 1 1 4 912 1 1 8 CYS N N 2.754 -4.855 3.808 1.00 . A A . 8 CYS N 1 1 4 913 1 1 8 CYS O O -0.270 -3.151 4.182 1.00 . A A . 8 CYS O 1 1 4 914 1 1 8 CYS SG S 1.924 -2.263 6.850 1.00 . A A . 8 CYS SG 1 1 4 915 1 1 9 HIS C C -0.710 -2.967 1.294 1.00 . A A . 9 HIS C 1 1 4 916 1 1 9 HIS CA C 0.443 -2.078 1.727 1.00 . A A . 9 HIS CA 1 1 4 917 1 1 9 HIS CB C 1.201 -1.609 0.485 1.00 . A A . 9 HIS CB 1 1 4 918 1 1 9 HIS CD2 C 0.815 0.661 -0.725 1.00 . A A . 9 HIS CD2 1 1 4 919 1 1 9 HIS CE1 C -1.212 0.287 -1.477 1.00 . A A . 9 HIS CE1 1 1 4 920 1 1 9 HIS CG C 0.455 -0.582 -0.322 1.00 . A A . 9 HIS CG 1 1 4 921 1 1 9 HIS H H 2.270 -2.932 2.395 1.00 . A A . 9 HIS H 1 1 4 922 1 1 9 HIS HA H 0.050 -1.219 2.249 1.00 . A A . 9 HIS HA 1 1 4 923 1 1 9 HIS HB2 H 2.142 -1.182 0.787 1.00 . A A . 9 HIS HB2 1 1 4 924 1 1 9 HIS HB3 H 1.388 -2.460 -0.153 1.00 . A A . 9 HIS HB3 1 1 4 925 1 1 9 HIS HD1 H -1.370 -1.590 -0.674 1.00 . A A . 9 HIS HD1 1 1 4 926 1 1 9 HIS HD2 H 1.756 1.152 -0.522 1.00 . A A . 9 HIS HD2 1 1 4 927 1 1 9 HIS HE1 H -2.165 0.413 -1.968 1.00 . A A . 9 HIS HE1 1 1 4 928 1 1 9 HIS HE2 H -0.319 2.110 -1.740 1.00 . A A . 9 HIS HE2 1 1 4 929 1 1 9 HIS N N 1.324 -2.799 2.639 1.00 . A A . 9 HIS N 1 1 4 930 1 1 9 HIS ND1 N -0.822 -0.782 -0.811 1.00 . A A . 9 HIS ND1 1 1 4 931 1 1 9 HIS NE2 N -0.239 1.179 -1.441 1.00 . A A . 9 HIS NE2 1 1 4 932 1 1 9 HIS O O -1.850 -2.526 1.242 1.00 . A A . 9 HIS O 1 1 4 933 1 1 10 LEU C C -2.405 -5.443 1.647 1.00 . A A . 10 LEU C 1 1 4 934 1 1 10 LEU CA C -1.399 -5.173 0.531 1.00 . A A . 10 LEU CA 1 1 4 935 1 1 10 LEU CB C -0.728 -6.480 0.095 1.00 . A A . 10 LEU CB 1 1 4 936 1 1 10 LEU CD1 C -2.363 -7.068 -1.718 1.00 . A A . 10 LEU CD1 1 1 4 937 1 1 10 LEU CD2 C -0.916 -8.844 -0.713 1.00 . A A . 10 LEU CD2 1 1 4 938 1 1 10 LEU CG C -1.674 -7.552 -0.450 1.00 . A A . 10 LEU CG 1 1 4 939 1 1 10 LEU H H 0.548 -4.492 1.023 1.00 . A A . 10 LEU H 1 1 4 940 1 1 10 LEU HA H -1.920 -4.746 -0.313 1.00 . A A . 10 LEU HA 1 1 4 941 1 1 10 LEU HB2 H -0.002 -6.248 -0.670 1.00 . A A . 10 LEU HB2 1 1 4 942 1 1 10 LEU HB3 H -0.207 -6.892 0.947 1.00 . A A . 10 LEU HB3 1 1 4 943 1 1 10 LEU HD11 H -2.022 -6.071 -1.956 1.00 . A A . 10 LEU HD11 1 1 4 944 1 1 10 LEU HD12 H -3.432 -7.055 -1.564 1.00 . A A . 10 LEU HD12 1 1 4 945 1 1 10 LEU HD13 H -2.124 -7.734 -2.534 1.00 . A A . 10 LEU HD13 1 1 4 946 1 1 10 LEU HD21 H 0.083 -8.763 -0.313 1.00 . A A . 10 LEU HD21 1 1 4 947 1 1 10 LEU HD22 H -0.863 -9.020 -1.778 1.00 . A A . 10 LEU HD22 1 1 4 948 1 1 10 LEU HD23 H -1.429 -9.666 -0.237 1.00 . A A . 10 LEU HD23 1 1 4 949 1 1 10 LEU HG H -2.437 -7.756 0.286 1.00 . A A . 10 LEU HG 1 1 4 950 1 1 10 LEU N N -0.394 -4.212 0.972 1.00 . A A . 10 LEU N 1 1 4 951 1 1 10 LEU O O -3.617 -5.410 1.429 1.00 . A A . 10 LEU O 1 1 4 952 1 1 11 GLU C C -3.537 -4.732 4.390 1.00 . A A . 11 GLU C 1 1 4 953 1 1 11 GLU CA C -2.732 -5.973 4.000 1.00 . A A . 11 GLU CA 1 1 4 954 1 1 11 GLU CB C -1.853 -6.417 5.176 1.00 . A A . 11 GLU CB 1 1 4 955 1 1 11 GLU CD C -1.736 -6.866 7.658 1.00 . A A . 11 GLU CD 1 1 4 956 1 1 11 GLU CG C -2.629 -6.779 6.435 1.00 . A A . 11 GLU CG 1 1 4 957 1 1 11 GLU H H -0.915 -5.708 2.948 1.00 . A A . 11 GLU H 1 1 4 958 1 1 11 GLU HA H -3.411 -6.767 3.745 1.00 . A A . 11 GLU HA 1 1 4 959 1 1 11 GLU HB2 H -1.282 -7.282 4.874 1.00 . A A . 11 GLU HB2 1 1 4 960 1 1 11 GLU HB3 H -1.170 -5.617 5.419 1.00 . A A . 11 GLU HB3 1 1 4 961 1 1 11 GLU HG2 H -3.380 -6.024 6.610 1.00 . A A . 11 GLU HG2 1 1 4 962 1 1 11 GLU HG3 H -3.107 -7.736 6.287 1.00 . A A . 11 GLU HG3 1 1 4 963 1 1 11 GLU N N -1.891 -5.701 2.841 1.00 . A A . 11 GLU N 1 1 4 964 1 1 11 GLU O O -4.739 -4.802 4.641 1.00 . A A . 11 GLU O 1 1 4 965 1 1 11 GLU OE1 O -0.775 -7.656 7.637 1.00 . A A . 11 GLU OE1 1 1 4 966 1 1 11 GLU OE2 O -1.983 -6.120 8.633 1.00 . A A . 11 GLU OE2 1 1 4 967 1 1 12 HIS C C -3.880 -1.532 3.581 1.00 . A A . 12 HIS C 1 1 4 968 1 1 12 HIS CA C -3.493 -2.336 4.819 1.00 . A A . 12 HIS CA 1 1 4 969 1 1 12 HIS CB C -2.567 -1.479 5.712 1.00 . A A . 12 HIS CB 1 1 4 970 1 1 12 HIS CD2 C -1.727 -3.491 7.126 1.00 . A A . 12 HIS CD2 1 1 4 971 1 1 12 HIS CE1 C -1.168 -2.421 8.944 1.00 . A A . 12 HIS CE1 1 1 4 972 1 1 12 HIS CG C -2.005 -2.187 6.917 1.00 . A A . 12 HIS CG 1 1 4 973 1 1 12 HIS H H -1.897 -3.608 4.235 1.00 . A A . 12 HIS H 1 1 4 974 1 1 12 HIS HA H -4.390 -2.572 5.371 1.00 . A A . 12 HIS HA 1 1 4 975 1 1 12 HIS HB2 H -1.733 -1.137 5.120 1.00 . A A . 12 HIS HB2 1 1 4 976 1 1 12 HIS HB3 H -3.122 -0.620 6.063 1.00 . A A . 12 HIS HB3 1 1 4 977 1 1 12 HIS HD1 H -1.710 -0.574 8.244 1.00 . A A . 12 HIS HD1 1 1 4 978 1 1 12 HIS HD2 H -1.865 -4.290 6.414 1.00 . A A . 12 HIS HD2 1 1 4 979 1 1 12 HIS HE1 H -0.807 -2.201 9.938 1.00 . A A . 12 HIS HE1 1 1 4 980 1 1 12 HIS HE2 H -1.169 -4.474 8.886 1.00 . A A . 12 HIS HE2 1 1 4 981 1 1 12 HIS N N -2.858 -3.596 4.445 1.00 . A A . 12 HIS N 1 1 4 982 1 1 12 HIS ND1 N -1.641 -1.537 8.079 1.00 . A A . 12 HIS ND1 1 1 4 983 1 1 12 HIS NE2 N -1.213 -3.614 8.388 1.00 . A A . 12 HIS NE2 1 1 4 984 1 1 12 HIS O O -3.710 -0.316 3.555 1.00 . A A . 12 HIS O 1 1 4 985 1 1 13 SER C C -5.862 -0.489 1.567 1.00 . A A . 13 SER C 1 1 4 986 1 1 13 SER CA C -4.787 -1.542 1.319 1.00 . A A . 13 SER CA 1 1 4 987 1 1 13 SER CB C -5.283 -2.561 0.290 1.00 . A A . 13 SER CB 1 1 4 988 1 1 13 SER H H -4.497 -3.184 2.633 1.00 . A A . 13 SER H 1 1 4 989 1 1 13 SER HA H -3.913 -1.049 0.923 1.00 . A A . 13 SER HA 1 1 4 990 1 1 13 SER HB2 H -6.029 -3.195 0.744 1.00 . A A . 13 SER HB2 1 1 4 991 1 1 13 SER HB3 H -5.717 -2.038 -0.550 1.00 . A A . 13 SER HB3 1 1 4 992 1 1 13 SER HG H -4.168 -4.175 0.357 1.00 . A A . 13 SER HG 1 1 4 993 1 1 13 SER N N -4.391 -2.210 2.558 1.00 . A A . 13 SER N 1 1 4 994 1 1 13 SER O O -5.846 0.578 0.960 1.00 . A A . 13 SER O 1 1 4 995 1 1 13 SER OG O -4.220 -3.371 -0.178 1.00 . A A . 13 SER OG 1 1 4 996 1 1 14 ASN C C -7.358 1.381 3.471 1.00 . A A . 14 ASN C 1 1 4 997 1 1 14 ASN CA C -7.879 0.118 2.788 1.00 . A A . 14 ASN CA 1 1 4 998 1 1 14 ASN CB C -8.906 -0.598 3.678 1.00 . A A . 14 ASN CB 1 1 4 999 1 1 14 ASN CG C -10.031 0.309 4.152 1.00 . A A . 14 ASN CG 1 1 4 1000 1 1 14 ASN H H -6.747 -1.667 2.909 1.00 . A A . 14 ASN H 1 1 4 1001 1 1 14 ASN HA H -8.356 0.400 1.866 1.00 . A A . 14 ASN HA 1 1 4 1002 1 1 14 ASN HB2 H -9.343 -1.413 3.122 1.00 . A A . 14 ASN HB2 1 1 4 1003 1 1 14 ASN HB3 H -8.400 -0.995 4.546 1.00 . A A . 14 ASN HB3 1 1 4 1004 1 1 14 ASN HD21 H -11.291 -0.531 2.868 1.00 . A A . 14 ASN HD21 1 1 4 1005 1 1 14 ASN HD22 H -11.946 0.728 3.852 1.00 . A A . 14 ASN HD22 1 1 4 1006 1 1 14 ASN N N -6.791 -0.798 2.460 1.00 . A A . 14 ASN N 1 1 4 1007 1 1 14 ASN ND2 N -11.208 0.150 3.565 1.00 . A A . 14 ASN ND2 1 1 4 1008 1 1 14 ASN O O -7.811 2.485 3.181 1.00 . A A . 14 ASN O 1 1 4 1009 1 1 14 ASN OD1 O -9.847 1.139 5.038 1.00 . A A . 14 ASN OD1 1 1 4 1010 1 1 15 LEU C C -4.850 3.124 4.286 1.00 . A A . 15 LEU C 1 1 4 1011 1 1 15 LEU CA C -5.838 2.321 5.126 1.00 . A A . 15 LEU CA 1 1 4 1012 1 1 15 LEU CB C -5.141 1.805 6.388 1.00 . A A . 15 LEU CB 1 1 4 1013 1 1 15 LEU CD1 C -5.225 0.526 8.540 1.00 . A A . 15 LEU CD1 1 1 4 1014 1 1 15 LEU CD2 C -7.173 1.936 7.853 1.00 . A A . 15 LEU CD2 1 1 4 1015 1 1 15 LEU CG C -6.040 1.045 7.365 1.00 . A A . 15 LEU CG 1 1 4 1016 1 1 15 LEU H H -6.104 0.298 4.566 1.00 . A A . 15 LEU H 1 1 4 1017 1 1 15 LEU HA H -6.645 2.969 5.418 1.00 . A A . 15 LEU HA 1 1 4 1018 1 1 15 LEU HB2 H -4.337 1.149 6.087 1.00 . A A . 15 LEU HB2 1 1 4 1019 1 1 15 LEU HB3 H -4.716 2.649 6.910 1.00 . A A . 15 LEU HB3 1 1 4 1020 1 1 15 LEU HD11 H -4.959 1.351 9.184 1.00 . A A . 15 LEU HD11 1 1 4 1021 1 1 15 LEU HD12 H -4.328 0.051 8.174 1.00 . A A . 15 LEU HD12 1 1 4 1022 1 1 15 LEU HD13 H -5.812 -0.191 9.096 1.00 . A A . 15 LEU HD13 1 1 4 1023 1 1 15 LEU HD21 H -8.053 1.759 7.254 1.00 . A A . 15 LEU HD21 1 1 4 1024 1 1 15 LEU HD22 H -6.879 2.971 7.766 1.00 . A A . 15 LEU HD22 1 1 4 1025 1 1 15 LEU HD23 H -7.390 1.709 8.887 1.00 . A A . 15 LEU HD23 1 1 4 1026 1 1 15 LEU HG H -6.474 0.195 6.859 1.00 . A A . 15 LEU HG 1 1 4 1027 1 1 15 LEU N N -6.414 1.203 4.382 1.00 . A A . 15 LEU N 1 1 4 1028 1 1 15 LEU O O -4.884 4.352 4.275 1.00 . A A . 15 LEU O 1 1 4 1029 1 1 16 CYS C C -3.523 3.682 1.526 1.00 . A A . 16 CYS C 1 1 4 1030 1 1 16 CYS CA C -2.936 3.063 2.788 1.00 . A A . 16 CYS CA 1 1 4 1031 1 1 16 CYS CB C -1.853 2.056 2.406 1.00 . A A . 16 CYS CB 1 1 4 1032 1 1 16 CYS H H -3.972 1.445 3.679 1.00 . A A . 16 CYS H 1 1 4 1033 1 1 16 CYS HA H -2.485 3.847 3.378 1.00 . A A . 16 CYS HA 1 1 4 1034 1 1 16 CYS HB2 H -2.316 1.207 1.925 1.00 . A A . 16 CYS HB2 1 1 4 1035 1 1 16 CYS HB3 H -1.165 2.523 1.716 1.00 . A A . 16 CYS HB3 1 1 4 1036 1 1 16 CYS N N -3.957 2.423 3.610 1.00 . A A . 16 CYS N 1 1 4 1037 1 1 16 CYS O O -3.077 4.741 1.080 1.00 . A A . 16 CYS O 1 1 4 1038 1 1 16 CYS SG S -0.882 1.427 3.815 1.00 . A A . 16 CYS SG 1 1 4 1039 1 1 17 GLY C C -4.099 3.626 -1.395 1.00 . A A . 17 GLY C 1 1 4 1040 1 1 17 GLY CA C -5.115 3.502 -0.277 1.00 . A A . 17 GLY CA 1 1 4 1041 1 1 17 GLY H H -4.813 2.162 1.329 1.00 . A A . 17 GLY H 1 1 4 1042 1 1 17 GLY HA2 H -5.895 2.821 -0.582 1.00 . A A . 17 GLY HA2 1 1 4 1043 1 1 17 GLY HA3 H -5.547 4.473 -0.087 1.00 . A A . 17 GLY HA3 1 1 4 1044 1 1 17 GLY N N -4.506 3.009 0.939 1.00 . A A . 17 GLY N 1 1 4 1045 1 1 17 GLY O O -3.294 2.716 -1.616 1.00 . A A . 17 GLY O 1 1 4 1046 1 1 18 ALA C C -1.948 5.758 -2.654 1.00 . A A . 18 ALA C 1 1 4 1047 1 1 18 ALA CA C -3.171 5.000 -3.163 1.00 . A A . 18 ALA CA 1 1 4 1048 1 1 18 ALA CB C -3.846 5.765 -4.292 1.00 . A A . 18 ALA CB 1 1 4 1049 1 1 18 ALA H H -4.761 5.453 -1.846 1.00 . A A . 18 ALA H 1 1 4 1050 1 1 18 ALA HA H -2.854 4.042 -3.548 1.00 . A A . 18 ALA HA 1 1 4 1051 1 1 18 ALA HB1 H -4.229 5.067 -5.022 1.00 . A A . 18 ALA HB1 1 1 4 1052 1 1 18 ALA HB2 H -3.128 6.420 -4.763 1.00 . A A . 18 ALA HB2 1 1 4 1053 1 1 18 ALA HB3 H -4.661 6.351 -3.894 1.00 . A A . 18 ALA HB3 1 1 4 1054 1 1 18 ALA N N -4.113 4.757 -2.082 1.00 . A A . 18 ALA N 1 1 4 1055 1 1 18 ALA O O -1.150 6.268 -3.438 1.00 . A A . 18 ALA O 1 1 4 1056 1 1 19 GLY C C -0.981 7.989 -0.496 1.00 . A A . 19 GLY C 1 1 4 1057 1 1 19 GLY CA C -0.684 6.522 -0.741 1.00 . A A . 19 GLY CA 1 1 4 1058 1 1 19 GLY H H -2.477 5.398 -0.757 1.00 . A A . 19 GLY H 1 1 4 1059 1 1 19 GLY HA2 H -0.439 6.053 0.201 1.00 . A A . 19 GLY HA2 1 1 4 1060 1 1 19 GLY HA3 H 0.166 6.443 -1.403 1.00 . A A . 19 GLY HA3 1 1 4 1061 1 1 19 GLY N N -1.807 5.823 -1.335 1.00 . A A . 19 GLY N 1 1 4 1062 1 1 19 GLY O O -1.977 8.519 -0.992 1.00 . A A . 19 GLY O 1 1 4 1063 1 1 20 GLY C C 0.983 10.745 0.925 1.00 . A A . 20 GLY C 1 1 4 1064 1 1 20 GLY CA C -0.315 10.053 0.564 1.00 . A A . 20 GLY CA 1 1 4 1065 1 1 20 GLY H H 0.655 8.176 0.639 1.00 . A A . 20 GLY H 1 1 4 1066 1 1 20 GLY HA2 H -0.740 10.536 -0.303 1.00 . A A . 20 GLY HA2 1 1 4 1067 1 1 20 GLY HA3 H -1.003 10.146 1.391 1.00 . A A . 20 GLY HA3 1 1 4 1068 1 1 20 GLY N N -0.120 8.647 0.271 1.00 . A A . 20 GLY N 1 1 4 1069 1 1 20 GLY O O 2.045 10.374 0.429 1.00 . A A . 20 GLY O 1 1 4 1070 1 1 21 ALA C C 2.851 11.774 3.327 1.00 . A A . 21 ALA C 1 1 4 1071 1 1 21 ALA CA C 2.087 12.496 2.217 1.00 . A A . 21 ALA CA 1 1 4 1072 1 1 21 ALA CB C 1.688 13.893 2.670 1.00 . A A . 21 ALA CB 1 1 4 1073 1 1 21 ALA H H 0.030 11.994 2.159 1.00 . A A . 21 ALA H 1 1 4 1074 1 1 21 ALA HA H 2.737 12.596 1.360 1.00 . A A . 21 ALA HA 1 1 4 1075 1 1 21 ALA HB1 H 1.757 14.576 1.835 1.00 . A A . 21 ALA HB1 1 1 4 1076 1 1 21 ALA HB2 H 2.351 14.218 3.458 1.00 . A A . 21 ALA HB2 1 1 4 1077 1 1 21 ALA HB3 H 0.673 13.876 3.038 1.00 . A A . 21 ALA HB3 1 1 4 1078 1 1 21 ALA N N 0.905 11.747 1.794 1.00 . A A . 21 ALA N 1 1 4 1079 1 1 21 ALA O O 3.371 12.407 4.246 1.00 . A A . 21 ALA O 1 1 4 1080 1 1 22 ALA C C 3.641 8.179 3.745 1.00 . A A . 22 ALA C 1 1 4 1081 1 1 22 ALA CA C 3.623 9.629 4.200 1.00 . A A . 22 ALA CA 1 1 4 1082 1 1 22 ALA CB C 2.971 9.734 5.574 1.00 . A A . 22 ALA CB 1 1 4 1083 1 1 22 ALA H H 2.492 10.014 2.458 1.00 . A A . 22 ALA H 1 1 4 1084 1 1 22 ALA HA H 4.639 9.988 4.276 1.00 . A A . 22 ALA HA 1 1 4 1085 1 1 22 ALA HB1 H 2.332 8.878 5.736 1.00 . A A . 22 ALA HB1 1 1 4 1086 1 1 22 ALA HB2 H 2.384 10.639 5.627 1.00 . A A . 22 ALA HB2 1 1 4 1087 1 1 22 ALA HB3 H 3.738 9.758 6.335 1.00 . A A . 22 ALA HB3 1 1 4 1088 1 1 22 ALA N N 2.921 10.453 3.224 1.00 . A A . 22 ALA N 1 1 4 1089 1 1 22 ALA O O 2.612 7.635 3.343 1.00 . A A . 22 ALA O 1 1 4 1090 1 1 23 GLY C C 4.758 5.226 4.568 1.00 . A A . 23 GLY C 1 1 4 1091 1 1 23 GLY CA C 4.930 6.174 3.400 1.00 . A A . 23 GLY CA 1 1 4 1092 1 1 23 GLY H H 5.594 8.042 4.133 1.00 . A A . 23 GLY H 1 1 4 1093 1 1 23 GLY HA2 H 4.173 5.959 2.659 1.00 . A A . 23 GLY HA2 1 1 4 1094 1 1 23 GLY HA3 H 5.905 6.018 2.962 1.00 . A A . 23 GLY HA3 1 1 4 1095 1 1 23 GLY N N 4.810 7.558 3.807 1.00 . A A . 23 GLY N 1 1 4 1096 1 1 23 GLY O O 3.783 4.479 4.636 1.00 . A A . 23 GLY O 1 1 5 1097 1 1 1 GLY C C 5.201 1.956 6.258 1.00 . A A . 1 GLY C 1 1 5 1098 1 1 1 GLY CA C 5.787 3.234 6.811 1.00 . A A . 1 GLY CA 1 1 5 1099 1 1 1 GLY H1 H 6.670 4.726 5.599 1.00 . A A . 1 GLY H1 1 1 5 1100 1 1 1 GLY HA2 H 6.790 3.037 7.149 1.00 . A A . 1 GLY HA2 1 1 5 1101 1 1 1 GLY HA3 H 5.193 3.551 7.655 1.00 . A A . 1 GLY HA3 1 1 5 1102 1 1 1 GLY N N 5.817 4.305 5.833 1.00 . A A . 1 GLY N 1 1 5 1103 1 1 1 GLY O O 5.810 1.287 5.422 1.00 . A A . 1 GLY O 1 1 5 1104 1 1 2 CYS C C 3.066 0.468 4.786 1.00 . A A . 2 CYS C 1 1 5 1105 1 1 2 CYS CA C 3.294 0.440 6.292 1.00 . A A . 2 CYS CA 1 1 5 1106 1 1 2 CYS CB C 1.948 0.356 7.013 1.00 . A A . 2 CYS CB 1 1 5 1107 1 1 2 CYS H H 3.591 2.225 7.383 1.00 . A A . 2 CYS H 1 1 5 1108 1 1 2 CYS HA H 3.889 -0.423 6.545 1.00 . A A . 2 CYS HA 1 1 5 1109 1 1 2 CYS HB2 H 2.123 0.326 8.072 1.00 . A A . 2 CYS HB2 1 1 5 1110 1 1 2 CYS HB3 H 1.372 1.240 6.777 1.00 . A A . 2 CYS HB3 1 1 5 1111 1 1 2 CYS N N 4.009 1.634 6.726 1.00 . A A . 2 CYS N 1 1 5 1112 1 1 2 CYS O O 3.243 -0.534 4.098 1.00 . A A . 2 CYS O 1 1 5 1113 1 1 2 CYS SG S 0.936 -1.097 6.572 1.00 . A A . 2 CYS SG 1 1 5 1114 1 1 3 CYS C C 3.651 1.608 2.021 1.00 . A A . 3 CYS C 1 1 5 1115 1 1 3 CYS CA C 2.398 1.800 2.867 1.00 . A A . 3 CYS CA 1 1 5 1116 1 1 3 CYS CB C 1.787 3.177 2.610 1.00 . A A . 3 CYS CB 1 1 5 1117 1 1 3 CYS H H 2.544 2.388 4.898 1.00 . A A . 3 CYS H 1 1 5 1118 1 1 3 CYS HA H 1.687 1.044 2.583 1.00 . A A . 3 CYS HA 1 1 5 1119 1 1 3 CYS HB2 H 2.528 3.937 2.808 1.00 . A A . 3 CYS HB2 1 1 5 1120 1 1 3 CYS HB3 H 1.482 3.239 1.575 1.00 . A A . 3 CYS HB3 1 1 5 1121 1 1 3 CYS N N 2.669 1.626 4.289 1.00 . A A . 3 CYS N 1 1 5 1122 1 1 3 CYS O O 3.567 1.147 0.882 1.00 . A A . 3 CYS O 1 1 5 1123 1 1 3 CYS SG S 0.329 3.539 3.642 1.00 . A A . 3 CYS SG 1 1 5 1124 1 1 4 SER C C 6.444 0.333 1.730 1.00 . A A . 4 SER C 1 1 5 1125 1 1 4 SER CA C 6.071 1.807 1.869 1.00 . A A . 4 SER CA 1 1 5 1126 1 1 4 SER CB C 7.177 2.563 2.606 1.00 . A A . 4 SER CB 1 1 5 1127 1 1 4 SER H H 4.812 2.310 3.489 1.00 . A A . 4 SER H 1 1 5 1128 1 1 4 SER HA H 5.952 2.230 0.884 1.00 . A A . 4 SER HA 1 1 5 1129 1 1 4 SER HB2 H 7.330 2.117 3.578 1.00 . A A . 4 SER HB2 1 1 5 1130 1 1 4 SER HB3 H 8.092 2.507 2.036 1.00 . A A . 4 SER HB3 1 1 5 1131 1 1 4 SER HG H 7.230 4.449 2.077 1.00 . A A . 4 SER HG 1 1 5 1132 1 1 4 SER N N 4.806 1.954 2.576 1.00 . A A . 4 SER N 1 1 5 1133 1 1 4 SER O O 7.233 -0.043 0.867 1.00 . A A . 4 SER O 1 1 5 1134 1 1 4 SER OG O 6.828 3.928 2.779 1.00 . A A . 4 SER OG 1 1 5 1135 1 1 5 ASN C C 5.095 -2.626 1.673 1.00 . A A . 5 ASN C 1 1 5 1136 1 1 5 ASN CA C 6.117 -1.929 2.553 1.00 . A A . 5 ASN CA 1 1 5 1137 1 1 5 ASN CB C 6.080 -2.511 3.968 1.00 . A A . 5 ASN CB 1 1 5 1138 1 1 5 ASN CG C 7.386 -2.319 4.710 1.00 . A A . 5 ASN CG 1 1 5 1139 1 1 5 ASN H H 5.220 -0.134 3.238 1.00 . A A . 5 ASN H 1 1 5 1140 1 1 5 ASN HA H 7.101 -2.081 2.135 1.00 . A A . 5 ASN HA 1 1 5 1141 1 1 5 ASN HB2 H 5.295 -2.027 4.529 1.00 . A A . 5 ASN HB2 1 1 5 1142 1 1 5 ASN HB3 H 5.872 -3.569 3.909 1.00 . A A . 5 ASN HB3 1 1 5 1143 1 1 5 ASN HD21 H 6.539 -1.006 5.934 1.00 . A A . 5 ASN HD21 1 1 5 1144 1 1 5 ASN HD22 H 8.213 -1.327 6.213 1.00 . A A . 5 ASN HD22 1 1 5 1145 1 1 5 ASN N N 5.859 -0.496 2.583 1.00 . A A . 5 ASN N 1 1 5 1146 1 1 5 ASN ND2 N 7.377 -1.465 5.723 1.00 . A A . 5 ASN ND2 1 1 5 1147 1 1 5 ASN O O 3.898 -2.474 1.876 1.00 . A A . 5 ASN O 1 1 5 1148 1 1 5 ASN OD1 O 8.397 -2.927 4.370 1.00 . A A . 5 ASN OD1 1 1 5 1149 1 1 6 PRO C C 3.664 -5.021 0.466 1.00 . A A . 6 PRO C 1 1 5 1150 1 1 6 PRO CA C 4.665 -4.113 -0.248 1.00 . A A . 6 PRO CA 1 1 5 1151 1 1 6 PRO CB C 5.625 -4.944 -1.114 1.00 . A A . 6 PRO CB 1 1 5 1152 1 1 6 PRO CD C 6.968 -3.625 0.361 1.00 . A A . 6 PRO CD 1 1 5 1153 1 1 6 PRO CG C 6.935 -4.918 -0.400 1.00 . A A . 6 PRO CG 1 1 5 1154 1 1 6 PRO HA H 4.124 -3.421 -0.877 1.00 . A A . 6 PRO HA 1 1 5 1155 1 1 6 PRO HB2 H 5.247 -5.952 -1.202 1.00 . A A . 6 PRO HB2 1 1 5 1156 1 1 6 PRO HB3 H 5.702 -4.499 -2.094 1.00 . A A . 6 PRO HB3 1 1 5 1157 1 1 6 PRO HD2 H 7.557 -3.730 1.262 1.00 . A A . 6 PRO HD2 1 1 5 1158 1 1 6 PRO HD3 H 7.357 -2.830 -0.258 1.00 . A A . 6 PRO HD3 1 1 5 1159 1 1 6 PRO HG2 H 7.001 -5.754 0.280 1.00 . A A . 6 PRO HG2 1 1 5 1160 1 1 6 PRO HG3 H 7.743 -4.952 -1.115 1.00 . A A . 6 PRO HG3 1 1 5 1161 1 1 6 PRO N N 5.552 -3.399 0.678 1.00 . A A . 6 PRO N 1 1 5 1162 1 1 6 PRO O O 2.472 -5.003 0.161 1.00 . A A . 6 PRO O 1 1 5 1163 1 1 7 VAL C C 2.301 -5.954 3.028 1.00 . A A . 7 VAL C 1 1 5 1164 1 1 7 VAL CA C 3.298 -6.723 2.168 1.00 . A A . 7 VAL CA 1 1 5 1165 1 1 7 VAL CB C 4.129 -7.661 3.071 1.00 . A A . 7 VAL CB 1 1 5 1166 1 1 7 VAL CG1 C 3.225 -8.615 3.840 1.00 . A A . 7 VAL CG1 1 1 5 1167 1 1 7 VAL CG2 C 5.148 -8.433 2.247 1.00 . A A . 7 VAL CG2 1 1 5 1168 1 1 7 VAL H H 5.110 -5.777 1.619 1.00 . A A . 7 VAL H 1 1 5 1169 1 1 7 VAL HA H 2.753 -7.330 1.459 1.00 . A A . 7 VAL HA 1 1 5 1170 1 1 7 VAL HB H 4.664 -7.055 3.788 1.00 . A A . 7 VAL HB 1 1 5 1171 1 1 7 VAL HG11 H 2.845 -9.371 3.169 1.00 . A A . 7 VAL HG11 1 1 5 1172 1 1 7 VAL HG12 H 2.399 -8.064 4.266 1.00 . A A . 7 VAL HG12 1 1 5 1173 1 1 7 VAL HG13 H 3.789 -9.086 4.632 1.00 . A A . 7 VAL HG13 1 1 5 1174 1 1 7 VAL HG21 H 5.950 -7.772 1.954 1.00 . A A . 7 VAL HG21 1 1 5 1175 1 1 7 VAL HG22 H 4.669 -8.831 1.364 1.00 . A A . 7 VAL HG22 1 1 5 1176 1 1 7 VAL HG23 H 5.548 -9.244 2.836 1.00 . A A . 7 VAL HG23 1 1 5 1177 1 1 7 VAL N N 4.153 -5.810 1.417 1.00 . A A . 7 VAL N 1 1 5 1178 1 1 7 VAL O O 1.104 -6.235 3.014 1.00 . A A . 7 VAL O 1 1 5 1179 1 1 8 CYS C C 0.948 -3.389 3.817 1.00 . A A . 8 CYS C 1 1 5 1180 1 1 8 CYS CA C 1.969 -4.164 4.643 1.00 . A A . 8 CYS CA 1 1 5 1181 1 1 8 CYS CB C 2.834 -3.202 5.457 1.00 . A A . 8 CYS CB 1 1 5 1182 1 1 8 CYS H H 3.770 -4.804 3.732 1.00 . A A . 8 CYS H 1 1 5 1183 1 1 8 CYS HA H 1.445 -4.826 5.316 1.00 . A A . 8 CYS HA 1 1 5 1184 1 1 8 CYS HB2 H 3.779 -3.674 5.666 1.00 . A A . 8 CYS HB2 1 1 5 1185 1 1 8 CYS HB3 H 3.007 -2.309 4.874 1.00 . A A . 8 CYS HB3 1 1 5 1186 1 1 8 CYS N N 2.808 -4.980 3.771 1.00 . A A . 8 CYS N 1 1 5 1187 1 1 8 CYS O O -0.198 -3.215 4.230 1.00 . A A . 8 CYS O 1 1 5 1188 1 1 8 CYS SG S 2.100 -2.691 7.049 1.00 . A A . 8 CYS SG 1 1 5 1189 1 1 9 HIS C C -0.695 -2.988 1.349 1.00 . A A . 9 HIS C 1 1 5 1190 1 1 9 HIS CA C 0.527 -2.178 1.737 1.00 . A A . 9 HIS CA 1 1 5 1191 1 1 9 HIS CB C 1.291 -1.799 0.470 1.00 . A A . 9 HIS CB 1 1 5 1192 1 1 9 HIS CD2 C 0.095 -1.013 -1.694 1.00 . A A . 9 HIS CD2 1 1 5 1193 1 1 9 HIS CE1 C -0.506 0.984 -1.021 1.00 . A A . 9 HIS CE1 1 1 5 1194 1 1 9 HIS CG C 0.540 -0.859 -0.424 1.00 . A A . 9 HIS CG 1 1 5 1195 1 1 9 HIS H H 2.314 -3.110 2.386 1.00 . A A . 9 HIS H 1 1 5 1196 1 1 9 HIS HA H 0.209 -1.278 2.241 1.00 . A A . 9 HIS HA 1 1 5 1197 1 1 9 HIS HB2 H 2.220 -1.335 0.745 1.00 . A A . 9 HIS HB2 1 1 5 1198 1 1 9 HIS HB3 H 1.500 -2.697 -0.093 1.00 . A A . 9 HIS HB3 1 1 5 1199 1 1 9 HIS HD1 H 0.320 0.809 0.842 1.00 . A A . 9 HIS HD1 1 1 5 1200 1 1 9 HIS HD2 H 0.225 -1.885 -2.318 1.00 . A A . 9 HIS HD2 1 1 5 1201 1 1 9 HIS HE1 H -0.930 1.977 -0.998 1.00 . A A . 9 HIS HE1 1 1 5 1202 1 1 9 HIS HE2 H -1.131 0.257 -2.827 1.00 . A A . 9 HIS HE2 1 1 5 1203 1 1 9 HIS N N 1.381 -2.933 2.647 1.00 . A A . 9 HIS N 1 1 5 1204 1 1 9 HIS ND1 N 0.148 0.402 -0.033 1.00 . A A . 9 HIS ND1 1 1 5 1205 1 1 9 HIS NE2 N -0.554 0.148 -2.042 1.00 . A A . 9 HIS NE2 1 1 5 1206 1 1 9 HIS O O -1.804 -2.479 1.343 1.00 . A A . 9 HIS O 1 1 5 1207 1 1 10 LEU C C -2.470 -5.421 1.810 1.00 . A A . 10 LEU C 1 1 5 1208 1 1 10 LEU CA C -1.563 -5.134 0.619 1.00 . A A . 10 LEU CA 1 1 5 1209 1 1 10 LEU CB C -1.008 -6.445 0.053 1.00 . A A . 10 LEU CB 1 1 5 1210 1 1 10 LEU CD1 C 0.405 -7.651 -1.629 1.00 . A A . 10 LEU CD1 1 1 5 1211 1 1 10 LEU CD2 C -0.927 -5.656 -2.327 1.00 . A A . 10 LEU CD2 1 1 5 1212 1 1 10 LEU CG C -0.137 -6.299 -1.197 1.00 . A A . 10 LEU CG 1 1 5 1213 1 1 10 LEU H H 0.447 -4.589 1.029 1.00 . A A . 10 LEU H 1 1 5 1214 1 1 10 LEU HA H -2.138 -4.635 -0.147 1.00 . A A . 10 LEU HA 1 1 5 1215 1 1 10 LEU HB2 H -0.419 -6.922 0.823 1.00 . A A . 10 LEU HB2 1 1 5 1216 1 1 10 LEU HB3 H -1.841 -7.088 -0.190 1.00 . A A . 10 LEU HB3 1 1 5 1217 1 1 10 LEU HD11 H 1.451 -7.556 -1.882 1.00 . A A . 10 LEU HD11 1 1 5 1218 1 1 10 LEU HD12 H -0.143 -8.001 -2.490 1.00 . A A . 10 LEU HD12 1 1 5 1219 1 1 10 LEU HD13 H 0.294 -8.359 -0.819 1.00 . A A . 10 LEU HD13 1 1 5 1220 1 1 10 LEU HD21 H -1.031 -6.359 -3.140 1.00 . A A . 10 LEU HD21 1 1 5 1221 1 1 10 LEU HD22 H -0.404 -4.777 -2.677 1.00 . A A . 10 LEU HD22 1 1 5 1222 1 1 10 LEU HD23 H -1.905 -5.373 -1.969 1.00 . A A . 10 LEU HD23 1 1 5 1223 1 1 10 LEU HG H 0.704 -5.659 -0.969 1.00 . A A . 10 LEU HG 1 1 5 1224 1 1 10 LEU N N -0.473 -4.248 1.014 1.00 . A A . 10 LEU N 1 1 5 1225 1 1 10 LEU O O -3.693 -5.301 1.718 1.00 . A A . 10 LEU O 1 1 5 1226 1 1 11 GLU C C -3.424 -4.920 4.615 1.00 . A A . 11 GLU C 1 1 5 1227 1 1 11 GLU CA C -2.553 -6.091 4.168 1.00 . A A . 11 GLU CA 1 1 5 1228 1 1 11 GLU CB C -1.522 -6.402 5.263 1.00 . A A . 11 GLU CB 1 1 5 1229 1 1 11 GLU CD C -2.827 -7.991 6.749 1.00 . A A . 11 GLU CD 1 1 5 1230 1 1 11 GLU CG C -2.119 -6.658 6.638 1.00 . A A . 11 GLU CG 1 1 5 1231 1 1 11 GLU H H -0.867 -5.848 2.916 1.00 . A A . 11 GLU H 1 1 5 1232 1 1 11 GLU HA H -3.172 -6.956 4.005 1.00 . A A . 11 GLU HA 1 1 5 1233 1 1 11 GLU HB2 H -0.960 -7.273 4.974 1.00 . A A . 11 GLU HB2 1 1 5 1234 1 1 11 GLU HB3 H -0.845 -5.564 5.343 1.00 . A A . 11 GLU HB3 1 1 5 1235 1 1 11 GLU HG2 H -1.325 -6.633 7.369 1.00 . A A . 11 GLU HG2 1 1 5 1236 1 1 11 GLU HG3 H -2.829 -5.873 6.858 1.00 . A A . 11 GLU HG3 1 1 5 1237 1 1 11 GLU N N -1.847 -5.785 2.926 1.00 . A A . 11 GLU N 1 1 5 1238 1 1 11 GLU O O -4.550 -5.089 5.083 1.00 . A A . 11 GLU O 1 1 5 1239 1 1 11 GLU OE1 O -3.775 -8.228 5.978 1.00 . A A . 11 GLU OE1 1 1 5 1240 1 1 11 GLU OE2 O -2.435 -8.790 7.622 1.00 . A A . 11 GLU OE2 1 1 5 1241 1 1 12 HIS C C -3.805 -1.585 3.746 1.00 . A A . 12 HIS C 1 1 5 1242 1 1 12 HIS CA C -3.586 -2.530 4.918 1.00 . A A . 12 HIS CA 1 1 5 1243 1 1 12 HIS CB C -2.794 -1.846 6.036 1.00 . A A . 12 HIS CB 1 1 5 1244 1 1 12 HIS CD2 C -1.358 -3.353 7.591 1.00 . A A . 12 HIS CD2 1 1 5 1245 1 1 12 HIS CE1 C -2.943 -4.023 8.945 1.00 . A A . 12 HIS CE1 1 1 5 1246 1 1 12 HIS CG C -2.509 -2.762 7.192 1.00 . A A . 12 HIS CG 1 1 5 1247 1 1 12 HIS H H -1.970 -3.648 4.136 1.00 . A A . 12 HIS H 1 1 5 1248 1 1 12 HIS HA H -4.547 -2.832 5.306 1.00 . A A . 12 HIS HA 1 1 5 1249 1 1 12 HIS HB2 H -1.849 -1.502 5.642 1.00 . A A . 12 HIS HB2 1 1 5 1250 1 1 12 HIS HB3 H -3.357 -1.003 6.407 1.00 . A A . 12 HIS HB3 1 1 5 1251 1 1 12 HIS HD1 H -4.432 -2.975 8.020 1.00 . A A . 12 HIS HD1 1 1 5 1252 1 1 12 HIS HD2 H -0.391 -3.255 7.119 1.00 . A A . 12 HIS HD2 1 1 5 1253 1 1 12 HIS HE1 H -3.469 -4.520 9.745 1.00 . A A . 12 HIS HE1 1 1 5 1254 1 1 12 HIS HE2 H -1.083 -4.857 9.021 1.00 . A A . 12 HIS HE2 1 1 5 1255 1 1 12 HIS N N -2.883 -3.725 4.498 1.00 . A A . 12 HIS N 1 1 5 1256 1 1 12 HIS ND1 N -3.483 -3.205 8.059 1.00 . A A . 12 HIS ND1 1 1 5 1257 1 1 12 HIS NE2 N -1.654 -4.133 8.685 1.00 . A A . 12 HIS NE2 1 1 5 1258 1 1 12 HIS O O -3.561 -0.383 3.847 1.00 . A A . 12 HIS O 1 1 5 1259 1 1 13 SER C C -5.564 -0.286 1.685 1.00 . A A . 13 SER C 1 1 5 1260 1 1 13 SER CA C -4.520 -1.368 1.425 1.00 . A A . 13 SER CA 1 1 5 1261 1 1 13 SER CB C -4.976 -2.293 0.289 1.00 . A A . 13 SER CB 1 1 5 1262 1 1 13 SER H H -4.433 -3.113 2.621 1.00 . A A . 13 SER H 1 1 5 1263 1 1 13 SER HA H -3.593 -0.893 1.137 1.00 . A A . 13 SER HA 1 1 5 1264 1 1 13 SER HB2 H -4.297 -3.130 0.216 1.00 . A A . 13 SER HB2 1 1 5 1265 1 1 13 SER HB3 H -5.971 -2.656 0.503 1.00 . A A . 13 SER HB3 1 1 5 1266 1 1 13 SER HG H -5.868 -1.694 -1.350 1.00 . A A . 13 SER HG 1 1 5 1267 1 1 13 SER N N -4.267 -2.144 2.633 1.00 . A A . 13 SER N 1 1 5 1268 1 1 13 SER O O -5.466 0.823 1.163 1.00 . A A . 13 SER O 1 1 5 1269 1 1 13 SER OG O -4.995 -1.615 -0.956 1.00 . A A . 13 SER OG 1 1 5 1270 1 1 14 ASN C C -7.064 1.532 3.587 1.00 . A A . 14 ASN C 1 1 5 1271 1 1 14 ASN CA C -7.623 0.317 2.850 1.00 . A A . 14 ASN CA 1 1 5 1272 1 1 14 ASN CB C -8.679 -0.376 3.718 1.00 . A A . 14 ASN CB 1 1 5 1273 1 1 14 ASN CG C -9.869 0.519 4.008 1.00 . A A . 14 ASN CG 1 1 5 1274 1 1 14 ASN H H -6.569 -1.519 2.890 1.00 . A A . 14 ASN H 1 1 5 1275 1 1 14 ASN HA H -8.082 0.647 1.934 1.00 . A A . 14 ASN HA 1 1 5 1276 1 1 14 ASN HB2 H -9.031 -1.259 3.208 1.00 . A A . 14 ASN HB2 1 1 5 1277 1 1 14 ASN HB3 H -8.230 -0.664 4.657 1.00 . A A . 14 ASN HB3 1 1 5 1278 1 1 14 ASN HD21 H -9.494 0.451 5.956 1.00 . A A . 14 ASN HD21 1 1 5 1279 1 1 14 ASN HD22 H -10.857 1.397 5.485 1.00 . A A . 14 ASN HD22 1 1 5 1280 1 1 14 ASN N N -6.556 -0.620 2.505 1.00 . A A . 14 ASN N 1 1 5 1281 1 1 14 ASN ND2 N -10.096 0.817 5.278 1.00 . A A . 14 ASN ND2 1 1 5 1282 1 1 14 ASN O O -7.547 2.649 3.422 1.00 . A A . 14 ASN O 1 1 5 1283 1 1 14 ASN OD1 O -10.582 0.933 3.099 1.00 . A A . 14 ASN OD1 1 1 5 1284 1 1 15 LEU C C -4.643 3.306 4.225 1.00 . A A . 15 LEU C 1 1 5 1285 1 1 15 LEU CA C -5.401 2.369 5.156 1.00 . A A . 15 LEU CA 1 1 5 1286 1 1 15 LEU CB C -4.453 1.801 6.222 1.00 . A A . 15 LEU CB 1 1 5 1287 1 1 15 LEU CD1 C -6.077 2.213 8.098 1.00 . A A . 15 LEU CD1 1 1 5 1288 1 1 15 LEU CD2 C -5.854 -0.089 7.141 1.00 . A A . 15 LEU CD2 1 1 5 1289 1 1 15 LEU CG C -5.125 1.207 7.470 1.00 . A A . 15 LEU CG 1 1 5 1290 1 1 15 LEU H H -5.693 0.389 4.473 1.00 . A A . 15 LEU H 1 1 5 1291 1 1 15 LEU HA H -6.181 2.930 5.645 1.00 . A A . 15 LEU HA 1 1 5 1292 1 1 15 LEU HB2 H -3.855 1.028 5.761 1.00 . A A . 15 LEU HB2 1 1 5 1293 1 1 15 LEU HB3 H -3.794 2.594 6.542 1.00 . A A . 15 LEU HB3 1 1 5 1294 1 1 15 LEU HD11 H -5.761 2.425 9.109 1.00 . A A . 15 LEU HD11 1 1 5 1295 1 1 15 LEU HD12 H -7.076 1.803 8.111 1.00 . A A . 15 LEU HD12 1 1 5 1296 1 1 15 LEU HD13 H -6.069 3.125 7.519 1.00 . A A . 15 LEU HD13 1 1 5 1297 1 1 15 LEU HD21 H -6.743 -0.166 7.750 1.00 . A A . 15 LEU HD21 1 1 5 1298 1 1 15 LEU HD22 H -5.206 -0.929 7.343 1.00 . A A . 15 LEU HD22 1 1 5 1299 1 1 15 LEU HD23 H -6.132 -0.090 6.098 1.00 . A A . 15 LEU HD23 1 1 5 1300 1 1 15 LEU HG H -4.360 0.980 8.201 1.00 . A A . 15 LEU HG 1 1 5 1301 1 1 15 LEU N N -6.037 1.300 4.395 1.00 . A A . 15 LEU N 1 1 5 1302 1 1 15 LEU O O -4.677 4.524 4.384 1.00 . A A . 15 LEU O 1 1 5 1303 1 1 16 CYS C C -4.094 3.813 1.057 1.00 . A A . 16 CYS C 1 1 5 1304 1 1 16 CYS CA C -3.219 3.501 2.270 1.00 . A A . 16 CYS CA 1 1 5 1305 1 1 16 CYS CB C -1.979 2.729 1.825 1.00 . A A . 16 CYS CB 1 1 5 1306 1 1 16 CYS H H -3.999 1.750 3.164 1.00 . A A . 16 CYS H 1 1 5 1307 1 1 16 CYS HA H -2.917 4.427 2.736 1.00 . A A . 16 CYS HA 1 1 5 1308 1 1 16 CYS HB2 H -2.287 1.902 1.206 1.00 . A A . 16 CYS HB2 1 1 5 1309 1 1 16 CYS HB3 H -1.345 3.385 1.246 1.00 . A A . 16 CYS HB3 1 1 5 1310 1 1 16 CYS N N -3.974 2.726 3.244 1.00 . A A . 16 CYS N 1 1 5 1311 1 1 16 CYS O O -3.631 3.778 -0.087 1.00 . A A . 16 CYS O 1 1 5 1312 1 1 16 CYS SG S -0.977 2.050 3.192 1.00 . A A . 16 CYS SG 1 1 5 1313 1 1 17 GLY C C -5.985 5.689 -0.460 1.00 . A A . 17 GLY C 1 1 5 1314 1 1 17 GLY CA C -6.301 4.393 0.256 1.00 . A A . 17 GLY CA 1 1 5 1315 1 1 17 GLY H H -5.669 4.094 2.250 1.00 . A A . 17 GLY H 1 1 5 1316 1 1 17 GLY HA2 H -6.281 3.586 -0.460 1.00 . A A . 17 GLY HA2 1 1 5 1317 1 1 17 GLY HA3 H -7.294 4.461 0.677 1.00 . A A . 17 GLY HA3 1 1 5 1318 1 1 17 GLY N N -5.363 4.097 1.319 1.00 . A A . 17 GLY N 1 1 5 1319 1 1 17 GLY O O -6.048 6.764 0.135 1.00 . A A . 17 GLY O 1 1 5 1320 1 1 18 ALA C C -4.193 7.561 -1.997 1.00 . A A . 18 ALA C 1 1 5 1321 1 1 18 ALA CA C -5.319 6.717 -2.592 1.00 . A A . 18 ALA CA 1 1 5 1322 1 1 18 ALA CB C -6.556 7.570 -2.843 1.00 . A A . 18 ALA CB 1 1 5 1323 1 1 18 ALA H H -5.625 4.675 -2.138 1.00 . A A . 18 ALA H 1 1 5 1324 1 1 18 ALA HA H -4.987 6.330 -3.546 1.00 . A A . 18 ALA HA 1 1 5 1325 1 1 18 ALA HB1 H -6.430 8.534 -2.372 1.00 . A A . 18 ALA HB1 1 1 5 1326 1 1 18 ALA HB2 H -7.423 7.078 -2.427 1.00 . A A . 18 ALA HB2 1 1 5 1327 1 1 18 ALA HB3 H -6.693 7.703 -3.906 1.00 . A A . 18 ALA HB3 1 1 5 1328 1 1 18 ALA N N -5.649 5.570 -1.744 1.00 . A A . 18 ALA N 1 1 5 1329 1 1 18 ALA O O -4.170 8.782 -2.153 1.00 . A A . 18 ALA O 1 1 5 1330 1 1 19 GLY C C -1.355 6.751 0.222 1.00 . A A . 19 GLY C 1 1 5 1331 1 1 19 GLY CA C -2.152 7.620 -0.724 1.00 . A A . 19 GLY CA 1 1 5 1332 1 1 19 GLY H H -3.321 5.934 -1.227 1.00 . A A . 19 GLY H 1 1 5 1333 1 1 19 GLY HA2 H -1.499 7.973 -1.509 1.00 . A A . 19 GLY HA2 1 1 5 1334 1 1 19 GLY HA3 H -2.536 8.470 -0.180 1.00 . A A . 19 GLY HA3 1 1 5 1335 1 1 19 GLY N N -3.259 6.908 -1.322 1.00 . A A . 19 GLY N 1 1 5 1336 1 1 19 GLY O O -1.037 5.602 -0.092 1.00 . A A . 19 GLY O 1 1 5 1337 1 1 20 GLY C C -0.121 7.321 3.660 1.00 . A A . 20 GLY C 1 1 5 1338 1 1 20 GLY CA C -0.273 6.558 2.364 1.00 . A A . 20 GLY CA 1 1 5 1339 1 1 20 GLY H H -1.316 8.217 1.579 1.00 . A A . 20 GLY H 1 1 5 1340 1 1 20 GLY HA2 H -0.776 5.623 2.564 1.00 . A A . 20 GLY HA2 1 1 5 1341 1 1 20 GLY HA3 H 0.707 6.350 1.962 1.00 . A A . 20 GLY HA3 1 1 5 1342 1 1 20 GLY N N -1.033 7.298 1.384 1.00 . A A . 20 GLY N 1 1 5 1343 1 1 20 GLY O O 0.077 8.537 3.649 1.00 . A A . 20 GLY O 1 1 5 1344 1 1 21 ALA C C 1.370 7.533 6.420 1.00 . A A . 21 ALA C 1 1 5 1345 1 1 21 ALA CA C -0.087 7.206 6.098 1.00 . A A . 21 ALA CA 1 1 5 1346 1 1 21 ALA CB C -0.674 6.278 7.151 1.00 . A A . 21 ALA CB 1 1 5 1347 1 1 21 ALA H H -0.373 5.641 4.705 1.00 . A A . 21 ALA H 1 1 5 1348 1 1 21 ALA HA H -0.659 8.123 6.102 1.00 . A A . 21 ALA HA 1 1 5 1349 1 1 21 ALA HB1 H -1.129 5.426 6.669 1.00 . A A . 21 ALA HB1 1 1 5 1350 1 1 21 ALA HB2 H -1.422 6.809 7.722 1.00 . A A . 21 ALA HB2 1 1 5 1351 1 1 21 ALA HB3 H 0.110 5.941 7.812 1.00 . A A . 21 ALA HB3 1 1 5 1352 1 1 21 ALA N N -0.213 6.606 4.774 1.00 . A A . 21 ALA N 1 1 5 1353 1 1 21 ALA O O 1.969 6.924 7.306 1.00 . A A . 21 ALA O 1 1 5 1354 1 1 22 ALA C C 4.285 7.768 5.612 1.00 . A A . 22 ALA C 1 1 5 1355 1 1 22 ALA CA C 3.316 8.923 5.851 1.00 . A A . 22 ALA CA 1 1 5 1356 1 1 22 ALA CB C 3.527 9.533 7.233 1.00 . A A . 22 ALA CB 1 1 5 1357 1 1 22 ALA H H 1.384 8.922 4.984 1.00 . A A . 22 ALA H 1 1 5 1358 1 1 22 ALA HA H 3.512 9.691 5.117 1.00 . A A . 22 ALA HA 1 1 5 1359 1 1 22 ALA HB1 H 3.360 10.599 7.185 1.00 . A A . 22 ALA HB1 1 1 5 1360 1 1 22 ALA HB2 H 4.538 9.341 7.560 1.00 . A A . 22 ALA HB2 1 1 5 1361 1 1 22 ALA HB3 H 2.833 9.091 7.932 1.00 . A A . 22 ALA HB3 1 1 5 1362 1 1 22 ALA N N 1.929 8.493 5.678 1.00 . A A . 22 ALA N 1 1 5 1363 1 1 22 ALA O O 5.254 7.585 6.349 1.00 . A A . 22 ALA O 1 1 5 1364 1 1 23 GLY C C 4.702 4.734 5.248 1.00 . A A . 23 GLY C 1 1 5 1365 1 1 23 GLY CA C 4.859 5.862 4.250 1.00 . A A . 23 GLY CA 1 1 5 1366 1 1 23 GLY H H 3.227 7.185 4.025 1.00 . A A . 23 GLY H 1 1 5 1367 1 1 23 GLY HA2 H 4.601 5.499 3.266 1.00 . A A . 23 GLY HA2 1 1 5 1368 1 1 23 GLY HA3 H 5.889 6.186 4.246 1.00 . A A . 23 GLY HA3 1 1 5 1369 1 1 23 GLY N N 4.012 6.991 4.572 1.00 . A A . 23 GLY N 1 1 5 1370 1 1 23 GLY O O 3.586 4.263 5.485 1.00 . A A . 23 GLY O 1 1 6 1371 1 1 1 GLY C C 5.554 1.964 6.243 1.00 . A A . 1 GLY C 1 1 6 1372 1 1 1 GLY CA C 6.178 3.253 6.721 1.00 . A A . 1 GLY CA 1 1 6 1373 1 1 1 GLY H1 H 7.050 4.573 5.316 1.00 . A A . 1 GLY H1 1 1 6 1374 1 1 1 GLY HA2 H 7.187 3.055 7.039 1.00 . A A . 1 GLY HA2 1 1 6 1375 1 1 1 GLY HA3 H 5.613 3.623 7.564 1.00 . A A . 1 GLY HA3 1 1 6 1376 1 1 1 GLY N N 6.196 4.269 5.688 1.00 . A A . 1 GLY N 1 1 6 1377 1 1 1 GLY O O 6.129 1.247 5.424 1.00 . A A . 1 GLY O 1 1 6 1378 1 1 2 CYS C C 3.342 0.464 4.893 1.00 . A A . 2 CYS C 1 1 6 1379 1 1 2 CYS CA C 3.628 0.483 6.385 1.00 . A A . 2 CYS CA 1 1 6 1380 1 1 2 CYS CB C 2.310 0.431 7.157 1.00 . A A . 2 CYS CB 1 1 6 1381 1 1 2 CYS H H 3.976 2.311 7.391 1.00 . A A . 2 CYS H 1 1 6 1382 1 1 2 CYS HA H 4.226 -0.376 6.643 1.00 . A A . 2 CYS HA 1 1 6 1383 1 1 2 CYS HB2 H 2.523 0.268 8.197 1.00 . A A . 2 CYS HB2 1 1 6 1384 1 1 2 CYS HB3 H 1.804 1.377 7.046 1.00 . A A . 2 CYS HB3 1 1 6 1385 1 1 2 CYS N N 4.369 1.683 6.752 1.00 . A A . 2 CYS N 1 1 6 1386 1 1 2 CYS O O 3.556 -0.541 4.219 1.00 . A A . 2 CYS O 1 1 6 1387 1 1 2 CYS SG S 1.161 -0.878 6.610 1.00 . A A . 2 CYS SG 1 1 6 1388 1 1 3 CYS C C 3.725 1.545 2.083 1.00 . A A . 3 CYS C 1 1 6 1389 1 1 3 CYS CA C 2.503 1.705 2.984 1.00 . A A . 3 CYS CA 1 1 6 1390 1 1 3 CYS CB C 1.804 3.040 2.736 1.00 . A A . 3 CYS CB 1 1 6 1391 1 1 3 CYS H H 2.689 2.341 4.992 1.00 . A A . 3 CYS H 1 1 6 1392 1 1 3 CYS HA H 1.818 0.908 2.753 1.00 . A A . 3 CYS HA 1 1 6 1393 1 1 3 CYS HB2 H 2.502 3.846 2.905 1.00 . A A . 3 CYS HB2 1 1 6 1394 1 1 3 CYS HB3 H 1.458 3.073 1.714 1.00 . A A . 3 CYS HB3 1 1 6 1395 1 1 3 CYS N N 2.845 1.580 4.392 1.00 . A A . 3 CYS N 1 1 6 1396 1 1 3 CYS O O 3.609 1.053 0.961 1.00 . A A . 3 CYS O 1 1 6 1397 1 1 3 CYS SG S 0.364 3.307 3.821 1.00 . A A . 3 CYS SG 1 1 6 1398 1 1 4 SER C C 6.477 0.318 1.639 1.00 . A A . 4 SER C 1 1 6 1399 1 1 4 SER CA C 6.125 1.794 1.813 1.00 . A A . 4 SER CA 1 1 6 1400 1 1 4 SER CB C 7.273 2.529 2.506 1.00 . A A . 4 SER CB 1 1 6 1401 1 1 4 SER H H 4.932 2.299 3.486 1.00 . A A . 4 SER H 1 1 6 1402 1 1 4 SER HA H 5.962 2.230 0.840 1.00 . A A . 4 SER HA 1 1 6 1403 1 1 4 SER HB2 H 7.455 2.080 3.471 1.00 . A A . 4 SER HB2 1 1 6 1404 1 1 4 SER HB3 H 8.164 2.455 1.901 1.00 . A A . 4 SER HB3 1 1 6 1405 1 1 4 SER HG H 6.556 4.241 1.885 1.00 . A A . 4 SER HG 1 1 6 1406 1 1 4 SER N N 4.893 1.932 2.579 1.00 . A A . 4 SER N 1 1 6 1407 1 1 4 SER O O 7.172 -0.064 0.702 1.00 . A A . 4 SER O 1 1 6 1408 1 1 4 SER OG O 6.957 3.897 2.690 1.00 . A A . 4 SER OG 1 1 6 1409 1 1 5 ASN C C 5.123 -2.620 1.683 1.00 . A A . 5 ASN C 1 1 6 1410 1 1 5 ASN CA C 6.206 -1.937 2.503 1.00 . A A . 5 ASN CA 1 1 6 1411 1 1 5 ASN CB C 6.244 -2.523 3.916 1.00 . A A . 5 ASN CB 1 1 6 1412 1 1 5 ASN CG C 7.596 -2.353 4.578 1.00 . A A . 5 ASN CG 1 1 6 1413 1 1 5 ASN H H 5.400 -0.132 3.258 1.00 . A A . 5 ASN H 1 1 6 1414 1 1 5 ASN HA H 7.161 -2.102 2.026 1.00 . A A . 5 ASN HA 1 1 6 1415 1 1 5 ASN HB2 H 5.503 -2.026 4.524 1.00 . A A . 5 ASN HB2 1 1 6 1416 1 1 5 ASN HB3 H 6.016 -3.578 3.868 1.00 . A A . 5 ASN HB3 1 1 6 1417 1 1 5 ASN HD21 H 6.848 -1.024 5.847 1.00 . A A . 5 ASN HD21 1 1 6 1418 1 1 5 ASN HD22 H 8.529 -1.374 6.027 1.00 . A A . 5 ASN HD22 1 1 6 1419 1 1 5 ASN N N 5.970 -0.503 2.548 1.00 . A A . 5 ASN N 1 1 6 1420 1 1 5 ASN ND2 N 7.663 -1.498 5.586 1.00 . A A . 5 ASN ND2 1 1 6 1421 1 1 5 ASN O O 3.940 -2.478 1.976 1.00 . A A . 5 ASN O 1 1 6 1422 1 1 5 ASN OD1 O 8.575 -2.979 4.178 1.00 . A A . 5 ASN OD1 1 1 6 1423 1 1 6 PRO C C 3.619 -4.984 0.518 1.00 . A A . 6 PRO C 1 1 6 1424 1 1 6 PRO CA C 4.567 -4.057 -0.240 1.00 . A A . 6 PRO CA 1 1 6 1425 1 1 6 PRO CB C 5.472 -4.867 -1.173 1.00 . A A . 6 PRO CB 1 1 6 1426 1 1 6 PRO CD C 6.911 -3.564 0.217 1.00 . A A . 6 PRO CD 1 1 6 1427 1 1 6 PRO CG C 6.772 -4.139 -1.164 1.00 . A A . 6 PRO CG 1 1 6 1428 1 1 6 PRO HA H 3.986 -3.357 -0.823 1.00 . A A . 6 PRO HA 1 1 6 1429 1 1 6 PRO HB2 H 5.579 -5.872 -0.790 1.00 . A A . 6 PRO HB2 1 1 6 1430 1 1 6 PRO HB3 H 5.043 -4.895 -2.162 1.00 . A A . 6 PRO HB3 1 1 6 1431 1 1 6 PRO HD2 H 7.414 -4.263 0.869 1.00 . A A . 6 PRO HD2 1 1 6 1432 1 1 6 PRO HD3 H 7.443 -2.624 0.183 1.00 . A A . 6 PRO HD3 1 1 6 1433 1 1 6 PRO HG2 H 7.580 -4.827 -1.367 1.00 . A A . 6 PRO HG2 1 1 6 1434 1 1 6 PRO HG3 H 6.755 -3.348 -1.900 1.00 . A A . 6 PRO HG3 1 1 6 1435 1 1 6 PRO N N 5.513 -3.362 0.639 1.00 . A A . 6 PRO N 1 1 6 1436 1 1 6 PRO O O 2.415 -4.989 0.268 1.00 . A A . 6 PRO O 1 1 6 1437 1 1 7 VAL C C 2.362 -5.955 3.108 1.00 . A A . 7 VAL C 1 1 6 1438 1 1 7 VAL CA C 3.368 -6.696 2.232 1.00 . A A . 7 VAL CA 1 1 6 1439 1 1 7 VAL CB C 4.263 -7.583 3.125 1.00 . A A . 7 VAL CB 1 1 6 1440 1 1 7 VAL CG1 C 3.428 -8.602 3.890 1.00 . A A . 7 VAL CG1 1 1 6 1441 1 1 7 VAL CG2 C 5.329 -8.280 2.291 1.00 . A A . 7 VAL CG2 1 1 6 1442 1 1 7 VAL H H 5.130 -5.708 1.601 1.00 . A A . 7 VAL H 1 1 6 1443 1 1 7 VAL HA H 2.832 -7.337 1.547 1.00 . A A . 7 VAL HA 1 1 6 1444 1 1 7 VAL HB H 4.759 -6.948 3.844 1.00 . A A . 7 VAL HB 1 1 6 1445 1 1 7 VAL HG11 H 2.738 -8.084 4.541 1.00 . A A . 7 VAL HG11 1 1 6 1446 1 1 7 VAL HG12 H 4.078 -9.231 4.479 1.00 . A A . 7 VAL HG12 1 1 6 1447 1 1 7 VAL HG13 H 2.875 -9.211 3.190 1.00 . A A . 7 VAL HG13 1 1 6 1448 1 1 7 VAL HG21 H 6.304 -7.916 2.577 1.00 . A A . 7 VAL HG21 1 1 6 1449 1 1 7 VAL HG22 H 5.159 -8.073 1.245 1.00 . A A . 7 VAL HG22 1 1 6 1450 1 1 7 VAL HG23 H 5.279 -9.345 2.460 1.00 . A A . 7 VAL HG23 1 1 6 1451 1 1 7 VAL N N 4.167 -5.762 1.444 1.00 . A A . 7 VAL N 1 1 6 1452 1 1 7 VAL O O 1.175 -6.281 3.120 1.00 . A A . 7 VAL O 1 1 6 1453 1 1 8 CYS C C 0.953 -3.405 3.891 1.00 . A A . 8 CYS C 1 1 6 1454 1 1 8 CYS CA C 1.996 -4.159 4.708 1.00 . A A . 8 CYS CA 1 1 6 1455 1 1 8 CYS CB C 2.840 -3.171 5.513 1.00 . A A . 8 CYS CB 1 1 6 1456 1 1 8 CYS H H 3.801 -4.742 3.764 1.00 . A A . 8 CYS H 1 1 6 1457 1 1 8 CYS HA H 1.493 -4.832 5.387 1.00 . A A . 8 CYS HA 1 1 6 1458 1 1 8 CYS HB2 H 3.790 -3.624 5.741 1.00 . A A . 8 CYS HB2 1 1 6 1459 1 1 8 CYS HB3 H 3.005 -2.292 4.910 1.00 . A A . 8 CYS HB3 1 1 6 1460 1 1 8 CYS N N 2.847 -4.954 3.828 1.00 . A A . 8 CYS N 1 1 6 1461 1 1 8 CYS O O -0.201 -3.287 4.296 1.00 . A A . 8 CYS O 1 1 6 1462 1 1 8 CYS SG S 2.090 -2.621 7.085 1.00 . A A . 8 CYS SG 1 1 6 1463 1 1 9 HIS C C -0.671 -3.014 1.387 1.00 . A A . 9 HIS C 1 1 6 1464 1 1 9 HIS CA C 0.489 -2.147 1.853 1.00 . A A . 9 HIS CA 1 1 6 1465 1 1 9 HIS CB C 1.249 -1.637 0.629 1.00 . A A . 9 HIS CB 1 1 6 1466 1 1 9 HIS CD2 C 0.975 0.715 -0.435 1.00 . A A . 9 HIS CD2 1 1 6 1467 1 1 9 HIS CE1 C -1.087 0.516 -1.146 1.00 . A A . 9 HIS CE1 1 1 6 1468 1 1 9 HIS CG C 0.548 -0.523 -0.093 1.00 . A A . 9 HIS CG 1 1 6 1469 1 1 9 HIS H H 2.315 -3.023 2.479 1.00 . A A . 9 HIS H 1 1 6 1470 1 1 9 HIS HA H 0.098 -1.304 2.403 1.00 . A A . 9 HIS HA 1 1 6 1471 1 1 9 HIS HB2 H 2.216 -1.280 0.939 1.00 . A A . 9 HIS HB2 1 1 6 1472 1 1 9 HIS HB3 H 1.379 -2.453 -0.067 1.00 . A A . 9 HIS HB3 1 1 6 1473 1 1 9 HIS HD1 H -1.346 -1.393 -0.447 1.00 . A A . 9 HIS HD1 1 1 6 1474 1 1 9 HIS HD2 H 1.950 1.134 -0.232 1.00 . A A . 9 HIS HD2 1 1 6 1475 1 1 9 HIS HE1 H -2.043 0.731 -1.601 1.00 . A A . 9 HIS HE1 1 1 6 1476 1 1 9 HIS HE2 H -0.092 2.297 -1.301 1.00 . A A . 9 HIS HE2 1 1 6 1477 1 1 9 HIS N N 1.374 -2.896 2.739 1.00 . A A . 9 HIS N 1 1 6 1478 1 1 9 HIS ND1 N -0.752 -0.614 -0.554 1.00 . A A . 9 HIS ND1 1 1 6 1479 1 1 9 HIS NE2 N -0.058 1.340 -1.088 1.00 . A A . 9 HIS NE2 1 1 6 1480 1 1 9 HIS O O -1.805 -2.553 1.329 1.00 . A A . 9 HIS O 1 1 6 1481 1 1 10 LEU C C -2.420 -5.456 1.663 1.00 . A A . 10 LEU C 1 1 6 1482 1 1 10 LEU CA C -1.393 -5.188 0.570 1.00 . A A . 10 LEU CA 1 1 6 1483 1 1 10 LEU CB C -0.761 -6.507 0.115 1.00 . A A . 10 LEU CB 1 1 6 1484 1 1 10 LEU CD1 C 0.746 -7.765 -1.443 1.00 . A A . 10 LEU CD1 1 1 6 1485 1 1 10 LEU CD2 C -0.676 -5.904 -2.319 1.00 . A A . 10 LEU CD2 1 1 6 1486 1 1 10 LEU CG C 0.125 -6.413 -1.129 1.00 . A A . 10 LEU CG 1 1 6 1487 1 1 10 LEU H H 0.564 -4.557 1.097 1.00 . A A . 10 LEU H 1 1 6 1488 1 1 10 LEU HA H -1.892 -4.730 -0.271 1.00 . A A . 10 LEU HA 1 1 6 1489 1 1 10 LEU HB2 H -0.163 -6.893 0.928 1.00 . A A . 10 LEU HB2 1 1 6 1490 1 1 10 LEU HB3 H -1.555 -7.209 -0.089 1.00 . A A . 10 LEU HB3 1 1 6 1491 1 1 10 LEU HD11 H 0.394 -8.107 -2.405 1.00 . A A . 10 LEU HD11 1 1 6 1492 1 1 10 LEU HD12 H 0.463 -8.477 -0.682 1.00 . A A . 10 LEU HD12 1 1 6 1493 1 1 10 LEU HD13 H 1.822 -7.670 -1.467 1.00 . A A . 10 LEU HD13 1 1 6 1494 1 1 10 LEU HD21 H -0.154 -5.078 -2.778 1.00 . A A . 10 LEU HD21 1 1 6 1495 1 1 10 LEU HD22 H -1.648 -5.574 -1.983 1.00 . A A . 10 LEU HD22 1 1 6 1496 1 1 10 LEU HD23 H -0.795 -6.700 -3.040 1.00 . A A . 10 LEU HD23 1 1 6 1497 1 1 10 LEU HG H 0.927 -5.713 -0.940 1.00 . A A . 10 LEU HG 1 1 6 1498 1 1 10 LEU N N -0.371 -4.259 1.041 1.00 . A A . 10 LEU N 1 1 6 1499 1 1 10 LEU O O -3.627 -5.406 1.421 1.00 . A A . 10 LEU O 1 1 6 1500 1 1 11 GLU C C -3.575 -4.741 4.395 1.00 . A A . 11 GLU C 1 1 6 1501 1 1 11 GLU CA C -2.803 -5.999 3.999 1.00 . A A . 11 GLU CA 1 1 6 1502 1 1 11 GLU CB C -1.973 -6.497 5.188 1.00 . A A . 11 GLU CB 1 1 6 1503 1 1 11 GLU CD C -2.018 -6.771 7.705 1.00 . A A . 11 GLU CD 1 1 6 1504 1 1 11 GLU CG C -2.806 -6.859 6.409 1.00 . A A . 11 GLU CG 1 1 6 1505 1 1 11 GLU H H -0.959 -5.751 2.992 1.00 . A A . 11 GLU H 1 1 6 1506 1 1 11 GLU HA H -3.503 -6.764 3.710 1.00 . A A . 11 GLU HA 1 1 6 1507 1 1 11 GLU HB2 H -1.421 -7.374 4.883 1.00 . A A . 11 GLU HB2 1 1 6 1508 1 1 11 GLU HB3 H -1.275 -5.725 5.472 1.00 . A A . 11 GLU HB3 1 1 6 1509 1 1 11 GLU HG2 H -3.645 -6.182 6.471 1.00 . A A . 11 GLU HG2 1 1 6 1510 1 1 11 GLU HG3 H -3.169 -7.870 6.294 1.00 . A A . 11 GLU HG3 1 1 6 1511 1 1 11 GLU N N -1.933 -5.731 2.864 1.00 . A A . 11 GLU N 1 1 6 1512 1 1 11 GLU O O -4.776 -4.782 4.652 1.00 . A A . 11 GLU O 1 1 6 1513 1 1 11 GLU OE1 O -0.824 -6.401 7.658 1.00 . A A . 11 GLU OE1 1 1 6 1514 1 1 11 GLU OE2 O -2.602 -7.029 8.773 1.00 . A A . 11 GLU OE2 1 1 6 1515 1 1 12 HIS C C -3.850 -1.528 3.607 1.00 . A A . 12 HIS C 1 1 6 1516 1 1 12 HIS CA C -3.475 -2.351 4.836 1.00 . A A . 12 HIS CA 1 1 6 1517 1 1 12 HIS CB C -2.531 -1.526 5.737 1.00 . A A . 12 HIS CB 1 1 6 1518 1 1 12 HIS CD2 C -1.775 -3.574 7.144 1.00 . A A . 12 HIS CD2 1 1 6 1519 1 1 12 HIS CE1 C -1.148 -2.532 8.957 1.00 . A A . 12 HIS CE1 1 1 6 1520 1 1 12 HIS CG C -1.997 -2.260 6.938 1.00 . A A . 12 HIS CG 1 1 6 1521 1 1 12 HIS H H -1.908 -3.654 4.240 1.00 . A A . 12 HIS H 1 1 6 1522 1 1 12 HIS HA H -4.375 -2.573 5.389 1.00 . A A . 12 HIS HA 1 1 6 1523 1 1 12 HIS HB2 H -1.685 -1.204 5.150 1.00 . A A . 12 HIS HB2 1 1 6 1524 1 1 12 HIS HB3 H -3.063 -0.655 6.092 1.00 . A A . 12 HIS HB3 1 1 6 1525 1 1 12 HIS HD1 H -1.607 -0.663 8.257 1.00 . A A . 12 HIS HD1 1 1 6 1526 1 1 12 HIS HD2 H -1.952 -4.368 6.433 1.00 . A A . 12 HIS HD2 1 1 6 1527 1 1 12 HIS HE1 H -0.766 -2.331 9.947 1.00 . A A . 12 HIS HE1 1 1 6 1528 1 1 12 HIS HE2 H -0.952 -4.574 8.793 1.00 . A A . 12 HIS HE2 1 1 6 1529 1 1 12 HIS N N -2.869 -3.621 4.452 1.00 . A A . 12 HIS N 1 1 6 1530 1 1 12 HIS ND1 N -1.590 -1.627 8.096 1.00 . A A . 12 HIS ND1 1 1 6 1531 1 1 12 HIS NE2 N -1.254 -3.718 8.398 1.00 . A A . 12 HIS NE2 1 1 6 1532 1 1 12 HIS O O -3.615 -0.321 3.572 1.00 . A A . 12 HIS O 1 1 6 1533 1 1 13 SER C C -5.875 -0.415 1.671 1.00 . A A . 13 SER C 1 1 6 1534 1 1 13 SER CA C -4.834 -1.492 1.380 1.00 . A A . 13 SER CA 1 1 6 1535 1 1 13 SER CB C -5.373 -2.490 0.354 1.00 . A A . 13 SER CB 1 1 6 1536 1 1 13 SER H H -4.593 -3.143 2.690 1.00 . A A . 13 SER H 1 1 6 1537 1 1 13 SER HA H -3.955 -1.016 0.971 1.00 . A A . 13 SER HA 1 1 6 1538 1 1 13 SER HB2 H -6.135 -3.102 0.816 1.00 . A A . 13 SER HB2 1 1 6 1539 1 1 13 SER HB3 H -5.799 -1.953 -0.480 1.00 . A A . 13 SER HB3 1 1 6 1540 1 1 13 SER HG H -4.290 -4.130 0.422 1.00 . A A . 13 SER HG 1 1 6 1541 1 1 13 SER N N -4.432 -2.179 2.606 1.00 . A A . 13 SER N 1 1 6 1542 1 1 13 SER O O -5.854 0.657 1.067 1.00 . A A . 13 SER O 1 1 6 1543 1 1 13 SER OG O -4.339 -3.333 -0.125 1.00 . A A . 13 SER OG 1 1 6 1544 1 1 14 ASN C C -7.227 1.479 3.615 1.00 . A A . 14 ASN C 1 1 6 1545 1 1 14 ASN CA C -7.827 0.233 2.981 1.00 . A A . 14 ASN CA 1 1 6 1546 1 1 14 ASN CB C -8.814 -0.417 3.958 1.00 . A A . 14 ASN CB 1 1 6 1547 1 1 14 ASN CG C -9.523 -1.620 3.366 1.00 . A A . 14 ASN CG 1 1 6 1548 1 1 14 ASN H H -6.738 -1.583 3.044 1.00 . A A . 14 ASN H 1 1 6 1549 1 1 14 ASN HA H -8.354 0.518 2.086 1.00 . A A . 14 ASN HA 1 1 6 1550 1 1 14 ASN HB2 H -8.278 -0.738 4.838 1.00 . A A . 14 ASN HB2 1 1 6 1551 1 1 14 ASN HB3 H -9.558 0.313 4.242 1.00 . A A . 14 ASN HB3 1 1 6 1552 1 1 14 ASN HD21 H -11.278 -0.707 3.533 1.00 . A A . 14 ASN HD21 1 1 6 1553 1 1 14 ASN HD22 H -11.318 -2.297 2.862 1.00 . A A . 14 ASN HD22 1 1 6 1554 1 1 14 ASN N N -6.777 -0.708 2.601 1.00 . A A . 14 ASN N 1 1 6 1555 1 1 14 ASN ND2 N -10.839 -1.532 3.242 1.00 . A A . 14 ASN ND2 1 1 6 1556 1 1 14 ASN O O -7.699 2.592 3.393 1.00 . A A . 14 ASN O 1 1 6 1557 1 1 14 ASN OD1 O -8.895 -2.620 3.026 1.00 . A A . 14 ASN OD1 1 1 6 1558 1 1 15 LEU C C -4.668 3.176 4.088 1.00 . A A . 15 LEU C 1 1 6 1559 1 1 15 LEU CA C -5.506 2.382 5.078 1.00 . A A . 15 LEU CA 1 1 6 1560 1 1 15 LEU CB C -4.624 1.858 6.216 1.00 . A A . 15 LEU CB 1 1 6 1561 1 1 15 LEU CD1 C -4.395 0.624 8.386 1.00 . A A . 15 LEU CD1 1 1 6 1562 1 1 15 LEU CD2 C -6.433 2.003 7.949 1.00 . A A . 15 LEU CD2 1 1 6 1563 1 1 15 LEU CG C -5.369 1.111 7.326 1.00 . A A . 15 LEU CG 1 1 6 1564 1 1 15 LEU H H -5.855 0.368 4.536 1.00 . A A . 15 LEU H 1 1 6 1565 1 1 15 LEU HA H -6.261 3.029 5.488 1.00 . A A . 15 LEU HA 1 1 6 1566 1 1 15 LEU HB2 H -3.888 1.189 5.792 1.00 . A A . 15 LEU HB2 1 1 6 1567 1 1 15 LEU HB3 H -4.111 2.696 6.659 1.00 . A A . 15 LEU HB3 1 1 6 1568 1 1 15 LEU HD11 H -3.393 0.622 7.982 1.00 . A A . 15 LEU HD11 1 1 6 1569 1 1 15 LEU HD12 H -4.663 -0.378 8.688 1.00 . A A . 15 LEU HD12 1 1 6 1570 1 1 15 LEU HD13 H -4.436 1.281 9.243 1.00 . A A . 15 LEU HD13 1 1 6 1571 1 1 15 LEU HD21 H -7.365 1.876 7.418 1.00 . A A . 15 LEU HD21 1 1 6 1572 1 1 15 LEU HD22 H -6.121 3.035 7.886 1.00 . A A . 15 LEU HD22 1 1 6 1573 1 1 15 LEU HD23 H -6.569 1.731 8.985 1.00 . A A . 15 LEU HD23 1 1 6 1574 1 1 15 LEU HG H -5.861 0.247 6.902 1.00 . A A . 15 LEU HG 1 1 6 1575 1 1 15 LEU N N -6.182 1.279 4.407 1.00 . A A . 15 LEU N 1 1 6 1576 1 1 15 LEU O O -4.768 4.398 4.011 1.00 . A A . 15 LEU O 1 1 6 1577 1 1 16 CYS C C -3.802 3.325 1.030 1.00 . A A . 16 CYS C 1 1 6 1578 1 1 16 CYS CA C -3.008 3.085 2.310 1.00 . A A . 16 CYS CA 1 1 6 1579 1 1 16 CYS CB C -1.805 2.195 2.009 1.00 . A A . 16 CYS CB 1 1 6 1580 1 1 16 CYS H H -3.847 1.493 3.421 1.00 . A A . 16 CYS H 1 1 6 1581 1 1 16 CYS HA H -2.664 4.032 2.695 1.00 . A A . 16 CYS HA 1 1 6 1582 1 1 16 CYS HB2 H -2.155 1.296 1.531 1.00 . A A . 16 CYS HB2 1 1 6 1583 1 1 16 CYS HB3 H -1.143 2.717 1.334 1.00 . A A . 16 CYS HB3 1 1 6 1584 1 1 16 CYS N N -3.860 2.466 3.318 1.00 . A A . 16 CYS N 1 1 6 1585 1 1 16 CYS O O -3.347 3.005 -0.076 1.00 . A A . 16 CYS O 1 1 6 1586 1 1 16 CYS SG S -0.834 1.704 3.471 1.00 . A A . 16 CYS SG 1 1 6 1587 1 1 17 GLY C C -5.234 5.015 -0.972 1.00 . A A . 17 GLY C 1 1 6 1588 1 1 17 GLY CA C -5.883 4.152 0.091 1.00 . A A . 17 GLY CA 1 1 6 1589 1 1 17 GLY H H -5.284 4.075 2.117 1.00 . A A . 17 GLY H 1 1 6 1590 1 1 17 GLY HA2 H -6.187 3.218 -0.358 1.00 . A A . 17 GLY HA2 1 1 6 1591 1 1 17 GLY HA3 H -6.760 4.660 0.464 1.00 . A A . 17 GLY HA3 1 1 6 1592 1 1 17 GLY N N -4.996 3.871 1.203 1.00 . A A . 17 GLY N 1 1 6 1593 1 1 17 GLY O O -4.546 5.987 -0.655 1.00 . A A . 17 GLY O 1 1 6 1594 1 1 18 ALA C C -3.356 5.368 -3.329 1.00 . A A . 18 ALA C 1 1 6 1595 1 1 18 ALA CA C -4.882 5.348 -3.384 1.00 . A A . 18 ALA CA 1 1 6 1596 1 1 18 ALA CB C -5.438 6.765 -3.470 1.00 . A A . 18 ALA CB 1 1 6 1597 1 1 18 ALA H H -5.995 3.843 -2.397 1.00 . A A . 18 ALA H 1 1 6 1598 1 1 18 ALA HA H -5.186 4.818 -4.276 1.00 . A A . 18 ALA HA 1 1 6 1599 1 1 18 ALA HB1 H -4.716 7.460 -3.069 1.00 . A A . 18 ALA HB1 1 1 6 1600 1 1 18 ALA HB2 H -6.353 6.828 -2.900 1.00 . A A . 18 ALA HB2 1 1 6 1601 1 1 18 ALA HB3 H -5.640 7.011 -4.502 1.00 . A A . 18 ALA HB3 1 1 6 1602 1 1 18 ALA N N -5.445 4.637 -2.234 1.00 . A A . 18 ALA N 1 1 6 1603 1 1 18 ALA O O -2.712 6.232 -3.917 1.00 . A A . 18 ALA O 1 1 6 1604 1 1 19 GLY C C -0.765 5.411 -1.624 1.00 . A A . 19 GLY C 1 1 6 1605 1 1 19 GLY CA C -1.350 4.305 -2.481 1.00 . A A . 19 GLY CA 1 1 6 1606 1 1 19 GLY H H -3.363 3.742 -2.166 1.00 . A A . 19 GLY H 1 1 6 1607 1 1 19 GLY HA2 H -1.103 3.352 -2.036 1.00 . A A . 19 GLY HA2 1 1 6 1608 1 1 19 GLY HA3 H -0.906 4.355 -3.464 1.00 . A A . 19 GLY HA3 1 1 6 1609 1 1 19 GLY N N -2.791 4.400 -2.614 1.00 . A A . 19 GLY N 1 1 6 1610 1 1 19 GLY O O 0.440 5.648 -1.653 1.00 . A A . 19 GLY O 1 1 6 1611 1 1 20 GLY C C -0.904 6.693 1.422 1.00 . A A . 20 GLY C 1 1 6 1612 1 1 20 GLY CA C -1.159 7.151 0.001 1.00 . A A . 20 GLY CA 1 1 6 1613 1 1 20 GLY H H -2.570 5.840 -0.872 1.00 . A A . 20 GLY H 1 1 6 1614 1 1 20 GLY HA2 H -0.242 7.553 -0.405 1.00 . A A . 20 GLY HA2 1 1 6 1615 1 1 20 GLY HA3 H -1.906 7.930 0.014 1.00 . A A . 20 GLY HA3 1 1 6 1616 1 1 20 GLY N N -1.617 6.079 -0.857 1.00 . A A . 20 GLY N 1 1 6 1617 1 1 20 GLY O O -0.306 5.641 1.641 1.00 . A A . 20 GLY O 1 1 6 1618 1 1 21 ALA C C 0.242 7.260 4.241 1.00 . A A . 21 ALA C 1 1 6 1619 1 1 21 ALA CA C -1.224 7.223 3.810 1.00 . A A . 21 ALA CA 1 1 6 1620 1 1 21 ALA CB C -1.868 5.895 4.184 1.00 . A A . 21 ALA CB 1 1 6 1621 1 1 21 ALA H H -1.842 8.313 2.109 1.00 . A A . 21 ALA H 1 1 6 1622 1 1 21 ALA HA H -1.750 8.004 4.342 1.00 . A A . 21 ALA HA 1 1 6 1623 1 1 21 ALA HB1 H -1.314 5.086 3.733 1.00 . A A . 21 ALA HB1 1 1 6 1624 1 1 21 ALA HB2 H -2.888 5.876 3.827 1.00 . A A . 21 ALA HB2 1 1 6 1625 1 1 21 ALA HB3 H -1.861 5.782 5.259 1.00 . A A . 21 ALA HB3 1 1 6 1626 1 1 21 ALA N N -1.373 7.499 2.378 1.00 . A A . 21 ALA N 1 1 6 1627 1 1 21 ALA O O 0.671 6.481 5.093 1.00 . A A . 21 ALA O 1 1 6 1628 1 1 22 ALA C C 3.233 7.136 3.639 1.00 . A A . 22 ALA C 1 1 6 1629 1 1 22 ALA CA C 2.409 8.382 3.957 1.00 . A A . 22 ALA CA 1 1 6 1630 1 1 22 ALA CB C 2.590 8.795 5.415 1.00 . A A . 22 ALA CB 1 1 6 1631 1 1 22 ALA H H 0.571 8.780 2.994 1.00 . A A . 22 ALA H 1 1 6 1632 1 1 22 ALA HA H 2.774 9.188 3.343 1.00 . A A . 22 ALA HA 1 1 6 1633 1 1 22 ALA HB1 H 2.999 9.793 5.458 1.00 . A A . 22 ALA HB1 1 1 6 1634 1 1 22 ALA HB2 H 3.267 8.108 5.902 1.00 . A A . 22 ALA HB2 1 1 6 1635 1 1 22 ALA HB3 H 1.634 8.775 5.916 1.00 . A A . 22 ALA HB3 1 1 6 1636 1 1 22 ALA N N 0.991 8.193 3.651 1.00 . A A . 22 ALA N 1 1 6 1637 1 1 22 ALA O O 2.891 6.353 2.753 1.00 . A A . 22 ALA O 1 1 6 1638 1 1 23 GLY C C 5.065 4.792 5.229 1.00 . A A . 23 GLY C 1 1 6 1639 1 1 23 GLY CA C 5.202 5.843 4.148 1.00 . A A . 23 GLY CA 1 1 6 1640 1 1 23 GLY H H 4.549 7.644 5.039 1.00 . A A . 23 GLY H 1 1 6 1641 1 1 23 GLY HA2 H 4.965 5.395 3.194 1.00 . A A . 23 GLY HA2 1 1 6 1642 1 1 23 GLY HA3 H 6.225 6.190 4.126 1.00 . A A . 23 GLY HA3 1 1 6 1643 1 1 23 GLY N N 4.330 6.977 4.360 1.00 . A A . 23 GLY N 1 1 6 1644 1 1 23 GLY O O 3.955 4.455 5.644 1.00 . A A . 23 GLY O 1 1 7 1645 1 1 1 GLY C C 5.674 1.498 6.204 1.00 . A A . 1 GLY C 1 1 7 1646 1 1 1 GLY CA C 6.481 2.711 6.600 1.00 . A A . 1 GLY CA 1 1 7 1647 1 1 1 GLY H1 H 6.150 3.170 8.637 1.00 . A A . 1 GLY H1 1 1 7 1648 1 1 1 GLY HA2 H 6.546 3.381 5.756 1.00 . A A . 1 GLY HA2 1 1 7 1649 1 1 1 GLY HA3 H 7.468 2.392 6.869 1.00 . A A . 1 GLY HA3 1 1 7 1650 1 1 1 GLY N N 5.904 3.421 7.724 1.00 . A A . 1 GLY N 1 1 7 1651 1 1 1 GLY O O 6.188 0.576 5.572 1.00 . A A . 1 GLY O 1 1 7 1652 1 1 2 CYS C C 3.216 0.368 4.774 1.00 . A A . 2 CYS C 1 1 7 1653 1 1 2 CYS CA C 3.522 0.392 6.262 1.00 . A A . 2 CYS CA 1 1 7 1654 1 1 2 CYS CB C 2.223 0.500 7.059 1.00 . A A . 2 CYS CB 1 1 7 1655 1 1 2 CYS H H 4.072 2.266 7.081 1.00 . A A . 2 CYS H 1 1 7 1656 1 1 2 CYS HA H 4.025 -0.526 6.530 1.00 . A A . 2 CYS HA 1 1 7 1657 1 1 2 CYS HB2 H 2.446 0.412 8.109 1.00 . A A . 2 CYS HB2 1 1 7 1658 1 1 2 CYS HB3 H 1.780 1.469 6.874 1.00 . A A . 2 CYS HB3 1 1 7 1659 1 1 2 CYS N N 4.412 1.499 6.579 1.00 . A A . 2 CYS N 1 1 7 1660 1 1 2 CYS O O 3.400 -0.646 4.107 1.00 . A A . 2 CYS O 1 1 7 1661 1 1 2 CYS SG S 0.976 -0.767 6.646 1.00 . A A . 2 CYS SG 1 1 7 1662 1 1 3 CYS C C 3.657 1.472 1.973 1.00 . A A . 3 CYS C 1 1 7 1663 1 1 3 CYS CA C 2.416 1.597 2.843 1.00 . A A . 3 CYS CA 1 1 7 1664 1 1 3 CYS CB C 1.685 2.910 2.569 1.00 . A A . 3 CYS CB 1 1 7 1665 1 1 3 CYS H H 2.626 2.270 4.839 1.00 . A A . 3 CYS H 1 1 7 1666 1 1 3 CYS HA H 1.761 0.775 2.608 1.00 . A A . 3 CYS HA 1 1 7 1667 1 1 3 CYS HB2 H 2.365 3.735 2.723 1.00 . A A . 3 CYS HB2 1 1 7 1668 1 1 3 CYS HB3 H 1.339 2.914 1.546 1.00 . A A . 3 CYS HB3 1 1 7 1669 1 1 3 CYS N N 2.752 1.492 4.256 1.00 . A A . 3 CYS N 1 1 7 1670 1 1 3 CYS O O 3.582 1.011 0.832 1.00 . A A . 3 CYS O 1 1 7 1671 1 1 3 CYS SG S 0.238 3.169 3.642 1.00 . A A . 3 CYS SG 1 1 7 1672 1 1 4 SER C C 6.464 0.328 1.639 1.00 . A A . 4 SER C 1 1 7 1673 1 1 4 SER CA C 6.062 1.789 1.820 1.00 . A A . 4 SER CA 1 1 7 1674 1 1 4 SER CB C 7.135 2.540 2.607 1.00 . A A . 4 SER CB 1 1 7 1675 1 1 4 SER H H 4.781 2.220 3.438 1.00 . A A . 4 SER H 1 1 7 1676 1 1 4 SER HA H 5.941 2.246 0.852 1.00 . A A . 4 SER HA 1 1 7 1677 1 1 4 SER HB2 H 7.459 1.934 3.440 1.00 . A A . 4 SER HB2 1 1 7 1678 1 1 4 SER HB3 H 7.976 2.746 1.960 1.00 . A A . 4 SER HB3 1 1 7 1679 1 1 4 SER HG H 6.975 4.495 2.576 1.00 . A A . 4 SER HG 1 1 7 1680 1 1 4 SER N N 4.793 1.871 2.524 1.00 . A A . 4 SER N 1 1 7 1681 1 1 4 SER O O 7.188 -0.026 0.711 1.00 . A A . 4 SER O 1 1 7 1682 1 1 4 SER OG O 6.627 3.769 3.102 1.00 . A A . 4 SER OG 1 1 7 1683 1 1 5 ASN C C 5.167 -2.667 1.708 1.00 . A A . 5 ASN C 1 1 7 1684 1 1 5 ASN CA C 6.249 -1.944 2.486 1.00 . A A . 5 ASN CA 1 1 7 1685 1 1 5 ASN CB C 6.357 -2.523 3.898 1.00 . A A . 5 ASN CB 1 1 7 1686 1 1 5 ASN CG C 7.773 -2.476 4.434 1.00 . A A . 5 ASN CG 1 1 7 1687 1 1 5 ASN H H 5.375 -0.167 3.237 1.00 . A A . 5 ASN H 1 1 7 1688 1 1 5 ASN HA H 7.193 -2.078 1.978 1.00 . A A . 5 ASN HA 1 1 7 1689 1 1 5 ASN HB2 H 5.720 -1.958 4.561 1.00 . A A . 5 ASN HB2 1 1 7 1690 1 1 5 ASN HB3 H 6.031 -3.553 3.883 1.00 . A A . 5 ASN HB3 1 1 7 1691 1 1 5 ASN HD21 H 7.285 -1.007 5.679 1.00 . A A . 5 ASN HD21 1 1 7 1692 1 1 5 ASN HD22 H 8.930 -1.538 5.741 1.00 . A A . 5 ASN HD22 1 1 7 1693 1 1 5 ASN N N 5.968 -0.515 2.534 1.00 . A A . 5 ASN N 1 1 7 1694 1 1 5 ASN ND2 N 8.021 -1.585 5.381 1.00 . A A . 5 ASN ND2 1 1 7 1695 1 1 5 ASN O O 3.986 -2.515 2.000 1.00 . A A . 5 ASN O 1 1 7 1696 1 1 5 ASN OD1 O 8.640 -3.221 3.987 1.00 . A A . 5 ASN OD1 1 1 7 1697 1 1 6 PRO C C 3.659 -5.095 0.655 1.00 . A A . 6 PRO C 1 1 7 1698 1 1 6 PRO CA C 4.607 -4.197 -0.142 1.00 . A A . 6 PRO CA 1 1 7 1699 1 1 6 PRO CB C 5.506 -5.045 -1.053 1.00 . A A . 6 PRO CB 1 1 7 1700 1 1 6 PRO CD C 6.943 -3.678 0.283 1.00 . A A . 6 PRO CD 1 1 7 1701 1 1 6 PRO CG C 6.866 -4.991 -0.438 1.00 . A A . 6 PRO CG 1 1 7 1702 1 1 6 PRO HA H 4.020 -3.523 -0.749 1.00 . A A . 6 PRO HA 1 1 7 1703 1 1 6 PRO HB2 H 5.132 -6.057 -1.088 1.00 . A A . 6 PRO HB2 1 1 7 1704 1 1 6 PRO HB3 H 5.510 -4.625 -2.048 1.00 . A A . 6 PRO HB3 1 1 7 1705 1 1 6 PRO HD2 H 7.597 -3.754 1.140 1.00 . A A . 6 PRO HD2 1 1 7 1706 1 1 6 PRO HD3 H 7.277 -2.897 -0.383 1.00 . A A . 6 PRO HD3 1 1 7 1707 1 1 6 PRO HG2 H 6.986 -5.808 0.258 1.00 . A A . 6 PRO HG2 1 1 7 1708 1 1 6 PRO HG3 H 7.620 -5.040 -1.209 1.00 . A A . 6 PRO HG3 1 1 7 1709 1 1 6 PRO N N 5.552 -3.456 0.700 1.00 . A A . 6 PRO N 1 1 7 1710 1 1 6 PRO O O 2.468 -5.162 0.360 1.00 . A A . 6 PRO O 1 1 7 1711 1 1 7 VAL C C 2.341 -5.908 3.284 1.00 . A A . 7 VAL C 1 1 7 1712 1 1 7 VAL CA C 3.386 -6.678 2.485 1.00 . A A . 7 VAL CA 1 1 7 1713 1 1 7 VAL CB C 4.269 -7.490 3.456 1.00 . A A . 7 VAL CB 1 1 7 1714 1 1 7 VAL CG1 C 3.429 -8.471 4.264 1.00 . A A . 7 VAL CG1 1 1 7 1715 1 1 7 VAL CG2 C 5.365 -8.222 2.698 1.00 . A A . 7 VAL CG2 1 1 7 1716 1 1 7 VAL H H 5.145 -5.684 1.853 1.00 . A A . 7 VAL H 1 1 7 1717 1 1 7 VAL HA H 2.882 -7.370 1.826 1.00 . A A . 7 VAL HA 1 1 7 1718 1 1 7 VAL HB H 4.736 -6.802 4.146 1.00 . A A . 7 VAL HB 1 1 7 1719 1 1 7 VAL HG11 H 3.892 -8.634 5.226 1.00 . A A . 7 VAL HG11 1 1 7 1720 1 1 7 VAL HG12 H 3.361 -9.409 3.733 1.00 . A A . 7 VAL HG12 1 1 7 1721 1 1 7 VAL HG13 H 2.438 -8.065 4.405 1.00 . A A . 7 VAL HG13 1 1 7 1722 1 1 7 VAL HG21 H 4.932 -8.761 1.869 1.00 . A A . 7 VAL HG21 1 1 7 1723 1 1 7 VAL HG22 H 5.861 -8.915 3.362 1.00 . A A . 7 VAL HG22 1 1 7 1724 1 1 7 VAL HG23 H 6.083 -7.505 2.325 1.00 . A A . 7 VAL HG23 1 1 7 1725 1 1 7 VAL N N 4.191 -5.780 1.661 1.00 . A A . 7 VAL N 1 1 7 1726 1 1 7 VAL O O 1.156 -6.236 3.258 1.00 . A A . 7 VAL O 1 1 7 1727 1 1 8 CYS C C 0.922 -3.299 3.908 1.00 . A A . 8 CYS C 1 1 7 1728 1 1 8 CYS CA C 1.891 -4.064 4.799 1.00 . A A . 8 CYS CA 1 1 7 1729 1 1 8 CYS CB C 2.688 -3.089 5.661 1.00 . A A . 8 CYS CB 1 1 7 1730 1 1 8 CYS H H 3.744 -4.664 3.961 1.00 . A A . 8 CYS H 1 1 7 1731 1 1 8 CYS HA H 1.329 -4.725 5.440 1.00 . A A . 8 CYS HA 1 1 7 1732 1 1 8 CYS HB2 H 3.614 -3.554 5.954 1.00 . A A . 8 CYS HB2 1 1 7 1733 1 1 8 CYS HB3 H 2.906 -2.210 5.074 1.00 . A A . 8 CYS HB3 1 1 7 1734 1 1 8 CYS N N 2.789 -4.879 3.988 1.00 . A A . 8 CYS N 1 1 7 1735 1 1 8 CYS O O -0.240 -3.122 4.252 1.00 . A A . 8 CYS O 1 1 7 1736 1 1 8 CYS SG S 1.832 -2.532 7.176 1.00 . A A . 8 CYS SG 1 1 7 1737 1 1 9 HIS C C -0.567 -2.907 1.318 1.00 . A A . 9 HIS C 1 1 7 1738 1 1 9 HIS CA C 0.618 -2.085 1.810 1.00 . A A . 9 HIS CA 1 1 7 1739 1 1 9 HIS CB C 1.483 -1.662 0.619 1.00 . A A . 9 HIS CB 1 1 7 1740 1 1 9 HIS CD2 C -0.370 -0.055 -0.253 1.00 . A A . 9 HIS CD2 1 1 7 1741 1 1 9 HIS CE1 C 0.761 0.870 -1.884 1.00 . A A . 9 HIS CE1 1 1 7 1742 1 1 9 HIS CG C 0.869 -0.606 -0.252 1.00 . A A . 9 HIS CG 1 1 7 1743 1 1 9 HIS H H 2.369 -3.013 2.563 1.00 . A A . 9 HIS H 1 1 7 1744 1 1 9 HIS HA H 0.250 -1.202 2.309 1.00 . A A . 9 HIS HA 1 1 7 1745 1 1 9 HIS HB2 H 2.422 -1.286 0.985 1.00 . A A . 9 HIS HB2 1 1 7 1746 1 1 9 HIS HB3 H 1.670 -2.529 0.002 1.00 . A A . 9 HIS HB3 1 1 7 1747 1 1 9 HIS HD1 H 2.485 -0.176 -1.535 1.00 . A A . 9 HIS HD1 1 1 7 1748 1 1 9 HIS HD2 H -1.176 -0.293 0.428 1.00 . A A . 9 HIS HD2 1 1 7 1749 1 1 9 HIS HE1 H 1.029 1.488 -2.729 1.00 . A A . 9 HIS HE1 1 1 7 1750 1 1 9 HIS HE2 H -1.230 1.262 -1.637 1.00 . A A . 9 HIS HE2 1 1 7 1751 1 1 9 HIS N N 1.421 -2.843 2.766 1.00 . A A . 9 HIS N 1 1 7 1752 1 1 9 HIS ND1 N 1.551 -0.002 -1.286 1.00 . A A . 9 HIS ND1 1 1 7 1753 1 1 9 HIS NE2 N -0.412 0.858 -1.277 1.00 . A A . 9 HIS NE2 1 1 7 1754 1 1 9 HIS O O -1.691 -2.417 1.288 1.00 . A A . 9 HIS O 1 1 7 1755 1 1 10 LEU C C -2.379 -5.318 1.516 1.00 . A A . 10 LEU C 1 1 7 1756 1 1 10 LEU CA C -1.351 -5.033 0.427 1.00 . A A . 10 LEU CA 1 1 7 1757 1 1 10 LEU CB C -0.753 -6.346 -0.088 1.00 . A A . 10 LEU CB 1 1 7 1758 1 1 10 LEU CD1 C 0.691 -7.574 -1.731 1.00 . A A . 10 LEU CD1 1 1 7 1759 1 1 10 LEU CD2 C -0.649 -5.602 -2.482 1.00 . A A . 10 LEU CD2 1 1 7 1760 1 1 10 LEU CG C 0.132 -6.218 -1.331 1.00 . A A . 10 LEU CG 1 1 7 1761 1 1 10 LEU H H 0.625 -4.473 0.968 1.00 . A A . 10 LEU H 1 1 7 1762 1 1 10 LEU HA H -1.846 -4.529 -0.390 1.00 . A A . 10 LEU HA 1 1 7 1763 1 1 10 LEU HB2 H -0.164 -6.782 0.705 1.00 . A A . 10 LEU HB2 1 1 7 1764 1 1 10 LEU HB3 H -1.565 -7.019 -0.321 1.00 . A A . 10 LEU HB3 1 1 7 1765 1 1 10 LEU HD11 H 0.467 -7.762 -2.772 1.00 . A A . 10 LEU HD11 1 1 7 1766 1 1 10 LEU HD12 H 0.242 -8.344 -1.122 1.00 . A A . 10 LEU HD12 1 1 7 1767 1 1 10 LEU HD13 H 1.762 -7.580 -1.587 1.00 . A A . 10 LEU HD13 1 1 7 1768 1 1 10 LEU HD21 H 0.039 -5.211 -3.216 1.00 . A A . 10 LEU HD21 1 1 7 1769 1 1 10 LEU HD22 H -1.271 -4.802 -2.109 1.00 . A A . 10 LEU HD22 1 1 7 1770 1 1 10 LEU HD23 H -1.270 -6.358 -2.939 1.00 . A A . 10 LEU HD23 1 1 7 1771 1 1 10 LEU HG H 0.965 -5.567 -1.105 1.00 . A A . 10 LEU HG 1 1 7 1772 1 1 10 LEU N N -0.302 -4.147 0.925 1.00 . A A . 10 LEU N 1 1 7 1773 1 1 10 LEU O O -3.585 -5.250 1.279 1.00 . A A . 10 LEU O 1 1 7 1774 1 1 11 GLU C C -3.543 -4.670 4.250 1.00 . A A . 11 GLU C 1 1 7 1775 1 1 11 GLU CA C -2.758 -5.917 3.841 1.00 . A A . 11 GLU CA 1 1 7 1776 1 1 11 GLU CB C -1.912 -6.425 5.016 1.00 . A A . 11 GLU CB 1 1 7 1777 1 1 11 GLU CD C -3.743 -7.818 6.064 1.00 . A A . 11 GLU CD 1 1 7 1778 1 1 11 GLU CG C -2.708 -6.732 6.275 1.00 . A A . 11 GLU CG 1 1 7 1779 1 1 11 GLU H H -0.919 -5.660 2.831 1.00 . A A . 11 GLU H 1 1 7 1780 1 1 11 GLU HA H -3.451 -6.685 3.545 1.00 . A A . 11 GLU HA 1 1 7 1781 1 1 11 GLU HB2 H -1.404 -7.327 4.712 1.00 . A A . 11 GLU HB2 1 1 7 1782 1 1 11 GLU HB3 H -1.173 -5.675 5.260 1.00 . A A . 11 GLU HB3 1 1 7 1783 1 1 11 GLU HG2 H -2.025 -7.054 7.047 1.00 . A A . 11 GLU HG2 1 1 7 1784 1 1 11 GLU HG3 H -3.212 -5.833 6.594 1.00 . A A . 11 GLU HG3 1 1 7 1785 1 1 11 GLU N N -1.891 -5.627 2.708 1.00 . A A . 11 GLU N 1 1 7 1786 1 1 11 GLU O O -4.757 -4.709 4.438 1.00 . A A . 11 GLU O 1 1 7 1787 1 1 11 GLU OE1 O -3.360 -8.929 5.647 1.00 . A A . 11 GLU OE1 1 1 7 1788 1 1 11 GLU OE2 O -4.933 -7.557 6.329 1.00 . A A . 11 GLU OE2 1 1 7 1789 1 1 12 HIS C C -3.852 -1.469 3.562 1.00 . A A . 12 HIS C 1 1 7 1790 1 1 12 HIS CA C -3.461 -2.301 4.778 1.00 . A A . 12 HIS CA 1 1 7 1791 1 1 12 HIS CB C -2.533 -1.477 5.686 1.00 . A A . 12 HIS CB 1 1 7 1792 1 1 12 HIS CD2 C -1.938 -3.477 7.240 1.00 . A A . 12 HIS CD2 1 1 7 1793 1 1 12 HIS CE1 C -1.470 -2.347 9.055 1.00 . A A . 12 HIS CE1 1 1 7 1794 1 1 12 HIS CG C -2.123 -2.165 6.957 1.00 . A A . 12 HIS CG 1 1 7 1795 1 1 12 HIS H H -1.870 -3.586 4.214 1.00 . A A . 12 HIS H 1 1 7 1796 1 1 12 HIS HA H -4.358 -2.542 5.329 1.00 . A A . 12 HIS HA 1 1 7 1797 1 1 12 HIS HB2 H -1.635 -1.237 5.140 1.00 . A A . 12 HIS HB2 1 1 7 1798 1 1 12 HIS HB3 H -3.036 -0.558 5.955 1.00 . A A . 12 HIS HB3 1 1 7 1799 1 1 12 HIS HD1 H -1.839 -0.511 8.231 1.00 . A A . 12 HIS HD1 1 1 7 1800 1 1 12 HIS HD2 H -2.055 -4.301 6.551 1.00 . A A . 12 HIS HD2 1 1 7 1801 1 1 12 HIS HE1 H -1.181 -2.098 10.066 1.00 . A A . 12 HIS HE1 1 1 7 1802 1 1 12 HIS HE2 H -1.484 -4.393 9.070 1.00 . A A . 12 HIS HE2 1 1 7 1803 1 1 12 HIS N N -2.839 -3.559 4.384 1.00 . A A . 12 HIS N 1 1 7 1804 1 1 12 HIS ND1 N -1.818 -1.484 8.118 1.00 . A A . 12 HIS ND1 1 1 7 1805 1 1 12 HIS NE2 N -1.536 -3.564 8.549 1.00 . A A . 12 HIS NE2 1 1 7 1806 1 1 12 HIS O O -3.679 -0.248 3.561 1.00 . A A . 12 HIS O 1 1 7 1807 1 1 13 SER C C -5.901 -0.401 1.670 1.00 . A A . 13 SER C 1 1 7 1808 1 1 13 SER CA C -4.816 -1.416 1.330 1.00 . A A . 13 SER CA 1 1 7 1809 1 1 13 SER CB C -5.325 -2.403 0.278 1.00 . A A . 13 SER CB 1 1 7 1810 1 1 13 SER H H -4.513 -3.091 2.596 1.00 . A A . 13 SER H 1 1 7 1811 1 1 13 SER HA H -3.959 -0.890 0.936 1.00 . A A . 13 SER HA 1 1 7 1812 1 1 13 SER HB2 H -6.062 -3.053 0.724 1.00 . A A . 13 SER HB2 1 1 7 1813 1 1 13 SER HB3 H -5.774 -1.856 -0.539 1.00 . A A . 13 SER HB3 1 1 7 1814 1 1 13 SER HG H -4.159 -3.984 0.320 1.00 . A A . 13 SER HG 1 1 7 1815 1 1 13 SER N N -4.391 -2.119 2.537 1.00 . A A . 13 SER N 1 1 7 1816 1 1 13 SER O O -5.974 0.673 1.077 1.00 . A A . 13 SER O 1 1 7 1817 1 1 13 SER OG O -4.267 -3.194 -0.231 1.00 . A A . 13 SER OG 1 1 7 1818 1 1 14 ASN C C -7.271 1.331 3.849 1.00 . A A . 14 ASN C 1 1 7 1819 1 1 14 ASN CA C -7.804 0.100 3.115 1.00 . A A . 14 ASN CA 1 1 7 1820 1 1 14 ASN CB C -8.762 -0.691 4.019 1.00 . A A . 14 ASN CB 1 1 7 1821 1 1 14 ASN CG C -8.085 -1.857 4.722 1.00 . A A . 14 ASN CG 1 1 7 1822 1 1 14 ASN H H -6.584 -1.623 3.086 1.00 . A A . 14 ASN H 1 1 7 1823 1 1 14 ASN HA H -8.347 0.434 2.246 1.00 . A A . 14 ASN HA 1 1 7 1824 1 1 14 ASN HB2 H -9.164 -0.029 4.772 1.00 . A A . 14 ASN HB2 1 1 7 1825 1 1 14 ASN HB3 H -9.572 -1.079 3.419 1.00 . A A . 14 ASN HB3 1 1 7 1826 1 1 14 ASN HD21 H -9.522 -3.094 4.126 1.00 . A A . 14 ASN HD21 1 1 7 1827 1 1 14 ASN HD22 H -8.265 -3.805 5.079 1.00 . A A . 14 ASN HD22 1 1 7 1828 1 1 14 ASN N N -6.721 -0.756 2.649 1.00 . A A . 14 ASN N 1 1 7 1829 1 1 14 ASN ND2 N -8.685 -3.036 4.633 1.00 . A A . 14 ASN ND2 1 1 7 1830 1 1 14 ASN O O -7.890 2.388 3.822 1.00 . A A . 14 ASN O 1 1 7 1831 1 1 14 ASN OD1 O -7.034 -1.703 5.336 1.00 . A A . 14 ASN OD1 1 1 7 1832 1 1 15 LEU C C -4.783 3.247 4.299 1.00 . A A . 15 LEU C 1 1 7 1833 1 1 15 LEU CA C -5.528 2.307 5.238 1.00 . A A . 15 LEU CA 1 1 7 1834 1 1 15 LEU CB C -4.573 1.823 6.340 1.00 . A A . 15 LEU CB 1 1 7 1835 1 1 15 LEU CD1 C -6.225 2.402 8.147 1.00 . A A . 15 LEU CD1 1 1 7 1836 1 1 15 LEU CD2 C -5.889 0.010 7.498 1.00 . A A . 15 LEU CD2 1 1 7 1837 1 1 15 LEU CG C -5.226 1.367 7.653 1.00 . A A . 15 LEU CG 1 1 7 1838 1 1 15 LEU H H -5.672 0.323 4.494 1.00 . A A . 15 LEU H 1 1 7 1839 1 1 15 LEU HA H -6.332 2.857 5.696 1.00 . A A . 15 LEU HA 1 1 7 1840 1 1 15 LEU HB2 H -4.000 0.996 5.947 1.00 . A A . 15 LEU HB2 1 1 7 1841 1 1 15 LEU HB3 H -3.891 2.628 6.569 1.00 . A A . 15 LEU HB3 1 1 7 1842 1 1 15 LEU HD11 H -6.303 3.200 7.423 1.00 . A A . 15 LEU HD11 1 1 7 1843 1 1 15 LEU HD12 H -5.889 2.804 9.091 1.00 . A A . 15 LEU HD12 1 1 7 1844 1 1 15 LEU HD13 H -7.191 1.936 8.276 1.00 . A A . 15 LEU HD13 1 1 7 1845 1 1 15 LEU HD21 H -5.732 -0.572 8.394 1.00 . A A . 15 LEU HD21 1 1 7 1846 1 1 15 LEU HD22 H -5.458 -0.507 6.653 1.00 . A A . 15 LEU HD22 1 1 7 1847 1 1 15 LEU HD23 H -6.948 0.143 7.336 1.00 . A A . 15 LEU HD23 1 1 7 1848 1 1 15 LEU HG H -4.456 1.273 8.406 1.00 . A A . 15 LEU HG 1 1 7 1849 1 1 15 LEU N N -6.124 1.189 4.506 1.00 . A A . 15 LEU N 1 1 7 1850 1 1 15 LEU O O -4.895 4.468 4.403 1.00 . A A . 15 LEU O 1 1 7 1851 1 1 16 CYS C C -4.107 4.060 1.367 1.00 . A A . 16 CYS C 1 1 7 1852 1 1 16 CYS CA C -3.222 3.456 2.455 1.00 . A A . 16 CYS CA 1 1 7 1853 1 1 16 CYS CB C -2.123 2.599 1.826 1.00 . A A . 16 CYS CB 1 1 7 1854 1 1 16 CYS H H -3.945 1.691 3.378 1.00 . A A . 16 CYS H 1 1 7 1855 1 1 16 CYS HA H -2.760 4.262 3.007 1.00 . A A . 16 CYS HA 1 1 7 1856 1 1 16 CYS HB2 H -2.572 1.850 1.195 1.00 . A A . 16 CYS HB2 1 1 7 1857 1 1 16 CYS HB3 H -1.485 3.230 1.225 1.00 . A A . 16 CYS HB3 1 1 7 1858 1 1 16 CYS N N -4.005 2.669 3.399 1.00 . A A . 16 CYS N 1 1 7 1859 1 1 16 CYS O O -3.914 5.208 0.964 1.00 . A A . 16 CYS O 1 1 7 1860 1 1 16 CYS SG S -1.067 1.738 3.038 1.00 . A A . 16 CYS SG 1 1 7 1861 1 1 17 GLY C C -7.071 4.631 0.434 1.00 . A A . 17 GLY C 1 1 7 1862 1 1 17 GLY CA C -5.968 3.766 -0.134 1.00 . A A . 17 GLY CA 1 1 7 1863 1 1 17 GLY H H -5.191 2.379 1.256 1.00 . A A . 17 GLY H 1 1 7 1864 1 1 17 GLY HA2 H -5.400 4.344 -0.850 1.00 . A A . 17 GLY HA2 1 1 7 1865 1 1 17 GLY HA3 H -6.411 2.920 -0.638 1.00 . A A . 17 GLY HA3 1 1 7 1866 1 1 17 GLY N N -5.074 3.286 0.895 1.00 . A A . 17 GLY N 1 1 7 1867 1 1 17 GLY O O -7.855 4.169 1.257 1.00 . A A . 17 GLY O 1 1 7 1868 1 1 18 ALA C C -8.057 7.039 1.959 1.00 . A A . 18 ALA C 1 1 7 1869 1 1 18 ALA CA C -8.125 6.847 0.446 1.00 . A A . 18 ALA CA 1 1 7 1870 1 1 18 ALA CB C -9.523 6.412 0.016 1.00 . A A . 18 ALA CB 1 1 7 1871 1 1 18 ALA H H -6.454 6.178 -0.666 1.00 . A A . 18 ALA H 1 1 7 1872 1 1 18 ALA HA H -7.912 7.794 -0.030 1.00 . A A . 18 ALA HA 1 1 7 1873 1 1 18 ALA HB1 H -9.824 6.976 -0.855 1.00 . A A . 18 ALA HB1 1 1 7 1874 1 1 18 ALA HB2 H -10.219 6.594 0.822 1.00 . A A . 18 ALA HB2 1 1 7 1875 1 1 18 ALA HB3 H -9.514 5.359 -0.222 1.00 . A A . 18 ALA HB3 1 1 7 1876 1 1 18 ALA N N -7.119 5.887 -0.012 1.00 . A A . 18 ALA N 1 1 7 1877 1 1 18 ALA O O -9.080 7.167 2.630 1.00 . A A . 18 ALA O 1 1 7 1878 1 1 19 GLY C C -5.359 7.968 4.214 1.00 . A A . 19 GLY C 1 1 7 1879 1 1 19 GLY CA C -6.645 7.234 3.905 1.00 . A A . 19 GLY CA 1 1 7 1880 1 1 19 GLY H H -6.064 6.953 1.896 1.00 . A A . 19 GLY H 1 1 7 1881 1 1 19 GLY HA2 H -7.475 7.796 4.306 1.00 . A A . 19 GLY HA2 1 1 7 1882 1 1 19 GLY HA3 H -6.617 6.263 4.376 1.00 . A A . 19 GLY HA3 1 1 7 1883 1 1 19 GLY N N -6.840 7.060 2.482 1.00 . A A . 19 GLY N 1 1 7 1884 1 1 19 GLY O O -5.294 9.192 4.104 1.00 . A A . 19 GLY O 1 1 7 1885 1 1 20 GLY C C -1.941 6.837 5.041 1.00 . A A . 20 GLY C 1 1 7 1886 1 1 20 GLY CA C -3.062 7.844 4.913 1.00 . A A . 20 GLY CA 1 1 7 1887 1 1 20 GLY H H -4.434 6.249 4.664 1.00 . A A . 20 GLY H 1 1 7 1888 1 1 20 GLY HA2 H -2.812 8.547 4.133 1.00 . A A . 20 GLY HA2 1 1 7 1889 1 1 20 GLY HA3 H -3.158 8.379 5.847 1.00 . A A . 20 GLY HA3 1 1 7 1890 1 1 20 GLY N N -4.331 7.227 4.597 1.00 . A A . 20 GLY N 1 1 7 1891 1 1 20 GLY O O -2.141 5.730 5.543 1.00 . A A . 20 GLY O 1 1 7 1892 1 1 21 ALA C C 0.948 6.287 6.077 1.00 . A A . 21 ALA C 1 1 7 1893 1 1 21 ALA CA C 0.416 6.365 4.649 1.00 . A A . 21 ALA CA 1 1 7 1894 1 1 21 ALA CB C 1.493 6.868 3.699 1.00 . A A . 21 ALA CB 1 1 7 1895 1 1 21 ALA H H -0.667 8.122 4.201 1.00 . A A . 21 ALA H 1 1 7 1896 1 1 21 ALA HA H 0.120 5.376 4.331 1.00 . A A . 21 ALA HA 1 1 7 1897 1 1 21 ALA HB1 H 2.406 7.042 4.250 1.00 . A A . 21 ALA HB1 1 1 7 1898 1 1 21 ALA HB2 H 1.168 7.790 3.242 1.00 . A A . 21 ALA HB2 1 1 7 1899 1 1 21 ALA HB3 H 1.671 6.129 2.932 1.00 . A A . 21 ALA HB3 1 1 7 1900 1 1 21 ALA N N -0.756 7.226 4.586 1.00 . A A . 21 ALA N 1 1 7 1901 1 1 21 ALA O O 1.857 7.027 6.455 1.00 . A A . 21 ALA O 1 1 7 1902 1 1 22 ALA C C 2.153 4.639 8.375 1.00 . A A . 22 ALA C 1 1 7 1903 1 1 22 ALA CA C 0.751 5.232 8.261 1.00 . A A . 22 ALA CA 1 1 7 1904 1 1 22 ALA CB C -0.258 4.356 8.988 1.00 . A A . 22 ALA CB 1 1 7 1905 1 1 22 ALA H H -0.375 4.858 6.509 1.00 . A A . 22 ALA H 1 1 7 1906 1 1 22 ALA HA H 0.745 6.205 8.728 1.00 . A A . 22 ALA HA 1 1 7 1907 1 1 22 ALA HB1 H 0.233 3.839 9.801 1.00 . A A . 22 ALA HB1 1 1 7 1908 1 1 22 ALA HB2 H -0.670 3.632 8.300 1.00 . A A . 22 ALA HB2 1 1 7 1909 1 1 22 ALA HB3 H -1.053 4.971 9.383 1.00 . A A . 22 ALA HB3 1 1 7 1910 1 1 22 ALA N N 0.358 5.403 6.869 1.00 . A A . 22 ALA N 1 1 7 1911 1 1 22 ALA O O 2.346 3.430 8.220 1.00 . A A . 22 ALA O 1 1 7 1912 1 1 23 GLY C C 5.040 4.411 7.534 1.00 . A A . 23 GLY C 1 1 7 1913 1 1 23 GLY CA C 4.502 5.078 8.785 1.00 . A A . 23 GLY CA 1 1 7 1914 1 1 23 GLY H H 2.897 6.451 8.752 1.00 . A A . 23 GLY H 1 1 7 1915 1 1 23 GLY HA2 H 5.112 5.941 9.008 1.00 . A A . 23 GLY HA2 1 1 7 1916 1 1 23 GLY HA3 H 4.570 4.381 9.608 1.00 . A A . 23 GLY HA3 1 1 7 1917 1 1 23 GLY N N 3.123 5.504 8.648 1.00 . A A . 23 GLY N 1 1 7 1918 1 1 23 GLY O O 4.678 4.776 6.417 1.00 . A A . 23 GLY O 1 1 8 1919 1 1 1 GLY C C 5.664 2.808 6.035 1.00 . A A . 1 GLY C 1 1 8 1920 1 1 1 GLY CA C 5.838 4.295 6.258 1.00 . A A . 1 GLY CA 1 1 8 1921 1 1 1 GLY H1 H 5.372 4.623 4.224 1.00 . A A . 1 GLY H1 1 1 8 1922 1 1 1 GLY HA2 H 6.807 4.471 6.702 1.00 . A A . 1 GLY HA2 1 1 8 1923 1 1 1 GLY HA3 H 5.073 4.638 6.938 1.00 . A A . 1 GLY HA3 1 1 8 1924 1 1 1 GLY N N 5.744 5.045 5.026 1.00 . A A . 1 GLY N 1 1 8 1925 1 1 1 GLY O O 6.348 2.214 5.204 1.00 . A A . 1 GLY O 1 1 8 1926 1 1 2 CYS C C 3.984 0.410 5.275 1.00 . A A . 2 CYS C 1 1 8 1927 1 1 2 CYS CA C 4.494 0.771 6.668 1.00 . A A . 2 CYS CA 1 1 8 1928 1 1 2 CYS CB C 3.479 0.332 7.730 1.00 . A A . 2 CYS CB 1 1 8 1929 1 1 2 CYS H H 4.241 2.730 7.428 1.00 . A A . 2 CYS H 1 1 8 1930 1 1 2 CYS HA H 5.425 0.247 6.834 1.00 . A A . 2 CYS HA 1 1 8 1931 1 1 2 CYS HB2 H 3.721 0.815 8.664 1.00 . A A . 2 CYS HB2 1 1 8 1932 1 1 2 CYS HB3 H 2.492 0.642 7.418 1.00 . A A . 2 CYS HB3 1 1 8 1933 1 1 2 CYS N N 4.751 2.203 6.780 1.00 . A A . 2 CYS N 1 1 8 1934 1 1 2 CYS O O 4.439 -0.563 4.679 1.00 . A A . 2 CYS O 1 1 8 1935 1 1 2 CYS SG S 3.424 -1.466 8.036 1.00 . A A . 2 CYS SG 1 1 8 1936 1 1 3 CYS C C 3.503 1.058 2.314 1.00 . A A . 3 CYS C 1 1 8 1937 1 1 3 CYS CA C 2.475 0.935 3.434 1.00 . A A . 3 CYS CA 1 1 8 1938 1 1 3 CYS CB C 1.264 1.826 3.165 1.00 . A A . 3 CYS CB 1 1 8 1939 1 1 3 CYS H H 2.716 1.960 5.274 1.00 . A A . 3 CYS H 1 1 8 1940 1 1 3 CYS HA H 2.132 -0.089 3.445 1.00 . A A . 3 CYS HA 1 1 8 1941 1 1 3 CYS HB2 H 1.382 2.758 3.698 1.00 . A A . 3 CYS HB2 1 1 8 1942 1 1 3 CYS HB3 H 1.193 2.023 2.107 1.00 . A A . 3 CYS HB3 1 1 8 1943 1 1 3 CYS N N 3.041 1.195 4.757 1.00 . A A . 3 CYS N 1 1 8 1944 1 1 3 CYS O O 3.243 0.639 1.187 1.00 . A A . 3 CYS O 1 1 8 1945 1 1 3 CYS SG S -0.301 1.065 3.701 1.00 . A A . 3 CYS SG 1 1 8 1946 1 1 4 SER C C 6.248 0.280 1.325 1.00 . A A . 4 SER C 1 1 8 1947 1 1 4 SER CA C 5.740 1.686 1.633 1.00 . A A . 4 SER CA 1 1 8 1948 1 1 4 SER CB C 6.873 2.577 2.141 1.00 . A A . 4 SER CB 1 1 8 1949 1 1 4 SER H H 4.857 1.874 3.544 1.00 . A A . 4 SER H 1 1 8 1950 1 1 4 SER HA H 5.319 2.114 0.735 1.00 . A A . 4 SER HA 1 1 8 1951 1 1 4 SER HB2 H 7.315 2.130 3.019 1.00 . A A . 4 SER HB2 1 1 8 1952 1 1 4 SER HB3 H 7.624 2.677 1.370 1.00 . A A . 4 SER HB3 1 1 8 1953 1 1 4 SER HG H 7.085 4.515 2.329 1.00 . A A . 4 SER HG 1 1 8 1954 1 1 4 SER N N 4.682 1.585 2.625 1.00 . A A . 4 SER N 1 1 8 1955 1 1 4 SER O O 6.775 0.007 0.249 1.00 . A A . 4 SER O 1 1 8 1956 1 1 4 SER OG O 6.388 3.868 2.480 1.00 . A A . 4 SER OG 1 1 8 1957 1 1 5 ASN C C 5.269 -2.782 1.507 1.00 . A A . 5 ASN C 1 1 8 1958 1 1 5 ASN CA C 6.412 -2.010 2.152 1.00 . A A . 5 ASN CA 1 1 8 1959 1 1 5 ASN CB C 6.745 -2.609 3.523 1.00 . A A . 5 ASN CB 1 1 8 1960 1 1 5 ASN CG C 8.209 -2.455 3.882 1.00 . A A . 5 ASN CG 1 1 8 1961 1 1 5 ASN H H 5.575 -0.327 3.103 1.00 . A A . 5 ASN H 1 1 8 1962 1 1 5 ASN HA H 7.282 -2.065 1.515 1.00 . A A . 5 ASN HA 1 1 8 1963 1 1 5 ASN HB2 H 6.154 -2.109 4.282 1.00 . A A . 5 ASN HB2 1 1 8 1964 1 1 5 ASN HB3 H 6.502 -3.661 3.519 1.00 . A A . 5 ASN HB3 1 1 8 1965 1 1 5 ASN HD21 H 7.742 -1.339 5.456 1.00 . A A . 5 ASN HD21 1 1 8 1966 1 1 5 ASN HD22 H 9.427 -1.619 5.206 1.00 . A A . 5 ASN HD22 1 1 8 1967 1 1 5 ASN N N 6.034 -0.615 2.286 1.00 . A A . 5 ASN N 1 1 8 1968 1 1 5 ASN ND2 N 8.486 -1.732 4.957 1.00 . A A . 5 ASN ND2 1 1 8 1969 1 1 5 ASN O O 4.120 -2.666 1.933 1.00 . A A . 5 ASN O 1 1 8 1970 1 1 5 ASN OD1 O 9.084 -2.985 3.202 1.00 . A A . 5 ASN OD1 1 1 8 1971 1 1 6 PRO C C 3.654 -5.192 0.598 1.00 . A A . 6 PRO C 1 1 8 1972 1 1 6 PRO CA C 4.563 -4.338 -0.289 1.00 . A A . 6 PRO CA 1 1 8 1973 1 1 6 PRO CB C 5.413 -5.233 -1.190 1.00 . A A . 6 PRO CB 1 1 8 1974 1 1 6 PRO CD C 6.917 -3.716 -0.122 1.00 . A A . 6 PRO CD 1 1 8 1975 1 1 6 PRO CG C 6.671 -4.466 -1.402 1.00 . A A . 6 PRO CG 1 1 8 1976 1 1 6 PRO HA H 3.950 -3.697 -0.904 1.00 . A A . 6 PRO HA 1 1 8 1977 1 1 6 PRO HB2 H 5.601 -6.174 -0.694 1.00 . A A . 6 PRO HB2 1 1 8 1978 1 1 6 PRO HB3 H 4.897 -5.407 -2.123 1.00 . A A . 6 PRO HB3 1 1 8 1979 1 1 6 PRO HD2 H 7.553 -4.291 0.537 1.00 . A A . 6 PRO HD2 1 1 8 1980 1 1 6 PRO HD3 H 7.361 -2.753 -0.328 1.00 . A A . 6 PRO HD3 1 1 8 1981 1 1 6 PRO HG2 H 7.487 -5.146 -1.601 1.00 . A A . 6 PRO HG2 1 1 8 1982 1 1 6 PRO HG3 H 6.547 -3.776 -2.223 1.00 . A A . 6 PRO HG3 1 1 8 1983 1 1 6 PRO N N 5.566 -3.559 0.454 1.00 . A A . 6 PRO N 1 1 8 1984 1 1 6 PRO O O 2.446 -5.263 0.368 1.00 . A A . 6 PRO O 1 1 8 1985 1 1 7 VAL C C 2.444 -5.889 3.289 1.00 . A A . 7 VAL C 1 1 8 1986 1 1 7 VAL CA C 3.476 -6.694 2.507 1.00 . A A . 7 VAL CA 1 1 8 1987 1 1 7 VAL CB C 4.405 -7.426 3.499 1.00 . A A . 7 VAL CB 1 1 8 1988 1 1 7 VAL CG1 C 3.606 -8.342 4.416 1.00 . A A . 7 VAL CG1 1 1 8 1989 1 1 7 VAL CG2 C 5.473 -8.211 2.753 1.00 . A A . 7 VAL CG2 1 1 8 1990 1 1 7 VAL H H 5.200 -5.742 1.734 1.00 . A A . 7 VAL H 1 1 8 1991 1 1 7 VAL HA H 2.962 -7.436 1.912 1.00 . A A . 7 VAL HA 1 1 8 1992 1 1 7 VAL HB H 4.898 -6.685 4.112 1.00 . A A . 7 VAL HB 1 1 8 1993 1 1 7 VAL HG11 H 2.894 -7.756 4.978 1.00 . A A . 7 VAL HG11 1 1 8 1994 1 1 7 VAL HG12 H 4.277 -8.844 5.097 1.00 . A A . 7 VAL HG12 1 1 8 1995 1 1 7 VAL HG13 H 3.080 -9.075 3.823 1.00 . A A . 7 VAL HG13 1 1 8 1996 1 1 7 VAL HG21 H 6.331 -8.351 3.394 1.00 . A A . 7 VAL HG21 1 1 8 1997 1 1 7 VAL HG22 H 5.769 -7.666 1.869 1.00 . A A . 7 VAL HG22 1 1 8 1998 1 1 7 VAL HG23 H 5.077 -9.175 2.467 1.00 . A A . 7 VAL HG23 1 1 8 1999 1 1 7 VAL N N 4.237 -5.839 1.602 1.00 . A A . 7 VAL N 1 1 8 2000 1 1 7 VAL O O 1.269 -6.248 3.344 1.00 . A A . 7 VAL O 1 1 8 2001 1 1 8 CYS C C 1.013 -3.238 3.758 1.00 . A A . 8 CYS C 1 1 8 2002 1 1 8 CYS CA C 2.009 -3.940 4.665 1.00 . A A . 8 CYS CA 1 1 8 2003 1 1 8 CYS CB C 2.815 -2.903 5.431 1.00 . A A . 8 CYS CB 1 1 8 2004 1 1 8 CYS H H 3.840 -4.560 3.796 1.00 . A A . 8 CYS H 1 1 8 2005 1 1 8 CYS HA H 1.470 -4.561 5.366 1.00 . A A . 8 CYS HA 1 1 8 2006 1 1 8 CYS HB2 H 3.711 -3.363 5.808 1.00 . A A . 8 CYS HB2 1 1 8 2007 1 1 8 CYS HB3 H 3.085 -2.109 4.754 1.00 . A A . 8 CYS HB3 1 1 8 2008 1 1 8 CYS N N 2.892 -4.797 3.885 1.00 . A A . 8 CYS N 1 1 8 2009 1 1 8 CYS O O -0.145 -3.052 4.120 1.00 . A A . 8 CYS O 1 1 8 2010 1 1 8 CYS SG S 1.932 -2.145 6.836 1.00 . A A . 8 CYS SG 1 1 8 2011 1 1 9 HIS C C -0.562 -2.983 1.240 1.00 . A A . 9 HIS C 1 1 8 2012 1 1 9 HIS CA C 0.657 -2.149 1.602 1.00 . A A . 9 HIS CA 1 1 8 2013 1 1 9 HIS CB C 1.453 -1.862 0.329 1.00 . A A . 9 HIS CB 1 1 8 2014 1 1 9 HIS CD2 C 1.266 0.251 -1.170 1.00 . A A . 9 HIS CD2 1 1 8 2015 1 1 9 HIS CE1 C -0.804 -0.007 -1.845 1.00 . A A . 9 HIS CE1 1 1 8 2016 1 1 9 HIS CG C 0.791 -0.879 -0.596 1.00 . A A . 9 HIS CG 1 1 8 2017 1 1 9 HIS H H 2.432 -3.019 2.373 1.00 . A A . 9 HIS H 1 1 8 2018 1 1 9 HIS HA H 0.331 -1.216 2.036 1.00 . A A . 9 HIS HA 1 1 8 2019 1 1 9 HIS HB2 H 2.417 -1.468 0.601 1.00 . A A . 9 HIS HB2 1 1 8 2020 1 1 9 HIS HB3 H 1.591 -2.786 -0.213 1.00 . A A . 9 HIS HB3 1 1 8 2021 1 1 9 HIS HD1 H -1.138 -1.728 -0.785 1.00 . A A . 9 HIS HD1 1 1 8 2022 1 1 9 HIS HD2 H 2.257 0.665 -1.045 1.00 . A A . 9 HIS HD2 1 1 8 2023 1 1 9 HIS HE1 H -1.751 0.151 -2.340 1.00 . A A . 9 HIS HE1 1 1 8 2024 1 1 9 HIS HE2 H 0.340 1.541 -2.544 1.00 . A A . 9 HIS HE2 1 1 8 2025 1 1 9 HIS N N 1.485 -2.844 2.583 1.00 . A A . 9 HIS N 1 1 8 2026 1 1 9 HIS ND1 N -0.512 -1.009 -1.039 1.00 . A A . 9 HIS ND1 1 1 8 2027 1 1 9 HIS NE2 N 0.256 0.773 -1.941 1.00 . A A . 9 HIS NE2 1 1 8 2028 1 1 9 HIS O O -1.670 -2.465 1.168 1.00 . A A . 9 HIS O 1 1 8 2029 1 1 10 LEU C C -2.451 -5.271 1.731 1.00 . A A . 10 LEU C 1 1 8 2030 1 1 10 LEU CA C -1.410 -5.176 0.619 1.00 . A A . 10 LEU CA 1 1 8 2031 1 1 10 LEU CB C -0.843 -6.565 0.309 1.00 . A A . 10 LEU CB 1 1 8 2032 1 1 10 LEU CD1 C -2.490 -7.175 -1.484 1.00 . A A . 10 LEU CD1 1 1 8 2033 1 1 10 LEU CD2 C -1.213 -8.968 -0.297 1.00 . A A . 10 LEU CD2 1 1 8 2034 1 1 10 LEU CG C -1.865 -7.601 -0.164 1.00 . A A . 10 LEU CG 1 1 8 2035 1 1 10 LEU H H 0.585 -4.606 1.053 1.00 . A A . 10 LEU H 1 1 8 2036 1 1 10 LEU HA H -1.885 -4.784 -0.269 1.00 . A A . 10 LEU HA 1 1 8 2037 1 1 10 LEU HB2 H -0.089 -6.459 -0.458 1.00 . A A . 10 LEU HB2 1 1 8 2038 1 1 10 LEU HB3 H -0.369 -6.944 1.203 1.00 . A A . 10 LEU HB3 1 1 8 2039 1 1 10 LEU HD11 H -3.067 -6.274 -1.335 1.00 . A A . 10 LEU HD11 1 1 8 2040 1 1 10 LEU HD12 H -3.137 -7.960 -1.846 1.00 . A A . 10 LEU HD12 1 1 8 2041 1 1 10 LEU HD13 H -1.711 -6.987 -2.207 1.00 . A A . 10 LEU HD13 1 1 8 2042 1 1 10 LEU HD21 H -1.974 -9.713 -0.484 1.00 . A A . 10 LEU HD21 1 1 8 2043 1 1 10 LEU HD22 H -0.690 -9.209 0.617 1.00 . A A . 10 LEU HD22 1 1 8 2044 1 1 10 LEU HD23 H -0.513 -8.955 -1.120 1.00 . A A . 10 LEU HD23 1 1 8 2045 1 1 10 LEU HG H -2.656 -7.677 0.569 1.00 . A A . 10 LEU HG 1 1 8 2046 1 1 10 LEU N N -0.336 -4.265 0.993 1.00 . A A . 10 LEU N 1 1 8 2047 1 1 10 LEU O O -3.651 -5.153 1.486 1.00 . A A . 10 LEU O 1 1 8 2048 1 1 11 GLU C C -3.554 -4.268 4.402 1.00 . A A . 11 GLU C 1 1 8 2049 1 1 11 GLU CA C -2.844 -5.592 4.111 1.00 . A A . 11 GLU CA 1 1 8 2050 1 1 11 GLU CB C -2.010 -6.025 5.323 1.00 . A A . 11 GLU CB 1 1 8 2051 1 1 11 GLU CD C -3.880 -7.216 6.534 1.00 . A A . 11 GLU CD 1 1 8 2052 1 1 11 GLU CG C -2.799 -6.160 6.615 1.00 . A A . 11 GLU CG 1 1 8 2053 1 1 11 GLU H H -1.005 -5.562 3.071 1.00 . A A . 11 GLU H 1 1 8 2054 1 1 11 GLU HA H -3.583 -6.346 3.904 1.00 . A A . 11 GLU HA 1 1 8 2055 1 1 11 GLU HB2 H -1.556 -6.981 5.106 1.00 . A A . 11 GLU HB2 1 1 8 2056 1 1 11 GLU HB3 H -1.227 -5.297 5.481 1.00 . A A . 11 GLU HB3 1 1 8 2057 1 1 11 GLU HG2 H -2.120 -6.425 7.411 1.00 . A A . 11 GLU HG2 1 1 8 2058 1 1 11 GLU HG3 H -3.261 -5.210 6.840 1.00 . A A . 11 GLU HG3 1 1 8 2059 1 1 11 GLU N N -1.974 -5.479 2.948 1.00 . A A . 11 GLU N 1 1 8 2060 1 1 11 GLU O O -4.759 -4.221 4.633 1.00 . A A . 11 GLU O 1 1 8 2061 1 1 11 GLU OE1 O -3.549 -8.380 6.235 1.00 . A A . 11 GLU OE1 1 1 8 2062 1 1 11 GLU OE2 O -5.055 -6.877 6.778 1.00 . A A . 11 GLU OE2 1 1 8 2063 1 1 12 HIS C C -3.773 -1.141 3.412 1.00 . A A . 12 HIS C 1 1 8 2064 1 1 12 HIS CA C -3.348 -1.867 4.685 1.00 . A A . 12 HIS CA 1 1 8 2065 1 1 12 HIS CB C -2.338 -0.992 5.448 1.00 . A A . 12 HIS CB 1 1 8 2066 1 1 12 HIS CD2 C -1.698 -2.860 7.150 1.00 . A A . 12 HIS CD2 1 1 8 2067 1 1 12 HIS CE1 C -0.942 -1.578 8.756 1.00 . A A . 12 HIS CE1 1 1 8 2068 1 1 12 HIS CG C -1.826 -1.576 6.735 1.00 . A A . 12 HIS CG 1 1 8 2069 1 1 12 HIS H H -1.834 -3.278 4.210 1.00 . A A . 12 HIS H 1 1 8 2070 1 1 12 HIS HA H -4.221 -2.007 5.304 1.00 . A A . 12 HIS HA 1 1 8 2071 1 1 12 HIS HB2 H -1.485 -0.812 4.813 1.00 . A A . 12 HIS HB2 1 1 8 2072 1 1 12 HIS HB3 H -2.806 -0.045 5.680 1.00 . A A . 12 HIS HB3 1 1 8 2073 1 1 12 HIS HD1 H -1.288 0.181 7.769 1.00 . A A . 12 HIS HD1 1 1 8 2074 1 1 12 HIS HD2 H -1.946 -3.742 6.579 1.00 . A A . 12 HIS HD2 1 1 8 2075 1 1 12 HIS HE1 H -0.520 -1.245 9.693 1.00 . A A . 12 HIS HE1 1 1 8 2076 1 1 12 HIS HE2 H -0.874 -3.619 8.925 1.00 . A A . 12 HIS HE2 1 1 8 2077 1 1 12 HIS N N -2.794 -3.186 4.399 1.00 . A A . 12 HIS N 1 1 8 2078 1 1 12 HIS ND1 N -1.341 -0.798 7.767 1.00 . A A . 12 HIS ND1 1 1 8 2079 1 1 12 HIS NE2 N -1.150 -2.832 8.407 1.00 . A A . 12 HIS NE2 1 1 8 2080 1 1 12 HIS O O -3.654 0.081 3.328 1.00 . A A . 12 HIS O 1 1 8 2081 1 1 13 SER C C -5.836 -0.273 1.418 1.00 . A A . 13 SER C 1 1 8 2082 1 1 13 SER CA C -4.709 -1.272 1.176 1.00 . A A . 13 SER CA 1 1 8 2083 1 1 13 SER CB C -5.166 -2.342 0.184 1.00 . A A . 13 SER CB 1 1 8 2084 1 1 13 SER H H -4.350 -2.852 2.548 1.00 . A A . 13 SER H 1 1 8 2085 1 1 13 SER HA H -3.866 -0.745 0.756 1.00 . A A . 13 SER HA 1 1 8 2086 1 1 13 SER HB2 H -5.919 -2.961 0.649 1.00 . A A . 13 SER HB2 1 1 8 2087 1 1 13 SER HB3 H -5.584 -1.864 -0.689 1.00 . A A . 13 SER HB3 1 1 8 2088 1 1 13 SER HG H -4.029 -3.931 0.370 1.00 . A A . 13 SER HG 1 1 8 2089 1 1 13 SER N N -4.273 -1.880 2.430 1.00 . A A . 13 SER N 1 1 8 2090 1 1 13 SER O O -5.807 0.845 0.911 1.00 . A A . 13 SER O 1 1 8 2091 1 1 13 SER OG O -4.085 -3.164 -0.217 1.00 . A A . 13 SER OG 1 1 8 2092 1 1 14 ASN C C -7.567 1.259 3.508 1.00 . A A . 14 ASN C 1 1 8 2093 1 1 14 ASN CA C -7.960 0.179 2.509 1.00 . A A . 14 ASN CA 1 1 8 2094 1 1 14 ASN CB C -9.124 -0.643 3.066 1.00 . A A . 14 ASN CB 1 1 8 2095 1 1 14 ASN CG C -10.365 0.198 3.304 1.00 . A A . 14 ASN CG 1 1 8 2096 1 1 14 ASN H H -6.789 -1.586 2.583 1.00 . A A . 14 ASN H 1 1 8 2097 1 1 14 ASN HA H -8.271 0.653 1.593 1.00 . A A . 14 ASN HA 1 1 8 2098 1 1 14 ASN HB2 H -9.372 -1.427 2.365 1.00 . A A . 14 ASN HB2 1 1 8 2099 1 1 14 ASN HB3 H -8.826 -1.088 4.004 1.00 . A A . 14 ASN HB3 1 1 8 2100 1 1 14 ASN HD21 H -10.304 -0.193 5.250 1.00 . A A . 14 ASN HD21 1 1 8 2101 1 1 14 ASN HD22 H -11.595 0.828 4.728 1.00 . A A . 14 ASN HD22 1 1 8 2102 1 1 14 ASN N N -6.824 -0.683 2.201 1.00 . A A . 14 ASN N 1 1 8 2103 1 1 14 ASN ND2 N -10.797 0.284 4.554 1.00 . A A . 14 ASN ND2 1 1 8 2104 1 1 14 ASN O O -7.979 2.410 3.391 1.00 . A A . 14 ASN O 1 1 8 2105 1 1 14 ASN OD1 O -10.929 0.764 2.373 1.00 . A A . 14 ASN OD1 1 1 8 2106 1 1 15 LEU C C -5.539 2.952 4.980 1.00 . A A . 15 LEU C 1 1 8 2107 1 1 15 LEU CA C -6.328 1.779 5.545 1.00 . A A . 15 LEU CA 1 1 8 2108 1 1 15 LEU CB C -5.478 1.026 6.572 1.00 . A A . 15 LEU CB 1 1 8 2109 1 1 15 LEU CD1 C -5.241 -0.819 8.253 1.00 . A A . 15 LEU CD1 1 1 8 2110 1 1 15 LEU CD2 C -7.415 0.396 8.038 1.00 . A A . 15 LEU CD2 1 1 8 2111 1 1 15 LEU CG C -6.192 -0.120 7.294 1.00 . A A . 15 LEU CG 1 1 8 2112 1 1 15 LEU H H -6.495 -0.068 4.528 1.00 . A A . 15 LEU H 1 1 8 2113 1 1 15 LEU HA H -7.203 2.163 6.038 1.00 . A A . 15 LEU HA 1 1 8 2114 1 1 15 LEU HB2 H -4.614 0.621 6.065 1.00 . A A . 15 LEU HB2 1 1 8 2115 1 1 15 LEU HB3 H -5.139 1.733 7.314 1.00 . A A . 15 LEU HB3 1 1 8 2116 1 1 15 LEU HD11 H -4.291 -0.979 7.766 1.00 . A A . 15 LEU HD11 1 1 8 2117 1 1 15 LEU HD12 H -5.661 -1.770 8.545 1.00 . A A . 15 LEU HD12 1 1 8 2118 1 1 15 LEU HD13 H -5.097 -0.205 9.130 1.00 . A A . 15 LEU HD13 1 1 8 2119 1 1 15 LEU HD21 H -8.286 -0.164 7.732 1.00 . A A . 15 LEU HD21 1 1 8 2120 1 1 15 LEU HD22 H -7.560 1.441 7.811 1.00 . A A . 15 LEU HD22 1 1 8 2121 1 1 15 LEU HD23 H -7.267 0.277 9.102 1.00 . A A . 15 LEU HD23 1 1 8 2122 1 1 15 LEU HG H -6.523 -0.845 6.565 1.00 . A A . 15 LEU HG 1 1 8 2123 1 1 15 LEU N N -6.776 0.865 4.497 1.00 . A A . 15 LEU N 1 1 8 2124 1 1 15 LEU O O -5.777 4.101 5.340 1.00 . A A . 15 LEU O 1 1 8 2125 1 1 16 CYS C C -4.496 4.372 2.340 1.00 . A A . 16 CYS C 1 1 8 2126 1 1 16 CYS CA C -3.778 3.704 3.507 1.00 . A A . 16 CYS CA 1 1 8 2127 1 1 16 CYS CB C -2.427 3.140 3.069 1.00 . A A . 16 CYS CB 1 1 8 2128 1 1 16 CYS H H -4.445 1.723 3.855 1.00 . A A . 16 CYS H 1 1 8 2129 1 1 16 CYS HA H -3.606 4.450 4.269 1.00 . A A . 16 CYS HA 1 1 8 2130 1 1 16 CYS HB2 H -2.590 2.286 2.429 1.00 . A A . 16 CYS HB2 1 1 8 2131 1 1 16 CYS HB3 H -1.887 3.898 2.521 1.00 . A A . 16 CYS HB3 1 1 8 2132 1 1 16 CYS N N -4.598 2.660 4.104 1.00 . A A . 16 CYS N 1 1 8 2133 1 1 16 CYS O O -4.376 5.582 2.144 1.00 . A A . 16 CYS O 1 1 8 2134 1 1 16 CYS SG S -1.378 2.603 4.461 1.00 . A A . 16 CYS SG 1 1 8 2135 1 1 17 GLY C C -6.991 5.171 0.850 1.00 . A A . 17 GLY C 1 1 8 2136 1 1 17 GLY CA C -5.975 4.128 0.440 1.00 . A A . 17 GLY CA 1 1 8 2137 1 1 17 GLY H H -5.312 2.631 1.781 1.00 . A A . 17 GLY H 1 1 8 2138 1 1 17 GLY HA2 H -5.275 4.578 -0.237 1.00 . A A . 17 GLY HA2 1 1 8 2139 1 1 17 GLY HA3 H -6.485 3.322 -0.066 1.00 . A A . 17 GLY HA3 1 1 8 2140 1 1 17 GLY N N -5.247 3.587 1.575 1.00 . A A . 17 GLY N 1 1 8 2141 1 1 17 GLY O O -7.141 6.201 0.196 1.00 . A A . 17 GLY O 1 1 8 2142 1 1 18 ALA C C -8.264 6.350 3.822 1.00 . A A . 18 ALA C 1 1 8 2143 1 1 18 ALA CA C -8.684 5.809 2.461 1.00 . A A . 18 ALA CA 1 1 8 2144 1 1 18 ALA CB C -10.033 5.108 2.553 1.00 . A A . 18 ALA CB 1 1 8 2145 1 1 18 ALA H H -7.498 4.062 2.414 1.00 . A A . 18 ALA H 1 1 8 2146 1 1 18 ALA HA H -8.778 6.634 1.769 1.00 . A A . 18 ALA HA 1 1 8 2147 1 1 18 ALA HB1 H -9.878 4.046 2.672 1.00 . A A . 18 ALA HB1 1 1 8 2148 1 1 18 ALA HB2 H -10.596 5.291 1.649 1.00 . A A . 18 ALA HB2 1 1 8 2149 1 1 18 ALA HB3 H -10.581 5.490 3.402 1.00 . A A . 18 ALA HB3 1 1 8 2150 1 1 18 ALA N N -7.678 4.900 1.939 1.00 . A A . 18 ALA N 1 1 8 2151 1 1 18 ALA O O -9.047 6.352 4.773 1.00 . A A . 18 ALA O 1 1 8 2152 1 1 19 GLY C C -5.192 8.043 5.028 1.00 . A A . 19 GLY C 1 1 8 2153 1 1 19 GLY CA C -6.525 7.336 5.169 1.00 . A A . 19 GLY CA 1 1 8 2154 1 1 19 GLY H H -6.437 6.778 3.127 1.00 . A A . 19 GLY H 1 1 8 2155 1 1 19 GLY HA2 H -7.249 8.035 5.560 1.00 . A A . 19 GLY HA2 1 1 8 2156 1 1 19 GLY HA3 H -6.415 6.521 5.869 1.00 . A A . 19 GLY HA3 1 1 8 2157 1 1 19 GLY N N -7.020 6.807 3.914 1.00 . A A . 19 GLY N 1 1 8 2158 1 1 19 GLY O O -4.985 9.110 5.605 1.00 . A A . 19 GLY O 1 1 8 2159 1 1 20 GLY C C -1.853 7.122 4.471 1.00 . A A . 20 GLY C 1 1 8 2160 1 1 20 GLY CA C -2.976 8.057 4.089 1.00 . A A . 20 GLY CA 1 1 8 2161 1 1 20 GLY H H -4.487 6.598 3.833 1.00 . A A . 20 GLY H 1 1 8 2162 1 1 20 GLY HA2 H -2.857 8.339 3.056 1.00 . A A . 20 GLY HA2 1 1 8 2163 1 1 20 GLY HA3 H -2.916 8.943 4.702 1.00 . A A . 20 GLY HA3 1 1 8 2164 1 1 20 GLY N N -4.280 7.453 4.270 1.00 . A A . 20 GLY N 1 1 8 2165 1 1 20 GLY O O -1.692 6.059 3.876 1.00 . A A . 20 GLY O 1 1 8 2166 1 1 21 ALA C C 1.110 6.532 4.896 1.00 . A A . 21 ALA C 1 1 8 2167 1 1 21 ALA CA C 0.054 6.759 5.976 1.00 . A A . 21 ALA CA 1 1 8 2168 1 1 21 ALA CB C -0.415 5.432 6.563 1.00 . A A . 21 ALA CB 1 1 8 2169 1 1 21 ALA H H -1.283 8.397 5.883 1.00 . A A . 21 ALA H 1 1 8 2170 1 1 21 ALA HA H 0.505 7.331 6.775 1.00 . A A . 21 ALA HA 1 1 8 2171 1 1 21 ALA HB1 H -1.165 5.618 7.317 1.00 . A A . 21 ALA HB1 1 1 8 2172 1 1 21 ALA HB2 H 0.424 4.918 7.009 1.00 . A A . 21 ALA HB2 1 1 8 2173 1 1 21 ALA HB3 H -0.837 4.821 5.779 1.00 . A A . 21 ALA HB3 1 1 8 2174 1 1 21 ALA N N -1.081 7.535 5.469 1.00 . A A . 21 ALA N 1 1 8 2175 1 1 21 ALA O O 1.743 5.473 4.832 1.00 . A A . 21 ALA O 1 1 8 2176 1 1 22 ALA C C 3.694 7.675 3.578 1.00 . A A . 22 ALA C 1 1 8 2177 1 1 22 ALA CA C 2.300 7.477 3.001 1.00 . A A . 22 ALA CA 1 1 8 2178 1 1 22 ALA CB C 2.007 8.521 1.934 1.00 . A A . 22 ALA CB 1 1 8 2179 1 1 22 ALA H H 0.790 8.363 4.178 1.00 . A A . 22 ALA H 1 1 8 2180 1 1 22 ALA HA H 2.241 6.498 2.547 1.00 . A A . 22 ALA HA 1 1 8 2181 1 1 22 ALA HB1 H 1.779 8.027 1.000 1.00 . A A . 22 ALA HB1 1 1 8 2182 1 1 22 ALA HB2 H 2.872 9.155 1.804 1.00 . A A . 22 ALA HB2 1 1 8 2183 1 1 22 ALA HB3 H 1.163 9.121 2.240 1.00 . A A . 22 ALA HB3 1 1 8 2184 1 1 22 ALA N N 1.309 7.544 4.063 1.00 . A A . 22 ALA N 1 1 8 2185 1 1 22 ALA O O 3.896 8.532 4.437 1.00 . A A . 22 ALA O 1 1 8 2186 1 1 23 GLY C C 6.158 6.302 4.963 1.00 . A A . 23 GLY C 1 1 8 2187 1 1 23 GLY CA C 6.002 6.985 3.620 1.00 . A A . 23 GLY CA 1 1 8 2188 1 1 23 GLY H H 4.428 6.205 2.441 1.00 . A A . 23 GLY H 1 1 8 2189 1 1 23 GLY HA2 H 6.678 6.527 2.912 1.00 . A A . 23 GLY HA2 1 1 8 2190 1 1 23 GLY HA3 H 6.256 8.029 3.725 1.00 . A A . 23 GLY HA3 1 1 8 2191 1 1 23 GLY N N 4.647 6.877 3.117 1.00 . A A . 23 GLY N 1 1 8 2192 1 1 23 GLY O O 6.638 6.899 5.923 1.00 . A A . 23 GLY O 1 1 9 2193 1 1 1 GLY C C 5.419 2.999 6.465 1.00 . A A . 1 GLY C 1 1 9 2194 1 1 1 GLY CA C 5.492 4.450 6.899 1.00 . A A . 1 GLY CA 1 1 9 2195 1 1 1 GLY H1 H 6.552 5.913 5.804 1.00 . A A . 1 GLY H1 1 1 9 2196 1 1 1 GLY HA2 H 6.286 4.555 7.623 1.00 . A A . 1 GLY HA2 1 1 9 2197 1 1 1 GLY HA3 H 4.557 4.720 7.369 1.00 . A A . 1 GLY HA3 1 1 9 2198 1 1 1 GLY N N 5.741 5.364 5.801 1.00 . A A . 1 GLY N 1 1 9 2199 1 1 1 GLY O O 6.241 2.529 5.680 1.00 . A A . 1 GLY O 1 1 9 2200 1 1 2 CYS C C 3.790 0.706 5.224 1.00 . A A . 2 CYS C 1 1 9 2201 1 1 2 CYS CA C 4.229 0.880 6.673 1.00 . A A . 2 CYS CA 1 1 9 2202 1 1 2 CYS CB C 3.178 0.285 7.609 1.00 . A A . 2 CYS CB 1 1 9 2203 1 1 2 CYS H H 3.812 2.728 7.609 1.00 . A A . 2 CYS H 1 1 9 2204 1 1 2 CYS HA H 5.167 0.363 6.818 1.00 . A A . 2 CYS HA 1 1 9 2205 1 1 2 CYS HB2 H 3.238 0.783 8.564 1.00 . A A . 2 CYS HB2 1 1 9 2206 1 1 2 CYS HB3 H 2.200 0.453 7.182 1.00 . A A . 2 CYS HB3 1 1 9 2207 1 1 2 CYS N N 4.428 2.290 6.987 1.00 . A A . 2 CYS N 1 1 9 2208 1 1 2 CYS O O 4.084 -0.307 4.596 1.00 . A A . 2 CYS O 1 1 9 2209 1 1 2 CYS SG S 3.358 -1.506 7.905 1.00 . A A . 2 CYS SG 1 1 9 2210 1 1 3 CYS C C 3.710 1.513 2.319 1.00 . A A . 3 CYS C 1 1 9 2211 1 1 3 CYS CA C 2.582 1.682 3.335 1.00 . A A . 3 CYS CA 1 1 9 2212 1 1 3 CYS CB C 1.793 2.956 3.034 1.00 . A A . 3 CYS CB 1 1 9 2213 1 1 3 CYS H H 2.879 2.480 5.272 1.00 . A A . 3 CYS H 1 1 9 2214 1 1 3 CYS HA H 1.919 0.836 3.246 1.00 . A A . 3 CYS HA 1 1 9 2215 1 1 3 CYS HB2 H 2.434 3.812 3.188 1.00 . A A . 3 CYS HB2 1 1 9 2216 1 1 3 CYS HB3 H 1.470 2.935 2.004 1.00 . A A . 3 CYS HB3 1 1 9 2217 1 1 3 CYS N N 3.080 1.704 4.709 1.00 . A A . 3 CYS N 1 1 9 2218 1 1 3 CYS O O 3.479 1.034 1.208 1.00 . A A . 3 CYS O 1 1 9 2219 1 1 3 CYS SG S 0.315 3.178 4.076 1.00 . A A . 3 CYS SG 1 1 9 2220 1 1 4 SER C C 6.398 0.300 1.574 1.00 . A A . 4 SER C 1 1 9 2221 1 1 4 SER CA C 6.086 1.771 1.834 1.00 . A A . 4 SER CA 1 1 9 2222 1 1 4 SER CB C 7.298 2.450 2.469 1.00 . A A . 4 SER CB 1 1 9 2223 1 1 4 SER H H 5.045 2.267 3.606 1.00 . A A . 4 SER H 1 1 9 2224 1 1 4 SER HA H 5.858 2.252 0.897 1.00 . A A . 4 SER HA 1 1 9 2225 1 1 4 SER HB2 H 7.596 1.901 3.350 1.00 . A A . 4 SER HB2 1 1 9 2226 1 1 4 SER HB3 H 8.113 2.467 1.760 1.00 . A A . 4 SER HB3 1 1 9 2227 1 1 4 SER HG H 7.794 4.313 2.809 1.00 . A A . 4 SER HG 1 1 9 2228 1 1 4 SER N N 4.924 1.897 2.705 1.00 . A A . 4 SER N 1 1 9 2229 1 1 4 SER O O 7.009 -0.054 0.568 1.00 . A A . 4 SER O 1 1 9 2230 1 1 4 SER OG O 6.993 3.782 2.844 1.00 . A A . 4 SER OG 1 1 9 2231 1 1 5 ASN C C 5.038 -2.625 1.604 1.00 . A A . 5 ASN C 1 1 9 2232 1 1 5 ASN CA C 6.175 -1.982 2.381 1.00 . A A . 5 ASN CA 1 1 9 2233 1 1 5 ASN CB C 6.285 -2.616 3.771 1.00 . A A . 5 ASN CB 1 1 9 2234 1 1 5 ASN CG C 7.647 -2.412 4.401 1.00 . A A . 5 ASN CG 1 1 9 2235 1 1 5 ASN H H 5.466 -0.199 3.264 1.00 . A A . 5 ASN H 1 1 9 2236 1 1 5 ASN HA H 7.099 -2.140 1.846 1.00 . A A . 5 ASN HA 1 1 9 2237 1 1 5 ASN HB2 H 5.542 -2.171 4.421 1.00 . A A . 5 ASN HB2 1 1 9 2238 1 1 5 ASN HB3 H 6.099 -3.678 3.691 1.00 . A A . 5 ASN HB3 1 1 9 2239 1 1 5 ASN HD21 H 6.839 -1.389 5.898 1.00 . A A . 5 ASN HD21 1 1 9 2240 1 1 5 ASN HD22 H 8.554 -1.582 5.958 1.00 . A A . 5 ASN HD22 1 1 9 2241 1 1 5 ASN N N 5.960 -0.549 2.492 1.00 . A A . 5 ASN N 1 1 9 2242 1 1 5 ASN ND2 N 7.682 -1.724 5.533 1.00 . A A . 5 ASN ND2 1 1 9 2243 1 1 5 ASN O O 3.869 -2.458 1.952 1.00 . A A . 5 ASN O 1 1 9 2244 1 1 5 ASN OD1 O 8.659 -2.871 3.878 1.00 . A A . 5 ASN OD1 1 1 9 2245 1 1 6 PRO C C 3.485 -4.993 0.494 1.00 . A A . 6 PRO C 1 1 9 2246 1 1 6 PRO CA C 4.369 -4.039 -0.303 1.00 . A A . 6 PRO CA 1 1 9 2247 1 1 6 PRO CB C 5.210 -4.814 -1.329 1.00 . A A . 6 PRO CB 1 1 9 2248 1 1 6 PRO CD C 6.736 -3.608 0.060 1.00 . A A . 6 PRO CD 1 1 9 2249 1 1 6 PRO CG C 6.589 -4.853 -0.764 1.00 . A A . 6 PRO CG 1 1 9 2250 1 1 6 PRO HA H 3.745 -3.322 -0.817 1.00 . A A . 6 PRO HA 1 1 9 2251 1 1 6 PRO HB2 H 4.805 -5.808 -1.448 1.00 . A A . 6 PRO HB2 1 1 9 2252 1 1 6 PRO HB3 H 5.187 -4.297 -2.277 1.00 . A A . 6 PRO HB3 1 1 9 2253 1 1 6 PRO HD2 H 7.410 -3.778 0.887 1.00 . A A . 6 PRO HD2 1 1 9 2254 1 1 6 PRO HD3 H 7.080 -2.787 -0.551 1.00 . A A . 6 PRO HD3 1 1 9 2255 1 1 6 PRO HG2 H 6.706 -5.729 -0.142 1.00 . A A . 6 PRO HG2 1 1 9 2256 1 1 6 PRO HG3 H 7.315 -4.860 -1.564 1.00 . A A . 6 PRO HG3 1 1 9 2257 1 1 6 PRO N N 5.365 -3.369 0.538 1.00 . A A . 6 PRO N 1 1 9 2258 1 1 6 PRO O O 2.272 -5.040 0.295 1.00 . A A . 6 PRO O 1 1 9 2259 1 1 7 VAL C C 2.369 -5.964 3.122 1.00 . A A . 7 VAL C 1 1 9 2260 1 1 7 VAL CA C 3.376 -6.691 2.238 1.00 . A A . 7 VAL CA 1 1 9 2261 1 1 7 VAL CB C 4.338 -7.508 3.126 1.00 . A A . 7 VAL CB 1 1 9 2262 1 1 7 VAL CG1 C 3.575 -8.534 3.954 1.00 . A A . 7 VAL CG1 1 1 9 2263 1 1 7 VAL CG2 C 5.403 -8.187 2.278 1.00 . A A . 7 VAL CG2 1 1 9 2264 1 1 7 VAL H H 5.068 -5.648 1.517 1.00 . A A . 7 VAL H 1 1 9 2265 1 1 7 VAL HA H 2.846 -7.373 1.589 1.00 . A A . 7 VAL HA 1 1 9 2266 1 1 7 VAL HB H 4.832 -6.829 3.805 1.00 . A A . 7 VAL HB 1 1 9 2267 1 1 7 VAL HG11 H 2.677 -8.082 4.349 1.00 . A A . 7 VAL HG11 1 1 9 2268 1 1 7 VAL HG12 H 4.197 -8.871 4.769 1.00 . A A . 7 VAL HG12 1 1 9 2269 1 1 7 VAL HG13 H 3.311 -9.375 3.331 1.00 . A A . 7 VAL HG13 1 1 9 2270 1 1 7 VAL HG21 H 6.270 -8.395 2.887 1.00 . A A . 7 VAL HG21 1 1 9 2271 1 1 7 VAL HG22 H 5.683 -7.537 1.463 1.00 . A A . 7 VAL HG22 1 1 9 2272 1 1 7 VAL HG23 H 5.013 -9.113 1.881 1.00 . A A . 7 VAL HG23 1 1 9 2273 1 1 7 VAL N N 4.101 -5.742 1.402 1.00 . A A . 7 VAL N 1 1 9 2274 1 1 7 VAL O O 1.212 -6.369 3.231 1.00 . A A . 7 VAL O 1 1 9 2275 1 1 8 CYS C C 0.867 -3.415 3.786 1.00 . A A . 8 CYS C 1 1 9 2276 1 1 8 CYS CA C 1.949 -4.093 4.605 1.00 . A A . 8 CYS CA 1 1 9 2277 1 1 8 CYS CB C 2.746 -3.036 5.357 1.00 . A A . 8 CYS CB 1 1 9 2278 1 1 8 CYS H H 3.742 -4.599 3.603 1.00 . A A . 8 CYS H 1 1 9 2279 1 1 8 CYS HA H 1.486 -4.762 5.314 1.00 . A A . 8 CYS HA 1 1 9 2280 1 1 8 CYS HB2 H 3.672 -3.465 5.696 1.00 . A A . 8 CYS HB2 1 1 9 2281 1 1 8 CYS HB3 H 2.958 -2.219 4.687 1.00 . A A . 8 CYS HB3 1 1 9 2282 1 1 8 CYS N N 2.814 -4.880 3.739 1.00 . A A . 8 CYS N 1 1 9 2283 1 1 8 CYS O O -0.284 -3.353 4.199 1.00 . A A . 8 CYS O 1 1 9 2284 1 1 8 CYS SG S 1.877 -2.346 6.804 1.00 . A A . 8 CYS SG 1 1 9 2285 1 1 9 HIS C C -0.794 -3.140 1.302 1.00 . A A . 9 HIS C 1 1 9 2286 1 1 9 HIS CA C 0.325 -2.209 1.741 1.00 . A A . 9 HIS CA 1 1 9 2287 1 1 9 HIS CB C 1.046 -1.673 0.505 1.00 . A A . 9 HIS CB 1 1 9 2288 1 1 9 HIS CD2 C 0.541 0.683 -0.468 1.00 . A A . 9 HIS CD2 1 1 9 2289 1 1 9 HIS CE1 C -1.416 0.254 -1.353 1.00 . A A . 9 HIS CE1 1 1 9 2290 1 1 9 HIS CG C 0.265 -0.622 -0.230 1.00 . A A . 9 HIS CG 1 1 9 2291 1 1 9 HIS H H 2.202 -2.975 2.369 1.00 . A A . 9 HIS H 1 1 9 2292 1 1 9 HIS HA H -0.102 -1.381 2.285 1.00 . A A . 9 HIS HA 1 1 9 2293 1 1 9 HIS HB2 H 1.989 -1.248 0.804 1.00 . A A . 9 HIS HB2 1 1 9 2294 1 1 9 HIS HB3 H 1.227 -2.490 -0.178 1.00 . A A . 9 HIS HB3 1 1 9 2295 1 1 9 HIS HD1 H -1.457 -1.710 -0.783 1.00 . A A . 9 HIS HD1 1 1 9 2296 1 1 9 HIS HD2 H 1.432 1.214 -0.163 1.00 . A A . 9 HIS HD2 1 1 9 2297 1 1 9 HIS HE1 H -2.355 0.366 -1.872 1.00 . A A . 9 HIS HE1 1 1 9 2298 1 1 9 HIS HE2 H -0.712 2.169 -1.253 1.00 . A A . 9 HIS HE2 1 1 9 2299 1 1 9 HIS N N 1.255 -2.898 2.628 1.00 . A A . 9 HIS N 1 1 9 2300 1 1 9 HIS ND1 N -0.970 -0.856 -0.799 1.00 . A A . 9 HIS ND1 1 1 9 2301 1 1 9 HIS NE2 N -0.520 1.208 -1.166 1.00 . A A . 9 HIS NE2 1 1 9 2302 1 1 9 HIS O O -1.947 -2.735 1.234 1.00 . A A . 9 HIS O 1 1 9 2303 1 1 10 LEU C C -2.465 -5.597 1.634 1.00 . A A . 10 LEU C 1 1 9 2304 1 1 10 LEU CA C -1.411 -5.373 0.554 1.00 . A A . 10 LEU CA 1 1 9 2305 1 1 10 LEU CB C -0.708 -6.693 0.222 1.00 . A A . 10 LEU CB 1 1 9 2306 1 1 10 LEU CD1 C -2.240 -7.422 -1.628 1.00 . A A . 10 LEU CD1 1 1 9 2307 1 1 10 LEU CD2 C -0.843 -9.110 -0.421 1.00 . A A . 10 LEU CD2 1 1 9 2308 1 1 10 LEU CG C -1.620 -7.809 -0.294 1.00 . A A . 10 LEU CG 1 1 9 2309 1 1 10 LEU H H 0.513 -4.629 1.057 1.00 . A A . 10 LEU H 1 1 9 2310 1 1 10 LEU HA H -1.894 -4.997 -0.335 1.00 . A A . 10 LEU HA 1 1 9 2311 1 1 10 LEU HB2 H 0.045 -6.496 -0.528 1.00 . A A . 10 LEU HB2 1 1 9 2312 1 1 10 LEU HB3 H -0.216 -7.047 1.116 1.00 . A A . 10 LEU HB3 1 1 9 2313 1 1 10 LEU HD11 H -3.216 -7.876 -1.717 1.00 . A A . 10 LEU HD11 1 1 9 2314 1 1 10 LEU HD12 H -1.607 -7.766 -2.434 1.00 . A A . 10 LEU HD12 1 1 9 2315 1 1 10 LEU HD13 H -2.337 -6.348 -1.681 1.00 . A A . 10 LEU HD13 1 1 9 2316 1 1 10 LEU HD21 H -0.795 -9.597 0.541 1.00 . A A . 10 LEU HD21 1 1 9 2317 1 1 10 LEU HD22 H 0.157 -8.900 -0.769 1.00 . A A . 10 LEU HD22 1 1 9 2318 1 1 10 LEU HD23 H -1.341 -9.760 -1.127 1.00 . A A . 10 LEU HD23 1 1 9 2319 1 1 10 LEU HG H -2.422 -7.965 0.413 1.00 . A A . 10 LEU HG 1 1 9 2320 1 1 10 LEU N N -0.436 -4.378 0.994 1.00 . A A . 10 LEU N 1 1 9 2321 1 1 10 LEU O O -3.666 -5.549 1.368 1.00 . A A . 10 LEU O 1 1 9 2322 1 1 11 GLU C C -3.630 -4.760 4.348 1.00 . A A . 11 GLU C 1 1 9 2323 1 1 11 GLU CA C -2.889 -6.047 3.988 1.00 . A A . 11 GLU CA 1 1 9 2324 1 1 11 GLU CB C -2.069 -6.545 5.184 1.00 . A A . 11 GLU CB 1 1 9 2325 1 1 11 GLU CD C -3.920 -7.723 6.461 1.00 . A A . 11 GLU CD 1 1 9 2326 1 1 11 GLU CG C -2.849 -6.649 6.486 1.00 . A A . 11 GLU CG 1 1 9 2327 1 1 11 GLU H H -1.035 -5.845 2.998 1.00 . A A . 11 GLU H 1 1 9 2328 1 1 11 GLU HA H -3.609 -6.799 3.711 1.00 . A A . 11 GLU HA 1 1 9 2329 1 1 11 GLU HB2 H -1.676 -7.524 4.949 1.00 . A A . 11 GLU HB2 1 1 9 2330 1 1 11 GLU HB3 H -1.242 -5.868 5.340 1.00 . A A . 11 GLU HB3 1 1 9 2331 1 1 11 GLU HG2 H -2.159 -6.876 7.284 1.00 . A A . 11 GLU HG2 1 1 9 2332 1 1 11 GLU HG3 H -3.320 -5.696 6.682 1.00 . A A . 11 GLU HG3 1 1 9 2333 1 1 11 GLU N N -2.002 -5.827 2.853 1.00 . A A . 11 GLU N 1 1 9 2334 1 1 11 GLU O O -4.842 -4.746 4.555 1.00 . A A . 11 GLU O 1 1 9 2335 1 1 11 GLU OE1 O -4.027 -8.438 5.445 1.00 . A A . 11 GLU OE1 1 1 9 2336 1 1 11 GLU OE2 O -4.645 -7.849 7.468 1.00 . A A . 11 GLU OE2 1 1 9 2337 1 1 12 HIS C C -3.873 -1.618 3.503 1.00 . A A . 12 HIS C 1 1 9 2338 1 1 12 HIS CA C -3.456 -2.373 4.760 1.00 . A A . 12 HIS CA 1 1 9 2339 1 1 12 HIS CB C -2.462 -1.509 5.562 1.00 . A A . 12 HIS CB 1 1 9 2340 1 1 12 HIS CD2 C -1.706 -3.444 7.137 1.00 . A A . 12 HIS CD2 1 1 9 2341 1 1 12 HIS CE1 C -1.034 -2.230 8.831 1.00 . A A . 12 HIS CE1 1 1 9 2342 1 1 12 HIS CG C -1.918 -2.145 6.812 1.00 . A A . 12 HIS CG 1 1 9 2343 1 1 12 HIS H H -1.923 -3.739 4.237 1.00 . A A . 12 HIS H 1 1 9 2344 1 1 12 HIS HA H -4.333 -2.548 5.365 1.00 . A A . 12 HIS HA 1 1 9 2345 1 1 12 HIS HB2 H -1.623 -1.271 4.928 1.00 . A A . 12 HIS HB2 1 1 9 2346 1 1 12 HIS HB3 H -2.955 -0.590 5.848 1.00 . A A . 12 HIS HB3 1 1 9 2347 1 1 12 HIS HD1 H -1.496 -0.433 7.968 1.00 . A A . 12 HIS HD1 1 1 9 2348 1 1 12 HIS HD2 H -1.899 -4.299 6.507 1.00 . A A . 12 HIS HD2 1 1 9 2349 1 1 12 HIS HE1 H -0.630 -1.935 9.789 1.00 . A A . 12 HIS HE1 1 1 9 2350 1 1 12 HIS HE2 H -1.017 -4.275 8.936 1.00 . A A . 12 HIS HE2 1 1 9 2351 1 1 12 HIS N N -2.886 -3.668 4.420 1.00 . A A . 12 HIS N 1 1 9 2352 1 1 12 HIS ND1 N -1.483 -1.411 7.897 1.00 . A A . 12 HIS ND1 1 1 9 2353 1 1 12 HIS NE2 N -1.159 -3.468 8.395 1.00 . A A . 12 HIS NE2 1 1 9 2354 1 1 12 HIS O O -3.615 -0.424 3.385 1.00 . A A . 12 HIS O 1 1 9 2355 1 1 13 SER C C -5.937 -0.560 1.580 1.00 . A A . 13 SER C 1 1 9 2356 1 1 13 SER CA C -4.948 -1.692 1.318 1.00 . A A . 13 SER CA 1 1 9 2357 1 1 13 SER CB C -5.569 -2.735 0.385 1.00 . A A . 13 SER CB 1 1 9 2358 1 1 13 SER H H -4.682 -3.269 2.713 1.00 . A A . 13 SER H 1 1 9 2359 1 1 13 SER HA H -4.073 -1.277 0.839 1.00 . A A . 13 SER HA 1 1 9 2360 1 1 13 SER HB2 H -6.290 -3.322 0.933 1.00 . A A . 13 SER HB2 1 1 9 2361 1 1 13 SER HB3 H -6.062 -2.233 -0.435 1.00 . A A . 13 SER HB3 1 1 9 2362 1 1 13 SER HG H -4.450 -4.351 0.462 1.00 . A A . 13 SER HG 1 1 9 2363 1 1 13 SER N N -4.509 -2.313 2.567 1.00 . A A . 13 SER N 1 1 9 2364 1 1 13 SER O O -5.943 0.446 0.873 1.00 . A A . 13 SER O 1 1 9 2365 1 1 13 SER OG O -4.578 -3.601 -0.139 1.00 . A A . 13 SER OG 1 1 9 2366 1 1 14 ASN C C -7.082 1.535 3.508 1.00 . A A . 14 ASN C 1 1 9 2367 1 1 14 ASN CA C -7.757 0.279 2.963 1.00 . A A . 14 ASN CA 1 1 9 2368 1 1 14 ASN CB C -8.739 -0.301 3.992 1.00 . A A . 14 ASN CB 1 1 9 2369 1 1 14 ASN CG C -9.753 0.715 4.499 1.00 . A A . 14 ASN CG 1 1 9 2370 1 1 14 ASN H H -6.708 -1.553 3.128 1.00 . A A . 14 ASN H 1 1 9 2371 1 1 14 ASN HA H -8.299 0.540 2.071 1.00 . A A . 14 ASN HA 1 1 9 2372 1 1 14 ASN HB2 H -9.280 -1.118 3.540 1.00 . A A . 14 ASN HB2 1 1 9 2373 1 1 14 ASN HB3 H -8.180 -0.674 4.838 1.00 . A A . 14 ASN HB3 1 1 9 2374 1 1 14 ASN HD21 H -11.195 -0.151 3.445 1.00 . A A . 14 ASN HD21 1 1 9 2375 1 1 14 ASN HD22 H -11.664 1.227 4.373 1.00 . A A . 14 ASN HD22 1 1 9 2376 1 1 14 ASN N N -6.767 -0.730 2.601 1.00 . A A . 14 ASN N 1 1 9 2377 1 1 14 ASN ND2 N -10.996 0.581 4.061 1.00 . A A . 14 ASN ND2 1 1 9 2378 1 1 14 ASN O O -7.403 2.650 3.104 1.00 . A A . 14 ASN O 1 1 9 2379 1 1 14 ASN OD1 O -9.425 1.605 5.278 1.00 . A A . 14 ASN OD1 1 1 9 2380 1 1 15 LEU C C -4.490 3.118 4.033 1.00 . A A . 15 LEU C 1 1 9 2381 1 1 15 LEU CA C -5.421 2.448 5.036 1.00 . A A . 15 LEU CA 1 1 9 2382 1 1 15 LEU CB C -4.617 1.955 6.243 1.00 . A A . 15 LEU CB 1 1 9 2383 1 1 15 LEU CD1 C -4.540 0.829 8.481 1.00 . A A . 15 LEU CD1 1 1 9 2384 1 1 15 LEU CD2 C -6.456 2.329 7.907 1.00 . A A . 15 LEU CD2 1 1 9 2385 1 1 15 LEU CG C -5.447 1.327 7.366 1.00 . A A . 15 LEU CG 1 1 9 2386 1 1 15 LEU H H -5.941 0.426 4.696 1.00 . A A . 15 LEU H 1 1 9 2387 1 1 15 LEU HA H -6.146 3.171 5.370 1.00 . A A . 15 LEU HA 1 1 9 2388 1 1 15 LEU HB2 H -3.903 1.222 5.897 1.00 . A A . 15 LEU HB2 1 1 9 2389 1 1 15 LEU HB3 H -4.075 2.794 6.653 1.00 . A A . 15 LEU HB3 1 1 9 2390 1 1 15 LEU HD11 H -5.141 0.509 9.319 1.00 . A A . 15 LEU HD11 1 1 9 2391 1 1 15 LEU HD12 H -3.882 1.627 8.794 1.00 . A A . 15 LEU HD12 1 1 9 2392 1 1 15 LEU HD13 H -3.951 -0.003 8.123 1.00 . A A . 15 LEU HD13 1 1 9 2393 1 1 15 LEU HD21 H -7.062 2.703 7.096 1.00 . A A . 15 LEU HD21 1 1 9 2394 1 1 15 LEU HD22 H -5.934 3.151 8.374 1.00 . A A . 15 LEU HD22 1 1 9 2395 1 1 15 LEU HD23 H -7.089 1.845 8.636 1.00 . A A . 15 LEU HD23 1 1 9 2396 1 1 15 LEU HG H -5.990 0.481 6.974 1.00 . A A . 15 LEU HG 1 1 9 2397 1 1 15 LEU N N -6.147 1.338 4.425 1.00 . A A . 15 LEU N 1 1 9 2398 1 1 15 LEU O O -4.435 4.341 3.933 1.00 . A A . 15 LEU O 1 1 9 2399 1 1 16 CYS C C -3.526 2.956 0.941 1.00 . A A . 16 CYS C 1 1 9 2400 1 1 16 CYS CA C -2.833 2.803 2.293 1.00 . A A . 16 CYS CA 1 1 9 2401 1 1 16 CYS CB C -1.644 1.855 2.162 1.00 . A A . 16 CYS CB 1 1 9 2402 1 1 16 CYS H H -3.858 1.336 3.418 1.00 . A A . 16 CYS H 1 1 9 2403 1 1 16 CYS HA H -2.480 3.771 2.618 1.00 . A A . 16 CYS HA 1 1 9 2404 1 1 16 CYS HB2 H -1.992 0.917 1.762 1.00 . A A . 16 CYS HB2 1 1 9 2405 1 1 16 CYS HB3 H -0.925 2.285 1.480 1.00 . A A . 16 CYS HB3 1 1 9 2406 1 1 16 CYS N N -3.763 2.304 3.292 1.00 . A A . 16 CYS N 1 1 9 2407 1 1 16 CYS O O -2.946 2.669 -0.109 1.00 . A A . 16 CYS O 1 1 9 2408 1 1 16 CYS SG S -0.781 1.503 3.732 1.00 . A A . 16 CYS SG 1 1 9 2409 1 1 17 GLY C C -5.988 5.020 -0.402 1.00 . A A . 17 GLY C 1 1 9 2410 1 1 17 GLY CA C -5.529 3.590 -0.236 1.00 . A A . 17 GLY CA 1 1 9 2411 1 1 17 GLY H H -5.178 3.614 1.845 1.00 . A A . 17 GLY H 1 1 9 2412 1 1 17 GLY HA2 H -4.912 3.318 -1.081 1.00 . A A . 17 GLY HA2 1 1 9 2413 1 1 17 GLY HA3 H -6.394 2.944 -0.211 1.00 . A A . 17 GLY HA3 1 1 9 2414 1 1 17 GLY N N -4.769 3.406 0.977 1.00 . A A . 17 GLY N 1 1 9 2415 1 1 17 GLY O O -6.523 5.611 0.532 1.00 . A A . 17 GLY O 1 1 9 2416 1 1 18 ALA C C -5.533 7.950 -0.941 1.00 . A A . 18 ALA C 1 1 9 2417 1 1 18 ALA CA C -6.152 6.948 -1.917 1.00 . A A . 18 ALA CA 1 1 9 2418 1 1 18 ALA CB C -7.670 7.088 -1.942 1.00 . A A . 18 ALA CB 1 1 9 2419 1 1 18 ALA H H -5.331 5.033 -2.286 1.00 . A A . 18 ALA H 1 1 9 2420 1 1 18 ALA HA H -5.784 7.166 -2.910 1.00 . A A . 18 ALA HA 1 1 9 2421 1 1 18 ALA HB1 H -8.010 7.142 -2.965 1.00 . A A . 18 ALA HB1 1 1 9 2422 1 1 18 ALA HB2 H -7.957 7.988 -1.419 1.00 . A A . 18 ALA HB2 1 1 9 2423 1 1 18 ALA HB3 H -8.117 6.232 -1.459 1.00 . A A . 18 ALA HB3 1 1 9 2424 1 1 18 ALA N N -5.768 5.572 -1.596 1.00 . A A . 18 ALA N 1 1 9 2425 1 1 18 ALA O O -6.131 8.977 -0.625 1.00 . A A . 18 ALA O 1 1 9 2426 1 1 19 GLY C C -2.344 7.946 0.939 1.00 . A A . 19 GLY C 1 1 9 2427 1 1 19 GLY CA C -3.648 8.532 0.443 1.00 . A A . 19 GLY CA 1 1 9 2428 1 1 19 GLY H H -3.894 6.822 -0.771 1.00 . A A . 19 GLY H 1 1 9 2429 1 1 19 GLY HA2 H -3.444 9.468 -0.055 1.00 . A A . 19 GLY HA2 1 1 9 2430 1 1 19 GLY HA3 H -4.293 8.719 1.289 1.00 . A A . 19 GLY HA3 1 1 9 2431 1 1 19 GLY N N -4.327 7.649 -0.480 1.00 . A A . 19 GLY N 1 1 9 2432 1 1 19 GLY O O -1.286 8.551 0.782 1.00 . A A . 19 GLY O 1 1 9 2433 1 1 20 GLY C C -0.374 5.529 0.937 1.00 . A A . 20 GLY C 1 1 9 2434 1 1 20 GLY CA C -1.217 6.125 2.042 1.00 . A A . 20 GLY CA 1 1 9 2435 1 1 20 GLY H H -3.287 6.322 1.635 1.00 . A A . 20 GLY H 1 1 9 2436 1 1 20 GLY HA2 H -0.628 6.861 2.569 1.00 . A A . 20 GLY HA2 1 1 9 2437 1 1 20 GLY HA3 H -1.493 5.345 2.727 1.00 . A A . 20 GLY HA3 1 1 9 2438 1 1 20 GLY N N -2.416 6.763 1.537 1.00 . A A . 20 GLY N 1 1 9 2439 1 1 20 GLY O O -0.779 4.570 0.276 1.00 . A A . 20 GLY O 1 1 9 2440 1 1 21 ALA C C 3.101 6.243 -0.060 1.00 . A A . 21 ALA C 1 1 9 2441 1 1 21 ALA CA C 1.725 5.639 -0.281 1.00 . A A . 21 ALA CA 1 1 9 2442 1 1 21 ALA CB C 1.208 6.004 -1.668 1.00 . A A . 21 ALA CB 1 1 9 2443 1 1 21 ALA H H 1.053 6.856 1.311 1.00 . A A . 21 ALA H 1 1 9 2444 1 1 21 ALA HA H 1.795 4.563 -0.216 1.00 . A A . 21 ALA HA 1 1 9 2445 1 1 21 ALA HB1 H 0.271 5.497 -1.847 1.00 . A A . 21 ALA HB1 1 1 9 2446 1 1 21 ALA HB2 H 1.929 5.702 -2.412 1.00 . A A . 21 ALA HB2 1 1 9 2447 1 1 21 ALA HB3 H 1.056 7.072 -1.726 1.00 . A A . 21 ALA HB3 1 1 9 2448 1 1 21 ALA N N 0.800 6.097 0.744 1.00 . A A . 21 ALA N 1 1 9 2449 1 1 21 ALA O O 3.218 7.433 0.221 1.00 . A A . 21 ALA O 1 1 9 2450 1 1 22 ALA C C 5.728 6.506 1.353 1.00 . A A . 22 ALA C 1 1 9 2451 1 1 22 ALA CA C 5.522 5.836 -0.004 1.00 . A A . 22 ALA CA 1 1 9 2452 1 1 22 ALA CB C 5.947 6.763 -1.136 1.00 . A A . 22 ALA CB 1 1 9 2453 1 1 22 ALA H H 3.956 4.472 -0.409 1.00 . A A . 22 ALA H 1 1 9 2454 1 1 22 ALA HA H 6.144 4.953 -0.048 1.00 . A A . 22 ALA HA 1 1 9 2455 1 1 22 ALA HB1 H 5.096 6.978 -1.765 1.00 . A A . 22 ALA HB1 1 1 9 2456 1 1 22 ALA HB2 H 6.716 6.284 -1.724 1.00 . A A . 22 ALA HB2 1 1 9 2457 1 1 22 ALA HB3 H 6.331 7.684 -0.723 1.00 . A A . 22 ALA HB3 1 1 9 2458 1 1 22 ALA N N 4.134 5.408 -0.185 1.00 . A A . 22 ALA N 1 1 9 2459 1 1 22 ALA O O 6.415 7.521 1.461 1.00 . A A . 22 ALA O 1 1 9 2460 1 1 23 GLY C C 4.891 5.477 4.789 1.00 . A A . 23 GLY C 1 1 9 2461 1 1 23 GLY CA C 5.272 6.474 3.715 1.00 . A A . 23 GLY CA 1 1 9 2462 1 1 23 GLY H H 4.611 5.114 2.245 1.00 . A A . 23 GLY H 1 1 9 2463 1 1 23 GLY HA2 H 6.298 6.776 3.867 1.00 . A A . 23 GLY HA2 1 1 9 2464 1 1 23 GLY HA3 H 4.635 7.341 3.801 1.00 . A A . 23 GLY HA3 1 1 9 2465 1 1 23 GLY N N 5.138 5.925 2.385 1.00 . A A . 23 GLY N 1 1 9 2466 1 1 23 GLY O O 3.847 4.825 4.701 1.00 . A A . 23 GLY O 1 1 10 2467 1 1 1 GLY C C 5.475 1.743 6.561 1.00 . A A . 1 GLY C 1 1 10 2468 1 1 1 GLY CA C 6.129 3.016 7.039 1.00 . A A . 1 GLY CA 1 1 10 2469 1 1 1 GLY H1 H 7.094 3.491 5.222 1.00 . A A . 1 GLY H1 1 1 10 2470 1 1 1 GLY HA2 H 7.002 2.769 7.620 1.00 . A A . 1 GLY HA2 1 1 10 2471 1 1 1 GLY HA3 H 5.431 3.556 7.662 1.00 . A A . 1 GLY HA3 1 1 10 2472 1 1 1 GLY N N 6.517 3.855 5.931 1.00 . A A . 1 GLY N 1 1 10 2473 1 1 1 GLY O O 6.105 0.916 5.901 1.00 . A A . 1 GLY O 1 1 10 2474 1 1 2 CYS C C 3.173 0.438 4.990 1.00 . A A . 2 CYS C 1 1 10 2475 1 1 2 CYS CA C 3.453 0.414 6.487 1.00 . A A . 2 CYS CA 1 1 10 2476 1 1 2 CYS CB C 2.130 0.356 7.254 1.00 . A A . 2 CYS CB 1 1 10 2477 1 1 2 CYS H H 3.768 2.288 7.414 1.00 . A A . 2 CYS H 1 1 10 2478 1 1 2 CYS HA H 4.038 -0.461 6.724 1.00 . A A . 2 CYS HA 1 1 10 2479 1 1 2 CYS HB2 H 2.338 0.224 8.302 1.00 . A A . 2 CYS HB2 1 1 10 2480 1 1 2 CYS HB3 H 1.603 1.288 7.114 1.00 . A A . 2 CYS HB3 1 1 10 2481 1 1 2 CYS N N 4.209 1.589 6.890 1.00 . A A . 2 CYS N 1 1 10 2482 1 1 2 CYS O O 3.408 -0.539 4.285 1.00 . A A . 2 CYS O 1 1 10 2483 1 1 2 CYS SG S 1.015 -0.991 6.735 1.00 . A A . 2 CYS SG 1 1 10 2484 1 1 3 CYS C C 3.499 1.572 2.178 1.00 . A A . 3 CYS C 1 1 10 2485 1 1 3 CYS CA C 2.302 1.717 3.115 1.00 . A A . 3 CYS CA 1 1 10 2486 1 1 3 CYS CB C 1.612 3.059 2.904 1.00 . A A . 3 CYS CB 1 1 10 2487 1 1 3 CYS H H 2.476 2.294 5.142 1.00 . A A . 3 CYS H 1 1 10 2488 1 1 3 CYS HA H 1.603 0.934 2.876 1.00 . A A . 3 CYS HA 1 1 10 2489 1 1 3 CYS HB2 H 2.291 3.854 3.173 1.00 . A A . 3 CYS HB2 1 1 10 2490 1 1 3 CYS HB3 H 1.342 3.159 1.862 1.00 . A A . 3 CYS HB3 1 1 10 2491 1 1 3 CYS N N 2.652 1.557 4.521 1.00 . A A . 3 CYS N 1 1 10 2492 1 1 3 CYS O O 3.352 1.043 1.076 1.00 . A A . 3 CYS O 1 1 10 2493 1 1 3 CYS SG S 0.097 3.265 3.894 1.00 . A A . 3 CYS SG 1 1 10 2494 1 1 4 SER C C 6.268 0.461 1.596 1.00 . A A . 4 SER C 1 1 10 2495 1 1 4 SER CA C 5.865 1.925 1.768 1.00 . A A . 4 SER CA 1 1 10 2496 1 1 4 SER CB C 7.014 2.736 2.369 1.00 . A A . 4 SER CB 1 1 10 2497 1 1 4 SER H H 4.738 2.447 3.485 1.00 . A A . 4 SER H 1 1 10 2498 1 1 4 SER HA H 5.622 2.329 0.797 1.00 . A A . 4 SER HA 1 1 10 2499 1 1 4 SER HB2 H 7.920 2.537 1.816 1.00 . A A . 4 SER HB2 1 1 10 2500 1 1 4 SER HB3 H 6.780 3.789 2.308 1.00 . A A . 4 SER HB3 1 1 10 2501 1 1 4 SER HG H 7.555 1.491 3.783 1.00 . A A . 4 SER HG 1 1 10 2502 1 1 4 SER N N 4.670 2.031 2.600 1.00 . A A . 4 SER N 1 1 10 2503 1 1 4 SER O O 6.976 0.102 0.657 1.00 . A A . 4 SER O 1 1 10 2504 1 1 4 SER OG O 7.228 2.396 3.729 1.00 . A A . 4 SER OG 1 1 10 2505 1 1 5 ASN C C 5.004 -2.517 1.636 1.00 . A A . 5 ASN C 1 1 10 2506 1 1 5 ASN CA C 6.075 -1.808 2.448 1.00 . A A . 5 ASN CA 1 1 10 2507 1 1 5 ASN CB C 6.146 -2.398 3.858 1.00 . A A . 5 ASN CB 1 1 10 2508 1 1 5 ASN CG C 7.537 -2.308 4.452 1.00 . A A . 5 ASN CG 1 1 10 2509 1 1 5 ASN H H 5.206 -0.036 3.213 1.00 . A A . 5 ASN H 1 1 10 2510 1 1 5 ASN HA H 7.029 -1.939 1.961 1.00 . A A . 5 ASN HA 1 1 10 2511 1 1 5 ASN HB2 H 5.466 -1.859 4.502 1.00 . A A . 5 ASN HB2 1 1 10 2512 1 1 5 ASN HB3 H 5.856 -3.437 3.823 1.00 . A A . 5 ASN HB3 1 1 10 2513 1 1 5 ASN HD21 H 6.932 -0.930 5.752 1.00 . A A . 5 ASN HD21 1 1 10 2514 1 1 5 ASN HD22 H 8.596 -1.388 5.853 1.00 . A A . 5 ASN HD22 1 1 10 2515 1 1 5 ASN N N 5.790 -0.382 2.503 1.00 . A A . 5 ASN N 1 1 10 2516 1 1 5 ASN ND2 N 7.705 -1.457 5.453 1.00 . A A . 5 ASN ND2 1 1 10 2517 1 1 5 ASN O O 3.819 -2.386 1.922 1.00 . A A . 5 ASN O 1 1 10 2518 1 1 5 ASN OD1 O 8.456 -2.990 4.006 1.00 . A A . 5 ASN OD1 1 1 10 2519 1 1 6 PRO C C 3.550 -4.944 0.491 1.00 . A A . 6 PRO C 1 1 10 2520 1 1 6 PRO CA C 4.468 -3.988 -0.270 1.00 . A A . 6 PRO CA 1 1 10 2521 1 1 6 PRO CB C 5.379 -4.768 -1.230 1.00 . A A . 6 PRO CB 1 1 10 2522 1 1 6 PRO CD C 6.800 -3.467 0.184 1.00 . A A . 6 PRO CD 1 1 10 2523 1 1 6 PRO CG C 6.734 -4.742 -0.603 1.00 . A A . 6 PRO CG 1 1 10 2524 1 1 6 PRO HA H 3.859 -3.297 -0.837 1.00 . A A . 6 PRO HA 1 1 10 2525 1 1 6 PRO HB2 H 5.012 -5.779 -1.333 1.00 . A A . 6 PRO HB2 1 1 10 2526 1 1 6 PRO HB3 H 5.384 -4.284 -2.195 1.00 . A A . 6 PRO HB3 1 1 10 2527 1 1 6 PRO HD2 H 7.448 -3.583 1.042 1.00 . A A . 6 PRO HD2 1 1 10 2528 1 1 6 PRO HD3 H 7.135 -2.652 -0.439 1.00 . A A . 6 PRO HD3 1 1 10 2529 1 1 6 PRO HG2 H 6.851 -5.594 0.052 1.00 . A A . 6 PRO HG2 1 1 10 2530 1 1 6 PRO HG3 H 7.494 -4.749 -1.369 1.00 . A A . 6 PRO HG3 1 1 10 2531 1 1 6 PRO N N 5.404 -3.270 0.602 1.00 . A A . 6 PRO N 1 1 10 2532 1 1 6 PRO O O 2.348 -4.995 0.232 1.00 . A A . 6 PRO O 1 1 10 2533 1 1 7 VAL C C 2.329 -5.922 3.099 1.00 . A A . 7 VAL C 1 1 10 2534 1 1 7 VAL CA C 3.342 -6.644 2.220 1.00 . A A . 7 VAL CA 1 1 10 2535 1 1 7 VAL CB C 4.255 -7.514 3.113 1.00 . A A . 7 VAL CB 1 1 10 2536 1 1 7 VAL CG1 C 3.433 -8.508 3.922 1.00 . A A . 7 VAL CG1 1 1 10 2537 1 1 7 VAL CG2 C 5.296 -8.235 2.271 1.00 . A A . 7 VAL CG2 1 1 10 2538 1 1 7 VAL H H 5.078 -5.606 1.593 1.00 . A A . 7 VAL H 1 1 10 2539 1 1 7 VAL HA H 2.815 -7.295 1.538 1.00 . A A . 7 VAL HA 1 1 10 2540 1 1 7 VAL HB H 4.772 -6.864 3.804 1.00 . A A . 7 VAL HB 1 1 10 2541 1 1 7 VAL HG11 H 3.094 -9.305 3.276 1.00 . A A . 7 VAL HG11 1 1 10 2542 1 1 7 VAL HG12 H 2.577 -8.003 4.349 1.00 . A A . 7 VAL HG12 1 1 10 2543 1 1 7 VAL HG13 H 4.042 -8.918 4.714 1.00 . A A . 7 VAL HG13 1 1 10 2544 1 1 7 VAL HG21 H 4.937 -9.224 2.025 1.00 . A A . 7 VAL HG21 1 1 10 2545 1 1 7 VAL HG22 H 6.217 -8.315 2.828 1.00 . A A . 7 VAL HG22 1 1 10 2546 1 1 7 VAL HG23 H 5.471 -7.679 1.362 1.00 . A A . 7 VAL HG23 1 1 10 2547 1 1 7 VAL N N 4.117 -5.694 1.429 1.00 . A A . 7 VAL N 1 1 10 2548 1 1 7 VAL O O 1.147 -6.264 3.114 1.00 . A A . 7 VAL O 1 1 10 2549 1 1 8 CYS C C 0.890 -3.398 3.900 1.00 . A A . 8 CYS C 1 1 10 2550 1 1 8 CYS CA C 1.947 -4.142 4.710 1.00 . A A . 8 CYS CA 1 1 10 2551 1 1 8 CYS CB C 2.788 -3.160 5.527 1.00 . A A . 8 CYS CB 1 1 10 2552 1 1 8 CYS H H 3.755 -4.696 3.760 1.00 . A A . 8 CYS H 1 1 10 2553 1 1 8 CYS HA H 1.453 -4.829 5.381 1.00 . A A . 8 CYS HA 1 1 10 2554 1 1 8 CYS HB2 H 3.750 -3.603 5.720 1.00 . A A . 8 CYS HB2 1 1 10 2555 1 1 8 CYS HB3 H 2.926 -2.256 4.951 1.00 . A A . 8 CYS HB3 1 1 10 2556 1 1 8 CYS N N 2.805 -4.919 3.823 1.00 . A A . 8 CYS N 1 1 10 2557 1 1 8 CYS O O -0.265 -3.301 4.308 1.00 . A A . 8 CYS O 1 1 10 2558 1 1 8 CYS SG S 2.060 -2.688 7.132 1.00 . A A . 8 CYS SG 1 1 10 2559 1 1 9 HIS C C -0.732 -3.059 1.384 1.00 . A A . 9 HIS C 1 1 10 2560 1 1 9 HIS CA C 0.394 -2.154 1.857 1.00 . A A . 9 HIS CA 1 1 10 2561 1 1 9 HIS CB C 1.145 -1.625 0.632 1.00 . A A . 9 HIS CB 1 1 10 2562 1 1 9 HIS CD2 C 0.740 0.690 -0.479 1.00 . A A . 9 HIS CD2 1 1 10 2563 1 1 9 HIS CE1 C -1.268 0.326 -1.277 1.00 . A A . 9 HIS CE1 1 1 10 2564 1 1 9 HIS CG C 0.393 -0.573 -0.137 1.00 . A A . 9 HIS CG 1 1 10 2565 1 1 9 HIS H H 2.237 -3.001 2.477 1.00 . A A . 9 HIS H 1 1 10 2566 1 1 9 HIS HA H -0.023 -1.324 2.406 1.00 . A A . 9 HIS HA 1 1 10 2567 1 1 9 HIS HB2 H 2.084 -1.205 0.949 1.00 . A A . 9 HIS HB2 1 1 10 2568 1 1 9 HIS HB3 H 1.338 -2.449 -0.040 1.00 . A A . 9 HIS HB3 1 1 10 2569 1 1 9 HIS HD1 H -1.412 -1.589 -0.560 1.00 . A A . 9 HIS HD1 1 1 10 2570 1 1 9 HIS HD2 H 1.671 1.185 -0.241 1.00 . A A . 9 HIS HD2 1 1 10 2571 1 1 9 HIS HE1 H -2.217 0.461 -1.776 1.00 . A A . 9 HIS HE1 1 1 10 2572 1 1 9 HIS HE2 H -0.398 2.176 -1.440 1.00 . A A . 9 HIS HE2 1 1 10 2573 1 1 9 HIS N N 1.297 -2.883 2.744 1.00 . A A . 9 HIS N 1 1 10 2574 1 1 9 HIS ND1 N -0.874 -0.768 -0.653 1.00 . A A . 9 HIS ND1 1 1 10 2575 1 1 9 HIS NE2 N -0.309 1.226 -1.186 1.00 . A A . 9 HIS NE2 1 1 10 2576 1 1 9 HIS O O -1.879 -2.639 1.304 1.00 . A A . 9 HIS O 1 1 10 2577 1 1 10 LEU C C -2.368 -5.589 1.650 1.00 . A A . 10 LEU C 1 1 10 2578 1 1 10 LEU CA C -1.349 -5.264 0.560 1.00 . A A . 10 LEU CA 1 1 10 2579 1 1 10 LEU CB C -0.618 -6.536 0.096 1.00 . A A . 10 LEU CB 1 1 10 2580 1 1 10 LEU CD1 C -2.434 -8.290 -0.059 1.00 . A A . 10 LEU CD1 1 1 10 2581 1 1 10 LEU CD2 C -2.077 -6.692 -1.948 1.00 . A A . 10 LEU CD2 1 1 10 2582 1 1 10 LEU CG C -1.405 -7.478 -0.832 1.00 . A A . 10 LEU CG 1 1 10 2583 1 1 10 LEU H H 0.567 -4.549 1.117 1.00 . A A . 10 LEU H 1 1 10 2584 1 1 10 LEU HA H -1.865 -4.826 -0.282 1.00 . A A . 10 LEU HA 1 1 10 2585 1 1 10 LEU HB2 H 0.281 -6.234 -0.420 1.00 . A A . 10 LEU HB2 1 1 10 2586 1 1 10 LEU HB3 H -0.333 -7.095 0.976 1.00 . A A . 10 LEU HB3 1 1 10 2587 1 1 10 LEU HD11 H -1.983 -9.210 0.286 1.00 . A A . 10 LEU HD11 1 1 10 2588 1 1 10 LEU HD12 H -3.270 -8.520 -0.703 1.00 . A A . 10 LEU HD12 1 1 10 2589 1 1 10 LEU HD13 H -2.780 -7.719 0.791 1.00 . A A . 10 LEU HD13 1 1 10 2590 1 1 10 LEU HD21 H -1.797 -5.652 -1.874 1.00 . A A . 10 LEU HD21 1 1 10 2591 1 1 10 LEU HD22 H -3.149 -6.784 -1.858 1.00 . A A . 10 LEU HD22 1 1 10 2592 1 1 10 LEU HD23 H -1.762 -7.082 -2.904 1.00 . A A . 10 LEU HD23 1 1 10 2593 1 1 10 LEU HG H -0.714 -8.174 -1.288 1.00 . A A . 10 LEU HG 1 1 10 2594 1 1 10 LEU N N -0.380 -4.290 1.048 1.00 . A A . 10 LEU N 1 1 10 2595 1 1 10 LEU O O -3.577 -5.521 1.424 1.00 . A A . 10 LEU O 1 1 10 2596 1 1 11 GLU C C -3.576 -5.061 4.367 1.00 . A A . 11 GLU C 1 1 10 2597 1 1 11 GLU CA C -2.729 -6.263 3.962 1.00 . A A . 11 GLU CA 1 1 10 2598 1 1 11 GLU CB C -1.877 -6.698 5.158 1.00 . A A . 11 GLU CB 1 1 10 2599 1 1 11 GLU CD C -1.937 -7.048 7.660 1.00 . A A . 11 GLU CD 1 1 10 2600 1 1 11 GLU CG C -2.695 -7.162 6.353 1.00 . A A . 11 GLU CG 1 1 10 2601 1 1 11 GLU H H -0.895 -5.961 2.948 1.00 . A A . 11 GLU H 1 1 10 2602 1 1 11 GLU HA H -3.377 -7.073 3.672 1.00 . A A . 11 GLU HA 1 1 10 2603 1 1 11 GLU HB2 H -1.231 -7.505 4.853 1.00 . A A . 11 GLU HB2 1 1 10 2604 1 1 11 GLU HB3 H -1.268 -5.863 5.471 1.00 . A A . 11 GLU HB3 1 1 10 2605 1 1 11 GLU HG2 H -3.588 -6.558 6.418 1.00 . A A . 11 GLU HG2 1 1 10 2606 1 1 11 GLU HG3 H -2.971 -8.196 6.202 1.00 . A A . 11 GLU HG3 1 1 10 2607 1 1 11 GLU N N -1.869 -5.931 2.832 1.00 . A A . 11 GLU N 1 1 10 2608 1 1 11 GLU O O -4.786 -5.161 4.565 1.00 . A A . 11 GLU O 1 1 10 2609 1 1 11 GLU OE1 O -0.749 -6.658 7.633 1.00 . A A . 11 GLU OE1 1 1 10 2610 1 1 11 GLU OE2 O -2.537 -7.304 8.720 1.00 . A A . 11 GLU OE2 1 1 10 2611 1 1 12 HIS C C -3.837 -1.797 3.717 1.00 . A A . 12 HIS C 1 1 10 2612 1 1 12 HIS CA C -3.565 -2.697 4.915 1.00 . A A . 12 HIS CA 1 1 10 2613 1 1 12 HIS CB C -2.691 -1.983 5.948 1.00 . A A . 12 HIS CB 1 1 10 2614 1 1 12 HIS CD2 C -1.237 -3.514 7.452 1.00 . A A . 12 HIS CD2 1 1 10 2615 1 1 12 HIS CE1 C -2.722 -3.971 8.986 1.00 . A A . 12 HIS CE1 1 1 10 2616 1 1 12 HIS CG C -2.367 -2.845 7.132 1.00 . A A . 12 HIS CG 1 1 10 2617 1 1 12 HIS H H -1.945 -3.926 4.344 1.00 . A A . 12 HIS H 1 1 10 2618 1 1 12 HIS HA H -4.506 -2.957 5.374 1.00 . A A . 12 HIS HA 1 1 10 2619 1 1 12 HIS HB2 H -1.761 -1.688 5.485 1.00 . A A . 12 HIS HB2 1 1 10 2620 1 1 12 HIS HB3 H -3.207 -1.101 6.305 1.00 . A A . 12 HIS HB3 1 1 10 2621 1 1 12 HIS HD1 H -4.202 -2.836 8.154 1.00 . A A . 12 HIS HD1 1 1 10 2622 1 1 12 HIS HD2 H -0.316 -3.518 6.887 1.00 . A A . 12 HIS HD2 1 1 10 2623 1 1 12 HIS HE1 H -3.204 -4.377 9.864 1.00 . A A . 12 HIS HE1 1 1 10 2624 1 1 12 HIS HE2 H -0.994 -5.039 8.856 1.00 . A A . 12 HIS HE2 1 1 10 2625 1 1 12 HIS N N -2.915 -3.930 4.507 1.00 . A A . 12 HIS N 1 1 10 2626 1 1 12 HIS ND1 N -3.279 -3.152 8.112 1.00 . A A . 12 HIS ND1 1 1 10 2627 1 1 12 HIS NE2 N -1.481 -4.213 8.610 1.00 . A A . 12 HIS NE2 1 1 10 2628 1 1 12 HIS O O -3.502 -0.611 3.726 1.00 . A A . 12 HIS O 1 1 10 2629 1 1 13 SER C C -5.760 -0.496 1.766 1.00 . A A . 13 SER C 1 1 10 2630 1 1 13 SER CA C -4.775 -1.624 1.474 1.00 . A A . 13 SER CA 1 1 10 2631 1 1 13 SER CB C -5.343 -2.557 0.403 1.00 . A A . 13 SER CB 1 1 10 2632 1 1 13 SER H H -4.689 -3.319 2.742 1.00 . A A . 13 SER H 1 1 10 2633 1 1 13 SER HA H -3.857 -1.190 1.104 1.00 . A A . 13 SER HA 1 1 10 2634 1 1 13 SER HB2 H -6.141 -3.146 0.828 1.00 . A A . 13 SER HB2 1 1 10 2635 1 1 13 SER HB3 H -5.727 -1.966 -0.416 1.00 . A A . 13 SER HB3 1 1 10 2636 1 1 13 SER HG H -4.261 -4.196 0.494 1.00 . A A . 13 SER HG 1 1 10 2637 1 1 13 SER N N -4.450 -2.368 2.687 1.00 . A A . 13 SER N 1 1 10 2638 1 1 13 SER O O -5.831 0.480 1.031 1.00 . A A . 13 SER O 1 1 10 2639 1 1 13 SER OG O -4.344 -3.432 -0.093 1.00 . A A . 13 SER OG 1 1 10 2640 1 1 14 ASN C C -6.806 1.656 3.722 1.00 . A A . 14 ASN C 1 1 10 2641 1 1 14 ASN CA C -7.490 0.378 3.228 1.00 . A A . 14 ASN CA 1 1 10 2642 1 1 14 ASN CB C -8.438 -0.167 4.303 1.00 . A A . 14 ASN CB 1 1 10 2643 1 1 14 ASN CG C -7.729 -0.524 5.596 1.00 . A A . 14 ASN CG 1 1 10 2644 1 1 14 ASN H H -6.413 -1.437 3.400 1.00 . A A . 14 ASN H 1 1 10 2645 1 1 14 ASN HA H -8.068 0.619 2.348 1.00 . A A . 14 ASN HA 1 1 10 2646 1 1 14 ASN HB2 H -9.186 0.581 4.523 1.00 . A A . 14 ASN HB2 1 1 10 2647 1 1 14 ASN HB3 H -8.925 -1.054 3.925 1.00 . A A . 14 ASN HB3 1 1 10 2648 1 1 14 ASN HD21 H -8.865 0.757 6.600 1.00 . A A . 14 ASN HD21 1 1 10 2649 1 1 14 ASN HD22 H -7.701 -0.109 7.536 1.00 . A A . 14 ASN HD22 1 1 10 2650 1 1 14 ASN N N -6.514 -0.635 2.844 1.00 . A A . 14 ASN N 1 1 10 2651 1 1 14 ASN ND2 N -8.139 0.104 6.687 1.00 . A A . 14 ASN ND2 1 1 10 2652 1 1 14 ASN O O -7.425 2.715 3.760 1.00 . A A . 14 ASN O 1 1 10 2653 1 1 14 ASN OD1 O -6.824 -1.360 5.616 1.00 . A A . 14 ASN OD1 1 1 10 2654 1 1 15 LEU C C -4.288 3.608 3.488 1.00 . A A . 15 LEU C 1 1 10 2655 1 1 15 LEU CA C -4.795 2.709 4.612 1.00 . A A . 15 LEU CA 1 1 10 2656 1 1 15 LEU CB C -3.611 2.273 5.490 1.00 . A A . 15 LEU CB 1 1 10 2657 1 1 15 LEU CD1 C -4.651 3.154 7.602 1.00 . A A . 15 LEU CD1 1 1 10 2658 1 1 15 LEU CD2 C -4.767 0.709 7.095 1.00 . A A . 15 LEU CD2 1 1 10 2659 1 1 15 LEU CG C -3.937 1.973 6.961 1.00 . A A . 15 LEU CG 1 1 10 2660 1 1 15 LEU H H -5.090 0.679 4.067 1.00 . A A . 15 LEU H 1 1 10 2661 1 1 15 LEU HA H -5.472 3.283 5.217 1.00 . A A . 15 LEU HA 1 1 10 2662 1 1 15 LEU HB2 H -3.183 1.382 5.055 1.00 . A A . 15 LEU HB2 1 1 10 2663 1 1 15 LEU HB3 H -2.868 3.053 5.464 1.00 . A A . 15 LEU HB3 1 1 10 2664 1 1 15 LEU HD11 H -5.691 3.146 7.312 1.00 . A A . 15 LEU HD11 1 1 10 2665 1 1 15 LEU HD12 H -4.191 4.074 7.271 1.00 . A A . 15 LEU HD12 1 1 10 2666 1 1 15 LEU HD13 H -4.576 3.080 8.676 1.00 . A A . 15 LEU HD13 1 1 10 2667 1 1 15 LEU HD21 H -5.595 0.746 6.402 1.00 . A A . 15 LEU HD21 1 1 10 2668 1 1 15 LEU HD22 H -5.146 0.632 8.104 1.00 . A A . 15 LEU HD22 1 1 10 2669 1 1 15 LEU HD23 H -4.152 -0.151 6.875 1.00 . A A . 15 LEU HD23 1 1 10 2670 1 1 15 LEU HG H -3.011 1.820 7.496 1.00 . A A . 15 LEU HG 1 1 10 2671 1 1 15 LEU N N -5.536 1.551 4.111 1.00 . A A . 15 LEU N 1 1 10 2672 1 1 15 LEU O O -4.425 4.828 3.550 1.00 . A A . 15 LEU O 1 1 10 2673 1 1 16 CYS C C -3.535 3.237 0.010 1.00 . A A . 16 CYS C 1 1 10 2674 1 1 16 CYS CA C -3.132 3.796 1.367 1.00 . A A . 16 CYS CA 1 1 10 2675 1 1 16 CYS CB C -1.607 3.830 1.453 1.00 . A A . 16 CYS CB 1 1 10 2676 1 1 16 CYS H H -3.581 2.043 2.482 1.00 . A A . 16 CYS H 1 1 10 2677 1 1 16 CYS HA H -3.507 4.803 1.454 1.00 . A A . 16 CYS HA 1 1 10 2678 1 1 16 CYS HB2 H -1.243 2.815 1.486 1.00 . A A . 16 CYS HB2 1 1 10 2679 1 1 16 CYS HB3 H -1.217 4.315 0.569 1.00 . A A . 16 CYS HB3 1 1 10 2680 1 1 16 CYS N N -3.680 3.015 2.474 1.00 . A A . 16 CYS N 1 1 10 2681 1 1 16 CYS O O -2.747 3.266 -0.936 1.00 . A A . 16 CYS O 1 1 10 2682 1 1 16 CYS SG S -0.939 4.703 2.905 1.00 . A A . 16 CYS SG 1 1 10 2683 1 1 17 GLY C C -5.450 3.270 -2.375 1.00 . A A . 17 GLY C 1 1 10 2684 1 1 17 GLY CA C -5.221 2.190 -1.349 1.00 . A A . 17 GLY CA 1 1 10 2685 1 1 17 GLY H H -5.338 2.739 0.696 1.00 . A A . 17 GLY H 1 1 10 2686 1 1 17 GLY HA2 H -4.487 1.504 -1.726 1.00 . A A . 17 GLY HA2 1 1 10 2687 1 1 17 GLY HA3 H -6.147 1.662 -1.182 1.00 . A A . 17 GLY HA3 1 1 10 2688 1 1 17 GLY N N -4.752 2.737 -0.089 1.00 . A A . 17 GLY N 1 1 10 2689 1 1 17 GLY O O -4.926 3.218 -3.485 1.00 . A A . 17 GLY O 1 1 10 2690 1 1 18 ALA C C -5.760 6.624 -2.392 1.00 . A A . 18 ALA C 1 1 10 2691 1 1 18 ALA CA C -6.530 5.389 -2.844 1.00 . A A . 18 ALA CA 1 1 10 2692 1 1 18 ALA CB C -8.029 5.656 -2.849 1.00 . A A . 18 ALA CB 1 1 10 2693 1 1 18 ALA H H -6.585 4.236 -1.078 1.00 . A A . 18 ALA H 1 1 10 2694 1 1 18 ALA HA H -6.227 5.135 -3.849 1.00 . A A . 18 ALA HA 1 1 10 2695 1 1 18 ALA HB1 H -8.297 6.177 -3.757 1.00 . A A . 18 ALA HB1 1 1 10 2696 1 1 18 ALA HB2 H -8.289 6.263 -1.995 1.00 . A A . 18 ALA HB2 1 1 10 2697 1 1 18 ALA HB3 H -8.562 4.719 -2.801 1.00 . A A . 18 ALA HB3 1 1 10 2698 1 1 18 ALA N N -6.221 4.260 -1.983 1.00 . A A . 18 ALA N 1 1 10 2699 1 1 18 ALA O O -6.350 7.657 -2.081 1.00 . A A . 18 ALA O 1 1 10 2700 1 1 19 GLY C C -2.177 7.495 -2.359 1.00 . A A . 19 GLY C 1 1 10 2701 1 1 19 GLY CA C -3.621 7.627 -1.925 1.00 . A A . 19 GLY CA 1 1 10 2702 1 1 19 GLY H H -4.022 5.660 -2.604 1.00 . A A . 19 GLY H 1 1 10 2703 1 1 19 GLY HA2 H -4.028 8.534 -2.344 1.00 . A A . 19 GLY HA2 1 1 10 2704 1 1 19 GLY HA3 H -3.656 7.694 -0.847 1.00 . A A . 19 GLY HA3 1 1 10 2705 1 1 19 GLY N N -4.440 6.508 -2.348 1.00 . A A . 19 GLY N 1 1 10 2706 1 1 19 GLY O O -1.618 8.415 -2.950 1.00 . A A . 19 GLY O 1 1 10 2707 1 1 20 GLY C C 0.525 5.127 -1.598 1.00 . A A . 20 GLY C 1 1 10 2708 1 1 20 GLY CA C -0.182 6.155 -2.456 1.00 . A A . 20 GLY CA 1 1 10 2709 1 1 20 GLY H H -2.049 5.646 -1.599 1.00 . A A . 20 GLY H 1 1 10 2710 1 1 20 GLY HA2 H -0.150 5.829 -3.485 1.00 . A A . 20 GLY HA2 1 1 10 2711 1 1 20 GLY HA3 H 0.340 7.096 -2.372 1.00 . A A . 20 GLY HA3 1 1 10 2712 1 1 20 GLY N N -1.564 6.353 -2.071 1.00 . A A . 20 GLY N 1 1 10 2713 1 1 20 GLY O O 0.032 4.011 -1.411 1.00 . A A . 20 GLY O 1 1 10 2714 1 1 21 ALA C C 3.311 5.419 0.755 1.00 . A A . 21 ALA C 1 1 10 2715 1 1 21 ALA CA C 2.482 4.620 -0.245 1.00 . A A . 21 ALA CA 1 1 10 2716 1 1 21 ALA CB C 3.382 3.745 -1.108 1.00 . A A . 21 ALA CB 1 1 10 2717 1 1 21 ALA H H 2.022 6.405 -1.275 1.00 . A A . 21 ALA H 1 1 10 2718 1 1 21 ALA HA H 1.805 3.975 0.297 1.00 . A A . 21 ALA HA 1 1 10 2719 1 1 21 ALA HB1 H 4.400 4.100 -1.041 1.00 . A A . 21 ALA HB1 1 1 10 2720 1 1 21 ALA HB2 H 3.051 3.789 -2.134 1.00 . A A . 21 ALA HB2 1 1 10 2721 1 1 21 ALA HB3 H 3.334 2.724 -0.758 1.00 . A A . 21 ALA HB3 1 1 10 2722 1 1 21 ALA N N 1.686 5.504 -1.082 1.00 . A A . 21 ALA N 1 1 10 2723 1 1 21 ALA O O 4.522 5.564 0.598 1.00 . A A . 21 ALA O 1 1 10 2724 1 1 22 ALA C C 4.366 5.889 3.536 1.00 . A A . 22 ALA C 1 1 10 2725 1 1 22 ALA CA C 3.303 6.718 2.820 1.00 . A A . 22 ALA CA 1 1 10 2726 1 1 22 ALA CB C 2.279 7.243 3.816 1.00 . A A . 22 ALA CB 1 1 10 2727 1 1 22 ALA H H 1.677 5.784 1.845 1.00 . A A . 22 ALA H 1 1 10 2728 1 1 22 ALA HA H 3.778 7.567 2.347 1.00 . A A . 22 ALA HA 1 1 10 2729 1 1 22 ALA HB1 H 1.674 8.003 3.344 1.00 . A A . 22 ALA HB1 1 1 10 2730 1 1 22 ALA HB2 H 2.791 7.666 4.668 1.00 . A A . 22 ALA HB2 1 1 10 2731 1 1 22 ALA HB3 H 1.647 6.430 4.143 1.00 . A A . 22 ALA HB3 1 1 10 2732 1 1 22 ALA N N 2.643 5.936 1.781 1.00 . A A . 22 ALA N 1 1 10 2733 1 1 22 ALA O O 4.204 4.678 3.711 1.00 . A A . 22 ALA O 1 1 10 2734 1 1 23 GLY C C 6.084 5.102 5.837 1.00 . A A . 23 GLY C 1 1 10 2735 1 1 23 GLY CA C 6.543 5.874 4.616 1.00 . A A . 23 GLY CA 1 1 10 2736 1 1 23 GLY H H 5.517 7.508 3.753 1.00 . A A . 23 GLY H 1 1 10 2737 1 1 23 GLY HA2 H 7.013 5.187 3.927 1.00 . A A . 23 GLY HA2 1 1 10 2738 1 1 23 GLY HA3 H 7.271 6.611 4.922 1.00 . A A . 23 GLY HA3 1 1 10 2739 1 1 23 GLY N N 5.453 6.549 3.932 1.00 . A A . 23 GLY N 1 1 10 2740 1 1 23 GLY O O 5.336 5.619 6.666 1.00 . A A . 23 GLY O 1 1 11 2741 1 1 1 GLY C C 5.836 2.629 6.177 1.00 . A A . 1 GLY C 1 1 11 2742 1 1 1 GLY CA C 6.031 4.103 6.464 1.00 . A A . 1 GLY CA 1 1 11 2743 1 1 1 GLY H1 H 6.757 5.468 5.023 1.00 . A A . 1 GLY H1 1 1 11 2744 1 1 1 GLY HA2 H 6.988 4.241 6.944 1.00 . A A . 1 GLY HA2 1 1 11 2745 1 1 1 GLY HA3 H 5.253 4.433 7.135 1.00 . A A . 1 GLY HA3 1 1 11 2746 1 1 1 GLY N N 5.987 4.910 5.261 1.00 . A A . 1 GLY N 1 1 11 2747 1 1 1 GLY O O 6.484 2.070 5.296 1.00 . A A . 1 GLY O 1 1 11 2748 1 1 2 CYS C C 4.047 0.348 5.349 1.00 . A A . 2 CYS C 1 1 11 2749 1 1 2 CYS CA C 4.636 0.588 6.735 1.00 . A A . 2 CYS CA 1 1 11 2750 1 1 2 CYS CB C 3.660 0.114 7.815 1.00 . A A . 2 CYS CB 1 1 11 2751 1 1 2 CYS H H 4.440 2.511 7.594 1.00 . A A . 2 CYS H 1 1 11 2752 1 1 2 CYS HA H 5.561 0.035 6.821 1.00 . A A . 2 CYS HA 1 1 11 2753 1 1 2 CYS HB2 H 3.946 0.548 8.760 1.00 . A A . 2 CYS HB2 1 1 11 2754 1 1 2 CYS HB3 H 2.665 0.451 7.560 1.00 . A A . 2 CYS HB3 1 1 11 2755 1 1 2 CYS N N 4.930 2.005 6.914 1.00 . A A . 2 CYS N 1 1 11 2756 1 1 2 CYS O O 4.384 -0.626 4.683 1.00 . A A . 2 CYS O 1 1 11 2757 1 1 2 CYS SG S 3.589 -1.695 8.039 1.00 . A A . 2 CYS SG 1 1 11 2758 1 1 3 CYS C C 3.573 1.215 2.471 1.00 . A A . 3 CYS C 1 1 11 2759 1 1 3 CYS CA C 2.549 1.149 3.600 1.00 . A A . 3 CYS CA 1 1 11 2760 1 1 3 CYS CB C 1.479 2.224 3.425 1.00 . A A . 3 CYS CB 1 1 11 2761 1 1 3 CYS H H 2.964 2.023 5.483 1.00 . A A . 3 CYS H 1 1 11 2762 1 1 3 CYS HA H 2.068 0.183 3.557 1.00 . A A . 3 CYS HA 1 1 11 2763 1 1 3 CYS HB2 H 1.868 3.171 3.768 1.00 . A A . 3 CYS HB2 1 1 11 2764 1 1 3 CYS HB3 H 1.223 2.301 2.379 1.00 . A A . 3 CYS HB3 1 1 11 2765 1 1 3 CYS N N 3.180 1.255 4.913 1.00 . A A . 3 CYS N 1 1 11 2766 1 1 3 CYS O O 3.285 0.806 1.348 1.00 . A A . 3 CYS O 1 1 11 2767 1 1 3 CYS SG S -0.052 1.881 4.352 1.00 . A A . 3 CYS SG 1 1 11 2768 1 1 4 SER C C 6.280 0.358 1.426 1.00 . A A . 4 SER C 1 1 11 2769 1 1 4 SER CA C 5.835 1.775 1.780 1.00 . A A . 4 SER CA 1 1 11 2770 1 1 4 SER CB C 7.017 2.597 2.305 1.00 . A A . 4 SER CB 1 1 11 2771 1 1 4 SER H H 4.955 1.994 3.692 1.00 . A A . 4 SER H 1 1 11 2772 1 1 4 SER HA H 5.433 2.247 0.896 1.00 . A A . 4 SER HA 1 1 11 2773 1 1 4 SER HB2 H 6.656 3.548 2.667 1.00 . A A . 4 SER HB2 1 1 11 2774 1 1 4 SER HB3 H 7.492 2.062 3.114 1.00 . A A . 4 SER HB3 1 1 11 2775 1 1 4 SER HG H 7.887 2.160 0.603 1.00 . A A . 4 SER HG 1 1 11 2776 1 1 4 SER N N 4.772 1.702 2.773 1.00 . A A . 4 SER N 1 1 11 2777 1 1 4 SER O O 6.818 0.106 0.349 1.00 . A A . 4 SER O 1 1 11 2778 1 1 4 SER OG O 7.975 2.832 1.288 1.00 . A A . 4 SER OG 1 1 11 2779 1 1 5 ASN C C 5.193 -2.674 1.467 1.00 . A A . 5 ASN C 1 1 11 2780 1 1 5 ASN CA C 6.357 -1.967 2.150 1.00 . A A . 5 ASN CA 1 1 11 2781 1 1 5 ASN CB C 6.673 -2.638 3.492 1.00 . A A . 5 ASN CB 1 1 11 2782 1 1 5 ASN CG C 8.056 -2.296 4.024 1.00 . A A . 5 ASN CG 1 1 11 2783 1 1 5 ASN H H 5.571 -0.297 3.174 1.00 . A A . 5 ASN H 1 1 11 2784 1 1 5 ASN HA H 7.226 -2.018 1.511 1.00 . A A . 5 ASN HA 1 1 11 2785 1 1 5 ASN HB2 H 5.945 -2.319 4.225 1.00 . A A . 5 ASN HB2 1 1 11 2786 1 1 5 ASN HB3 H 6.609 -3.711 3.373 1.00 . A A . 5 ASN HB3 1 1 11 2787 1 1 5 ASN HD21 H 8.399 -1.070 2.497 1.00 . A A . 5 ASN HD21 1 1 11 2788 1 1 5 ASN HD22 H 9.674 -1.208 3.654 1.00 . A A . 5 ASN HD22 1 1 11 2789 1 1 5 ASN N N 6.023 -0.566 2.345 1.00 . A A . 5 ASN N 1 1 11 2790 1 1 5 ASN ND2 N 8.782 -1.439 3.321 1.00 . A A . 5 ASN ND2 1 1 11 2791 1 1 5 ASN O O 4.044 -2.536 1.889 1.00 . A A . 5 ASN O 1 1 11 2792 1 1 5 ASN OD1 O 8.466 -2.800 5.065 1.00 . A A . 5 ASN OD1 1 1 11 2793 1 1 6 PRO C C 3.556 -5.045 0.464 1.00 . A A . 6 PRO C 1 1 11 2794 1 1 6 PRO CA C 4.447 -4.139 -0.386 1.00 . A A . 6 PRO CA 1 1 11 2795 1 1 6 PRO CB C 5.260 -4.978 -1.386 1.00 . A A . 6 PRO CB 1 1 11 2796 1 1 6 PRO CD C 6.810 -3.612 -0.185 1.00 . A A . 6 PRO CD 1 1 11 2797 1 1 6 PRO CG C 6.674 -4.916 -0.912 1.00 . A A . 6 PRO CG 1 1 11 2798 1 1 6 PRO HA H 3.822 -3.447 -0.931 1.00 . A A . 6 PRO HA 1 1 11 2799 1 1 6 PRO HB2 H 4.891 -5.993 -1.386 1.00 . A A . 6 PRO HB2 1 1 11 2800 1 1 6 PRO HB3 H 5.159 -4.556 -2.374 1.00 . A A . 6 PRO HB3 1 1 11 2801 1 1 6 PRO HD2 H 7.559 -3.684 0.590 1.00 . A A . 6 PRO HD2 1 1 11 2802 1 1 6 PRO HD3 H 7.050 -2.816 -0.875 1.00 . A A . 6 PRO HD3 1 1 11 2803 1 1 6 PRO HG2 H 6.874 -5.739 -0.242 1.00 . A A . 6 PRO HG2 1 1 11 2804 1 1 6 PRO HG3 H 7.346 -4.947 -1.756 1.00 . A A . 6 PRO HG3 1 1 11 2805 1 1 6 PRO N N 5.472 -3.423 0.390 1.00 . A A . 6 PRO N 1 1 11 2806 1 1 6 PRO O O 2.343 -5.091 0.262 1.00 . A A . 6 PRO O 1 1 11 2807 1 1 7 VAL C C 2.406 -5.907 3.129 1.00 . A A . 7 VAL C 1 1 11 2808 1 1 7 VAL CA C 3.410 -6.670 2.272 1.00 . A A . 7 VAL CA 1 1 11 2809 1 1 7 VAL CB C 4.355 -7.472 3.191 1.00 . A A . 7 VAL CB 1 1 11 2810 1 1 7 VAL CG1 C 3.569 -8.434 4.073 1.00 . A A . 7 VAL CG1 1 1 11 2811 1 1 7 VAL CG2 C 5.392 -8.222 2.370 1.00 . A A . 7 VAL CG2 1 1 11 2812 1 1 7 VAL H H 5.124 -5.682 1.522 1.00 . A A . 7 VAL H 1 1 11 2813 1 1 7 VAL HA H 2.875 -7.367 1.643 1.00 . A A . 7 VAL HA 1 1 11 2814 1 1 7 VAL HB H 4.873 -6.775 3.834 1.00 . A A . 7 VAL HB 1 1 11 2815 1 1 7 VAL HG11 H 2.602 -8.619 3.629 1.00 . A A . 7 VAL HG11 1 1 11 2816 1 1 7 VAL HG12 H 3.437 -7.998 5.053 1.00 . A A . 7 VAL HG12 1 1 11 2817 1 1 7 VAL HG13 H 4.109 -9.364 4.161 1.00 . A A . 7 VAL HG13 1 1 11 2818 1 1 7 VAL HG21 H 5.303 -9.281 2.556 1.00 . A A . 7 VAL HG21 1 1 11 2819 1 1 7 VAL HG22 H 6.382 -7.890 2.649 1.00 . A A . 7 VAL HG22 1 1 11 2820 1 1 7 VAL HG23 H 5.230 -8.025 1.320 1.00 . A A . 7 VAL HG23 1 1 11 2821 1 1 7 VAL N N 4.157 -5.762 1.406 1.00 . A A . 7 VAL N 1 1 11 2822 1 1 7 VAL O O 1.226 -6.251 3.180 1.00 . A A . 7 VAL O 1 1 11 2823 1 1 8 CYS C C 0.996 -3.318 3.825 1.00 . A A . 8 CYS C 1 1 11 2824 1 1 8 CYS CA C 2.041 -4.050 4.649 1.00 . A A . 8 CYS CA 1 1 11 2825 1 1 8 CYS CB C 2.882 -3.039 5.413 1.00 . A A . 8 CYS CB 1 1 11 2826 1 1 8 CYS H H 3.837 -4.645 3.700 1.00 . A A . 8 CYS H 1 1 11 2827 1 1 8 CYS HA H 1.543 -4.701 5.352 1.00 . A A . 8 CYS HA 1 1 11 2828 1 1 8 CYS HB2 H 3.782 -3.517 5.755 1.00 . A A . 8 CYS HB2 1 1 11 2829 1 1 8 CYS HB3 H 3.142 -2.236 4.742 1.00 . A A . 8 CYS HB3 1 1 11 2830 1 1 8 CYS N N 2.887 -4.869 3.791 1.00 . A A . 8 CYS N 1 1 11 2831 1 1 8 CYS O O -0.156 -3.197 4.230 1.00 . A A . 8 CYS O 1 1 11 2832 1 1 8 CYS SG S 2.053 -2.294 6.855 1.00 . A A . 8 CYS SG 1 1 11 2833 1 1 9 HIS C C -0.652 -2.982 1.362 1.00 . A A . 9 HIS C 1 1 11 2834 1 1 9 HIS CA C 0.510 -2.097 1.777 1.00 . A A . 9 HIS CA 1 1 11 2835 1 1 9 HIS CB C 1.238 -1.609 0.525 1.00 . A A . 9 HIS CB 1 1 11 2836 1 1 9 HIS CD2 C 0.880 0.741 -0.521 1.00 . A A . 9 HIS CD2 1 1 11 2837 1 1 9 HIS CE1 C -1.171 0.468 -1.239 1.00 . A A . 9 HIS CE1 1 1 11 2838 1 1 9 HIS CG C 0.503 -0.519 -0.201 1.00 . A A . 9 HIS CG 1 1 11 2839 1 1 9 HIS H H 2.354 -2.949 2.405 1.00 . A A . 9 HIS H 1 1 11 2840 1 1 9 HIS HA H 0.126 -1.244 2.317 1.00 . A A . 9 HIS HA 1 1 11 2841 1 1 9 HIS HB2 H 2.208 -1.235 0.804 1.00 . A A . 9 HIS HB2 1 1 11 2842 1 1 9 HIS HB3 H 1.360 -2.439 -0.156 1.00 . A A . 9 HIS HB3 1 1 11 2843 1 1 9 HIS HD1 H -1.350 -1.461 -0.577 1.00 . A A . 9 HIS HD1 1 1 11 2844 1 1 9 HIS HD2 H 1.837 1.196 -0.310 1.00 . A A . 9 HIS HD2 1 1 11 2845 1 1 9 HIS HE1 H -2.135 0.650 -1.692 1.00 . A A . 9 HIS HE1 1 1 11 2846 1 1 9 HIS HE2 H -0.284 2.313 -1.282 1.00 . A A . 9 HIS HE2 1 1 11 2847 1 1 9 HIS N N 1.411 -2.824 2.665 1.00 . A A . 9 HIS N 1 1 11 2848 1 1 9 HIS ND1 N -0.788 -0.656 -0.667 1.00 . A A . 9 HIS ND1 1 1 11 2849 1 1 9 HIS NE2 N -0.179 1.337 -1.164 1.00 . A A . 9 HIS NE2 1 1 11 2850 1 1 9 HIS O O -1.790 -2.531 1.306 1.00 . A A . 9 HIS O 1 1 11 2851 1 1 10 LEU C C -2.391 -5.392 1.758 1.00 . A A . 10 LEU C 1 1 11 2852 1 1 10 LEU CA C -1.359 -5.201 0.651 1.00 . A A . 10 LEU CA 1 1 11 2853 1 1 10 LEU CB C -0.706 -6.541 0.301 1.00 . A A . 10 LEU CB 1 1 11 2854 1 1 10 LEU CD1 C -2.305 -7.190 -1.523 1.00 . A A . 10 LEU CD1 1 1 11 2855 1 1 10 LEU CD2 C -0.925 -8.941 -0.388 1.00 . A A . 10 LEU CD2 1 1 11 2856 1 1 10 LEU CG C -1.661 -7.621 -0.213 1.00 . A A . 10 LEU CG 1 1 11 2857 1 1 10 LEU H H 0.593 -4.525 1.126 1.00 . A A . 10 LEU H 1 1 11 2858 1 1 10 LEU HA H -1.853 -4.808 -0.225 1.00 . A A . 10 LEU HA 1 1 11 2859 1 1 10 LEU HB2 H 0.044 -6.364 -0.456 1.00 . A A . 10 LEU HB2 1 1 11 2860 1 1 10 LEU HB3 H -0.215 -6.920 1.185 1.00 . A A . 10 LEU HB3 1 1 11 2861 1 1 10 LEU HD11 H -1.596 -7.309 -2.329 1.00 . A A . 10 LEU HD11 1 1 11 2862 1 1 10 LEU HD12 H -2.601 -6.154 -1.454 1.00 . A A . 10 LEU HD12 1 1 11 2863 1 1 10 LEU HD13 H -3.175 -7.800 -1.715 1.00 . A A . 10 LEU HD13 1 1 11 2864 1 1 10 LEU HD21 H -1.485 -9.579 -1.055 1.00 . A A . 10 LEU HD21 1 1 11 2865 1 1 10 LEU HD22 H -0.821 -9.425 0.571 1.00 . A A . 10 LEU HD22 1 1 11 2866 1 1 10 LEU HD23 H 0.054 -8.754 -0.806 1.00 . A A . 10 LEU HD23 1 1 11 2867 1 1 10 LEU HG H -2.448 -7.770 0.511 1.00 . A A . 10 LEU HG 1 1 11 2868 1 1 10 LEU N N -0.345 -4.238 1.067 1.00 . A A . 10 LEU N 1 1 11 2869 1 1 10 LEU O O -3.597 -5.378 1.510 1.00 . A A . 10 LEU O 1 1 11 2870 1 1 11 GLU C C -3.538 -4.443 4.434 1.00 . A A . 11 GLU C 1 1 11 2871 1 1 11 GLU CA C -2.776 -5.734 4.133 1.00 . A A . 11 GLU CA 1 1 11 2872 1 1 11 GLU CB C -1.942 -6.138 5.354 1.00 . A A . 11 GLU CB 1 1 11 2873 1 1 11 GLU CD C -1.955 -6.163 7.885 1.00 . A A . 11 GLU CD 1 1 11 2874 1 1 11 GLU CG C -2.762 -6.369 6.615 1.00 . A A . 11 GLU CG 1 1 11 2875 1 1 11 GLU H H -0.934 -5.547 3.113 1.00 . A A . 11 GLU H 1 1 11 2876 1 1 11 GLU HA H -3.480 -6.516 3.908 1.00 . A A . 11 GLU HA 1 1 11 2877 1 1 11 GLU HB2 H -1.411 -7.051 5.126 1.00 . A A . 11 GLU HB2 1 1 11 2878 1 1 11 GLU HB3 H -1.223 -5.359 5.557 1.00 . A A . 11 GLU HB3 1 1 11 2879 1 1 11 GLU HG2 H -3.592 -5.680 6.620 1.00 . A A . 11 GLU HG2 1 1 11 2880 1 1 11 GLU HG3 H -3.136 -7.383 6.605 1.00 . A A . 11 GLU HG3 1 1 11 2881 1 1 11 GLU N N -1.906 -5.555 2.980 1.00 . A A . 11 GLU N 1 1 11 2882 1 1 11 GLU O O -4.748 -4.447 4.656 1.00 . A A . 11 GLU O 1 1 11 2883 1 1 11 GLU OE1 O -0.760 -5.802 7.784 1.00 . A A . 11 GLU OE1 1 1 11 2884 1 1 11 GLU OE2 O -2.522 -6.320 8.981 1.00 . A A . 11 GLU OE2 1 1 11 2885 1 1 12 HIS C C -3.868 -1.336 3.464 1.00 . A A . 12 HIS C 1 1 11 2886 1 1 12 HIS CA C -3.393 -2.030 4.739 1.00 . A A . 12 HIS CA 1 1 11 2887 1 1 12 HIS CB C -2.386 -1.123 5.476 1.00 . A A . 12 HIS CB 1 1 11 2888 1 1 12 HIS CD2 C -1.635 -3.014 7.094 1.00 . A A . 12 HIS CD2 1 1 11 2889 1 1 12 HIS CE1 C -0.780 -1.783 8.683 1.00 . A A . 12 HIS CE1 1 1 11 2890 1 1 12 HIS CG C -1.786 -1.726 6.720 1.00 . A A . 12 HIS CG 1 1 11 2891 1 1 12 HIS H H -1.846 -3.402 4.265 1.00 . A A . 12 HIS H 1 1 11 2892 1 1 12 HIS HA H -4.247 -2.191 5.381 1.00 . A A . 12 HIS HA 1 1 11 2893 1 1 12 HIS HB2 H -1.575 -0.887 4.806 1.00 . A A . 12 HIS HB2 1 1 11 2894 1 1 12 HIS HB3 H -2.884 -0.207 5.760 1.00 . A A . 12 HIS HB3 1 1 11 2895 1 1 12 HIS HD1 H -1.179 0.003 7.764 1.00 . A A . 12 HIS HD1 1 1 11 2896 1 1 12 HIS HD2 H -1.917 -3.881 6.515 1.00 . A A . 12 HIS HD2 1 1 11 2897 1 1 12 HIS HE1 H -0.299 -1.479 9.601 1.00 . A A . 12 HIS HE1 1 1 11 2898 1 1 12 HIS HE2 H -0.674 -3.835 8.765 1.00 . A A . 12 HIS HE2 1 1 11 2899 1 1 12 HIS N N -2.810 -3.336 4.447 1.00 . A A . 12 HIS N 1 1 11 2900 1 1 12 HIS ND1 N -1.236 -0.973 7.739 1.00 . A A . 12 HIS ND1 1 1 11 2901 1 1 12 HIS NE2 N -1.014 -3.024 8.311 1.00 . A A . 12 HIS NE2 1 1 11 2902 1 1 12 HIS O O -3.724 -0.119 3.327 1.00 . A A . 12 HIS O 1 1 11 2903 1 1 13 SER C C -6.101 -0.603 1.516 1.00 . A A . 13 SER C 1 1 11 2904 1 1 13 SER CA C -4.931 -1.551 1.283 1.00 . A A . 13 SER CA 1 1 11 2905 1 1 13 SER CB C -5.342 -2.670 0.323 1.00 . A A . 13 SER CB 1 1 11 2906 1 1 13 SER H H -4.523 -3.068 2.708 1.00 . A A . 13 SER H 1 1 11 2907 1 1 13 SER HA H -4.122 -0.993 0.835 1.00 . A A . 13 SER HA 1 1 11 2908 1 1 13 SER HB2 H -6.005 -3.354 0.834 1.00 . A A . 13 SER HB2 1 1 11 2909 1 1 13 SER HB3 H -5.853 -2.242 -0.527 1.00 . A A . 13 SER HB3 1 1 11 2910 1 1 13 SER HG H -4.099 -4.187 0.399 1.00 . A A . 13 SER HG 1 1 11 2911 1 1 13 SER N N -4.436 -2.104 2.542 1.00 . A A . 13 SER N 1 1 11 2912 1 1 13 SER O O -6.286 0.357 0.777 1.00 . A A . 13 SER O 1 1 11 2913 1 1 13 SER OG O -4.212 -3.387 -0.135 1.00 . A A . 13 SER OG 1 1 11 2914 1 1 14 ASN C C -7.602 1.288 3.451 1.00 . A A . 14 ASN C 1 1 11 2915 1 1 14 ASN CA C -8.045 -0.046 2.866 1.00 . A A . 14 ASN CA 1 1 11 2916 1 1 14 ASN CB C -8.978 -0.763 3.845 1.00 . A A . 14 ASN CB 1 1 11 2917 1 1 14 ASN CG C -9.748 -1.909 3.208 1.00 . A A . 14 ASN CG 1 1 11 2918 1 1 14 ASN H H -6.697 -1.666 3.097 1.00 . A A . 14 ASN H 1 1 11 2919 1 1 14 ASN HA H -8.578 0.142 1.949 1.00 . A A . 14 ASN HA 1 1 11 2920 1 1 14 ASN HB2 H -8.393 -1.162 4.660 1.00 . A A . 14 ASN HB2 1 1 11 2921 1 1 14 ASN HB3 H -9.690 -0.051 4.237 1.00 . A A . 14 ASN HB3 1 1 11 2922 1 1 14 ASN HD21 H -9.035 -1.454 1.409 1.00 . A A . 14 ASN HD21 1 1 11 2923 1 1 14 ASN HD22 H -10.108 -2.805 1.474 1.00 . A A . 14 ASN HD22 1 1 11 2924 1 1 14 ASN N N -6.892 -0.881 2.543 1.00 . A A . 14 ASN N 1 1 11 2925 1 1 14 ASN ND2 N -9.616 -2.072 1.898 1.00 . A A . 14 ASN ND2 1 1 11 2926 1 1 14 ASN O O -8.196 2.326 3.174 1.00 . A A . 14 ASN O 1 1 11 2927 1 1 14 ASN OD1 O -10.464 -2.638 3.887 1.00 . A A . 14 ASN OD1 1 1 11 2928 1 1 15 LEU C C -5.260 3.303 3.906 1.00 . A A . 15 LEU C 1 1 11 2929 1 1 15 LEU CA C -6.031 2.448 4.904 1.00 . A A . 15 LEU CA 1 1 11 2930 1 1 15 LEU CB C -5.118 2.086 6.088 1.00 . A A . 15 LEU CB 1 1 11 2931 1 1 15 LEU CD1 C -7.047 2.217 7.701 1.00 . A A . 15 LEU CD1 1 1 11 2932 1 1 15 LEU CD2 C -6.143 -0.022 7.027 1.00 . A A . 15 LEU CD2 1 1 11 2933 1 1 15 LEU CG C -5.803 1.437 7.301 1.00 . A A . 15 LEU CG 1 1 11 2934 1 1 15 LEU H H -6.134 0.386 4.444 1.00 . A A . 15 LEU H 1 1 11 2935 1 1 15 LEU HA H -6.866 3.018 5.270 1.00 . A A . 15 LEU HA 1 1 11 2936 1 1 15 LEU HB2 H -4.359 1.407 5.729 1.00 . A A . 15 LEU HB2 1 1 11 2937 1 1 15 LEU HB3 H -4.632 2.991 6.423 1.00 . A A . 15 LEU HB3 1 1 11 2938 1 1 15 LEU HD11 H -7.733 1.560 8.216 1.00 . A A . 15 LEU HD11 1 1 11 2939 1 1 15 LEU HD12 H -7.523 2.613 6.816 1.00 . A A . 15 LEU HD12 1 1 11 2940 1 1 15 LEU HD13 H -6.768 3.030 8.355 1.00 . A A . 15 LEU HD13 1 1 11 2941 1 1 15 LEU HD21 H -7.202 -0.178 7.166 1.00 . A A . 15 LEU HD21 1 1 11 2942 1 1 15 LEU HD22 H -5.593 -0.654 7.709 1.00 . A A . 15 LEU HD22 1 1 11 2943 1 1 15 LEU HD23 H -5.873 -0.270 6.011 1.00 . A A . 15 LEU HD23 1 1 11 2944 1 1 15 LEU HG H -5.119 1.465 8.138 1.00 . A A . 15 LEU HG 1 1 11 2945 1 1 15 LEU N N -6.558 1.245 4.266 1.00 . A A . 15 LEU N 1 1 11 2946 1 1 15 LEU O O -5.486 4.504 3.790 1.00 . A A . 15 LEU O 1 1 11 2947 1 1 16 CYS C C -4.061 3.105 0.796 1.00 . A A . 16 CYS C 1 1 11 2948 1 1 16 CYS CA C -3.536 3.359 2.201 1.00 . A A . 16 CYS CA 1 1 11 2949 1 1 16 CYS CB C -2.088 2.906 2.320 1.00 . A A . 16 CYS CB 1 1 11 2950 1 1 16 CYS H H -4.220 1.709 3.332 1.00 . A A . 16 CYS H 1 1 11 2951 1 1 16 CYS HA H -3.590 4.418 2.407 1.00 . A A . 16 CYS HA 1 1 11 2952 1 1 16 CYS HB2 H -2.063 1.830 2.275 1.00 . A A . 16 CYS HB2 1 1 11 2953 1 1 16 CYS HB3 H -1.519 3.311 1.496 1.00 . A A . 16 CYS HB3 1 1 11 2954 1 1 16 CYS N N -4.351 2.670 3.190 1.00 . A A . 16 CYS N 1 1 11 2955 1 1 16 CYS O O -3.305 2.776 -0.124 1.00 . A A . 16 CYS O 1 1 11 2956 1 1 16 CYS SG S -1.277 3.425 3.872 1.00 . A A . 16 CYS SG 1 1 11 2957 1 1 17 GLY C C -5.570 4.037 -1.678 1.00 . A A . 17 GLY C 1 1 11 2958 1 1 17 GLY CA C -6.011 3.039 -0.628 1.00 . A A . 17 GLY CA 1 1 11 2959 1 1 17 GLY H H -5.898 3.507 1.429 1.00 . A A . 17 GLY H 1 1 11 2960 1 1 17 GLY HA2 H -5.779 2.043 -0.975 1.00 . A A . 17 GLY HA2 1 1 11 2961 1 1 17 GLY HA3 H -7.080 3.121 -0.497 1.00 . A A . 17 GLY HA3 1 1 11 2962 1 1 17 GLY N N -5.366 3.253 0.650 1.00 . A A . 17 GLY N 1 1 11 2963 1 1 17 GLY O O -5.662 5.245 -1.468 1.00 . A A . 17 GLY O 1 1 11 2964 1 1 18 ALA C C -3.531 5.316 -3.503 1.00 . A A . 18 ALA C 1 1 11 2965 1 1 18 ALA CA C -4.622 4.331 -3.927 1.00 . A A . 18 ALA CA 1 1 11 2966 1 1 18 ALA CB C -5.789 5.070 -4.573 1.00 . A A . 18 ALA CB 1 1 11 2967 1 1 18 ALA H H -5.054 2.541 -2.889 1.00 . A A . 18 ALA H 1 1 11 2968 1 1 18 ALA HA H -4.208 3.662 -4.666 1.00 . A A . 18 ALA HA 1 1 11 2969 1 1 18 ALA HB1 H -6.514 5.331 -3.816 1.00 . A A . 18 ALA HB1 1 1 11 2970 1 1 18 ALA HB2 H -6.253 4.433 -5.311 1.00 . A A . 18 ALA HB2 1 1 11 2971 1 1 18 ALA HB3 H -5.426 5.969 -5.050 1.00 . A A . 18 ALA HB3 1 1 11 2972 1 1 18 ALA N N -5.090 3.515 -2.806 1.00 . A A . 18 ALA N 1 1 11 2973 1 1 18 ALA O O -3.421 6.409 -4.054 1.00 . A A . 18 ALA O 1 1 11 2974 1 1 19 GLY C C -0.920 5.206 -0.880 1.00 . A A . 19 GLY C 1 1 11 2975 1 1 19 GLY CA C -1.659 5.785 -2.065 1.00 . A A . 19 GLY CA 1 1 11 2976 1 1 19 GLY H H -2.852 4.040 -2.121 1.00 . A A . 19 GLY H 1 1 11 2977 1 1 19 GLY HA2 H -0.959 5.940 -2.873 1.00 . A A . 19 GLY HA2 1 1 11 2978 1 1 19 GLY HA3 H -2.081 6.737 -1.781 1.00 . A A . 19 GLY HA3 1 1 11 2979 1 1 19 GLY N N -2.723 4.921 -2.529 1.00 . A A . 19 GLY N 1 1 11 2980 1 1 19 GLY O O -0.572 4.021 -0.872 1.00 . A A . 19 GLY O 1 1 11 2981 1 1 20 GLY C C 0.125 6.700 2.340 1.00 . A A . 20 GLY C 1 1 11 2982 1 1 20 GLY CA C 0.023 5.601 1.307 1.00 . A A . 20 GLY CA 1 1 11 2983 1 1 20 GLY H H -0.981 6.970 0.053 1.00 . A A . 20 GLY H 1 1 11 2984 1 1 20 GLY HA2 H -0.506 4.762 1.737 1.00 . A A . 20 GLY HA2 1 1 11 2985 1 1 20 GLY HA3 H 1.018 5.285 1.031 1.00 . A A . 20 GLY HA3 1 1 11 2986 1 1 20 GLY N N -0.678 6.039 0.121 1.00 . A A . 20 GLY N 1 1 11 2987 1 1 20 GLY O O 0.364 7.858 1.994 1.00 . A A . 20 GLY O 1 1 11 2988 1 1 21 ALA C C 1.444 7.719 4.983 1.00 . A A . 21 ALA C 1 1 11 2989 1 1 21 ALA CA C 0.003 7.298 4.704 1.00 . A A . 21 ALA CA 1 1 11 2990 1 1 21 ALA CB C -0.635 6.707 5.953 1.00 . A A . 21 ALA CB 1 1 11 2991 1 1 21 ALA H H -0.258 5.402 3.807 1.00 . A A . 21 ALA H 1 1 11 2992 1 1 21 ALA HA H -0.566 8.171 4.418 1.00 . A A . 21 ALA HA 1 1 11 2993 1 1 21 ALA HB1 H -1.302 7.434 6.395 1.00 . A A . 21 ALA HB1 1 1 11 2994 1 1 21 ALA HB2 H 0.136 6.449 6.663 1.00 . A A . 21 ALA HB2 1 1 11 2995 1 1 21 ALA HB3 H -1.192 5.820 5.688 1.00 . A A . 21 ALA HB3 1 1 11 2996 1 1 21 ALA N N -0.063 6.342 3.604 1.00 . A A . 21 ALA N 1 1 11 2997 1 1 21 ALA O O 2.051 7.272 5.956 1.00 . A A . 21 ALA O 1 1 11 2998 1 1 22 ALA C C 4.358 7.926 4.208 1.00 . A A . 22 ALA C 1 1 11 2999 1 1 22 ALA CA C 3.349 9.072 4.222 1.00 . A A . 22 ALA CA 1 1 11 3000 1 1 22 ALA CB C 3.512 9.922 5.478 1.00 . A A . 22 ALA CB 1 1 11 3001 1 1 22 ALA H H 1.430 8.871 3.352 1.00 . A A . 22 ALA H 1 1 11 3002 1 1 22 ALA HA H 3.538 9.705 3.367 1.00 . A A . 22 ALA HA 1 1 11 3003 1 1 22 ALA HB1 H 3.339 10.960 5.234 1.00 . A A . 22 ALA HB1 1 1 11 3004 1 1 22 ALA HB2 H 4.513 9.806 5.864 1.00 . A A . 22 ALA HB2 1 1 11 3005 1 1 22 ALA HB3 H 2.798 9.603 6.224 1.00 . A A . 22 ALA HB3 1 1 11 3006 1 1 22 ALA N N 1.978 8.572 4.108 1.00 . A A . 22 ALA N 1 1 11 3007 1 1 22 ALA O O 5.337 7.931 4.953 1.00 . A A . 22 ALA O 1 1 11 3008 1 1 23 GLY C C 4.916 4.917 4.473 1.00 . A A . 23 GLY C 1 1 11 3009 1 1 23 GLY CA C 4.995 5.806 3.250 1.00 . A A . 23 GLY CA 1 1 11 3010 1 1 23 GLY H H 3.313 6.998 2.783 1.00 . A A . 23 GLY H 1 1 11 3011 1 1 23 GLY HA2 H 4.729 5.229 2.378 1.00 . A A . 23 GLY HA2 1 1 11 3012 1 1 23 GLY HA3 H 6.010 6.161 3.140 1.00 . A A . 23 GLY HA3 1 1 11 3013 1 1 23 GLY N N 4.108 6.946 3.349 1.00 . A A . 23 GLY N 1 1 11 3014 1 1 23 GLY O O 3.902 4.250 4.699 1.00 . A A . 23 GLY O 1 1 12 3015 1 1 1 GLY C C 5.561 1.616 6.203 1.00 . A A . 1 GLY C 1 1 12 3016 1 1 1 GLY CA C 6.333 2.854 6.607 1.00 . A A . 1 GLY CA 1 1 12 3017 1 1 1 GLY H1 H 5.653 3.751 8.400 1.00 . A A . 1 GLY H1 1 1 12 3018 1 1 1 GLY HA2 H 6.653 3.372 5.716 1.00 . A A . 1 GLY HA2 1 1 12 3019 1 1 1 GLY HA3 H 7.202 2.551 7.166 1.00 . A A . 1 GLY HA3 1 1 12 3020 1 1 1 GLY N N 5.551 3.763 7.425 1.00 . A A . 1 GLY N 1 1 12 3021 1 1 1 GLY O O 6.112 0.704 5.587 1.00 . A A . 1 GLY O 1 1 12 3022 1 1 2 CYS C C 3.186 0.379 4.726 1.00 . A A . 2 CYS C 1 1 12 3023 1 1 2 CYS CA C 3.439 0.447 6.225 1.00 . A A . 2 CYS CA 1 1 12 3024 1 1 2 CYS CB C 2.109 0.538 6.971 1.00 . A A . 2 CYS CB 1 1 12 3025 1 1 2 CYS H H 3.911 2.340 7.044 1.00 . A A . 2 CYS H 1 1 12 3026 1 1 2 CYS HA H 3.954 -0.452 6.532 1.00 . A A . 2 CYS HA 1 1 12 3027 1 1 2 CYS HB2 H 2.297 0.495 8.030 1.00 . A A . 2 CYS HB2 1 1 12 3028 1 1 2 CYS HB3 H 1.639 1.481 6.733 1.00 . A A . 2 CYS HB3 1 1 12 3029 1 1 2 CYS N N 4.288 1.582 6.552 1.00 . A A . 2 CYS N 1 1 12 3030 1 1 2 CYS O O 3.406 -0.650 4.095 1.00 . A A . 2 CYS O 1 1 12 3031 1 1 2 CYS SG S 0.928 -0.790 6.560 1.00 . A A . 2 CYS SG 1 1 12 3032 1 1 3 CYS C C 3.693 1.399 1.908 1.00 . A A . 3 CYS C 1 1 12 3033 1 1 3 CYS CA C 2.427 1.543 2.739 1.00 . A A . 3 CYS CA 1 1 12 3034 1 1 3 CYS CB C 1.703 2.845 2.408 1.00 . A A . 3 CYS CB 1 1 12 3035 1 1 3 CYS H H 2.561 2.271 4.722 1.00 . A A . 3 CYS H 1 1 12 3036 1 1 3 CYS HA H 1.780 0.713 2.509 1.00 . A A . 3 CYS HA 1 1 12 3037 1 1 3 CYS HB2 H 2.403 3.666 2.457 1.00 . A A . 3 CYS HB2 1 1 12 3038 1 1 3 CYS HB3 H 1.295 2.778 1.411 1.00 . A A . 3 CYS HB3 1 1 12 3039 1 1 3 CYS N N 2.720 1.481 4.164 1.00 . A A . 3 CYS N 1 1 12 3040 1 1 3 CYS O O 3.655 0.883 0.790 1.00 . A A . 3 CYS O 1 1 12 3041 1 1 3 CYS SG S 0.330 3.210 3.542 1.00 . A A . 3 CYS SG 1 1 12 3042 1 1 4 SER C C 6.496 0.279 1.653 1.00 . A A . 4 SER C 1 1 12 3043 1 1 4 SER CA C 6.095 1.744 1.804 1.00 . A A . 4 SER CA 1 1 12 3044 1 1 4 SER CB C 7.150 2.501 2.612 1.00 . A A . 4 SER CB 1 1 12 3045 1 1 4 SER H H 4.765 2.232 3.366 1.00 . A A . 4 SER H 1 1 12 3046 1 1 4 SER HA H 6.004 2.189 0.827 1.00 . A A . 4 SER HA 1 1 12 3047 1 1 4 SER HB2 H 7.416 1.922 3.484 1.00 . A A . 4 SER HB2 1 1 12 3048 1 1 4 SER HB3 H 8.026 2.658 2.001 1.00 . A A . 4 SER HB3 1 1 12 3049 1 1 4 SER HG H 6.916 4.435 2.400 1.00 . A A . 4 SER HG 1 1 12 3050 1 1 4 SER N N 4.807 1.839 2.471 1.00 . A A . 4 SER N 1 1 12 3051 1 1 4 SER O O 7.232 -0.092 0.739 1.00 . A A . 4 SER O 1 1 12 3052 1 1 4 SER OG O 6.652 3.761 3.032 1.00 . A A . 4 SER OG 1 1 12 3053 1 1 5 ASN C C 5.191 -2.702 1.728 1.00 . A A . 5 ASN C 1 1 12 3054 1 1 5 ASN CA C 6.256 -1.979 2.533 1.00 . A A . 5 ASN CA 1 1 12 3055 1 1 5 ASN CB C 6.308 -2.537 3.956 1.00 . A A . 5 ASN CB 1 1 12 3056 1 1 5 ASN CG C 7.693 -2.456 4.563 1.00 . A A . 5 ASN CG 1 1 12 3057 1 1 5 ASN H H 5.380 -0.186 3.240 1.00 . A A . 5 ASN H 1 1 12 3058 1 1 5 ASN HA H 7.215 -2.128 2.059 1.00 . A A . 5 ASN HA 1 1 12 3059 1 1 5 ASN HB2 H 5.629 -1.975 4.581 1.00 . A A . 5 ASN HB2 1 1 12 3060 1 1 5 ASN HB3 H 6.000 -3.573 3.942 1.00 . A A . 5 ASN HB3 1 1 12 3061 1 1 5 ASN HD21 H 7.117 -0.987 5.769 1.00 . A A . 5 ASN HD21 1 1 12 3062 1 1 5 ASN HD22 H 8.765 -1.486 5.917 1.00 . A A . 5 ASN HD22 1 1 12 3063 1 1 5 ASN N N 5.983 -0.549 2.553 1.00 . A A . 5 ASN N 1 1 12 3064 1 1 5 ASN ND2 N 7.877 -1.553 5.513 1.00 . A A . 5 ASN ND2 1 1 12 3065 1 1 5 ASN O O 4.006 -2.556 1.999 1.00 . A A . 5 ASN O 1 1 12 3066 1 1 5 ASN OD1 O 8.596 -3.190 4.168 1.00 . A A . 5 ASN OD1 1 1 12 3067 1 1 6 PRO C C 3.683 -5.098 0.630 1.00 . A A . 6 PRO C 1 1 12 3068 1 1 6 PRO CA C 4.666 -4.219 -0.143 1.00 . A A . 6 PRO CA 1 1 12 3069 1 1 6 PRO CB C 5.589 -5.085 -1.004 1.00 . A A . 6 PRO CB 1 1 12 3070 1 1 6 PRO CD C 7.003 -3.695 0.326 1.00 . A A . 6 PRO CD 1 1 12 3071 1 1 6 PRO CG C 6.888 -4.360 -1.017 1.00 . A A . 6 PRO CG 1 1 12 3072 1 1 6 PRO HA H 4.110 -3.545 -0.779 1.00 . A A . 6 PRO HA 1 1 12 3073 1 1 6 PRO HB2 H 5.686 -6.065 -0.558 1.00 . A A . 6 PRO HB2 1 1 12 3074 1 1 6 PRO HB3 H 5.178 -5.176 -1.999 1.00 . A A . 6 PRO HB3 1 1 12 3075 1 1 6 PRO HD2 H 7.506 -4.344 1.028 1.00 . A A . 6 PRO HD2 1 1 12 3076 1 1 6 PRO HD3 H 7.524 -2.754 0.239 1.00 . A A . 6 PRO HD3 1 1 12 3077 1 1 6 PRO HG2 H 7.699 -5.059 -1.159 1.00 . A A . 6 PRO HG2 1 1 12 3078 1 1 6 PRO HG3 H 6.889 -3.619 -1.803 1.00 . A A . 6 PRO HG3 1 1 12 3079 1 1 6 PRO N N 5.597 -3.484 0.721 1.00 . A A . 6 PRO N 1 1 12 3080 1 1 6 PRO O O 2.496 -5.138 0.311 1.00 . A A . 6 PRO O 1 1 12 3081 1 1 7 VAL C C 2.298 -5.889 3.231 1.00 . A A . 7 VAL C 1 1 12 3082 1 1 7 VAL CA C 3.335 -6.682 2.444 1.00 . A A . 7 VAL CA 1 1 12 3083 1 1 7 VAL CB C 4.180 -7.527 3.423 1.00 . A A . 7 VAL CB 1 1 12 3084 1 1 7 VAL CG1 C 3.302 -8.504 4.193 1.00 . A A . 7 VAL CG1 1 1 12 3085 1 1 7 VAL CG2 C 5.281 -8.266 2.678 1.00 . A A . 7 VAL CG2 1 1 12 3086 1 1 7 VAL H H 5.129 -5.726 1.854 1.00 . A A . 7 VAL H 1 1 12 3087 1 1 7 VAL HA H 2.823 -7.354 1.771 1.00 . A A . 7 VAL HA 1 1 12 3088 1 1 7 VAL HB H 4.643 -6.858 4.133 1.00 . A A . 7 VAL HB 1 1 12 3089 1 1 7 VAL HG11 H 2.371 -8.022 4.453 1.00 . A A . 7 VAL HG11 1 1 12 3090 1 1 7 VAL HG12 H 3.813 -8.812 5.094 1.00 . A A . 7 VAL HG12 1 1 12 3091 1 1 7 VAL HG13 H 3.102 -9.369 3.579 1.00 . A A . 7 VAL HG13 1 1 12 3092 1 1 7 VAL HG21 H 4.963 -9.278 2.476 1.00 . A A . 7 VAL HG21 1 1 12 3093 1 1 7 VAL HG22 H 6.176 -8.285 3.283 1.00 . A A . 7 VAL HG22 1 1 12 3094 1 1 7 VAL HG23 H 5.489 -7.761 1.746 1.00 . A A . 7 VAL HG23 1 1 12 3095 1 1 7 VAL N N 4.177 -5.800 1.642 1.00 . A A . 7 VAL N 1 1 12 3096 1 1 7 VAL O O 1.102 -6.168 3.160 1.00 . A A . 7 VAL O 1 1 12 3097 1 1 8 CYS C C 0.930 -3.274 3.893 1.00 . A A . 8 CYS C 1 1 12 3098 1 1 8 CYS CA C 1.884 -4.061 4.784 1.00 . A A . 8 CYS CA 1 1 12 3099 1 1 8 CYS CB C 2.704 -3.100 5.643 1.00 . A A . 8 CYS CB 1 1 12 3100 1 1 8 CYS H H 3.731 -4.724 3.981 1.00 . A A . 8 CYS H 1 1 12 3101 1 1 8 CYS HA H 1.308 -4.709 5.427 1.00 . A A . 8 CYS HA 1 1 12 3102 1 1 8 CYS HB2 H 3.611 -3.593 5.949 1.00 . A A . 8 CYS HB2 1 1 12 3103 1 1 8 CYS HB3 H 2.957 -2.237 5.049 1.00 . A A . 8 CYS HB3 1 1 12 3104 1 1 8 CYS N N 2.767 -4.898 3.975 1.00 . A A . 8 CYS N 1 1 12 3105 1 1 8 CYS O O -0.232 -3.080 4.233 1.00 . A A . 8 CYS O 1 1 12 3106 1 1 8 CYS SG S 1.855 -2.501 7.147 1.00 . A A . 8 CYS SG 1 1 12 3107 1 1 9 HIS C C -0.563 -2.830 1.333 1.00 . A A . 9 HIS C 1 1 12 3108 1 1 9 HIS CA C 0.651 -2.042 1.804 1.00 . A A . 9 HIS CA 1 1 12 3109 1 1 9 HIS CB C 1.509 -1.654 0.597 1.00 . A A . 9 HIS CB 1 1 12 3110 1 1 9 HIS CD2 C -0.284 0.053 -0.208 1.00 . A A . 9 HIS CD2 1 1 12 3111 1 1 9 HIS CE1 C 0.832 0.908 -1.890 1.00 . A A . 9 HIS CE1 1 1 12 3112 1 1 9 HIS CG C 0.919 -0.571 -0.258 1.00 . A A . 9 HIS CG 1 1 12 3113 1 1 9 HIS H H 2.386 -3.003 2.555 1.00 . A A . 9 HIS H 1 1 12 3114 1 1 9 HIS HA H 0.315 -1.145 2.301 1.00 . A A . 9 HIS HA 1 1 12 3115 1 1 9 HIS HB2 H 2.470 -1.317 0.944 1.00 . A A . 9 HIS HB2 1 1 12 3116 1 1 9 HIS HB3 H 1.648 -2.527 -0.025 1.00 . A A . 9 HIS HB3 1 1 12 3117 1 1 9 HIS HD1 H 2.501 -0.242 -1.611 1.00 . A A . 9 HIS HD1 1 1 12 3118 1 1 9 HIS HD2 H -1.073 -0.135 0.505 1.00 . A A . 9 HIS HD2 1 1 12 3119 1 1 9 HIS HE1 H 1.100 1.509 -2.746 1.00 . A A . 9 HIS HE1 1 1 12 3120 1 1 9 HIS HE2 H -1.114 1.437 -1.546 1.00 . A A . 9 HIS HE2 1 1 12 3121 1 1 9 HIS N N 1.441 -2.818 2.756 1.00 . A A . 9 HIS N 1 1 12 3122 1 1 9 HIS ND1 N 1.592 -0.010 -1.323 1.00 . A A . 9 HIS ND1 1 1 12 3123 1 1 9 HIS NE2 N -0.313 0.967 -1.233 1.00 . A A . 9 HIS NE2 1 1 12 3124 1 1 9 HIS O O -1.675 -2.315 1.329 1.00 . A A . 9 HIS O 1 1 12 3125 1 1 10 LEU C C -2.386 -5.267 1.592 1.00 . A A . 10 LEU C 1 1 12 3126 1 1 10 LEU CA C -1.424 -4.928 0.458 1.00 . A A . 10 LEU CA 1 1 12 3127 1 1 10 LEU CB C -0.873 -6.213 -0.171 1.00 . A A . 10 LEU CB 1 1 12 3128 1 1 10 LEU CD1 C -1.957 -5.905 -2.415 1.00 . A A . 10 LEU CD1 1 1 12 3129 1 1 10 LEU CD2 C 0.379 -5.097 -2.053 1.00 . A A . 10 LEU CD2 1 1 12 3130 1 1 10 LEU CG C -0.645 -6.161 -1.688 1.00 . A A . 10 LEU CG 1 1 12 3131 1 1 10 LEU H H 0.577 -4.429 0.957 1.00 . A A . 10 LEU H 1 1 12 3132 1 1 10 LEU HA H -1.965 -4.377 -0.296 1.00 . A A . 10 LEU HA 1 1 12 3133 1 1 10 LEU HB2 H 0.070 -6.444 0.305 1.00 . A A . 10 LEU HB2 1 1 12 3134 1 1 10 LEU HB3 H -1.565 -7.016 0.038 1.00 . A A . 10 LEU HB3 1 1 12 3135 1 1 10 LEU HD11 H -2.584 -5.267 -1.810 1.00 . A A . 10 LEU HD11 1 1 12 3136 1 1 10 LEU HD12 H -2.460 -6.844 -2.590 1.00 . A A . 10 LEU HD12 1 1 12 3137 1 1 10 LEU HD13 H -1.755 -5.422 -3.360 1.00 . A A . 10 LEU HD13 1 1 12 3138 1 1 10 LEU HD21 H 0.655 -4.543 -1.166 1.00 . A A . 10 LEU HD21 1 1 12 3139 1 1 10 LEU HD22 H -0.046 -4.422 -2.780 1.00 . A A . 10 LEU HD22 1 1 12 3140 1 1 10 LEU HD23 H 1.257 -5.569 -2.468 1.00 . A A . 10 LEU HD23 1 1 12 3141 1 1 10 LEU HG H -0.265 -7.117 -2.018 1.00 . A A . 10 LEU HG 1 1 12 3142 1 1 10 LEU N N -0.340 -4.075 0.933 1.00 . A A . 10 LEU N 1 1 12 3143 1 1 10 LEU O O -3.606 -5.209 1.423 1.00 . A A . 10 LEU O 1 1 12 3144 1 1 11 GLU C C -3.461 -4.745 4.370 1.00 . A A . 11 GLU C 1 1 12 3145 1 1 11 GLU CA C -2.636 -5.949 3.914 1.00 . A A . 11 GLU CA 1 1 12 3146 1 1 11 GLU CB C -1.723 -6.424 5.051 1.00 . A A . 11 GLU CB 1 1 12 3147 1 1 11 GLU CD C -1.539 -7.074 7.484 1.00 . A A . 11 GLU CD 1 1 12 3148 1 1 11 GLU CG C -2.464 -6.887 6.296 1.00 . A A . 11 GLU CG 1 1 12 3149 1 1 11 GLU H H -0.853 -5.632 2.819 1.00 . A A . 11 GLU H 1 1 12 3150 1 1 11 GLU HA H -3.303 -6.748 3.638 1.00 . A A . 11 GLU HA 1 1 12 3151 1 1 11 GLU HB2 H -1.123 -7.247 4.691 1.00 . A A . 11 GLU HB2 1 1 12 3152 1 1 11 GLU HB3 H -1.068 -5.612 5.330 1.00 . A A . 11 GLU HB3 1 1 12 3153 1 1 11 GLU HG2 H -3.210 -6.150 6.552 1.00 . A A . 11 GLU HG2 1 1 12 3154 1 1 11 GLU HG3 H -2.948 -7.830 6.082 1.00 . A A . 11 GLU HG3 1 1 12 3155 1 1 11 GLU N N -1.833 -5.608 2.747 1.00 . A A . 11 GLU N 1 1 12 3156 1 1 11 GLU O O -4.640 -4.865 4.702 1.00 . A A . 11 GLU O 1 1 12 3157 1 1 11 GLU OE1 O -0.599 -7.882 7.384 1.00 . A A . 11 GLU OE1 1 1 12 3158 1 1 11 GLU OE2 O -1.744 -6.387 8.513 1.00 . A A . 11 GLU OE2 1 1 12 3159 1 1 12 HIS C C -3.856 -1.484 3.621 1.00 . A A . 12 HIS C 1 1 12 3160 1 1 12 HIS CA C -3.491 -2.355 4.819 1.00 . A A . 12 HIS CA 1 1 12 3161 1 1 12 HIS CB C -2.606 -1.544 5.787 1.00 . A A . 12 HIS CB 1 1 12 3162 1 1 12 HIS CD2 C -1.858 -3.624 7.150 1.00 . A A . 12 HIS CD2 1 1 12 3163 1 1 12 HIS CE1 C -1.353 -2.634 9.029 1.00 . A A . 12 HIS CE1 1 1 12 3164 1 1 12 HIS CG C -2.108 -2.308 6.983 1.00 . A A . 12 HIS CG 1 1 12 3165 1 1 12 HIS H H -1.883 -3.547 4.116 1.00 . A A . 12 HIS H 1 1 12 3166 1 1 12 HIS HA H -4.399 -2.636 5.331 1.00 . A A . 12 HIS HA 1 1 12 3167 1 1 12 HIS HB2 H -1.742 -1.183 5.250 1.00 . A A . 12 HIS HB2 1 1 12 3168 1 1 12 HIS HB3 H -3.172 -0.697 6.149 1.00 . A A . 12 HIS HB3 1 1 12 3169 1 1 12 HIS HD1 H -1.830 -0.753 8.378 1.00 . A A . 12 HIS HD1 1 1 12 3170 1 1 12 HIS HD2 H -1.981 -4.394 6.403 1.00 . A A . 12 HIS HD2 1 1 12 3171 1 1 12 HIS HE1 H -1.029 -2.461 10.044 1.00 . A A . 12 HIS HE1 1 1 12 3172 1 1 12 HIS HE2 H -1.318 -4.687 8.873 1.00 . A A . 12 HIS HE2 1 1 12 3173 1 1 12 HIS N N -2.828 -3.581 4.390 1.00 . A A . 12 HIS N 1 1 12 3174 1 1 12 HIS ND1 N -1.778 -1.710 8.182 1.00 . A A . 12 HIS ND1 1 1 12 3175 1 1 12 HIS NE2 N -1.395 -3.803 8.423 1.00 . A A . 12 HIS NE2 1 1 12 3176 1 1 12 HIS O O -3.707 -0.263 3.671 1.00 . A A . 12 HIS O 1 1 12 3177 1 1 13 SER C C -5.777 -0.322 1.662 1.00 . A A . 13 SER C 1 1 12 3178 1 1 13 SER CA C -4.720 -1.376 1.344 1.00 . A A . 13 SER CA 1 1 12 3179 1 1 13 SER CB C -5.240 -2.335 0.270 1.00 . A A . 13 SER CB 1 1 12 3180 1 1 13 SER H H -4.430 -3.087 2.567 1.00 . A A . 13 SER H 1 1 12 3181 1 1 13 SER HA H -3.838 -0.878 0.969 1.00 . A A . 13 SER HA 1 1 12 3182 1 1 13 SER HB2 H -6.023 -2.950 0.689 1.00 . A A . 13 SER HB2 1 1 12 3183 1 1 13 SER HB3 H -5.635 -1.764 -0.558 1.00 . A A . 13 SER HB3 1 1 12 3184 1 1 13 SER HG H -4.146 -3.964 0.350 1.00 . A A . 13 SER HG 1 1 12 3185 1 1 13 SER N N -4.337 -2.110 2.549 1.00 . A A . 13 SER N 1 1 12 3186 1 1 13 SER O O -5.724 0.797 1.152 1.00 . A A . 13 SER O 1 1 12 3187 1 1 13 SER OG O -4.206 -3.176 -0.208 1.00 . A A . 13 SER OG 1 1 12 3188 1 1 14 ASN C C -7.225 1.413 3.686 1.00 . A A . 14 ASN C 1 1 12 3189 1 1 14 ASN CA C -7.791 0.223 2.917 1.00 . A A . 14 ASN CA 1 1 12 3190 1 1 14 ASN CB C -8.826 -0.529 3.766 1.00 . A A . 14 ASN CB 1 1 12 3191 1 1 14 ASN CG C -9.975 0.351 4.234 1.00 . A A . 14 ASN CG 1 1 12 3192 1 1 14 ASN H H -6.701 -1.590 2.891 1.00 . A A . 14 ASN H 1 1 12 3193 1 1 14 ASN HA H -8.267 0.586 2.022 1.00 . A A . 14 ASN HA 1 1 12 3194 1 1 14 ASN HB2 H -9.238 -1.337 3.182 1.00 . A A . 14 ASN HB2 1 1 12 3195 1 1 14 ASN HB3 H -8.335 -0.937 4.636 1.00 . A A . 14 ASN HB3 1 1 12 3196 1 1 14 ASN HD21 H -11.236 -0.601 3.031 1.00 . A A . 14 ASN HD21 1 1 12 3197 1 1 14 ASN HD22 H -11.916 0.671 3.981 1.00 . A A . 14 ASN HD22 1 1 12 3198 1 1 14 ASN N N -6.724 -0.687 2.516 1.00 . A A . 14 ASN N 1 1 12 3199 1 1 14 ASN ND2 N -11.161 0.116 3.693 1.00 . A A . 14 ASN ND2 1 1 12 3200 1 1 14 ASN O O -7.611 2.555 3.453 1.00 . A A . 14 ASN O 1 1 12 3201 1 1 14 ASN OD1 O -9.803 1.227 5.075 1.00 . A A . 14 ASN OD1 1 1 12 3202 1 1 15 LEU C C -4.875 3.138 4.562 1.00 . A A . 15 LEU C 1 1 12 3203 1 1 15 LEU CA C -5.670 2.157 5.413 1.00 . A A . 15 LEU CA 1 1 12 3204 1 1 15 LEU CB C -4.752 1.531 6.475 1.00 . A A . 15 LEU CB 1 1 12 3205 1 1 15 LEU CD1 C -6.525 1.701 8.253 1.00 . A A . 15 LEU CD1 1 1 12 3206 1 1 15 LEU CD2 C -6.056 -0.514 7.182 1.00 . A A . 15 LEU CD2 1 1 12 3207 1 1 15 LEU CG C -5.457 0.811 7.636 1.00 . A A . 15 LEU CG 1 1 12 3208 1 1 15 LEU H H -6.040 0.195 4.718 1.00 . A A . 15 LEU H 1 1 12 3209 1 1 15 LEU HA H -6.453 2.699 5.911 1.00 . A A . 15 LEU HA 1 1 12 3210 1 1 15 LEU HB2 H -4.107 0.820 5.982 1.00 . A A . 15 LEU HB2 1 1 12 3211 1 1 15 LEU HB3 H -4.139 2.315 6.892 1.00 . A A . 15 LEU HB3 1 1 12 3212 1 1 15 LEU HD11 H -7.316 1.087 8.657 1.00 . A A . 15 LEU HD11 1 1 12 3213 1 1 15 LEU HD12 H -6.928 2.357 7.497 1.00 . A A . 15 LEU HD12 1 1 12 3214 1 1 15 LEU HD13 H -6.087 2.291 9.046 1.00 . A A . 15 LEU HD13 1 1 12 3215 1 1 15 LEU HD21 H -5.393 -1.322 7.453 1.00 . A A . 15 LEU HD21 1 1 12 3216 1 1 15 LEU HD22 H -6.188 -0.501 6.110 1.00 . A A . 15 LEU HD22 1 1 12 3217 1 1 15 LEU HD23 H -7.015 -0.659 7.660 1.00 . A A . 15 LEU HD23 1 1 12 3218 1 1 15 LEU HG H -4.727 0.597 8.404 1.00 . A A . 15 LEU HG 1 1 12 3219 1 1 15 LEU N N -6.302 1.126 4.594 1.00 . A A . 15 LEU N 1 1 12 3220 1 1 15 LEU O O -4.979 4.348 4.736 1.00 . A A . 15 LEU O 1 1 12 3221 1 1 16 CYS C C -4.163 4.219 1.789 1.00 . A A . 16 CYS C 1 1 12 3222 1 1 16 CYS CA C -3.276 3.459 2.770 1.00 . A A . 16 CYS CA 1 1 12 3223 1 1 16 CYS CB C -2.224 2.638 2.022 1.00 . A A . 16 CYS CB 1 1 12 3224 1 1 16 CYS H H -4.038 1.638 3.549 1.00 . A A . 16 CYS H 1 1 12 3225 1 1 16 CYS HA H -2.771 4.179 3.398 1.00 . A A . 16 CYS HA 1 1 12 3226 1 1 16 CYS HB2 H -2.712 1.892 1.417 1.00 . A A . 16 CYS HB2 1 1 12 3227 1 1 16 CYS HB3 H -1.656 3.296 1.381 1.00 . A A . 16 CYS HB3 1 1 12 3228 1 1 16 CYS N N -4.082 2.613 3.642 1.00 . A A . 16 CYS N 1 1 12 3229 1 1 16 CYS O O -3.859 5.349 1.414 1.00 . A A . 16 CYS O 1 1 12 3230 1 1 16 CYS SG S -1.045 1.779 3.113 1.00 . A A . 16 CYS SG 1 1 12 3231 1 1 17 GLY C C -6.925 5.389 1.112 1.00 . A A . 17 GLY C 1 1 12 3232 1 1 17 GLY CA C -6.179 4.245 0.462 1.00 . A A . 17 GLY CA 1 1 12 3233 1 1 17 GLY H H -5.467 2.701 1.721 1.00 . A A . 17 GLY H 1 1 12 3234 1 1 17 GLY HA2 H -5.620 4.626 -0.371 1.00 . A A . 17 GLY HA2 1 1 12 3235 1 1 17 GLY HA3 H -6.893 3.519 0.105 1.00 . A A . 17 GLY HA3 1 1 12 3236 1 1 17 GLY N N -5.265 3.600 1.384 1.00 . A A . 17 GLY N 1 1 12 3237 1 1 17 GLY O O -6.985 6.494 0.576 1.00 . A A . 17 GLY O 1 1 12 3238 1 1 18 ALA C C -7.348 6.735 4.113 1.00 . A A . 18 ALA C 1 1 12 3239 1 1 18 ALA CA C -8.225 6.112 3.031 1.00 . A A . 18 ALA CA 1 1 12 3240 1 1 18 ALA CB C -9.471 5.487 3.641 1.00 . A A . 18 ALA CB 1 1 12 3241 1 1 18 ALA H H -7.378 4.214 2.644 1.00 . A A . 18 ALA H 1 1 12 3242 1 1 18 ALA HA H -8.537 6.887 2.345 1.00 . A A . 18 ALA HA 1 1 12 3243 1 1 18 ALA HB1 H -9.273 4.454 3.886 1.00 . A A . 18 ALA HB1 1 1 12 3244 1 1 18 ALA HB2 H -10.284 5.539 2.933 1.00 . A A . 18 ALA HB2 1 1 12 3245 1 1 18 ALA HB3 H -9.741 6.024 4.539 1.00 . A A . 18 ALA HB3 1 1 12 3246 1 1 18 ALA N N -7.480 5.116 2.275 1.00 . A A . 18 ALA N 1 1 12 3247 1 1 18 ALA O O -7.757 6.857 5.268 1.00 . A A . 18 ALA O 1 1 12 3248 1 1 19 GLY C C -3.991 8.290 4.015 1.00 . A A . 19 GLY C 1 1 12 3249 1 1 19 GLY CA C -5.223 7.722 4.683 1.00 . A A . 19 GLY CA 1 1 12 3250 1 1 19 GLY H H -5.868 7.000 2.801 1.00 . A A . 19 GLY H 1 1 12 3251 1 1 19 GLY HA2 H -5.734 8.515 5.208 1.00 . A A . 19 GLY HA2 1 1 12 3252 1 1 19 GLY HA3 H -4.919 6.970 5.397 1.00 . A A . 19 GLY HA3 1 1 12 3253 1 1 19 GLY N N -6.140 7.123 3.734 1.00 . A A . 19 GLY N 1 1 12 3254 1 1 19 GLY O O -3.493 9.346 4.405 1.00 . A A . 19 GLY O 1 1 12 3255 1 1 20 GLY C C -1.051 7.397 2.819 1.00 . A A . 20 GLY C 1 1 12 3256 1 1 20 GLY CA C -2.315 8.046 2.305 1.00 . A A . 20 GLY CA 1 1 12 3257 1 1 20 GLY H H -3.925 6.751 2.738 1.00 . A A . 20 GLY H 1 1 12 3258 1 1 20 GLY HA2 H -2.422 7.819 1.256 1.00 . A A . 20 GLY HA2 1 1 12 3259 1 1 20 GLY HA3 H -2.230 9.116 2.424 1.00 . A A . 20 GLY HA3 1 1 12 3260 1 1 20 GLY N N -3.493 7.590 3.007 1.00 . A A . 20 GLY N 1 1 12 3261 1 1 20 GLY O O -0.947 6.170 2.871 1.00 . A A . 20 GLY O 1 1 12 3262 1 1 21 ALA C C 1.072 7.269 5.151 1.00 . A A . 21 ALA C 1 1 12 3263 1 1 21 ALA CA C 1.189 7.743 3.704 1.00 . A A . 21 ALA CA 1 1 12 3264 1 1 21 ALA CB C 2.245 8.833 3.582 1.00 . A A . 21 ALA CB 1 1 12 3265 1 1 21 ALA H H -0.239 9.186 3.122 1.00 . A A . 21 ALA H 1 1 12 3266 1 1 21 ALA HA H 1.498 6.909 3.090 1.00 . A A . 21 ALA HA 1 1 12 3267 1 1 21 ALA HB1 H 3.175 8.397 3.248 1.00 . A A . 21 ALA HB1 1 1 12 3268 1 1 21 ALA HB2 H 2.393 9.299 4.545 1.00 . A A . 21 ALA HB2 1 1 12 3269 1 1 21 ALA HB3 H 1.917 9.574 2.870 1.00 . A A . 21 ALA HB3 1 1 12 3270 1 1 21 ALA N N -0.088 8.223 3.193 1.00 . A A . 21 ALA N 1 1 12 3271 1 1 21 ALA O O 1.488 7.967 6.077 1.00 . A A . 21 ALA O 1 1 12 3272 1 1 22 ALA C C 1.663 4.977 7.218 1.00 . A A . 22 ALA C 1 1 12 3273 1 1 22 ALA CA C 0.331 5.502 6.668 1.00 . A A . 22 ALA CA 1 1 12 3274 1 1 22 ALA CB C -0.711 4.392 6.632 1.00 . A A . 22 ALA CB 1 1 12 3275 1 1 22 ALA H H 0.191 5.577 4.555 1.00 . A A . 22 ALA H 1 1 12 3276 1 1 22 ALA HA H -0.031 6.280 7.323 1.00 . A A . 22 ALA HA 1 1 12 3277 1 1 22 ALA HB1 H -1.692 4.816 6.783 1.00 . A A . 22 ALA HB1 1 1 12 3278 1 1 22 ALA HB2 H -0.503 3.678 7.415 1.00 . A A . 22 ALA HB2 1 1 12 3279 1 1 22 ALA HB3 H -0.677 3.897 5.673 1.00 . A A . 22 ALA HB3 1 1 12 3280 1 1 22 ALA N N 0.504 6.082 5.338 1.00 . A A . 22 ALA N 1 1 12 3281 1 1 22 ALA O O 1.808 3.789 7.519 1.00 . A A . 22 ALA O 1 1 12 3282 1 1 23 GLY C C 4.698 4.617 6.875 1.00 . A A . 23 GLY C 1 1 12 3283 1 1 23 GLY CA C 3.941 5.516 7.831 1.00 . A A . 23 GLY CA 1 1 12 3284 1 1 23 GLY H H 2.450 6.805 7.064 1.00 . A A . 23 GLY H 1 1 12 3285 1 1 23 GLY HA2 H 4.513 6.418 7.989 1.00 . A A . 23 GLY HA2 1 1 12 3286 1 1 23 GLY HA3 H 3.827 5.004 8.775 1.00 . A A . 23 GLY HA3 1 1 12 3287 1 1 23 GLY N N 2.630 5.875 7.333 1.00 . A A . 23 GLY N 1 1 12 3288 1 1 23 GLY O O 4.510 4.692 5.660 1.00 . A A . 23 GLY O 1 1 13 3289 1 1 1 GLY C C 5.691 1.881 6.185 1.00 . A A . 1 GLY C 1 1 13 3290 1 1 1 GLY CA C 6.367 3.141 6.681 1.00 . A A . 1 GLY CA 1 1 13 3291 1 1 1 GLY H1 H 7.187 4.563 5.344 1.00 . A A . 1 GLY H1 1 1 13 3292 1 1 1 GLY HA2 H 7.388 2.912 6.928 1.00 . A A . 1 GLY HA2 1 1 13 3293 1 1 1 GLY HA3 H 5.860 3.479 7.573 1.00 . A A . 1 GLY HA3 1 1 13 3294 1 1 1 GLY N N 6.345 4.211 5.699 1.00 . A A . 1 GLY N 1 1 13 3295 1 1 1 GLY O O 6.204 1.189 5.308 1.00 . A A . 1 GLY O 1 1 13 3296 1 1 2 CYS C C 3.405 0.421 4.916 1.00 . A A . 2 CYS C 1 1 13 3297 1 1 2 CYS CA C 3.746 0.423 6.400 1.00 . A A . 2 CYS CA 1 1 13 3298 1 1 2 CYS CB C 2.456 0.404 7.219 1.00 . A A . 2 CYS CB 1 1 13 3299 1 1 2 CYS H H 4.196 2.204 7.446 1.00 . A A . 2 CYS H 1 1 13 3300 1 1 2 CYS HA H 4.327 -0.457 6.630 1.00 . A A . 2 CYS HA 1 1 13 3301 1 1 2 CYS HB2 H 2.700 0.201 8.246 1.00 . A A . 2 CYS HB2 1 1 13 3302 1 1 2 CYS HB3 H 1.988 1.376 7.156 1.00 . A A . 2 CYS HB3 1 1 13 3303 1 1 2 CYS N N 4.535 1.597 6.757 1.00 . A A . 2 CYS N 1 1 13 3304 1 1 2 CYS O O 3.584 -0.579 4.226 1.00 . A A . 2 CYS O 1 1 13 3305 1 1 2 CYS SG S 1.225 -0.836 6.686 1.00 . A A . 2 CYS SG 1 1 13 3306 1 1 3 CYS C C 3.692 1.523 2.097 1.00 . A A . 3 CYS C 1 1 13 3307 1 1 3 CYS CA C 2.509 1.686 3.046 1.00 . A A . 3 CYS CA 1 1 13 3308 1 1 3 CYS CB C 1.820 3.031 2.836 1.00 . A A . 3 CYS CB 1 1 13 3309 1 1 3 CYS H H 2.776 2.304 5.053 1.00 . A A . 3 CYS H 1 1 13 3310 1 1 3 CYS HA H 1.805 0.899 2.835 1.00 . A A . 3 CYS HA 1 1 13 3311 1 1 3 CYS HB2 H 2.540 3.824 2.978 1.00 . A A . 3 CYS HB2 1 1 13 3312 1 1 3 CYS HB3 H 1.432 3.077 1.830 1.00 . A A . 3 CYS HB3 1 1 13 3313 1 1 3 CYS N N 2.903 1.546 4.442 1.00 . A A . 3 CYS N 1 1 13 3314 1 1 3 CYS O O 3.528 1.052 0.970 1.00 . A A . 3 CYS O 1 1 13 3315 1 1 3 CYS SG S 0.435 3.323 3.985 1.00 . A A . 3 CYS SG 1 1 13 3316 1 1 4 SER C C 6.448 0.287 1.581 1.00 . A A . 4 SER C 1 1 13 3317 1 1 4 SER CA C 6.085 1.760 1.748 1.00 . A A . 4 SER CA 1 1 13 3318 1 1 4 SER CB C 7.243 2.518 2.395 1.00 . A A . 4 SER CB 1 1 13 3319 1 1 4 SER H H 4.953 2.248 3.465 1.00 . A A . 4 SER H 1 1 13 3320 1 1 4 SER HA H 5.882 2.183 0.777 1.00 . A A . 4 SER HA 1 1 13 3321 1 1 4 SER HB2 H 7.484 2.063 3.345 1.00 . A A . 4 SER HB2 1 1 13 3322 1 1 4 SER HB3 H 8.106 2.476 1.748 1.00 . A A . 4 SER HB3 1 1 13 3323 1 1 4 SER HG H 6.454 4.218 1.831 1.00 . A A . 4 SER HG 1 1 13 3324 1 1 4 SER N N 4.880 1.893 2.556 1.00 . A A . 4 SER N 1 1 13 3325 1 1 4 SER O O 7.126 -0.098 0.631 1.00 . A A . 4 SER O 1 1 13 3326 1 1 4 SER OG O 6.899 3.875 2.613 1.00 . A A . 4 SER OG 1 1 13 3327 1 1 5 ASN C C 5.133 -2.664 1.671 1.00 . A A . 5 ASN C 1 1 13 3328 1 1 5 ASN CA C 6.222 -1.966 2.467 1.00 . A A . 5 ASN CA 1 1 13 3329 1 1 5 ASN CB C 6.288 -2.541 3.884 1.00 . A A . 5 ASN CB 1 1 13 3330 1 1 5 ASN CG C 7.653 -2.368 4.518 1.00 . A A . 5 ASN CG 1 1 13 3331 1 1 5 ASN H H 5.411 -0.162 3.227 1.00 . A A . 5 ASN H 1 1 13 3332 1 1 5 ASN HA H 7.170 -2.124 1.976 1.00 . A A . 5 ASN HA 1 1 13 3333 1 1 5 ASN HB2 H 5.558 -2.040 4.503 1.00 . A A . 5 ASN HB2 1 1 13 3334 1 1 5 ASN HB3 H 6.059 -3.597 3.848 1.00 . A A . 5 ASN HB3 1 1 13 3335 1 1 5 ASN HD21 H 6.938 -1.000 5.766 1.00 . A A . 5 ASN HD21 1 1 13 3336 1 1 5 ASN HD22 H 8.619 -1.361 5.925 1.00 . A A . 5 ASN HD22 1 1 13 3337 1 1 5 ASN N N 5.969 -0.533 2.507 1.00 . A A . 5 ASN N 1 1 13 3338 1 1 5 ASN ND2 N 7.745 -1.488 5.502 1.00 . A A . 5 ASN ND2 1 1 13 3339 1 1 5 ASN O O 3.954 -2.516 1.971 1.00 . A A . 5 ASN O 1 1 13 3340 1 1 5 ASN OD1 O 8.619 -3.010 4.116 1.00 . A A . 5 ASN OD1 1 1 13 3341 1 1 6 PRO C C 3.594 -5.028 0.552 1.00 . A A . 6 PRO C 1 1 13 3342 1 1 6 PRO CA C 4.558 -4.133 -0.225 1.00 . A A . 6 PRO CA 1 1 13 3343 1 1 6 PRO CB C 5.457 -4.979 -1.131 1.00 . A A . 6 PRO CB 1 1 13 3344 1 1 6 PRO CD C 6.907 -3.632 0.204 1.00 . A A . 6 PRO CD 1 1 13 3345 1 1 6 PRO CG C 6.760 -4.260 -1.153 1.00 . A A . 6 PRO CG 1 1 13 3346 1 1 6 PRO HA H 3.990 -3.442 -0.829 1.00 . A A . 6 PRO HA 1 1 13 3347 1 1 6 PRO HB2 H 5.559 -5.971 -0.714 1.00 . A A . 6 PRO HB2 1 1 13 3348 1 1 6 PRO HB3 H 5.023 -5.040 -2.117 1.00 . A A . 6 PRO HB3 1 1 13 3349 1 1 6 PRO HD2 H 7.423 -4.302 0.876 1.00 . A A . 6 PRO HD2 1 1 13 3350 1 1 6 PRO HD3 H 7.433 -2.690 0.130 1.00 . A A . 6 PRO HD3 1 1 13 3351 1 1 6 PRO HG2 H 7.563 -4.959 -1.333 1.00 . A A . 6 PRO HG2 1 1 13 3352 1 1 6 PRO HG3 H 6.746 -3.498 -1.918 1.00 . A A . 6 PRO HG3 1 1 13 3353 1 1 6 PRO N N 5.513 -3.423 0.635 1.00 . A A . 6 PRO N 1 1 13 3354 1 1 6 PRO O O 2.391 -5.017 0.299 1.00 . A A . 6 PRO O 1 1 13 3355 1 1 7 VAL C C 2.311 -5.934 3.154 1.00 . A A . 7 VAL C 1 1 13 3356 1 1 7 VAL CA C 3.309 -6.704 2.297 1.00 . A A . 7 VAL CA 1 1 13 3357 1 1 7 VAL CB C 4.186 -7.586 3.212 1.00 . A A . 7 VAL CB 1 1 13 3358 1 1 7 VAL CG1 C 3.328 -8.544 4.027 1.00 . A A . 7 VAL CG1 1 1 13 3359 1 1 7 VAL CG2 C 5.215 -8.350 2.392 1.00 . A A . 7 VAL CG2 1 1 13 3360 1 1 7 VAL H H 5.090 -5.760 1.651 1.00 . A A . 7 VAL H 1 1 13 3361 1 1 7 VAL HA H 2.766 -7.350 1.622 1.00 . A A . 7 VAL HA 1 1 13 3362 1 1 7 VAL HB H 4.715 -6.941 3.898 1.00 . A A . 7 VAL HB 1 1 13 3363 1 1 7 VAL HG11 H 3.942 -9.035 4.767 1.00 . A A . 7 VAL HG11 1 1 13 3364 1 1 7 VAL HG12 H 2.892 -9.283 3.373 1.00 . A A . 7 VAL HG12 1 1 13 3365 1 1 7 VAL HG13 H 2.542 -7.991 4.521 1.00 . A A . 7 VAL HG13 1 1 13 3366 1 1 7 VAL HG21 H 4.825 -9.328 2.146 1.00 . A A . 7 VAL HG21 1 1 13 3367 1 1 7 VAL HG22 H 6.124 -8.458 2.964 1.00 . A A . 7 VAL HG22 1 1 13 3368 1 1 7 VAL HG23 H 5.424 -7.808 1.482 1.00 . A A . 7 VAL HG23 1 1 13 3369 1 1 7 VAL N N 4.126 -5.799 1.494 1.00 . A A . 7 VAL N 1 1 13 3370 1 1 7 VAL O O 1.119 -6.239 3.169 1.00 . A A . 7 VAL O 1 1 13 3371 1 1 8 CYS C C 0.958 -3.328 3.896 1.00 . A A . 8 CYS C 1 1 13 3372 1 1 8 CYS CA C 1.964 -4.116 4.726 1.00 . A A . 8 CYS CA 1 1 13 3373 1 1 8 CYS CB C 2.822 -3.162 5.554 1.00 . A A . 8 CYS CB 1 1 13 3374 1 1 8 CYS H H 3.766 -4.736 3.801 1.00 . A A . 8 CYS H 1 1 13 3375 1 1 8 CYS HA H 1.428 -4.778 5.391 1.00 . A A . 8 CYS HA 1 1 13 3376 1 1 8 CYS HB2 H 3.760 -3.639 5.782 1.00 . A A . 8 CYS HB2 1 1 13 3377 1 1 8 CYS HB3 H 3.009 -2.275 4.971 1.00 . A A . 8 CYS HB3 1 1 13 3378 1 1 8 CYS N N 2.808 -4.932 3.862 1.00 . A A . 8 CYS N 1 1 13 3379 1 1 8 CYS O O -0.189 -3.157 4.295 1.00 . A A . 8 CYS O 1 1 13 3380 1 1 8 CYS SG S 2.064 -2.631 7.128 1.00 . A A . 8 CYS SG 1 1 13 3381 1 1 9 HIS C C -0.621 -2.899 1.356 1.00 . A A . 9 HIS C 1 1 13 3382 1 1 9 HIS CA C 0.567 -2.074 1.834 1.00 . A A . 9 HIS CA 1 1 13 3383 1 1 9 HIS CB C 1.387 -1.604 0.630 1.00 . A A . 9 HIS CB 1 1 13 3384 1 1 9 HIS CD2 C -0.471 0.079 -0.083 1.00 . A A . 9 HIS CD2 1 1 13 3385 1 1 9 HIS CE1 C 0.647 1.136 -1.643 1.00 . A A . 9 HIS CE1 1 1 13 3386 1 1 9 HIS CG C 0.765 -0.477 -0.144 1.00 . A A . 9 HIS CG 1 1 13 3387 1 1 9 HIS H H 2.344 -3.024 2.491 1.00 . A A . 9 HIS H 1 1 13 3388 1 1 9 HIS HA H 0.201 -1.212 2.371 1.00 . A A . 9 HIS HA 1 1 13 3389 1 1 9 HIS HB2 H 2.354 -1.282 0.972 1.00 . A A . 9 HIS HB2 1 1 13 3390 1 1 9 HIS HB3 H 1.515 -2.437 -0.047 1.00 . A A . 9 HIS HB3 1 1 13 3391 1 1 9 HIS HD1 H 2.369 0.056 -1.405 1.00 . A A . 9 HIS HD1 1 1 13 3392 1 1 9 HIS HD2 H -1.271 -0.212 0.583 1.00 . A A . 9 HIS HD2 1 1 13 3393 1 1 9 HIS HE1 H 0.908 1.824 -2.433 1.00 . A A . 9 HIS HE1 1 1 13 3394 1 1 9 HIS HE2 H -1.319 1.588 -1.278 1.00 . A A . 9 HIS HE2 1 1 13 3395 1 1 9 HIS N N 1.407 -2.852 2.741 1.00 . A A . 9 HIS N 1 1 13 3396 1 1 9 HIS ND1 N 1.439 0.211 -1.132 1.00 . A A . 9 HIS ND1 1 1 13 3397 1 1 9 HIS NE2 N -0.517 1.077 -1.024 1.00 . A A . 9 HIS NE2 1 1 13 3398 1 1 9 HIS O O -1.739 -2.403 1.299 1.00 . A A . 9 HIS O 1 1 13 3399 1 1 10 LEU C C -2.450 -5.285 1.633 1.00 . A A . 10 LEU C 1 1 13 3400 1 1 10 LEU CA C -1.421 -5.044 0.535 1.00 . A A . 10 LEU CA 1 1 13 3401 1 1 10 LEU CB C -0.834 -6.379 0.066 1.00 . A A . 10 LEU CB 1 1 13 3402 1 1 10 LEU CD1 C 0.623 -7.673 -1.511 1.00 . A A . 10 LEU CD1 1 1 13 3403 1 1 10 LEU CD2 C -0.719 -5.742 -2.359 1.00 . A A . 10 LEU CD2 1 1 13 3404 1 1 10 LEU CG C 0.057 -6.302 -1.175 1.00 . A A . 10 LEU CG 1 1 13 3405 1 1 10 LEU H H 0.558 -4.486 1.071 1.00 . A A . 10 LEU H 1 1 13 3406 1 1 10 LEU HA H -1.908 -4.562 -0.299 1.00 . A A . 10 LEU HA 1 1 13 3407 1 1 10 LEU HB2 H -0.253 -6.795 0.875 1.00 . A A . 10 LEU HB2 1 1 13 3408 1 1 10 LEU HB3 H -1.653 -7.050 -0.148 1.00 . A A . 10 LEU HB3 1 1 13 3409 1 1 10 LEU HD11 H 0.442 -8.348 -0.687 1.00 . A A . 10 LEU HD11 1 1 13 3410 1 1 10 LEU HD12 H 1.686 -7.592 -1.682 1.00 . A A . 10 LEU HD12 1 1 13 3411 1 1 10 LEU HD13 H 0.143 -8.053 -2.400 1.00 . A A . 10 LEU HD13 1 1 13 3412 1 1 10 LEU HD21 H -1.720 -6.148 -2.357 1.00 . A A . 10 LEU HD21 1 1 13 3413 1 1 10 LEU HD22 H -0.222 -6.014 -3.277 1.00 . A A . 10 LEU HD22 1 1 13 3414 1 1 10 LEU HD23 H -0.768 -4.666 -2.280 1.00 . A A . 10 LEU HD23 1 1 13 3415 1 1 10 LEU HG H 0.886 -5.639 -0.974 1.00 . A A . 10 LEU HG 1 1 13 3416 1 1 10 LEU N N -0.364 -4.152 1.009 1.00 . A A . 10 LEU N 1 1 13 3417 1 1 10 LEU O O -3.653 -5.152 1.408 1.00 . A A . 10 LEU O 1 1 13 3418 1 1 11 GLU C C -3.573 -4.609 4.369 1.00 . A A . 11 GLU C 1 1 13 3419 1 1 11 GLU CA C -2.827 -5.881 3.967 1.00 . A A . 11 GLU CA 1 1 13 3420 1 1 11 GLU CB C -1.982 -6.391 5.141 1.00 . A A . 11 GLU CB 1 1 13 3421 1 1 11 GLU CD C -3.681 -7.861 6.316 1.00 . A A . 11 GLU CD 1 1 13 3422 1 1 11 GLU CG C -2.772 -6.652 6.417 1.00 . A A . 11 GLU CG 1 1 13 3423 1 1 11 GLU H H -0.993 -5.707 2.928 1.00 . A A . 11 GLU H 1 1 13 3424 1 1 11 GLU HA H -3.542 -6.635 3.688 1.00 . A A . 11 GLU HA 1 1 13 3425 1 1 11 GLU HB2 H -1.505 -7.313 4.849 1.00 . A A . 11 GLU HB2 1 1 13 3426 1 1 11 GLU HB3 H -1.219 -5.658 5.362 1.00 . A A . 11 GLU HB3 1 1 13 3427 1 1 11 GLU HG2 H -2.077 -6.812 7.227 1.00 . A A . 11 GLU HG2 1 1 13 3428 1 1 11 GLU HG3 H -3.378 -5.783 6.632 1.00 . A A . 11 GLU HG3 1 1 13 3429 1 1 11 GLU N N -1.963 -5.627 2.819 1.00 . A A . 11 GLU N 1 1 13 3430 1 1 11 GLU O O -4.787 -4.607 4.564 1.00 . A A . 11 GLU O 1 1 13 3431 1 1 11 GLU OE1 O -4.575 -7.864 5.449 1.00 . A A . 11 GLU OE1 1 1 13 3432 1 1 11 GLU OE2 O -3.495 -8.802 7.114 1.00 . A A . 11 GLU OE2 1 1 13 3433 1 1 12 HIS C C -3.806 -1.443 3.618 1.00 . A A . 12 HIS C 1 1 13 3434 1 1 12 HIS CA C -3.418 -2.238 4.857 1.00 . A A . 12 HIS CA 1 1 13 3435 1 1 12 HIS CB C -2.449 -1.407 5.718 1.00 . A A . 12 HIS CB 1 1 13 3436 1 1 12 HIS CD2 C -1.798 -3.394 7.271 1.00 . A A . 12 HIS CD2 1 1 13 3437 1 1 12 HIS CE1 C -1.217 -2.241 9.039 1.00 . A A . 12 HIS CE1 1 1 13 3438 1 1 12 HIS CG C -1.980 -2.085 6.976 1.00 . A A . 12 HIS CG 1 1 13 3439 1 1 12 HIS H H -1.869 -3.576 4.302 1.00 . A A . 12 HIS H 1 1 13 3440 1 1 12 HIS HA H -4.309 -2.440 5.431 1.00 . A A . 12 HIS HA 1 1 13 3441 1 1 12 HIS HB2 H -1.576 -1.172 5.131 1.00 . A A . 12 HIS HB2 1 1 13 3442 1 1 12 HIS HB3 H -2.939 -0.487 6.002 1.00 . A A . 12 HIS HB3 1 1 13 3443 1 1 12 HIS HD1 H -1.604 -0.414 8.203 1.00 . A A . 12 HIS HD1 1 1 13 3444 1 1 12 HIS HD2 H -1.962 -4.227 6.604 1.00 . A A . 12 HIS HD2 1 1 13 3445 1 1 12 HIS HE1 H -0.871 -1.980 10.028 1.00 . A A . 12 HIS HE1 1 1 13 3446 1 1 12 HIS HE2 H -1.210 -4.289 9.076 1.00 . A A . 12 HIS HE2 1 1 13 3447 1 1 12 HIS N N -2.834 -3.519 4.482 1.00 . A A . 12 HIS N 1 1 13 3448 1 1 12 HIS ND1 N -1.604 -1.390 8.107 1.00 . A A . 12 HIS ND1 1 1 13 3449 1 1 12 HIS NE2 N -1.326 -3.463 8.558 1.00 . A A . 12 HIS NE2 1 1 13 3450 1 1 12 HIS O O -3.647 -0.224 3.580 1.00 . A A . 12 HIS O 1 1 13 3451 1 1 13 SER C C -5.849 -0.506 1.631 1.00 . A A . 13 SER C 1 1 13 3452 1 1 13 SER CA C -4.725 -1.499 1.362 1.00 . A A . 13 SER CA 1 1 13 3453 1 1 13 SER CB C -5.171 -2.558 0.350 1.00 . A A . 13 SER CB 1 1 13 3454 1 1 13 SER H H -4.411 -3.112 2.698 1.00 . A A . 13 SER H 1 1 13 3455 1 1 13 SER HA H -3.873 -0.965 0.965 1.00 . A A . 13 SER HA 1 1 13 3456 1 1 13 SER HB2 H -4.408 -3.317 0.268 1.00 . A A . 13 SER HB2 1 1 13 3457 1 1 13 SER HB3 H -6.091 -3.010 0.691 1.00 . A A . 13 SER HB3 1 1 13 3458 1 1 13 SER HG H -5.387 -2.691 -1.593 1.00 . A A . 13 SER HG 1 1 13 3459 1 1 13 SER N N -4.314 -2.138 2.607 1.00 . A A . 13 SER N 1 1 13 3460 1 1 13 SER O O -5.927 0.553 1.013 1.00 . A A . 13 SER O 1 1 13 3461 1 1 13 SER OG O -5.389 -1.993 -0.932 1.00 . A A . 13 SER OG 1 1 13 3462 1 1 14 ASN C C -7.361 1.274 3.636 1.00 . A A . 14 ASN C 1 1 13 3463 1 1 14 ASN CA C -7.830 -0.016 2.964 1.00 . A A . 14 ASN CA 1 1 13 3464 1 1 14 ASN CB C -8.775 -0.791 3.894 1.00 . A A . 14 ASN CB 1 1 13 3465 1 1 14 ASN CG C -8.036 -1.661 4.900 1.00 . A A . 14 ASN CG 1 1 13 3466 1 1 14 ASN H H -6.572 -1.713 3.036 1.00 . A A . 14 ASN H 1 1 13 3467 1 1 14 ASN HA H -8.365 0.243 2.066 1.00 . A A . 14 ASN HA 1 1 13 3468 1 1 14 ASN HB2 H -9.386 -0.087 4.439 1.00 . A A . 14 ASN HB2 1 1 13 3469 1 1 14 ASN HB3 H -9.414 -1.426 3.297 1.00 . A A . 14 ASN HB3 1 1 13 3470 1 1 14 ASN HD21 H -8.965 -3.280 4.221 1.00 . A A . 14 ASN HD21 1 1 13 3471 1 1 14 ASN HD22 H -7.843 -3.543 5.508 1.00 . A A . 14 ASN HD22 1 1 13 3472 1 1 14 ASN N N -6.706 -0.860 2.576 1.00 . A A . 14 ASN N 1 1 13 3473 1 1 14 ASN ND2 N -8.311 -2.957 4.874 1.00 . A A . 14 ASN ND2 1 1 13 3474 1 1 14 ASN O O -7.991 2.319 3.494 1.00 . A A . 14 ASN O 1 1 13 3475 1 1 14 ASN OD1 O -7.221 -1.180 5.684 1.00 . A A . 14 ASN OD1 1 1 13 3476 1 1 15 LEU C C -4.824 3.192 4.186 1.00 . A A . 15 LEU C 1 1 13 3477 1 1 15 LEU CA C -5.721 2.345 5.082 1.00 . A A . 15 LEU CA 1 1 13 3478 1 1 15 LEU CB C -4.935 1.889 6.314 1.00 . A A . 15 LEU CB 1 1 13 3479 1 1 15 LEU CD1 C -4.843 0.649 8.491 1.00 . A A . 15 LEU CD1 1 1 13 3480 1 1 15 LEU CD2 C -6.880 1.973 7.897 1.00 . A A . 15 LEU CD2 1 1 13 3481 1 1 15 LEU CG C -5.744 1.115 7.358 1.00 . A A . 15 LEU CG 1 1 13 3482 1 1 15 LEU H H -5.814 0.325 4.454 1.00 . A A . 15 LEU H 1 1 13 3483 1 1 15 LEU HA H -6.550 2.949 5.404 1.00 . A A . 15 LEU HA 1 1 13 3484 1 1 15 LEU HB2 H -4.121 1.259 5.983 1.00 . A A . 15 LEU HB2 1 1 13 3485 1 1 15 LEU HB3 H -4.519 2.763 6.792 1.00 . A A . 15 LEU HB3 1 1 13 3486 1 1 15 LEU HD11 H -4.929 1.334 9.322 1.00 . A A . 15 LEU HD11 1 1 13 3487 1 1 15 LEU HD12 H -3.820 0.623 8.150 1.00 . A A . 15 LEU HD12 1 1 13 3488 1 1 15 LEU HD13 H -5.145 -0.339 8.806 1.00 . A A . 15 LEU HD13 1 1 13 3489 1 1 15 LEU HD21 H -7.823 1.592 7.534 1.00 . A A . 15 LEU HD21 1 1 13 3490 1 1 15 LEU HD22 H -6.751 2.991 7.565 1.00 . A A . 15 LEU HD22 1 1 13 3491 1 1 15 LEU HD23 H -6.872 1.942 8.977 1.00 . A A . 15 LEU HD23 1 1 13 3492 1 1 15 LEU HG H -6.176 0.240 6.893 1.00 . A A . 15 LEU HG 1 1 13 3493 1 1 15 LEU N N -6.264 1.189 4.374 1.00 . A A . 15 LEU N 1 1 13 3494 1 1 15 LEU O O -4.935 4.415 4.158 1.00 . A A . 15 LEU O 1 1 13 3495 1 1 16 CYS C C -3.657 3.717 1.319 1.00 . A A . 16 CYS C 1 1 13 3496 1 1 16 CYS CA C -2.983 3.221 2.594 1.00 . A A . 16 CYS CA 1 1 13 3497 1 1 16 CYS CB C -1.819 2.300 2.234 1.00 . A A . 16 CYS CB 1 1 13 3498 1 1 16 CYS H H -3.878 1.556 3.556 1.00 . A A . 16 CYS H 1 1 13 3499 1 1 16 CYS HA H -2.596 4.074 3.132 1.00 . A A . 16 CYS HA 1 1 13 3500 1 1 16 CYS HB2 H -2.207 1.416 1.752 1.00 . A A . 16 CYS HB2 1 1 13 3501 1 1 16 CYS HB3 H -1.162 2.816 1.549 1.00 . A A . 16 CYS HB3 1 1 13 3502 1 1 16 CYS N N -3.923 2.533 3.475 1.00 . A A . 16 CYS N 1 1 13 3503 1 1 16 CYS O O -3.201 4.677 0.699 1.00 . A A . 16 CYS O 1 1 13 3504 1 1 16 CYS SG S -0.817 1.757 3.658 1.00 . A A . 16 CYS SG 1 1 13 3505 1 1 17 GLY C C -4.908 2.691 -1.504 1.00 . A A . 17 GLY C 1 1 13 3506 1 1 17 GLY CA C -5.424 3.435 -0.289 1.00 . A A . 17 GLY CA 1 1 13 3507 1 1 17 GLY H H -5.045 2.280 1.440 1.00 . A A . 17 GLY H 1 1 13 3508 1 1 17 GLY HA2 H -6.477 3.224 -0.170 1.00 . A A . 17 GLY HA2 1 1 13 3509 1 1 17 GLY HA3 H -5.294 4.495 -0.446 1.00 . A A . 17 GLY HA3 1 1 13 3510 1 1 17 GLY N N -4.730 3.050 0.918 1.00 . A A . 17 GLY N 1 1 13 3511 1 1 17 GLY O O -3.750 2.254 -1.532 1.00 . A A . 17 GLY O 1 1 13 3512 1 1 18 ALA C C -4.513 2.697 -4.629 1.00 . A A . 18 ALA C 1 1 13 3513 1 1 18 ALA CA C -5.424 1.845 -3.743 1.00 . A A . 18 ALA CA 1 1 13 3514 1 1 18 ALA CB C -6.688 1.454 -4.495 1.00 . A A . 18 ALA CB 1 1 13 3515 1 1 18 ALA H H -6.671 2.909 -2.410 1.00 . A A . 18 ALA H 1 1 13 3516 1 1 18 ALA HA H -4.899 0.938 -3.477 1.00 . A A . 18 ALA HA 1 1 13 3517 1 1 18 ALA HB1 H -6.819 0.383 -4.447 1.00 . A A . 18 ALA HB1 1 1 13 3518 1 1 18 ALA HB2 H -6.603 1.760 -5.527 1.00 . A A . 18 ALA HB2 1 1 13 3519 1 1 18 ALA HB3 H -7.541 1.941 -4.044 1.00 . A A . 18 ALA HB3 1 1 13 3520 1 1 18 ALA N N -5.770 2.541 -2.506 1.00 . A A . 18 ALA N 1 1 13 3521 1 1 18 ALA O O -4.818 2.958 -5.792 1.00 . A A . 18 ALA O 1 1 13 3522 1 1 19 GLY C C -1.206 4.193 -3.969 1.00 . A A . 19 GLY C 1 1 13 3523 1 1 19 GLY CA C -2.451 3.944 -4.789 1.00 . A A . 19 GLY CA 1 1 13 3524 1 1 19 GLY H H -3.215 2.887 -3.128 1.00 . A A . 19 GLY H 1 1 13 3525 1 1 19 GLY HA2 H -2.178 3.439 -5.704 1.00 . A A . 19 GLY HA2 1 1 13 3526 1 1 19 GLY HA3 H -2.910 4.891 -5.029 1.00 . A A . 19 GLY HA3 1 1 13 3527 1 1 19 GLY N N -3.398 3.128 -4.064 1.00 . A A . 19 GLY N 1 1 13 3528 1 1 19 GLY O O -0.703 3.281 -3.308 1.00 . A A . 19 GLY O 1 1 13 3529 1 1 20 GLY C C 0.205 6.879 -2.249 1.00 . A A . 20 GLY C 1 1 13 3530 1 1 20 GLY CA C 0.465 5.754 -3.221 1.00 . A A . 20 GLY CA 1 1 13 3531 1 1 20 GLY H H -1.165 6.113 -4.517 1.00 . A A . 20 GLY H 1 1 13 3532 1 1 20 GLY HA2 H 0.782 4.880 -2.670 1.00 . A A . 20 GLY HA2 1 1 13 3533 1 1 20 GLY HA3 H 1.253 6.048 -3.893 1.00 . A A . 20 GLY HA3 1 1 13 3534 1 1 20 GLY N N -0.715 5.421 -3.989 1.00 . A A . 20 GLY N 1 1 13 3535 1 1 20 GLY O O -0.205 7.968 -2.647 1.00 . A A . 20 GLY O 1 1 13 3536 1 1 21 ALA C C 0.780 7.032 1.401 1.00 . A A . 21 ALA C 1 1 13 3537 1 1 21 ALA CA C 0.242 7.577 0.087 1.00 . A A . 21 ALA CA 1 1 13 3538 1 1 21 ALA CB C -1.236 7.921 0.233 1.00 . A A . 21 ALA CB 1 1 13 3539 1 1 21 ALA H H 0.767 5.712 -0.739 1.00 . A A . 21 ALA H 1 1 13 3540 1 1 21 ALA HA H 0.779 8.479 -0.170 1.00 . A A . 21 ALA HA 1 1 13 3541 1 1 21 ALA HB1 H -1.730 7.148 0.804 1.00 . A A . 21 ALA HB1 1 1 13 3542 1 1 21 ALA HB2 H -1.687 7.991 -0.745 1.00 . A A . 21 ALA HB2 1 1 13 3543 1 1 21 ALA HB3 H -1.337 8.866 0.744 1.00 . A A . 21 ALA HB3 1 1 13 3544 1 1 21 ALA N N 0.445 6.605 -0.976 1.00 . A A . 21 ALA N 1 1 13 3545 1 1 21 ALA O O 0.617 5.846 1.689 1.00 . A A . 21 ALA O 1 1 13 3546 1 1 22 ALA C C 3.193 6.597 3.346 1.00 . A A . 22 ALA C 1 1 13 3547 1 1 22 ALA CA C 2.004 7.553 3.480 1.00 . A A . 22 ALA CA 1 1 13 3548 1 1 22 ALA CB C 0.947 6.967 4.410 1.00 . A A . 22 ALA CB 1 1 13 3549 1 1 22 ALA H H 1.511 8.831 1.867 1.00 . A A . 22 ALA H 1 1 13 3550 1 1 22 ALA HA H 2.360 8.469 3.931 1.00 . A A . 22 ALA HA 1 1 13 3551 1 1 22 ALA HB1 H 1.416 6.287 5.106 1.00 . A A . 22 ALA HB1 1 1 13 3552 1 1 22 ALA HB2 H 0.211 6.434 3.827 1.00 . A A . 22 ALA HB2 1 1 13 3553 1 1 22 ALA HB3 H 0.465 7.765 4.956 1.00 . A A . 22 ALA HB3 1 1 13 3554 1 1 22 ALA N N 1.423 7.909 2.180 1.00 . A A . 22 ALA N 1 1 13 3555 1 1 22 ALA O O 3.270 5.790 2.420 1.00 . A A . 22 ALA O 1 1 13 3556 1 1 23 GLY C C 5.195 4.724 5.275 1.00 . A A . 23 GLY C 1 1 13 3557 1 1 23 GLY CA C 5.291 5.844 4.257 1.00 . A A . 23 GLY CA 1 1 13 3558 1 1 23 GLY H H 4.018 7.359 4.997 1.00 . A A . 23 GLY H 1 1 13 3559 1 1 23 GLY HA2 H 5.389 5.414 3.271 1.00 . A A . 23 GLY HA2 1 1 13 3560 1 1 23 GLY HA3 H 6.167 6.437 4.471 1.00 . A A . 23 GLY HA3 1 1 13 3561 1 1 23 GLY N N 4.125 6.701 4.282 1.00 . A A . 23 GLY N 1 1 13 3562 1 1 23 GLY O O 4.095 4.338 5.678 1.00 . A A . 23 GLY O 1 1 14 3563 1 1 1 GLY C C 5.484 2.208 6.444 1.00 . A A . 1 GLY C 1 1 14 3564 1 1 1 GLY CA C 6.035 3.505 7.004 1.00 . A A . 1 GLY CA 1 1 14 3565 1 1 1 GLY H1 H 7.471 4.724 6.039 1.00 . A A . 1 GLY H1 1 1 14 3566 1 1 1 GLY HA2 H 6.836 3.273 7.691 1.00 . A A . 1 GLY HA2 1 1 14 3567 1 1 1 GLY HA3 H 5.250 4.011 7.547 1.00 . A A . 1 GLY HA3 1 1 14 3568 1 1 1 GLY N N 6.546 4.403 5.982 1.00 . A A . 1 GLY N 1 1 14 3569 1 1 1 GLY O O 6.123 1.555 5.618 1.00 . A A . 1 GLY O 1 1 14 3570 1 1 2 CYS C C 3.407 0.626 4.954 1.00 . A A . 2 CYS C 1 1 14 3571 1 1 2 CYS CA C 3.620 0.624 6.458 1.00 . A A . 2 CYS CA 1 1 14 3572 1 1 2 CYS CB C 2.269 0.501 7.163 1.00 . A A . 2 CYS CB 1 1 14 3573 1 1 2 CYS H H 3.843 2.419 7.554 1.00 . A A . 2 CYS H 1 1 14 3574 1 1 2 CYS HA H 4.239 -0.218 6.728 1.00 . A A . 2 CYS HA 1 1 14 3575 1 1 2 CYS HB2 H 2.436 0.320 8.208 1.00 . A A . 2 CYS HB2 1 1 14 3576 1 1 2 CYS HB3 H 1.731 1.431 7.050 1.00 . A A . 2 CYS HB3 1 1 14 3577 1 1 2 CYS N N 4.291 1.845 6.899 1.00 . A A . 2 CYS N 1 1 14 3578 1 1 2 CYS O O 3.685 -0.357 4.271 1.00 . A A . 2 CYS O 1 1 14 3579 1 1 2 CYS SG S 1.196 -0.834 6.533 1.00 . A A . 2 CYS SG 1 1 14 3580 1 1 3 CYS C C 3.845 1.686 2.160 1.00 . A A . 3 CYS C 1 1 14 3581 1 1 3 CYS CA C 2.612 1.896 3.036 1.00 . A A . 3 CYS CA 1 1 14 3582 1 1 3 CYS CB C 2.018 3.276 2.782 1.00 . A A . 3 CYS CB 1 1 14 3583 1 1 3 CYS H H 2.692 2.476 5.068 1.00 . A A . 3 CYS H 1 1 14 3584 1 1 3 CYS HA H 1.883 1.150 2.770 1.00 . A A . 3 CYS HA 1 1 14 3585 1 1 3 CYS HB2 H 2.778 4.025 2.949 1.00 . A A . 3 CYS HB2 1 1 14 3586 1 1 3 CYS HB3 H 1.684 3.331 1.759 1.00 . A A . 3 CYS HB3 1 1 14 3587 1 1 3 CYS N N 2.900 1.737 4.455 1.00 . A A . 3 CYS N 1 1 14 3588 1 1 3 CYS O O 3.724 1.306 0.997 1.00 . A A . 3 CYS O 1 1 14 3589 1 1 3 CYS SG S 0.598 3.679 3.854 1.00 . A A . 3 CYS SG 1 1 14 3590 1 1 4 SER C C 6.566 0.278 1.767 1.00 . A A . 4 SER C 1 1 14 3591 1 1 4 SER CA C 6.270 1.760 1.984 1.00 . A A . 4 SER CA 1 1 14 3592 1 1 4 SER CB C 7.431 2.415 2.738 1.00 . A A . 4 SER CB 1 1 14 3593 1 1 4 SER H H 5.054 2.231 3.651 1.00 . A A . 4 SER H 1 1 14 3594 1 1 4 SER HA H 6.158 2.238 1.024 1.00 . A A . 4 SER HA 1 1 14 3595 1 1 4 SER HB2 H 7.152 3.420 3.019 1.00 . A A . 4 SER HB2 1 1 14 3596 1 1 4 SER HB3 H 7.647 1.842 3.627 1.00 . A A . 4 SER HB3 1 1 14 3597 1 1 4 SER HG H 8.712 1.636 1.475 1.00 . A A . 4 SER HG 1 1 14 3598 1 1 4 SER N N 5.022 1.932 2.719 1.00 . A A . 4 SER N 1 1 14 3599 1 1 4 SER O O 7.327 -0.090 0.872 1.00 . A A . 4 SER O 1 1 14 3600 1 1 4 SER OG O 8.597 2.474 1.938 1.00 . A A . 4 SER OG 1 1 14 3601 1 1 5 ASN C C 5.091 -2.639 1.618 1.00 . A A . 5 ASN C 1 1 14 3602 1 1 5 ASN CA C 6.161 -2.005 2.491 1.00 . A A . 5 ASN CA 1 1 14 3603 1 1 5 ASN CB C 6.149 -2.647 3.881 1.00 . A A . 5 ASN CB 1 1 14 3604 1 1 5 ASN CG C 7.465 -2.476 4.612 1.00 . A A . 5 ASN CG 1 1 14 3605 1 1 5 ASN H H 5.355 -0.209 3.279 1.00 . A A . 5 ASN H 1 1 14 3606 1 1 5 ASN HA H 7.125 -2.174 2.037 1.00 . A A . 5 ASN HA 1 1 14 3607 1 1 5 ASN HB2 H 5.370 -2.191 4.473 1.00 . A A . 5 ASN HB2 1 1 14 3608 1 1 5 ASN HB3 H 5.948 -3.703 3.781 1.00 . A A . 5 ASN HB3 1 1 14 3609 1 1 5 ASN HD21 H 6.603 -1.311 5.967 1.00 . A A . 5 ASN HD21 1 1 14 3610 1 1 5 ASN HD22 H 8.292 -1.594 6.183 1.00 . A A . 5 ASN HD22 1 1 14 3611 1 1 5 ASN N N 5.962 -0.565 2.591 1.00 . A A . 5 ASN N 1 1 14 3612 1 1 5 ASN ND2 N 7.450 -1.718 5.698 1.00 . A A . 5 ASN ND2 1 1 14 3613 1 1 5 ASN O O 3.902 -2.408 1.826 1.00 . A A . 5 ASN O 1 1 14 3614 1 1 5 ASN OD1 O 8.487 -3.020 4.202 1.00 . A A . 5 ASN OD1 1 1 14 3615 1 1 6 PRO C C 3.545 -4.985 0.442 1.00 . A A . 6 PRO C 1 1 14 3616 1 1 6 PRO CA C 4.564 -4.113 -0.289 1.00 . A A . 6 PRO CA 1 1 14 3617 1 1 6 PRO CB C 5.476 -4.981 -1.164 1.00 . A A . 6 PRO CB 1 1 14 3618 1 1 6 PRO CD C 6.901 -3.762 0.314 1.00 . A A . 6 PRO CD 1 1 14 3619 1 1 6 PRO CG C 6.821 -4.346 -1.067 1.00 . A A . 6 PRO CG 1 1 14 3620 1 1 6 PRO HA H 4.043 -3.399 -0.908 1.00 . A A . 6 PRO HA 1 1 14 3621 1 1 6 PRO HB2 H 5.488 -5.992 -0.783 1.00 . A A . 6 PRO HB2 1 1 14 3622 1 1 6 PRO HB3 H 5.112 -4.979 -2.180 1.00 . A A . 6 PRO HB3 1 1 14 3623 1 1 6 PRO HD2 H 7.299 -4.488 1.009 1.00 . A A . 6 PRO HD2 1 1 14 3624 1 1 6 PRO HD3 H 7.506 -2.868 0.312 1.00 . A A . 6 PRO HD3 1 1 14 3625 1 1 6 PRO HG2 H 7.589 -5.091 -1.205 1.00 . A A . 6 PRO HG2 1 1 14 3626 1 1 6 PRO HG3 H 6.913 -3.568 -1.809 1.00 . A A . 6 PRO HG3 1 1 14 3627 1 1 6 PRO N N 5.497 -3.446 0.628 1.00 . A A . 6 PRO N 1 1 14 3628 1 1 6 PRO O O 2.345 -4.900 0.183 1.00 . A A . 6 PRO O 1 1 14 3629 1 1 7 VAL C C 2.196 -5.892 2.989 1.00 . A A . 7 VAL C 1 1 14 3630 1 1 7 VAL CA C 3.161 -6.700 2.129 1.00 . A A . 7 VAL CA 1 1 14 3631 1 1 7 VAL CB C 3.979 -7.647 3.033 1.00 . A A . 7 VAL CB 1 1 14 3632 1 1 7 VAL CG1 C 3.067 -8.602 3.788 1.00 . A A . 7 VAL CG1 1 1 14 3633 1 1 7 VAL CG2 C 5.004 -8.417 2.213 1.00 . A A . 7 VAL CG2 1 1 14 3634 1 1 7 VAL H H 4.993 -5.831 1.524 1.00 . A A . 7 VAL H 1 1 14 3635 1 1 7 VAL HA H 2.593 -7.299 1.432 1.00 . A A . 7 VAL HA 1 1 14 3636 1 1 7 VAL HB H 4.511 -7.046 3.757 1.00 . A A . 7 VAL HB 1 1 14 3637 1 1 7 VAL HG11 H 2.729 -8.132 4.700 1.00 . A A . 7 VAL HG11 1 1 14 3638 1 1 7 VAL HG12 H 3.609 -9.505 4.029 1.00 . A A . 7 VAL HG12 1 1 14 3639 1 1 7 VAL HG13 H 2.214 -8.848 3.172 1.00 . A A . 7 VAL HG13 1 1 14 3640 1 1 7 VAL HG21 H 5.809 -7.756 1.929 1.00 . A A . 7 VAL HG21 1 1 14 3641 1 1 7 VAL HG22 H 4.532 -8.812 1.326 1.00 . A A . 7 VAL HG22 1 1 14 3642 1 1 7 VAL HG23 H 5.398 -9.231 2.804 1.00 . A A . 7 VAL HG23 1 1 14 3643 1 1 7 VAL N N 4.029 -5.815 1.359 1.00 . A A . 7 VAL N 1 1 14 3644 1 1 7 VAL O O 0.993 -6.148 3.003 1.00 . A A . 7 VAL O 1 1 14 3645 1 1 8 CYS C C 0.916 -3.273 3.734 1.00 . A A . 8 CYS C 1 1 14 3646 1 1 8 CYS CA C 1.942 -4.047 4.559 1.00 . A A . 8 CYS CA 1 1 14 3647 1 1 8 CYS CB C 2.855 -3.081 5.317 1.00 . A A . 8 CYS CB 1 1 14 3648 1 1 8 CYS H H 3.704 -4.755 3.626 1.00 . A A . 8 CYS H 1 1 14 3649 1 1 8 CYS HA H 1.421 -4.674 5.268 1.00 . A A . 8 CYS HA 1 1 14 3650 1 1 8 CYS HB2 H 3.807 -3.558 5.483 1.00 . A A . 8 CYS HB2 1 1 14 3651 1 1 8 CYS HB3 H 3.005 -2.197 4.714 1.00 . A A . 8 CYS HB3 1 1 14 3652 1 1 8 CYS N N 2.739 -4.909 3.693 1.00 . A A . 8 CYS N 1 1 14 3653 1 1 8 CYS O O -0.217 -3.066 4.165 1.00 . A A . 8 CYS O 1 1 14 3654 1 1 8 CYS SG S 2.216 -2.542 6.939 1.00 . A A . 8 CYS SG 1 1 14 3655 1 1 9 HIS C C -0.769 -2.924 1.268 1.00 . A A . 9 HIS C 1 1 14 3656 1 1 9 HIS CA C 0.464 -2.110 1.629 1.00 . A A . 9 HIS CA 1 1 14 3657 1 1 9 HIS CB C 1.219 -1.756 0.347 1.00 . A A . 9 HIS CB 1 1 14 3658 1 1 9 HIS CD2 C -0.087 -0.921 -1.737 1.00 . A A . 9 HIS CD2 1 1 14 3659 1 1 9 HIS CE1 C -0.374 1.162 -1.124 1.00 . A A . 9 HIS CE1 1 1 14 3660 1 1 9 HIS CG C 0.499 -0.770 -0.525 1.00 . A A . 9 HIS CG 1 1 14 3661 1 1 9 HIS H H 2.250 -3.061 2.260 1.00 . A A . 9 HIS H 1 1 14 3662 1 1 9 HIS HA H 0.157 -1.202 2.124 1.00 . A A . 9 HIS HA 1 1 14 3663 1 1 9 HIS HB2 H 2.176 -1.340 0.607 1.00 . A A . 9 HIS HB2 1 1 14 3664 1 1 9 HIS HB3 H 1.372 -2.657 -0.228 1.00 . A A . 9 HIS HB3 1 1 14 3665 1 1 9 HIS HD1 H 0.615 0.970 0.657 1.00 . A A . 9 HIS HD1 1 1 14 3666 1 1 9 HIS HD2 H -0.125 -1.830 -2.321 1.00 . A A . 9 HIS HD2 1 1 14 3667 1 1 9 HIS HE1 H -0.673 2.200 -1.117 1.00 . A A . 9 HIS HE1 1 1 14 3668 1 1 9 HIS HE2 H -1.254 0.444 -2.825 1.00 . A A . 9 HIS HE2 1 1 14 3669 1 1 9 HIS N N 1.329 -2.856 2.539 1.00 . A A . 9 HIS N 1 1 14 3670 1 1 9 HIS ND1 N 0.303 0.548 -0.170 1.00 . A A . 9 HIS ND1 1 1 14 3671 1 1 9 HIS NE2 N -0.623 0.296 -2.087 1.00 . A A . 9 HIS NE2 1 1 14 3672 1 1 9 HIS O O -1.876 -2.404 1.237 1.00 . A A . 9 HIS O 1 1 14 3673 1 1 10 LEU C C -2.523 -5.417 1.824 1.00 . A A . 10 LEU C 1 1 14 3674 1 1 10 LEU CA C -1.650 -5.094 0.614 1.00 . A A . 10 LEU CA 1 1 14 3675 1 1 10 LEU CB C -1.110 -6.389 -0.007 1.00 . A A . 10 LEU CB 1 1 14 3676 1 1 10 LEU CD1 C -2.290 -6.141 -2.209 1.00 . A A . 10 LEU CD1 1 1 14 3677 1 1 10 LEU CD2 C 0.059 -5.322 -1.970 1.00 . A A . 10 LEU CD2 1 1 14 3678 1 1 10 LEU CG C -0.948 -6.377 -1.533 1.00 . A A . 10 LEU CG 1 1 14 3679 1 1 10 LEU H H 0.363 -4.546 1.014 1.00 . A A . 10 LEU H 1 1 14 3680 1 1 10 LEU HA H -2.255 -4.585 -0.120 1.00 . A A . 10 LEU HA 1 1 14 3681 1 1 10 LEU HB2 H -0.144 -6.596 0.432 1.00 . A A . 10 LEU HB2 1 1 14 3682 1 1 10 LEU HB3 H -1.781 -7.194 0.253 1.00 . A A . 10 LEU HB3 1 1 14 3683 1 1 10 LEU HD11 H -2.694 -7.084 -2.547 1.00 . A A . 10 LEU HD11 1 1 14 3684 1 1 10 LEU HD12 H -2.156 -5.482 -3.055 1.00 . A A . 10 LEU HD12 1 1 14 3685 1 1 10 LEU HD13 H -2.972 -5.688 -1.506 1.00 . A A . 10 LEU HD13 1 1 14 3686 1 1 10 LEU HD21 H 0.996 -5.800 -2.218 1.00 . A A . 10 LEU HD21 1 1 14 3687 1 1 10 LEU HD22 H 0.214 -4.619 -1.166 1.00 . A A . 10 LEU HD22 1 1 14 3688 1 1 10 LEU HD23 H -0.320 -4.801 -2.837 1.00 . A A . 10 LEU HD23 1 1 14 3689 1 1 10 LEU HG H -0.582 -7.342 -1.855 1.00 . A A . 10 LEU HG 1 1 14 3690 1 1 10 LEU N N -0.557 -4.199 0.982 1.00 . A A . 10 LEU N 1 1 14 3691 1 1 10 LEU O O -3.751 -5.358 1.743 1.00 . A A . 10 LEU O 1 1 14 3692 1 1 11 GLU C C -3.436 -4.899 4.640 1.00 . A A . 11 GLU C 1 1 14 3693 1 1 11 GLU CA C -2.586 -6.079 4.175 1.00 . A A . 11 GLU CA 1 1 14 3694 1 1 11 GLU CB C -1.580 -6.454 5.269 1.00 . A A . 11 GLU CB 1 1 14 3695 1 1 11 GLU CD C -1.204 -7.204 7.654 1.00 . A A . 11 GLU CD 1 1 14 3696 1 1 11 GLU CG C -2.222 -6.919 6.566 1.00 . A A . 11 GLU CG 1 1 14 3697 1 1 11 GLU H H -0.898 -5.773 2.934 1.00 . A A . 11 GLU H 1 1 14 3698 1 1 11 GLU HA H -3.230 -6.921 3.981 1.00 . A A . 11 GLU HA 1 1 14 3699 1 1 11 GLU HB2 H -0.945 -7.245 4.902 1.00 . A A . 11 GLU HB2 1 1 14 3700 1 1 11 GLU HB3 H -0.968 -5.590 5.486 1.00 . A A . 11 GLU HB3 1 1 14 3701 1 1 11 GLU HG2 H -2.893 -6.149 6.916 1.00 . A A . 11 GLU HG2 1 1 14 3702 1 1 11 GLU HG3 H -2.781 -7.822 6.371 1.00 . A A . 11 GLU HG3 1 1 14 3703 1 1 11 GLU N N -1.881 -5.749 2.939 1.00 . A A . 11 GLU N 1 1 14 3704 1 1 11 GLU O O -4.576 -5.056 5.076 1.00 . A A . 11 GLU O 1 1 14 3705 1 1 11 GLU OE1 O -0.456 -6.272 8.028 1.00 . A A . 11 GLU OE1 1 1 14 3706 1 1 11 GLU OE2 O -1.158 -8.346 8.141 1.00 . A A . 11 GLU OE2 1 1 14 3707 1 1 12 HIS C C -3.865 -1.650 3.726 1.00 . A A . 12 HIS C 1 1 14 3708 1 1 12 HIS CA C -3.542 -2.496 4.949 1.00 . A A . 12 HIS CA 1 1 14 3709 1 1 12 HIS CB C -2.668 -1.722 5.939 1.00 . A A . 12 HIS CB 1 1 14 3710 1 1 12 HIS CD2 C -1.084 -3.189 7.369 1.00 . A A . 12 HIS CD2 1 1 14 3711 1 1 12 HIS CE1 C -2.464 -3.685 8.985 1.00 . A A . 12 HIS CE1 1 1 14 3712 1 1 12 HIS CG C -2.248 -2.556 7.112 1.00 . A A . 12 HIS CG 1 1 14 3713 1 1 12 HIS H H -1.949 -3.657 4.184 1.00 . A A . 12 HIS H 1 1 14 3714 1 1 12 HIS HA H -4.466 -2.775 5.434 1.00 . A A . 12 HIS HA 1 1 14 3715 1 1 12 HIS HB2 H -1.776 -1.379 5.436 1.00 . A A . 12 HIS HB2 1 1 14 3716 1 1 12 HIS HB3 H -3.219 -0.871 6.312 1.00 . A A . 12 HIS HB3 1 1 14 3717 1 1 12 HIS HD1 H -4.020 -2.585 8.248 1.00 . A A . 12 HIS HD1 1 1 14 3718 1 1 12 HIS HD2 H -0.194 -3.162 6.756 1.00 . A A . 12 HIS HD2 1 1 14 3719 1 1 12 HIS HE1 H -2.881 -4.102 9.890 1.00 . A A . 12 HIS HE1 1 1 14 3720 1 1 12 HIS HE2 H -0.716 -4.712 8.749 1.00 . A A . 12 HIS HE2 1 1 14 3721 1 1 12 HIS N N -2.864 -3.714 4.542 1.00 . A A . 12 HIS N 1 1 14 3722 1 1 12 HIS ND1 N -3.094 -2.884 8.147 1.00 . A A . 12 HIS ND1 1 1 14 3723 1 1 12 HIS NE2 N -1.240 -3.892 8.538 1.00 . A A . 12 HIS NE2 1 1 14 3724 1 1 12 HIS O O -3.620 -0.444 3.703 1.00 . A A . 12 HIS O 1 1 14 3725 1 1 13 SER C C -5.768 -0.535 1.672 1.00 . A A . 13 SER C 1 1 14 3726 1 1 13 SER CA C -4.774 -1.669 1.456 1.00 . A A . 13 SER CA 1 1 14 3727 1 1 13 SER CB C -5.351 -2.716 0.507 1.00 . A A . 13 SER CB 1 1 14 3728 1 1 13 SER H H -4.566 -3.275 2.806 1.00 . A A . 13 SER H 1 1 14 3729 1 1 13 SER HA H -3.874 -1.262 1.019 1.00 . A A . 13 SER HA 1 1 14 3730 1 1 13 SER HB2 H -6.017 -2.237 -0.196 1.00 . A A . 13 SER HB2 1 1 14 3731 1 1 13 SER HB3 H -4.547 -3.197 -0.028 1.00 . A A . 13 SER HB3 1 1 14 3732 1 1 13 SER HG H -5.565 -4.521 1.247 1.00 . A A . 13 SER HG 1 1 14 3733 1 1 13 SER N N -4.409 -2.311 2.711 1.00 . A A . 13 SER N 1 1 14 3734 1 1 13 SER O O -5.650 0.524 1.064 1.00 . A A . 13 SER O 1 1 14 3735 1 1 13 SER OG O -6.074 -3.700 1.229 1.00 . A A . 13 SER OG 1 1 14 3736 1 1 14 ASN C C -7.127 1.474 3.475 1.00 . A A . 14 ASN C 1 1 14 3737 1 1 14 ASN CA C -7.757 0.235 2.846 1.00 . A A . 14 ASN CA 1 1 14 3738 1 1 14 ASN CB C -8.814 -0.348 3.791 1.00 . A A . 14 ASN CB 1 1 14 3739 1 1 14 ASN CG C -9.925 0.638 4.102 1.00 . A A . 14 ASN CG 1 1 14 3740 1 1 14 ASN H H -6.775 -1.638 2.990 1.00 . A A . 14 ASN H 1 1 14 3741 1 1 14 ASN HA H -8.230 0.516 1.920 1.00 . A A . 14 ASN HA 1 1 14 3742 1 1 14 ASN HB2 H -9.253 -1.223 3.333 1.00 . A A . 14 ASN HB2 1 1 14 3743 1 1 14 ASN HB3 H -8.339 -0.633 4.717 1.00 . A A . 14 ASN HB3 1 1 14 3744 1 1 14 ASN HD21 H -9.467 0.597 6.033 1.00 . A A . 14 ASN HD21 1 1 14 3745 1 1 14 ASN HD22 H -10.781 1.625 5.594 1.00 . A A . 14 ASN HD22 1 1 14 3746 1 1 14 ASN N N -6.740 -0.767 2.542 1.00 . A A . 14 ASN N 1 1 14 3747 1 1 14 ASN ND2 N -10.072 0.987 5.372 1.00 . A A . 14 ASN ND2 1 1 14 3748 1 1 14 ASN O O -7.534 2.601 3.204 1.00 . A A . 14 ASN O 1 1 14 3749 1 1 14 ASN OD1 O -10.647 1.078 3.213 1.00 . A A . 14 ASN OD1 1 1 14 3750 1 1 15 LEU C C -4.554 3.110 4.009 1.00 . A A . 15 LEU C 1 1 14 3751 1 1 15 LEU CA C -5.431 2.342 4.987 1.00 . A A . 15 LEU CA 1 1 14 3752 1 1 15 LEU CB C -4.578 1.817 6.153 1.00 . A A . 15 LEU CB 1 1 14 3753 1 1 15 LEU CD1 C -6.408 2.289 7.816 1.00 . A A . 15 LEU CD1 1 1 14 3754 1 1 15 LEU CD2 C -5.980 -0.068 7.081 1.00 . A A . 15 LEU CD2 1 1 14 3755 1 1 15 LEU CG C -5.351 1.289 7.372 1.00 . A A . 15 LEU CG 1 1 14 3756 1 1 15 LEU H H -5.845 0.331 4.480 1.00 . A A . 15 LEU H 1 1 14 3757 1 1 15 LEU HA H -6.177 3.013 5.376 1.00 . A A . 15 LEU HA 1 1 14 3758 1 1 15 LEU HB2 H -3.956 1.017 5.778 1.00 . A A . 15 LEU HB2 1 1 14 3759 1 1 15 LEU HB3 H -3.936 2.619 6.486 1.00 . A A . 15 LEU HB3 1 1 14 3760 1 1 15 LEU HD11 H -6.967 2.626 6.956 1.00 . A A . 15 LEU HD11 1 1 14 3761 1 1 15 LEU HD12 H -5.927 3.134 8.287 1.00 . A A . 15 LEU HD12 1 1 14 3762 1 1 15 LEU HD13 H -7.076 1.817 8.519 1.00 . A A . 15 LEU HD13 1 1 14 3763 1 1 15 LEU HD21 H -6.240 -0.127 6.034 1.00 . A A . 15 LEU HD21 1 1 14 3764 1 1 15 LEU HD22 H -6.870 -0.189 7.680 1.00 . A A . 15 LEU HD22 1 1 14 3765 1 1 15 LEU HD23 H -5.275 -0.850 7.322 1.00 . A A . 15 LEU HD23 1 1 14 3766 1 1 15 LEU HG H -4.657 1.163 8.192 1.00 . A A . 15 LEU HG 1 1 14 3767 1 1 15 LEU N N -6.127 1.251 4.314 1.00 . A A . 15 LEU N 1 1 14 3768 1 1 15 LEU O O -4.671 4.326 3.869 1.00 . A A . 15 LEU O 1 1 14 3769 1 1 16 CYS C C -3.457 3.086 0.977 1.00 . A A . 16 CYS C 1 1 14 3770 1 1 16 CYS CA C -2.789 2.997 2.346 1.00 . A A . 16 CYS CA 1 1 14 3771 1 1 16 CYS CB C -1.496 2.190 2.234 1.00 . A A . 16 CYS CB 1 1 14 3772 1 1 16 CYS H H -3.649 1.420 3.472 1.00 . A A . 16 CYS H 1 1 14 3773 1 1 16 CYS HA H -2.554 3.994 2.686 1.00 . A A . 16 CYS HA 1 1 14 3774 1 1 16 CYS HB2 H -1.731 1.198 1.883 1.00 . A A . 16 CYS HB2 1 1 14 3775 1 1 16 CYS HB3 H -0.846 2.672 1.516 1.00 . A A . 16 CYS HB3 1 1 14 3776 1 1 16 CYS N N -3.685 2.390 3.322 1.00 . A A . 16 CYS N 1 1 14 3777 1 1 16 CYS O O -2.796 2.956 -0.057 1.00 . A A . 16 CYS O 1 1 14 3778 1 1 16 CYS SG S -0.566 2.017 3.792 1.00 . A A . 16 CYS SG 1 1 14 3779 1 1 17 GLY C C -5.375 4.759 -0.902 1.00 . A A . 17 GLY C 1 1 14 3780 1 1 17 GLY CA C -5.506 3.398 -0.266 1.00 . A A . 17 GLY CA 1 1 14 3781 1 1 17 GLY H H -5.237 3.387 1.832 1.00 . A A . 17 GLY H 1 1 14 3782 1 1 17 GLY HA2 H -5.132 2.661 -0.950 1.00 . A A . 17 GLY HA2 1 1 14 3783 1 1 17 GLY HA3 H -6.549 3.201 -0.071 1.00 . A A . 17 GLY HA3 1 1 14 3784 1 1 17 GLY N N -4.766 3.301 0.976 1.00 . A A . 17 GLY N 1 1 14 3785 1 1 17 GLY O O -5.187 4.879 -2.110 1.00 . A A . 17 GLY O 1 1 14 3786 1 1 18 ALA C C -4.943 8.070 0.605 1.00 . A A . 18 ALA C 1 1 14 3787 1 1 18 ALA CA C -5.374 7.158 -0.535 1.00 . A A . 18 ALA CA 1 1 14 3788 1 1 18 ALA CB C -6.702 7.623 -1.117 1.00 . A A . 18 ALA CB 1 1 14 3789 1 1 18 ALA H H -5.624 5.602 0.873 1.00 . A A . 18 ALA H 1 1 14 3790 1 1 18 ALA HA H -4.629 7.196 -1.317 1.00 . A A . 18 ALA HA 1 1 14 3791 1 1 18 ALA HB1 H -6.917 7.064 -2.017 1.00 . A A . 18 ALA HB1 1 1 14 3792 1 1 18 ALA HB2 H -6.644 8.675 -1.353 1.00 . A A . 18 ALA HB2 1 1 14 3793 1 1 18 ALA HB3 H -7.488 7.459 -0.396 1.00 . A A . 18 ALA HB3 1 1 14 3794 1 1 18 ALA N N -5.476 5.781 -0.076 1.00 . A A . 18 ALA N 1 1 14 3795 1 1 18 ALA O O -5.455 9.177 0.761 1.00 . A A . 18 ALA O 1 1 14 3796 1 1 19 GLY C C -2.188 7.869 3.038 1.00 . A A . 19 GLY C 1 1 14 3797 1 1 19 GLY CA C -3.513 8.377 2.519 1.00 . A A . 19 GLY CA 1 1 14 3798 1 1 19 GLY H H -3.627 6.704 1.231 1.00 . A A . 19 GLY H 1 1 14 3799 1 1 19 GLY HA2 H -3.395 9.404 2.204 1.00 . A A . 19 GLY HA2 1 1 14 3800 1 1 19 GLY HA3 H -4.240 8.337 3.316 1.00 . A A . 19 GLY HA3 1 1 14 3801 1 1 19 GLY N N -3.997 7.595 1.401 1.00 . A A . 19 GLY N 1 1 14 3802 1 1 19 GLY O O -1.938 7.878 4.240 1.00 . A A . 19 GLY O 1 1 14 3803 1 1 20 GLY C C 0.668 6.225 1.369 1.00 . A A . 20 GLY C 1 1 14 3804 1 1 20 GLY CA C -0.035 6.925 2.511 1.00 . A A . 20 GLY CA 1 1 14 3805 1 1 20 GLY H H -1.588 7.449 1.180 1.00 . A A . 20 GLY H 1 1 14 3806 1 1 20 GLY HA2 H 0.575 7.751 2.845 1.00 . A A . 20 GLY HA2 1 1 14 3807 1 1 20 GLY HA3 H -0.157 6.227 3.326 1.00 . A A . 20 GLY HA3 1 1 14 3808 1 1 20 GLY N N -1.335 7.429 2.125 1.00 . A A . 20 GLY N 1 1 14 3809 1 1 20 GLY O O 0.087 5.358 0.713 1.00 . A A . 20 GLY O 1 1 14 3810 1 1 21 ALA C C 4.184 6.327 0.282 1.00 . A A . 21 ALA C 1 1 14 3811 1 1 21 ALA CA C 2.713 6.012 0.067 1.00 . A A . 21 ALA CA 1 1 14 3812 1 1 21 ALA CB C 2.256 6.525 -1.292 1.00 . A A . 21 ALA CB 1 1 14 3813 1 1 21 ALA H H 2.319 7.297 1.695 1.00 . A A . 21 ALA H 1 1 14 3814 1 1 21 ALA HA H 2.572 4.940 0.093 1.00 . A A . 21 ALA HA 1 1 14 3815 1 1 21 ALA HB1 H 1.967 5.691 -1.913 1.00 . A A . 21 ALA HB1 1 1 14 3816 1 1 21 ALA HB2 H 3.064 7.062 -1.764 1.00 . A A . 21 ALA HB2 1 1 14 3817 1 1 21 ALA HB3 H 1.411 7.186 -1.162 1.00 . A A . 21 ALA HB3 1 1 14 3818 1 1 21 ALA N N 1.916 6.600 1.133 1.00 . A A . 21 ALA N 1 1 14 3819 1 1 21 ALA O O 4.526 7.443 0.664 1.00 . A A . 21 ALA O 1 1 14 3820 1 1 22 ALA C C 6.850 5.946 1.613 1.00 . A A . 22 ALA C 1 1 14 3821 1 1 22 ALA CA C 6.487 5.479 0.203 1.00 . A A . 22 ALA CA 1 1 14 3822 1 1 22 ALA CB C 7.049 6.434 -0.845 1.00 . A A . 22 ALA CB 1 1 14 3823 1 1 22 ALA H H 4.686 4.470 -0.256 1.00 . A A . 22 ALA H 1 1 14 3824 1 1 22 ALA HA H 6.933 4.509 0.040 1.00 . A A . 22 ALA HA 1 1 14 3825 1 1 22 ALA HB1 H 6.267 7.096 -1.184 1.00 . A A . 22 ALA HB1 1 1 14 3826 1 1 22 ALA HB2 H 7.429 5.866 -1.681 1.00 . A A . 22 ALA HB2 1 1 14 3827 1 1 22 ALA HB3 H 7.849 7.014 -0.410 1.00 . A A . 22 ALA HB3 1 1 14 3828 1 1 22 ALA N N 5.039 5.332 0.041 1.00 . A A . 22 ALA N 1 1 14 3829 1 1 22 ALA O O 7.720 6.796 1.796 1.00 . A A . 22 ALA O 1 1 14 3830 1 1 23 GLY C C 5.788 4.807 4.966 1.00 . A A . 23 GLY C 1 1 14 3831 1 1 23 GLY CA C 6.448 5.746 3.979 1.00 . A A . 23 GLY CA 1 1 14 3832 1 1 23 GLY H H 5.501 4.708 2.406 1.00 . A A . 23 GLY H 1 1 14 3833 1 1 23 GLY HA2 H 7.516 5.732 4.142 1.00 . A A . 23 GLY HA2 1 1 14 3834 1 1 23 GLY HA3 H 6.082 6.748 4.152 1.00 . A A . 23 GLY HA3 1 1 14 3835 1 1 23 GLY N N 6.180 5.380 2.607 1.00 . A A . 23 GLY N 1 1 14 3836 1 1 23 GLY O O 4.617 4.454 4.807 1.00 . A A . 23 GLY O 1 1 15 3837 1 1 1 GLY C C 5.723 1.843 6.332 1.00 . A A . 1 GLY C 1 1 15 3838 1 1 1 GLY CA C 6.454 3.024 6.944 1.00 . A A . 1 GLY CA 1 1 15 3839 1 1 1 GLY H1 H 7.806 3.865 5.556 1.00 . A A . 1 GLY H1 1 1 15 3840 1 1 1 GLY HA2 H 7.300 2.652 7.502 1.00 . A A . 1 GLY HA2 1 1 15 3841 1 1 1 GLY HA3 H 5.785 3.527 7.627 1.00 . A A . 1 GLY HA3 1 1 15 3842 1 1 1 GLY N N 6.928 3.985 5.971 1.00 . A A . 1 GLY N 1 1 15 3843 1 1 1 GLY O O 6.239 1.179 5.433 1.00 . A A . 1 GLY O 1 1 15 3844 1 1 2 CYS C C 3.390 0.511 4.916 1.00 . A A . 2 CYS C 1 1 15 3845 1 1 2 CYS CA C 3.708 0.452 6.405 1.00 . A A . 2 CYS CA 1 1 15 3846 1 1 2 CYS CB C 2.402 0.429 7.200 1.00 . A A . 2 CYS CB 1 1 15 3847 1 1 2 CYS H H 4.202 2.139 7.580 1.00 . A A . 2 CYS H 1 1 15 3848 1 1 2 CYS HA H 4.251 -0.457 6.607 1.00 . A A . 2 CYS HA 1 1 15 3849 1 1 2 CYS HB2 H 2.627 0.236 8.234 1.00 . A A . 2 CYS HB2 1 1 15 3850 1 1 2 CYS HB3 H 1.927 1.396 7.119 1.00 . A A . 2 CYS HB3 1 1 15 3851 1 1 2 CYS N N 4.533 1.574 6.852 1.00 . A A . 2 CYS N 1 1 15 3852 1 1 2 CYS O O 3.573 -0.469 4.199 1.00 . A A . 2 CYS O 1 1 15 3853 1 1 2 CYS SG S 1.194 -0.827 6.651 1.00 . A A . 2 CYS SG 1 1 15 3854 1 1 3 CYS C C 3.672 1.625 2.110 1.00 . A A . 3 CYS C 1 1 15 3855 1 1 3 CYS CA C 2.498 1.816 3.070 1.00 . A A . 3 CYS CA 1 1 15 3856 1 1 3 CYS CB C 1.847 3.181 2.867 1.00 . A A . 3 CYS CB 1 1 15 3857 1 1 3 CYS H H 2.736 2.383 5.097 1.00 . A A . 3 CYS H 1 1 15 3858 1 1 3 CYS HA H 1.772 1.053 2.852 1.00 . A A . 3 CYS HA 1 1 15 3859 1 1 3 CYS HB2 H 2.584 3.952 3.029 1.00 . A A . 3 CYS HB2 1 1 15 3860 1 1 3 CYS HB3 H 1.477 3.248 1.854 1.00 . A A . 3 CYS HB3 1 1 15 3861 1 1 3 CYS N N 2.884 1.646 4.467 1.00 . A A . 3 CYS N 1 1 15 3862 1 1 3 CYS O O 3.484 1.164 0.981 1.00 . A A . 3 CYS O 1 1 15 3863 1 1 3 CYS SG S 0.447 3.502 3.995 1.00 . A A . 3 CYS SG 1 1 15 3864 1 1 4 SER C C 6.400 0.321 1.559 1.00 . A A . 4 SER C 1 1 15 3865 1 1 4 SER CA C 6.059 1.799 1.723 1.00 . A A . 4 SER CA 1 1 15 3866 1 1 4 SER CB C 7.241 2.550 2.329 1.00 . A A . 4 SER CB 1 1 15 3867 1 1 4 SER H H 4.971 2.313 3.462 1.00 . A A . 4 SER H 1 1 15 3868 1 1 4 SER HA H 5.840 2.212 0.751 1.00 . A A . 4 SER HA 1 1 15 3869 1 1 4 SER HB2 H 7.437 2.171 3.322 1.00 . A A . 4 SER HB2 1 1 15 3870 1 1 4 SER HB3 H 8.114 2.408 1.709 1.00 . A A . 4 SER HB3 1 1 15 3871 1 1 4 SER HG H 7.104 4.342 1.556 1.00 . A A . 4 SER HG 1 1 15 3872 1 1 4 SER N N 4.873 1.961 2.554 1.00 . A A . 4 SER N 1 1 15 3873 1 1 4 SER O O 7.074 -0.075 0.610 1.00 . A A . 4 SER O 1 1 15 3874 1 1 4 SER OG O 6.963 3.937 2.416 1.00 . A A . 4 SER OG 1 1 15 3875 1 1 5 ASN C C 5.043 -2.615 1.658 1.00 . A A . 5 ASN C 1 1 15 3876 1 1 5 ASN CA C 6.147 -1.929 2.441 1.00 . A A . 5 ASN CA 1 1 15 3877 1 1 5 ASN CB C 6.225 -2.506 3.856 1.00 . A A . 5 ASN CB 1 1 15 3878 1 1 5 ASN CG C 7.610 -2.385 4.458 1.00 . A A . 5 ASN CG 1 1 15 3879 1 1 5 ASN H H 5.356 -0.117 3.205 1.00 . A A . 5 ASN H 1 1 15 3880 1 1 5 ASN HA H 7.089 -2.096 1.939 1.00 . A A . 5 ASN HA 1 1 15 3881 1 1 5 ASN HB2 H 5.530 -1.978 4.493 1.00 . A A . 5 ASN HB2 1 1 15 3882 1 1 5 ASN HB3 H 5.955 -3.552 3.827 1.00 . A A . 5 ASN HB3 1 1 15 3883 1 1 5 ASN HD21 H 6.967 -1.027 5.756 1.00 . A A . 5 ASN HD21 1 1 15 3884 1 1 5 ASN HD22 H 8.640 -1.441 5.863 1.00 . A A . 5 ASN HD22 1 1 15 3885 1 1 5 ASN N N 5.911 -0.493 2.485 1.00 . A A . 5 ASN N 1 1 15 3886 1 1 5 ASN ND2 N 7.752 -1.532 5.461 1.00 . A A . 5 ASN ND2 1 1 15 3887 1 1 5 ASN O O 3.872 -2.483 1.993 1.00 . A A . 5 ASN O 1 1 15 3888 1 1 5 ASN OD1 O 8.547 -3.047 4.018 1.00 . A A . 5 ASN OD1 1 1 15 3889 1 1 6 PRO C C 3.517 -4.989 0.535 1.00 . A A . 6 PRO C 1 1 15 3890 1 1 6 PRO CA C 4.424 -4.045 -0.252 1.00 . A A . 6 PRO CA 1 1 15 3891 1 1 6 PRO CB C 5.298 -4.837 -1.229 1.00 . A A . 6 PRO CB 1 1 15 3892 1 1 6 PRO CD C 6.781 -3.541 0.121 1.00 . A A . 6 PRO CD 1 1 15 3893 1 1 6 PRO CG C 6.595 -4.106 -1.259 1.00 . A A . 6 PRO CG 1 1 15 3894 1 1 6 PRO HA H 3.812 -3.344 -0.802 1.00 . A A . 6 PRO HA 1 1 15 3895 1 1 6 PRO HB2 H 5.420 -5.847 -0.869 1.00 . A A . 6 PRO HB2 1 1 15 3896 1 1 6 PRO HB3 H 4.832 -4.850 -2.203 1.00 . A A . 6 PRO HB3 1 1 15 3897 1 1 6 PRO HD2 H 7.310 -4.242 0.749 1.00 . A A . 6 PRO HD2 1 1 15 3898 1 1 6 PRO HD3 H 7.307 -2.599 0.076 1.00 . A A . 6 PRO HD3 1 1 15 3899 1 1 6 PRO HG2 H 7.397 -4.790 -1.494 1.00 . A A . 6 PRO HG2 1 1 15 3900 1 1 6 PRO HG3 H 6.554 -3.310 -1.987 1.00 . A A . 6 PRO HG3 1 1 15 3901 1 1 6 PRO N N 5.398 -3.348 0.595 1.00 . A A . 6 PRO N 1 1 15 3902 1 1 6 PRO O O 2.310 -5.034 0.303 1.00 . A A . 6 PRO O 1 1 15 3903 1 1 7 VAL C C 2.348 -5.950 3.170 1.00 . A A . 7 VAL C 1 1 15 3904 1 1 7 VAL CA C 3.346 -6.679 2.279 1.00 . A A . 7 VAL CA 1 1 15 3905 1 1 7 VAL CB C 4.282 -7.537 3.158 1.00 . A A . 7 VAL CB 1 1 15 3906 1 1 7 VAL CG1 C 3.486 -8.551 3.968 1.00 . A A . 7 VAL CG1 1 1 15 3907 1 1 7 VAL CG2 C 5.328 -8.235 2.303 1.00 . A A . 7 VAL CG2 1 1 15 3908 1 1 7 VAL H H 5.067 -5.650 1.603 1.00 . A A . 7 VAL H 1 1 15 3909 1 1 7 VAL HA H 2.806 -7.337 1.613 1.00 . A A . 7 VAL HA 1 1 15 3910 1 1 7 VAL HB H 4.792 -6.882 3.849 1.00 . A A . 7 VAL HB 1 1 15 3911 1 1 7 VAL HG11 H 3.096 -9.313 3.309 1.00 . A A . 7 VAL HG11 1 1 15 3912 1 1 7 VAL HG12 H 2.667 -8.051 4.465 1.00 . A A . 7 VAL HG12 1 1 15 3913 1 1 7 VAL HG13 H 4.130 -9.007 4.706 1.00 . A A . 7 VAL HG13 1 1 15 3914 1 1 7 VAL HG21 H 6.238 -8.352 2.874 1.00 . A A . 7 VAL HG21 1 1 15 3915 1 1 7 VAL HG22 H 5.528 -7.641 1.424 1.00 . A A . 7 VAL HG22 1 1 15 3916 1 1 7 VAL HG23 H 4.962 -9.206 2.005 1.00 . A A . 7 VAL HG23 1 1 15 3917 1 1 7 VAL N N 4.103 -5.736 1.462 1.00 . A A . 7 VAL N 1 1 15 3918 1 1 7 VAL O O 1.171 -6.301 3.226 1.00 . A A . 7 VAL O 1 1 15 3919 1 1 8 CYS C C 0.929 -3.386 3.947 1.00 . A A . 8 CYS C 1 1 15 3920 1 1 8 CYS CA C 1.978 -4.142 4.751 1.00 . A A . 8 CYS CA 1 1 15 3921 1 1 8 CYS CB C 2.819 -3.157 5.562 1.00 . A A . 8 CYS CB 1 1 15 3922 1 1 8 CYS H H 3.772 -4.689 3.769 1.00 . A A . 8 CYS H 1 1 15 3923 1 1 8 CYS HA H 1.481 -4.822 5.424 1.00 . A A . 8 CYS HA 1 1 15 3924 1 1 8 CYS HB2 H 3.764 -3.614 5.800 1.00 . A A . 8 CYS HB2 1 1 15 3925 1 1 8 CYS HB3 H 2.992 -2.278 4.961 1.00 . A A . 8 CYS HB3 1 1 15 3926 1 1 8 CYS N N 2.827 -4.926 3.861 1.00 . A A . 8 CYS N 1 1 15 3927 1 1 8 CYS O O -0.222 -3.279 4.357 1.00 . A A . 8 CYS O 1 1 15 3928 1 1 8 CYS SG S 2.048 -2.608 7.122 1.00 . A A . 8 CYS SG 1 1 15 3929 1 1 9 HIS C C -0.676 -2.976 1.418 1.00 . A A . 9 HIS C 1 1 15 3930 1 1 9 HIS CA C 0.463 -2.103 1.922 1.00 . A A . 9 HIS CA 1 1 15 3931 1 1 9 HIS CB C 1.251 -1.540 0.736 1.00 . A A . 9 HIS CB 1 1 15 3932 1 1 9 HIS CD2 C -0.739 -0.078 -0.085 1.00 . A A . 9 HIS CD2 1 1 15 3933 1 1 9 HIS CE1 C 0.406 1.445 -1.162 1.00 . A A . 9 HIS CE1 1 1 15 3934 1 1 9 HIS CG C 0.572 -0.396 0.037 1.00 . A A . 9 HIS CG 1 1 15 3935 1 1 9 HIS H H 2.290 -2.980 2.542 1.00 . A A . 9 HIS H 1 1 15 3936 1 1 9 HIS HA H 0.050 -1.282 2.490 1.00 . A A . 9 HIS HA 1 1 15 3937 1 1 9 HIS HB2 H 2.211 -1.200 1.081 1.00 . A A . 9 HIS HB2 1 1 15 3938 1 1 9 HIS HB3 H 1.397 -2.327 0.011 1.00 . A A . 9 HIS HB3 1 1 15 3939 1 1 9 HIS HD1 H 2.240 0.640 -0.730 1.00 . A A . 9 HIS HD1 1 1 15 3940 1 1 9 HIS HD2 H -1.572 -0.628 0.330 1.00 . A A . 9 HIS HD2 1 1 15 3941 1 1 9 HIS HE1 H 0.664 2.312 -1.752 1.00 . A A . 9 HIS HE1 1 1 15 3942 1 1 9 HIS HE2 H -1.607 1.661 -0.867 1.00 . A A . 9 HIS HE2 1 1 15 3943 1 1 9 HIS N N 1.347 -2.860 2.802 1.00 . A A . 9 HIS N 1 1 15 3944 1 1 9 HIS ND1 N 1.262 0.578 -0.651 1.00 . A A . 9 HIS ND1 1 1 15 3945 1 1 9 HIS NE2 N -0.818 1.071 -0.833 1.00 . A A . 9 HIS NE2 1 1 15 3946 1 1 9 HIS O O -1.816 -2.533 1.352 1.00 . A A . 9 HIS O 1 1 15 3947 1 1 10 LEU C C -2.411 -5.412 1.631 1.00 . A A . 10 LEU C 1 1 15 3948 1 1 10 LEU CA C -1.354 -5.147 0.562 1.00 . A A . 10 LEU CA 1 1 15 3949 1 1 10 LEU CB C -0.689 -6.461 0.139 1.00 . A A . 10 LEU CB 1 1 15 3950 1 1 10 LEU CD1 C -2.249 -6.992 -1.755 1.00 . A A . 10 LEU CD1 1 1 15 3951 1 1 10 LEU CD2 C -0.886 -8.810 -0.710 1.00 . A A . 10 LEU CD2 1 1 15 3952 1 1 10 LEU CG C -1.630 -7.507 -0.463 1.00 . A A . 10 LEU CG 1 1 15 3953 1 1 10 LEU H H 0.584 -4.498 1.131 1.00 . A A . 10 LEU H 1 1 15 3954 1 1 10 LEU HA H -1.830 -4.699 -0.298 1.00 . A A . 10 LEU HA 1 1 15 3955 1 1 10 LEU HB2 H 0.076 -6.233 -0.589 1.00 . A A . 10 LEU HB2 1 1 15 3956 1 1 10 LEU HB3 H -0.216 -6.894 1.007 1.00 . A A . 10 LEU HB3 1 1 15 3957 1 1 10 LEU HD11 H -1.467 -6.777 -2.468 1.00 . A A . 10 LEU HD11 1 1 15 3958 1 1 10 LEU HD12 H -2.808 -6.090 -1.551 1.00 . A A . 10 LEU HD12 1 1 15 3959 1 1 10 LEU HD13 H -2.911 -7.742 -2.161 1.00 . A A . 10 LEU HD13 1 1 15 3960 1 1 10 LEU HD21 H -1.599 -9.602 -0.891 1.00 . A A . 10 LEU HD21 1 1 15 3961 1 1 10 LEU HD22 H -0.289 -9.054 0.156 1.00 . A A . 10 LEU HD22 1 1 15 3962 1 1 10 LEU HD23 H -0.243 -8.700 -1.571 1.00 . A A . 10 LEU HD23 1 1 15 3963 1 1 10 LEU HG H -2.431 -7.705 0.233 1.00 . A A . 10 LEU HG 1 1 15 3964 1 1 10 LEU N N -0.353 -4.209 1.060 1.00 . A A . 10 LEU N 1 1 15 3965 1 1 10 LEU O O -3.609 -5.304 1.374 1.00 . A A . 10 LEU O 1 1 15 3966 1 1 11 GLU C C -3.595 -4.754 4.354 1.00 . A A . 11 GLU C 1 1 15 3967 1 1 11 GLU CA C -2.833 -6.018 3.956 1.00 . A A . 11 GLU CA 1 1 15 3968 1 1 11 GLU CB C -2.007 -6.530 5.142 1.00 . A A . 11 GLU CB 1 1 15 3969 1 1 11 GLU CD C -3.652 -8.110 6.241 1.00 . A A . 11 GLU CD 1 1 15 3970 1 1 11 GLU CG C -2.823 -6.848 6.385 1.00 . A A . 11 GLU CG 1 1 15 3971 1 1 11 GLU H H -0.978 -5.803 2.963 1.00 . A A . 11 GLU H 1 1 15 3972 1 1 11 GLU HA H -3.536 -6.776 3.657 1.00 . A A . 11 GLU HA 1 1 15 3973 1 1 11 GLU HB2 H -1.490 -7.429 4.841 1.00 . A A . 11 GLU HB2 1 1 15 3974 1 1 11 GLU HB3 H -1.275 -5.778 5.403 1.00 . A A . 11 GLU HB3 1 1 15 3975 1 1 11 GLU HG2 H -2.150 -6.974 7.219 1.00 . A A . 11 GLU HG2 1 1 15 3976 1 1 11 GLU HG3 H -3.488 -6.020 6.584 1.00 . A A . 11 GLU HG3 1 1 15 3977 1 1 11 GLU N N -1.947 -5.744 2.830 1.00 . A A . 11 GLU N 1 1 15 3978 1 1 11 GLU O O -4.815 -4.756 4.514 1.00 . A A . 11 GLU O 1 1 15 3979 1 1 11 GLU OE1 O -4.504 -8.162 5.334 1.00 . A A . 11 GLU OE1 1 1 15 3980 1 1 11 GLU OE2 O -3.445 -9.042 7.043 1.00 . A A . 11 GLU OE2 1 1 15 3981 1 1 12 HIS C C -3.819 -1.594 3.630 1.00 . A A . 12 HIS C 1 1 15 3982 1 1 12 HIS CA C -3.453 -2.387 4.879 1.00 . A A . 12 HIS CA 1 1 15 3983 1 1 12 HIS CB C -2.494 -1.558 5.754 1.00 . A A . 12 HIS CB 1 1 15 3984 1 1 12 HIS CD2 C -1.772 -3.569 7.248 1.00 . A A . 12 HIS CD2 1 1 15 3985 1 1 12 HIS CE1 C -1.182 -2.448 9.033 1.00 . A A . 12 HIS CE1 1 1 15 3986 1 1 12 HIS CG C -1.988 -2.256 6.988 1.00 . A A . 12 HIS CG 1 1 15 3987 1 1 12 HIS H H -1.892 -3.721 4.349 1.00 . A A . 12 HIS H 1 1 15 3988 1 1 12 HIS HA H -4.354 -2.591 5.438 1.00 . A A . 12 HIS HA 1 1 15 3989 1 1 12 HIS HB2 H -1.635 -1.281 5.162 1.00 . A A . 12 HIS HB2 1 1 15 3990 1 1 12 HIS HB3 H -3.003 -0.659 6.070 1.00 . A A . 12 HIS HB3 1 1 15 3991 1 1 12 HIS HD1 H -1.624 -0.609 8.251 1.00 . A A . 12 HIS HD1 1 1 15 3992 1 1 12 HIS HD2 H -1.929 -4.389 6.563 1.00 . A A . 12 HIS HD2 1 1 15 3993 1 1 12 HIS HE1 H -0.822 -2.204 10.022 1.00 . A A . 12 HIS HE1 1 1 15 3994 1 1 12 HIS HE2 H -1.127 -4.495 9.017 1.00 . A A . 12 HIS HE2 1 1 15 3995 1 1 12 HIS N N -2.861 -3.665 4.504 1.00 . A A . 12 HIS N 1 1 15 3996 1 1 12 HIS ND1 N -1.605 -1.581 8.129 1.00 . A A . 12 HIS ND1 1 1 15 3997 1 1 12 HIS NE2 N -1.275 -3.660 8.523 1.00 . A A . 12 HIS NE2 1 1 15 3998 1 1 12 HIS O O -3.561 -0.394 3.552 1.00 . A A . 12 HIS O 1 1 15 3999 1 1 13 SER C C -5.767 -0.503 1.624 1.00 . A A . 13 SER C 1 1 15 4000 1 1 13 SER CA C -4.790 -1.654 1.394 1.00 . A A . 13 SER CA 1 1 15 4001 1 1 13 SER CB C -5.409 -2.703 0.461 1.00 . A A . 13 SER CB 1 1 15 4002 1 1 13 SER H H -4.566 -3.240 2.778 1.00 . A A . 13 SER H 1 1 15 4003 1 1 13 SER HA H -3.896 -1.263 0.933 1.00 . A A . 13 SER HA 1 1 15 4004 1 1 13 SER HB2 H -4.746 -3.551 0.390 1.00 . A A . 13 SER HB2 1 1 15 4005 1 1 13 SER HB3 H -6.360 -3.021 0.864 1.00 . A A . 13 SER HB3 1 1 15 4006 1 1 13 SER HG H -5.849 -2.895 -1.438 1.00 . A A . 13 SER HG 1 1 15 4007 1 1 13 SER N N -4.405 -2.278 2.655 1.00 . A A . 13 SER N 1 1 15 4008 1 1 13 SER O O -5.636 0.561 1.020 1.00 . A A . 13 SER O 1 1 15 4009 1 1 13 SER OG O -5.618 -2.180 -0.840 1.00 . A A . 13 SER OG 1 1 15 4010 1 1 14 ASN C C -7.099 1.515 3.473 1.00 . A A . 14 ASN C 1 1 15 4011 1 1 14 ASN CA C -7.739 0.297 2.816 1.00 . A A . 14 ASN CA 1 1 15 4012 1 1 14 ASN CB C -8.817 -0.283 3.737 1.00 . A A . 14 ASN CB 1 1 15 4013 1 1 14 ASN CG C -9.927 0.711 4.031 1.00 . A A . 14 ASN CG 1 1 15 4014 1 1 14 ASN H H -6.785 -1.590 2.951 1.00 . A A . 14 ASN H 1 1 15 4015 1 1 14 ASN HA H -8.198 0.603 1.891 1.00 . A A . 14 ASN HA 1 1 15 4016 1 1 14 ASN HB2 H -9.253 -1.152 3.269 1.00 . A A . 14 ASN HB2 1 1 15 4017 1 1 14 ASN HB3 H -8.362 -0.574 4.673 1.00 . A A . 14 ASN HB3 1 1 15 4018 1 1 14 ASN HD21 H -9.502 0.669 5.970 1.00 . A A . 14 ASN HD21 1 1 15 4019 1 1 14 ASN HD22 H -10.801 1.706 5.507 1.00 . A A . 14 ASN HD22 1 1 15 4020 1 1 14 ASN N N -6.739 -0.722 2.503 1.00 . A A . 14 ASN N 1 1 15 4021 1 1 14 ASN ND2 N -10.093 1.062 5.299 1.00 . A A . 14 ASN ND2 1 1 15 4022 1 1 14 ASN O O -7.442 2.654 3.167 1.00 . A A . 14 ASN O 1 1 15 4023 1 1 14 ASN OD1 O -10.631 1.154 3.130 1.00 . A A . 14 ASN OD1 1 1 15 4024 1 1 15 LEU C C -4.547 3.092 4.149 1.00 . A A . 15 LEU C 1 1 15 4025 1 1 15 LEU CA C -5.473 2.331 5.088 1.00 . A A . 15 LEU CA 1 1 15 4026 1 1 15 LEU CB C -4.675 1.761 6.264 1.00 . A A . 15 LEU CB 1 1 15 4027 1 1 15 LEU CD1 C -4.611 0.485 8.420 1.00 . A A . 15 LEU CD1 1 1 15 4028 1 1 15 LEU CD2 C -6.555 1.974 7.915 1.00 . A A . 15 LEU CD2 1 1 15 4029 1 1 15 LEU CG C -5.509 1.038 7.325 1.00 . A A . 15 LEU CG 1 1 15 4030 1 1 15 LEU H H -5.938 0.333 4.572 1.00 . A A . 15 LEU H 1 1 15 4031 1 1 15 LEU HA H -6.216 3.012 5.465 1.00 . A A . 15 LEU HA 1 1 15 4032 1 1 15 LEU HB2 H -3.945 1.068 5.873 1.00 . A A . 15 LEU HB2 1 1 15 4033 1 1 15 LEU HB3 H -4.152 2.575 6.744 1.00 . A A . 15 LEU HB3 1 1 15 4034 1 1 15 LEU HD11 H -3.584 0.748 8.212 1.00 . A A . 15 LEU HD11 1 1 15 4035 1 1 15 LEU HD12 H -4.707 -0.590 8.456 1.00 . A A . 15 LEU HD12 1 1 15 4036 1 1 15 LEU HD13 H -4.904 0.904 9.371 1.00 . A A . 15 LEU HD13 1 1 15 4037 1 1 15 LEU HD21 H -6.075 2.879 8.258 1.00 . A A . 15 LEU HD21 1 1 15 4038 1 1 15 LEU HD22 H -7.045 1.488 8.746 1.00 . A A . 15 LEU HD22 1 1 15 4039 1 1 15 LEU HD23 H -7.286 2.218 7.158 1.00 . A A . 15 LEU HD23 1 1 15 4040 1 1 15 LEU HG H -6.023 0.207 6.864 1.00 . A A . 15 LEU HG 1 1 15 4041 1 1 15 LEU N N -6.166 1.260 4.379 1.00 . A A . 15 LEU N 1 1 15 4042 1 1 15 LEU O O -4.525 4.320 4.134 1.00 . A A . 15 LEU O 1 1 15 4043 1 1 16 CYS C C -3.527 3.093 1.042 1.00 . A A . 16 CYS C 1 1 15 4044 1 1 16 CYS CA C -2.867 2.940 2.410 1.00 . A A . 16 CYS CA 1 1 15 4045 1 1 16 CYS CB C -1.617 2.078 2.290 1.00 . A A . 16 CYS CB 1 1 15 4046 1 1 16 CYS H H -3.864 1.373 3.418 1.00 . A A . 16 CYS H 1 1 15 4047 1 1 16 CYS HA H -2.588 3.916 2.776 1.00 . A A . 16 CYS HA 1 1 15 4048 1 1 16 CYS HB2 H -1.905 1.106 1.925 1.00 . A A . 16 CYS HB2 1 1 15 4049 1 1 16 CYS HB3 H -0.942 2.535 1.581 1.00 . A A . 16 CYS HB3 1 1 15 4050 1 1 16 CYS N N -3.793 2.350 3.362 1.00 . A A . 16 CYS N 1 1 15 4051 1 1 16 CYS O O -2.911 2.820 0.001 1.00 . A A . 16 CYS O 1 1 15 4052 1 1 16 CYS SG S -0.706 1.836 3.849 1.00 . A A . 16 CYS SG 1 1 15 4053 1 1 17 GLY C C -4.925 4.813 -1.025 1.00 . A A . 17 GLY C 1 1 15 4054 1 1 17 GLY CA C -5.525 3.719 -0.169 1.00 . A A . 17 GLY CA 1 1 15 4055 1 1 17 GLY H H -5.202 3.718 1.920 1.00 . A A . 17 GLY H 1 1 15 4056 1 1 17 GLY HA2 H -5.527 2.795 -0.728 1.00 . A A . 17 GLY HA2 1 1 15 4057 1 1 17 GLY HA3 H -6.543 3.985 0.077 1.00 . A A . 17 GLY HA3 1 1 15 4058 1 1 17 GLY N N -4.779 3.526 1.057 1.00 . A A . 17 GLY N 1 1 15 4059 1 1 17 GLY O O -4.616 5.894 -0.523 1.00 . A A . 17 GLY O 1 1 15 4060 1 1 18 ALA C C -2.787 5.934 -2.779 1.00 . A A . 18 ALA C 1 1 15 4061 1 1 18 ALA CA C -4.159 5.469 -3.261 1.00 . A A . 18 ALA CA 1 1 15 4062 1 1 18 ALA CB C -5.090 6.656 -3.483 1.00 . A A . 18 ALA CB 1 1 15 4063 1 1 18 ALA H H -5.006 3.632 -2.634 1.00 . A A . 18 ALA H 1 1 15 4064 1 1 18 ALA HA H -4.037 4.957 -4.206 1.00 . A A . 18 ALA HA 1 1 15 4065 1 1 18 ALA HB1 H -5.669 6.831 -2.588 1.00 . A A . 18 ALA HB1 1 1 15 4066 1 1 18 ALA HB2 H -5.755 6.443 -4.307 1.00 . A A . 18 ALA HB2 1 1 15 4067 1 1 18 ALA HB3 H -4.504 7.534 -3.712 1.00 . A A . 18 ALA HB3 1 1 15 4068 1 1 18 ALA N N -4.745 4.519 -2.314 1.00 . A A . 18 ALA N 1 1 15 4069 1 1 18 ALA O O -2.413 7.093 -2.940 1.00 . A A . 18 ALA O 1 1 15 4070 1 1 19 GLY C C -0.735 5.353 -0.136 1.00 . A A . 19 GLY C 1 1 15 4071 1 1 19 GLY CA C -0.739 5.327 -1.649 1.00 . A A . 19 GLY CA 1 1 15 4072 1 1 19 GLY H H -2.417 4.114 -2.058 1.00 . A A . 19 GLY H 1 1 15 4073 1 1 19 GLY HA2 H -0.036 4.581 -1.991 1.00 . A A . 19 GLY HA2 1 1 15 4074 1 1 19 GLY HA3 H -0.434 6.295 -2.018 1.00 . A A . 19 GLY HA3 1 1 15 4075 1 1 19 GLY N N -2.052 5.014 -2.170 1.00 . A A . 19 GLY N 1 1 15 4076 1 1 19 GLY O O 0.072 4.674 0.501 1.00 . A A . 19 GLY O 1 1 15 4077 1 1 20 GLY C C -0.698 7.091 2.489 1.00 . A A . 20 GLY C 1 1 15 4078 1 1 20 GLY CA C -1.773 6.219 1.874 1.00 . A A . 20 GLY CA 1 1 15 4079 1 1 20 GLY H H -2.281 6.618 -0.138 1.00 . A A . 20 GLY H 1 1 15 4080 1 1 20 GLY HA2 H -2.740 6.634 2.117 1.00 . A A . 20 GLY HA2 1 1 15 4081 1 1 20 GLY HA3 H -1.703 5.228 2.298 1.00 . A A . 20 GLY HA3 1 1 15 4082 1 1 20 GLY N N -1.658 6.119 0.432 1.00 . A A . 20 GLY N 1 1 15 4083 1 1 20 GLY O O -0.314 8.112 1.919 1.00 . A A . 20 GLY O 1 1 15 4084 1 1 21 ALA C C 2.187 7.178 3.734 1.00 . A A . 21 ALA C 1 1 15 4085 1 1 21 ALA CA C 0.820 7.433 4.354 1.00 . A A . 21 ALA CA 1 1 15 4086 1 1 21 ALA CB C 0.830 7.065 5.830 1.00 . A A . 21 ALA CB 1 1 15 4087 1 1 21 ALA H H -0.560 5.864 4.054 1.00 . A A . 21 ALA H 1 1 15 4088 1 1 21 ALA HA H 0.588 8.484 4.270 1.00 . A A . 21 ALA HA 1 1 15 4089 1 1 21 ALA HB1 H 1.274 7.868 6.399 1.00 . A A . 21 ALA HB1 1 1 15 4090 1 1 21 ALA HB2 H 1.408 6.163 5.972 1.00 . A A . 21 ALA HB2 1 1 15 4091 1 1 21 ALA HB3 H -0.182 6.900 6.167 1.00 . A A . 21 ALA HB3 1 1 15 4092 1 1 21 ALA N N -0.214 6.687 3.655 1.00 . A A . 21 ALA N 1 1 15 4093 1 1 21 ALA O O 2.582 6.031 3.524 1.00 . A A . 21 ALA O 1 1 15 4094 1 1 22 ALA C C 5.242 7.681 3.907 1.00 . A A . 22 ALA C 1 1 15 4095 1 1 22 ALA CA C 4.231 8.130 2.860 1.00 . A A . 22 ALA CA 1 1 15 4096 1 1 22 ALA CB C 4.656 9.453 2.240 1.00 . A A . 22 ALA CB 1 1 15 4097 1 1 22 ALA H H 2.548 9.135 3.641 1.00 . A A . 22 ALA H 1 1 15 4098 1 1 22 ALA HA H 4.184 7.388 2.076 1.00 . A A . 22 ALA HA 1 1 15 4099 1 1 22 ALA HB1 H 5.695 9.399 1.952 1.00 . A A . 22 ALA HB1 1 1 15 4100 1 1 22 ALA HB2 H 4.523 10.247 2.960 1.00 . A A . 22 ALA HB2 1 1 15 4101 1 1 22 ALA HB3 H 4.051 9.653 1.368 1.00 . A A . 22 ALA HB3 1 1 15 4102 1 1 22 ALA N N 2.909 8.248 3.447 1.00 . A A . 22 ALA N 1 1 15 4103 1 1 22 ALA O O 5.489 8.384 4.886 1.00 . A A . 22 ALA O 1 1 15 4104 1 1 23 GLY C C 6.191 5.037 5.643 1.00 . A A . 23 GLY C 1 1 15 4105 1 1 23 GLY CA C 6.797 5.985 4.626 1.00 . A A . 23 GLY CA 1 1 15 4106 1 1 23 GLY H H 5.582 5.991 2.900 1.00 . A A . 23 GLY H 1 1 15 4107 1 1 23 GLY HA2 H 7.561 5.460 4.072 1.00 . A A . 23 GLY HA2 1 1 15 4108 1 1 23 GLY HA3 H 7.255 6.812 5.151 1.00 . A A . 23 GLY HA3 1 1 15 4109 1 1 23 GLY N N 5.822 6.508 3.694 1.00 . A A . 23 GLY N 1 1 15 4110 1 1 23 GLY O O 5.081 5.252 6.129 1.00 . A A . 23 GLY O 1 1 16 4111 1 1 1 GLY C C 5.911 2.573 6.124 1.00 . A A . 1 GLY C 1 1 16 4112 1 1 1 GLY CA C 6.286 4.011 6.391 1.00 . A A . 1 GLY CA 1 1 16 4113 1 1 1 GLY H1 H 8.258 3.517 5.824 1.00 . A A . 1 GLY H1 1 1 16 4114 1 1 1 GLY HA2 H 6.105 4.236 7.432 1.00 . A A . 1 GLY HA2 1 1 16 4115 1 1 1 GLY HA3 H 5.672 4.654 5.778 1.00 . A A . 1 GLY HA3 1 1 16 4116 1 1 1 GLY N N 7.677 4.261 6.090 1.00 . A A . 1 GLY N 1 1 16 4117 1 1 1 GLY O O 6.509 1.925 5.269 1.00 . A A . 1 GLY O 1 1 16 4118 1 1 2 CYS C C 3.910 0.496 5.283 1.00 . A A . 2 CYS C 1 1 16 4119 1 1 2 CYS CA C 4.493 0.686 6.681 1.00 . A A . 2 CYS CA 1 1 16 4120 1 1 2 CYS CB C 3.454 0.310 7.744 1.00 . A A . 2 CYS CB 1 1 16 4121 1 1 2 CYS H H 4.493 2.627 7.529 1.00 . A A . 2 CYS H 1 1 16 4122 1 1 2 CYS HA H 5.357 0.048 6.788 1.00 . A A . 2 CYS HA 1 1 16 4123 1 1 2 CYS HB2 H 3.733 0.763 8.684 1.00 . A A . 2 CYS HB2 1 1 16 4124 1 1 2 CYS HB3 H 2.489 0.690 7.441 1.00 . A A . 2 CYS HB3 1 1 16 4125 1 1 2 CYS N N 4.930 2.066 6.855 1.00 . A A . 2 CYS N 1 1 16 4126 1 1 2 CYS O O 4.157 -0.513 4.630 1.00 . A A . 2 CYS O 1 1 16 4127 1 1 2 CYS SG S 3.280 -1.485 8.029 1.00 . A A . 2 CYS SG 1 1 16 4128 1 1 3 CYS C C 3.542 1.323 2.392 1.00 . A A . 3 CYS C 1 1 16 4129 1 1 3 CYS CA C 2.513 1.451 3.513 1.00 . A A . 3 CYS CA 1 1 16 4130 1 1 3 CYS CB C 1.669 2.707 3.308 1.00 . A A . 3 CYS CB 1 1 16 4131 1 1 3 CYS H H 2.994 2.266 5.403 1.00 . A A . 3 CYS H 1 1 16 4132 1 1 3 CYS HA H 1.867 0.588 3.483 1.00 . A A . 3 CYS HA 1 1 16 4133 1 1 3 CYS HB2 H 2.317 3.571 3.307 1.00 . A A . 3 CYS HB2 1 1 16 4134 1 1 3 CYS HB3 H 1.164 2.641 2.357 1.00 . A A . 3 CYS HB3 1 1 16 4135 1 1 3 CYS N N 3.144 1.485 4.832 1.00 . A A . 3 CYS N 1 1 16 4136 1 1 3 CYS O O 3.238 0.795 1.322 1.00 . A A . 3 CYS O 1 1 16 4137 1 1 3 CYS SG S 0.405 2.963 4.597 1.00 . A A . 3 CYS SG 1 1 16 4138 1 1 4 SER C C 6.249 0.282 1.421 1.00 . A A . 4 SER C 1 1 16 4139 1 1 4 SER CA C 5.828 1.732 1.661 1.00 . A A . 4 SER CA 1 1 16 4140 1 1 4 SER CB C 7.016 2.563 2.140 1.00 . A A . 4 SER CB 1 1 16 4141 1 1 4 SER H H 4.937 2.208 3.514 1.00 . A A . 4 SER H 1 1 16 4142 1 1 4 SER HA H 5.458 2.145 0.736 1.00 . A A . 4 SER HA 1 1 16 4143 1 1 4 SER HB2 H 7.492 2.065 2.971 1.00 . A A . 4 SER HB2 1 1 16 4144 1 1 4 SER HB3 H 7.723 2.676 1.331 1.00 . A A . 4 SER HB3 1 1 16 4145 1 1 4 SER HG H 7.365 4.372 2.823 1.00 . A A . 4 SER HG 1 1 16 4146 1 1 4 SER N N 4.754 1.801 2.642 1.00 . A A . 4 SER N 1 1 16 4147 1 1 4 SER O O 6.828 -0.048 0.388 1.00 . A A . 4 SER O 1 1 16 4148 1 1 4 SER OG O 6.591 3.851 2.560 1.00 . A A . 4 SER OG 1 1 16 4149 1 1 5 ASN C C 5.130 -2.727 1.549 1.00 . A A . 5 ASN C 1 1 16 4150 1 1 5 ASN CA C 6.254 -1.999 2.268 1.00 . A A . 5 ASN CA 1 1 16 4151 1 1 5 ASN CB C 6.472 -2.618 3.650 1.00 . A A . 5 ASN CB 1 1 16 4152 1 1 5 ASN CG C 7.774 -2.179 4.289 1.00 . A A . 5 ASN CG 1 1 16 4153 1 1 5 ASN H H 5.445 -0.262 3.168 1.00 . A A . 5 ASN H 1 1 16 4154 1 1 5 ASN HA H 7.161 -2.091 1.688 1.00 . A A . 5 ASN HA 1 1 16 4155 1 1 5 ASN HB2 H 5.660 -2.326 4.300 1.00 . A A . 5 ASN HB2 1 1 16 4156 1 1 5 ASN HB3 H 6.483 -3.694 3.558 1.00 . A A . 5 ASN HB3 1 1 16 4157 1 1 5 ASN HD21 H 6.787 -1.282 5.757 1.00 . A A . 5 ASN HD21 1 1 16 4158 1 1 5 ASN HD22 H 8.509 -1.182 5.837 1.00 . A A . 5 ASN HD22 1 1 16 4159 1 1 5 ASN N N 5.930 -0.583 2.376 1.00 . A A . 5 ASN N 1 1 16 4160 1 1 5 ASN ND2 N 7.680 -1.477 5.408 1.00 . A A . 5 ASN ND2 1 1 16 4161 1 1 5 ASN O O 3.964 -2.578 1.907 1.00 . A A . 5 ASN O 1 1 16 4162 1 1 5 ASN OD1 O 8.854 -2.471 3.784 1.00 . A A . 5 ASN OD1 1 1 16 4163 1 1 6 PRO C C 3.537 -5.114 0.552 1.00 . A A . 6 PRO C 1 1 16 4164 1 1 6 PRO CA C 4.486 -4.257 -0.285 1.00 . A A . 6 PRO CA 1 1 16 4165 1 1 6 PRO CB C 5.350 -5.150 -1.192 1.00 . A A . 6 PRO CB 1 1 16 4166 1 1 6 PRO CD C 6.833 -3.721 0.023 1.00 . A A . 6 PRO CD 1 1 16 4167 1 1 6 PRO CG C 6.738 -5.058 -0.648 1.00 . A A . 6 PRO CG 1 1 16 4168 1 1 6 PRO HA H 3.902 -3.589 -0.900 1.00 . A A . 6 PRO HA 1 1 16 4169 1 1 6 PRO HB2 H 4.981 -6.164 -1.155 1.00 . A A . 6 PRO HB2 1 1 16 4170 1 1 6 PRO HB3 H 5.302 -4.784 -2.207 1.00 . A A . 6 PRO HB3 1 1 16 4171 1 1 6 PRO HD2 H 7.539 -3.754 0.840 1.00 . A A . 6 PRO HD2 1 1 16 4172 1 1 6 PRO HD3 H 7.108 -2.956 -0.688 1.00 . A A . 6 PRO HD3 1 1 16 4173 1 1 6 PRO HG2 H 6.905 -5.849 0.067 1.00 . A A . 6 PRO HG2 1 1 16 4174 1 1 6 PRO HG3 H 7.454 -5.124 -1.455 1.00 . A A . 6 PRO HG3 1 1 16 4175 1 1 6 PRO N N 5.466 -3.513 0.515 1.00 . A A . 6 PRO N 1 1 16 4176 1 1 6 PRO O O 2.332 -5.128 0.306 1.00 . A A . 6 PRO O 1 1 16 4177 1 1 7 VAL C C 2.256 -5.872 3.186 1.00 . A A . 7 VAL C 1 1 16 4178 1 1 7 VAL CA C 3.270 -6.685 2.391 1.00 . A A . 7 VAL CA 1 1 16 4179 1 1 7 VAL CB C 4.153 -7.494 3.366 1.00 . A A . 7 VAL CB 1 1 16 4180 1 1 7 VAL CG1 C 3.309 -8.452 4.195 1.00 . A A . 7 VAL CG1 1 1 16 4181 1 1 7 VAL CG2 C 5.234 -8.250 2.608 1.00 . A A . 7 VAL CG2 1 1 16 4182 1 1 7 VAL H H 5.042 -5.769 1.686 1.00 . A A . 7 VAL H 1 1 16 4183 1 1 7 VAL HA H 2.740 -7.382 1.757 1.00 . A A . 7 VAL HA 1 1 16 4184 1 1 7 VAL HB H 4.635 -6.801 4.040 1.00 . A A . 7 VAL HB 1 1 16 4185 1 1 7 VAL HG11 H 2.277 -8.132 4.176 1.00 . A A . 7 VAL HG11 1 1 16 4186 1 1 7 VAL HG12 H 3.665 -8.456 5.215 1.00 . A A . 7 VAL HG12 1 1 16 4187 1 1 7 VAL HG13 H 3.384 -9.447 3.783 1.00 . A A . 7 VAL HG13 1 1 16 4188 1 1 7 VAL HG21 H 5.951 -8.653 3.309 1.00 . A A . 7 VAL HG21 1 1 16 4189 1 1 7 VAL HG22 H 5.735 -7.577 1.929 1.00 . A A . 7 VAL HG22 1 1 16 4190 1 1 7 VAL HG23 H 4.785 -9.057 2.049 1.00 . A A . 7 VAL HG23 1 1 16 4191 1 1 7 VAL N N 4.079 -5.824 1.534 1.00 . A A . 7 VAL N 1 1 16 4192 1 1 7 VAL O O 1.064 -6.169 3.183 1.00 . A A . 7 VAL O 1 1 16 4193 1 1 8 CYS C C 0.897 -3.231 3.771 1.00 . A A . 8 CYS C 1 1 16 4194 1 1 8 CYS CA C 1.885 -3.971 4.657 1.00 . A A . 8 CYS CA 1 1 16 4195 1 1 8 CYS CB C 2.723 -2.961 5.429 1.00 . A A . 8 CYS CB 1 1 16 4196 1 1 8 CYS H H 3.704 -4.650 3.806 1.00 . A A . 8 CYS H 1 1 16 4197 1 1 8 CYS HA H 1.340 -4.589 5.354 1.00 . A A . 8 CYS HA 1 1 16 4198 1 1 8 CYS HB2 H 3.556 -3.469 5.878 1.00 . A A . 8 CYS HB2 1 1 16 4199 1 1 8 CYS HB3 H 3.093 -2.224 4.736 1.00 . A A . 8 CYS HB3 1 1 16 4200 1 1 8 CYS N N 2.743 -4.838 3.855 1.00 . A A . 8 CYS N 1 1 16 4201 1 1 8 CYS O O -0.263 -3.059 4.127 1.00 . A A . 8 CYS O 1 1 16 4202 1 1 8 CYS SG S 1.821 -2.073 6.743 1.00 . A A . 8 CYS SG 1 1 16 4203 1 1 9 HIS C C -0.641 -2.890 1.233 1.00 . A A . 9 HIS C 1 1 16 4204 1 1 9 HIS CA C 0.551 -2.047 1.673 1.00 . A A . 9 HIS CA 1 1 16 4205 1 1 9 HIS CB C 1.375 -1.630 0.454 1.00 . A A . 9 HIS CB 1 1 16 4206 1 1 9 HIS CD2 C -0.391 0.172 -0.173 1.00 . A A . 9 HIS CD2 1 1 16 4207 1 1 9 HIS CE1 C 0.709 1.153 -1.794 1.00 . A A . 9 HIS CE1 1 1 16 4208 1 1 9 HIS CG C 0.796 -0.467 -0.301 1.00 . A A . 9 HIS CG 1 1 16 4209 1 1 9 HIS H H 2.327 -2.947 2.411 1.00 . A A . 9 HIS H 1 1 16 4210 1 1 9 HIS HA H 0.185 -1.161 2.171 1.00 . A A . 9 HIS HA 1 1 16 4211 1 1 9 HIS HB2 H 2.366 -1.358 0.776 1.00 . A A . 9 HIS HB2 1 1 16 4212 1 1 9 HIS HB3 H 1.443 -2.466 -0.227 1.00 . A A . 9 HIS HB3 1 1 16 4213 1 1 9 HIS HD1 H 2.361 -0.048 -1.652 1.00 . A A . 9 HIS HD1 1 1 16 4214 1 1 9 HIS HD2 H -1.172 -0.062 0.536 1.00 . A A . 9 HIS HD2 1 1 16 4215 1 1 9 HIS HE1 H 0.972 1.824 -2.598 1.00 . A A . 9 HIS HE1 1 1 16 4216 1 1 9 HIS HE2 H -1.210 1.722 -1.334 1.00 . A A . 9 HIS HE2 1 1 16 4217 1 1 9 HIS N N 1.378 -2.785 2.622 1.00 . A A . 9 HIS N 1 1 16 4218 1 1 9 HIS ND1 N 1.462 0.173 -1.326 1.00 . A A . 9 HIS ND1 1 1 16 4219 1 1 9 HIS NE2 N -0.419 1.171 -1.112 1.00 . A A . 9 HIS NE2 1 1 16 4220 1 1 9 HIS O O -1.760 -2.394 1.164 1.00 . A A . 9 HIS O 1 1 16 4221 1 1 10 LEU C C -2.403 -5.367 1.670 1.00 . A A . 10 LEU C 1 1 16 4222 1 1 10 LEU CA C -1.453 -5.065 0.513 1.00 . A A . 10 LEU CA 1 1 16 4223 1 1 10 LEU CB C -0.864 -6.368 -0.035 1.00 . A A . 10 LEU CB 1 1 16 4224 1 1 10 LEU CD1 C 0.526 -7.566 -1.742 1.00 . A A . 10 LEU CD1 1 1 16 4225 1 1 10 LEU CD2 C -0.898 -5.632 -2.434 1.00 . A A . 10 LEU CD2 1 1 16 4226 1 1 10 LEU CG C -0.046 -6.222 -1.321 1.00 . A A . 10 LEU CG 1 1 16 4227 1 1 10 LEU H H 0.528 -4.496 1.015 1.00 . A A . 10 LEU H 1 1 16 4228 1 1 10 LEU HA H -2.009 -4.575 -0.271 1.00 . A A . 10 LEU HA 1 1 16 4229 1 1 10 LEU HB2 H -0.228 -6.798 0.725 1.00 . A A . 10 LEU HB2 1 1 16 4230 1 1 10 LEU HB3 H -1.676 -7.052 -0.229 1.00 . A A . 10 LEU HB3 1 1 16 4231 1 1 10 LEU HD11 H 1.482 -7.718 -1.264 1.00 . A A . 10 LEU HD11 1 1 16 4232 1 1 10 LEU HD12 H 0.654 -7.583 -2.814 1.00 . A A . 10 LEU HD12 1 1 16 4233 1 1 10 LEU HD13 H -0.152 -8.355 -1.449 1.00 . A A . 10 LEU HD13 1 1 16 4234 1 1 10 LEU HD21 H -0.587 -6.044 -3.383 1.00 . A A . 10 LEU HD21 1 1 16 4235 1 1 10 LEU HD22 H -0.777 -4.559 -2.450 1.00 . A A . 10 LEU HD22 1 1 16 4236 1 1 10 LEU HD23 H -1.936 -5.874 -2.261 1.00 . A A . 10 LEU HD23 1 1 16 4237 1 1 10 LEU HG H 0.781 -5.551 -1.138 1.00 . A A . 10 LEU HG 1 1 16 4238 1 1 10 LEU N N -0.391 -4.159 0.940 1.00 . A A . 10 LEU N 1 1 16 4239 1 1 10 LEU O O -3.622 -5.333 1.513 1.00 . A A . 10 LEU O 1 1 16 4240 1 1 11 GLU C C -3.445 -4.752 4.461 1.00 . A A . 11 GLU C 1 1 16 4241 1 1 11 GLU CA C -2.625 -5.968 4.016 1.00 . A A . 11 GLU CA 1 1 16 4242 1 1 11 GLU CB C -1.699 -6.432 5.147 1.00 . A A . 11 GLU CB 1 1 16 4243 1 1 11 GLU CD C -1.482 -7.182 7.552 1.00 . A A . 11 GLU CD 1 1 16 4244 1 1 11 GLU CG C -2.429 -6.879 6.405 1.00 . A A . 11 GLU CG 1 1 16 4245 1 1 11 GLU H H -0.855 -5.670 2.895 1.00 . A A . 11 GLU H 1 1 16 4246 1 1 11 GLU HA H -3.300 -6.768 3.763 1.00 . A A . 11 GLU HA 1 1 16 4247 1 1 11 GLU HB2 H -1.106 -7.261 4.789 1.00 . A A . 11 GLU HB2 1 1 16 4248 1 1 11 GLU HB3 H -1.038 -5.619 5.409 1.00 . A A . 11 GLU HB3 1 1 16 4249 1 1 11 GLU HG2 H -3.102 -6.094 6.713 1.00 . A A . 11 GLU HG2 1 1 16 4250 1 1 11 GLU HG3 H -2.995 -7.771 6.179 1.00 . A A . 11 GLU HG3 1 1 16 4251 1 1 11 GLU N N -1.835 -5.659 2.830 1.00 . A A . 11 GLU N 1 1 16 4252 1 1 11 GLU O O -4.607 -4.872 4.846 1.00 . A A . 11 GLU O 1 1 16 4253 1 1 11 GLU OE1 O -0.776 -6.251 8.005 1.00 . A A . 11 GLU OE1 1 1 16 4254 1 1 11 GLU OE2 O -1.445 -8.342 8.000 1.00 . A A . 11 GLU OE2 1 1 16 4255 1 1 12 HIS C C -3.883 -1.507 3.614 1.00 . A A . 12 HIS C 1 1 16 4256 1 1 12 HIS CA C -3.492 -2.347 4.827 1.00 . A A . 12 HIS CA 1 1 16 4257 1 1 12 HIS CB C -2.593 -1.493 5.751 1.00 . A A . 12 HIS CB 1 1 16 4258 1 1 12 HIS CD2 C -1.670 -3.531 7.074 1.00 . A A . 12 HIS CD2 1 1 16 4259 1 1 12 HIS CE1 C -1.010 -2.493 8.879 1.00 . A A . 12 HIS CE1 1 1 16 4260 1 1 12 HIS CG C -1.969 -2.226 6.909 1.00 . A A . 12 HIS CG 1 1 16 4261 1 1 12 HIS H H -1.895 -3.545 4.102 1.00 . A A . 12 HIS H 1 1 16 4262 1 1 12 HIS HA H -4.389 -2.619 5.364 1.00 . A A . 12 HIS HA 1 1 16 4263 1 1 12 HIS HB2 H -1.790 -1.077 5.164 1.00 . A A . 12 HIS HB2 1 1 16 4264 1 1 12 HIS HB3 H -3.184 -0.683 6.155 1.00 . A A . 12 HIS HB3 1 1 16 4265 1 1 12 HIS HD1 H -1.605 -0.636 8.248 1.00 . A A . 12 HIS HD1 1 1 16 4266 1 1 12 HIS HD2 H -1.835 -4.318 6.353 1.00 . A A . 12 HIS HD2 1 1 16 4267 1 1 12 HIS HE1 H -0.593 -2.292 9.855 1.00 . A A . 12 HIS HE1 1 1 16 4268 1 1 12 HIS HE2 H -0.740 -4.525 8.670 1.00 . A A . 12 HIS HE2 1 1 16 4269 1 1 12 HIS N N -2.828 -3.580 4.415 1.00 . A A . 12 HIS N 1 1 16 4270 1 1 12 HIS ND1 N -1.540 -1.596 8.062 1.00 . A A . 12 HIS ND1 1 1 16 4271 1 1 12 HIS NE2 N -1.081 -3.670 8.298 1.00 . A A . 12 HIS NE2 1 1 16 4272 1 1 12 HIS O O -3.785 -0.282 3.654 1.00 . A A . 12 HIS O 1 1 16 4273 1 1 13 SER C C -5.852 -0.465 1.577 1.00 . A A . 13 SER C 1 1 16 4274 1 1 13 SER CA C -4.708 -1.442 1.321 1.00 . A A . 13 SER CA 1 1 16 4275 1 1 13 SER CB C -5.099 -2.425 0.218 1.00 . A A . 13 SER CB 1 1 16 4276 1 1 13 SER H H -4.371 -3.137 2.557 1.00 . A A . 13 SER H 1 1 16 4277 1 1 13 SER HA H -3.849 -0.877 0.989 1.00 . A A . 13 SER HA 1 1 16 4278 1 1 13 SER HB2 H -5.821 -3.128 0.605 1.00 . A A . 13 SER HB2 1 1 16 4279 1 1 13 SER HB3 H -5.530 -1.883 -0.609 1.00 . A A . 13 SER HB3 1 1 16 4280 1 1 13 SER HG H -3.233 -3.008 0.368 1.00 . A A . 13 SER HG 1 1 16 4281 1 1 13 SER N N -4.318 -2.156 2.539 1.00 . A A . 13 SER N 1 1 16 4282 1 1 13 SER O O -5.914 0.597 0.966 1.00 . A A . 13 SER O 1 1 16 4283 1 1 13 SER OG O -3.969 -3.141 -0.244 1.00 . A A . 13 SER OG 1 1 16 4284 1 1 14 ASN C C -7.462 1.331 3.432 1.00 . A A . 14 ASN C 1 1 16 4285 1 1 14 ASN CA C -7.898 0.005 2.809 1.00 . A A . 14 ASN CA 1 1 16 4286 1 1 14 ASN CB C -8.840 -0.754 3.756 1.00 . A A . 14 ASN CB 1 1 16 4287 1 1 14 ASN CG C -10.037 0.068 4.207 1.00 . A A . 14 ASN CG 1 1 16 4288 1 1 14 ASN H H -6.646 -1.698 2.926 1.00 . A A . 14 ASN H 1 1 16 4289 1 1 14 ASN HA H -8.423 0.215 1.894 1.00 . A A . 14 ASN HA 1 1 16 4290 1 1 14 ASN HB2 H -9.206 -1.636 3.252 1.00 . A A . 14 ASN HB2 1 1 16 4291 1 1 14 ASN HB3 H -8.284 -1.056 4.632 1.00 . A A . 14 ASN HB3 1 1 16 4292 1 1 14 ASN HD21 H -11.243 -0.991 3.037 1.00 . A A . 14 ASN HD21 1 1 16 4293 1 1 14 ASN HD22 H -11.994 0.264 3.953 1.00 . A A . 14 ASN HD22 1 1 16 4294 1 1 14 ASN N N -6.751 -0.835 2.477 1.00 . A A . 14 ASN N 1 1 16 4295 1 1 14 ASN ND2 N -11.209 -0.254 3.679 1.00 . A A . 14 ASN ND2 1 1 16 4296 1 1 14 ASN O O -7.994 2.387 3.100 1.00 . A A . 14 ASN O 1 1 16 4297 1 1 14 ASN OD1 O -9.914 0.975 5.023 1.00 . A A . 14 ASN OD1 1 1 16 4298 1 1 15 LEU C C -4.950 3.195 4.223 1.00 . A A . 15 LEU C 1 1 16 4299 1 1 15 LEU CA C -6.013 2.454 5.031 1.00 . A A . 15 LEU CA 1 1 16 4300 1 1 15 LEU CB C -5.442 2.089 6.411 1.00 . A A . 15 LEU CB 1 1 16 4301 1 1 15 LEU CD1 C -7.652 2.562 7.523 1.00 . A A . 15 LEU CD1 1 1 16 4302 1 1 15 LEU CD2 C -6.911 0.190 7.195 1.00 . A A . 15 LEU CD2 1 1 16 4303 1 1 15 LEU CG C -6.459 1.619 7.464 1.00 . A A . 15 LEU CG 1 1 16 4304 1 1 15 LEU H H -6.129 0.391 4.567 1.00 . A A . 15 LEU H 1 1 16 4305 1 1 15 LEU HA H -6.850 3.113 5.171 1.00 . A A . 15 LEU HA 1 1 16 4306 1 1 15 LEU HB2 H -4.714 1.304 6.275 1.00 . A A . 15 LEU HB2 1 1 16 4307 1 1 15 LEU HB3 H -4.934 2.958 6.802 1.00 . A A . 15 LEU HB3 1 1 16 4308 1 1 15 LEU HD11 H -7.835 2.972 6.540 1.00 . A A . 15 LEU HD11 1 1 16 4309 1 1 15 LEU HD12 H -7.443 3.365 8.214 1.00 . A A . 15 LEU HD12 1 1 16 4310 1 1 15 LEU HD13 H -8.524 2.018 7.855 1.00 . A A . 15 LEU HD13 1 1 16 4311 1 1 15 LEU HD21 H -7.274 0.112 6.181 1.00 . A A . 15 LEU HD21 1 1 16 4312 1 1 15 LEU HD22 H -7.702 -0.073 7.882 1.00 . A A . 15 LEU HD22 1 1 16 4313 1 1 15 LEU HD23 H -6.076 -0.483 7.331 1.00 . A A . 15 LEU HD23 1 1 16 4314 1 1 15 LEU HG H -5.983 1.637 8.434 1.00 . A A . 15 LEU HG 1 1 16 4315 1 1 15 LEU N N -6.504 1.262 4.343 1.00 . A A . 15 LEU N 1 1 16 4316 1 1 15 LEU O O -4.983 4.418 4.111 1.00 . A A . 15 LEU O 1 1 16 4317 1 1 16 CYS C C -3.358 3.566 1.572 1.00 . A A . 16 CYS C 1 1 16 4318 1 1 16 CYS CA C -2.899 3.039 2.927 1.00 . A A . 16 CYS CA 1 1 16 4319 1 1 16 CYS CB C -1.781 2.016 2.721 1.00 . A A . 16 CYS CB 1 1 16 4320 1 1 16 CYS H H -4.012 1.483 3.838 1.00 . A A . 16 CYS H 1 1 16 4321 1 1 16 CYS HA H -2.508 3.865 3.501 1.00 . A A . 16 CYS HA 1 1 16 4322 1 1 16 CYS HB2 H -2.193 1.134 2.255 1.00 . A A . 16 CYS HB2 1 1 16 4323 1 1 16 CYS HB3 H -1.031 2.443 2.070 1.00 . A A . 16 CYS HB3 1 1 16 4324 1 1 16 CYS N N -3.995 2.452 3.694 1.00 . A A . 16 CYS N 1 1 16 4325 1 1 16 CYS O O -2.875 4.602 1.109 1.00 . A A . 16 CYS O 1 1 16 4326 1 1 16 CYS SG S -0.946 1.486 4.254 1.00 . A A . 16 CYS SG 1 1 16 4327 1 1 17 GLY C C -3.598 3.303 -1.381 1.00 . A A . 17 GLY C 1 1 16 4328 1 1 17 GLY CA C -4.736 3.258 -0.382 1.00 . A A . 17 GLY CA 1 1 16 4329 1 1 17 GLY H H -4.608 2.019 1.327 1.00 . A A . 17 GLY H 1 1 16 4330 1 1 17 GLY HA2 H -5.484 2.559 -0.727 1.00 . A A . 17 GLY HA2 1 1 16 4331 1 1 17 GLY HA3 H -5.177 4.240 -0.306 1.00 . A A . 17 GLY HA3 1 1 16 4332 1 1 17 GLY N N -4.266 2.845 0.924 1.00 . A A . 17 GLY N 1 1 16 4333 1 1 17 GLY O O -2.812 2.358 -1.479 1.00 . A A . 17 GLY O 1 1 16 4334 1 1 18 ALA C C -1.214 5.267 -2.428 1.00 . A A . 18 ALA C 1 1 16 4335 1 1 18 ALA CA C -2.410 4.571 -3.071 1.00 . A A . 18 ALA CA 1 1 16 4336 1 1 18 ALA CB C -2.901 5.355 -4.279 1.00 . A A . 18 ALA CB 1 1 16 4337 1 1 18 ALA H H -4.121 5.138 -1.964 1.00 . A A . 18 ALA H 1 1 16 4338 1 1 18 ALA HA H -2.107 3.590 -3.402 1.00 . A A . 18 ALA HA 1 1 16 4339 1 1 18 ALA HB1 H -2.217 6.164 -4.486 1.00 . A A . 18 ALA HB1 1 1 16 4340 1 1 18 ALA HB2 H -3.882 5.758 -4.073 1.00 . A A . 18 ALA HB2 1 1 16 4341 1 1 18 ALA HB3 H -2.955 4.699 -5.136 1.00 . A A . 18 ALA HB3 1 1 16 4342 1 1 18 ALA N N -3.483 4.407 -2.101 1.00 . A A . 18 ALA N 1 1 16 4343 1 1 18 ALA O O -0.283 5.687 -3.111 1.00 . A A . 18 ALA O 1 1 16 4344 1 1 19 GLY C C 0.988 5.114 -0.103 1.00 . A A . 19 GLY C 1 1 16 4345 1 1 19 GLY CA C -0.182 6.035 -0.382 1.00 . A A . 19 GLY CA 1 1 16 4346 1 1 19 GLY H H -2.027 5.032 -0.617 1.00 . A A . 19 GLY H 1 1 16 4347 1 1 19 GLY HA2 H 0.169 6.876 -0.961 1.00 . A A . 19 GLY HA2 1 1 16 4348 1 1 19 GLY HA3 H -0.571 6.399 0.557 1.00 . A A . 19 GLY HA3 1 1 16 4349 1 1 19 GLY N N -1.254 5.387 -1.108 1.00 . A A . 19 GLY N 1 1 16 4350 1 1 19 GLY O O 0.805 3.962 0.298 1.00 . A A . 19 GLY O 1 1 16 4351 1 1 20 GLY C C 4.619 5.606 -0.559 1.00 . A A . 20 GLY C 1 1 16 4352 1 1 20 GLY CA C 3.397 4.868 -0.069 1.00 . A A . 20 GLY CA 1 1 16 4353 1 1 20 GLY H H 2.261 6.556 -0.626 1.00 . A A . 20 GLY H 1 1 16 4354 1 1 20 GLY HA2 H 3.495 4.689 0.991 1.00 . A A . 20 GLY HA2 1 1 16 4355 1 1 20 GLY HA3 H 3.330 3.925 -0.579 1.00 . A A . 20 GLY HA3 1 1 16 4356 1 1 20 GLY N N 2.189 5.631 -0.309 1.00 . A A . 20 GLY N 1 1 16 4357 1 1 20 GLY O O 4.754 5.860 -1.755 1.00 . A A . 20 GLY O 1 1 16 4358 1 1 21 ALA C C 7.540 6.904 1.326 1.00 . A A . 21 ALA C 1 1 16 4359 1 1 21 ALA CA C 6.723 6.681 0.062 1.00 . A A . 21 ALA CA 1 1 16 4360 1 1 21 ALA CB C 6.412 8.024 -0.591 1.00 . A A . 21 ALA CB 1 1 16 4361 1 1 21 ALA H H 5.311 5.714 1.302 1.00 . A A . 21 ALA H 1 1 16 4362 1 1 21 ALA HA H 7.300 6.090 -0.634 1.00 . A A . 21 ALA HA 1 1 16 4363 1 1 21 ALA HB1 H 7.076 8.180 -1.428 1.00 . A A . 21 ALA HB1 1 1 16 4364 1 1 21 ALA HB2 H 6.552 8.815 0.131 1.00 . A A . 21 ALA HB2 1 1 16 4365 1 1 21 ALA HB3 H 5.389 8.028 -0.935 1.00 . A A . 21 ALA HB3 1 1 16 4366 1 1 21 ALA N N 5.496 5.954 0.371 1.00 . A A . 21 ALA N 1 1 16 4367 1 1 21 ALA O O 6.977 7.125 2.397 1.00 . A A . 21 ALA O 1 1 16 4368 1 1 22 ALA C C 9.522 6.056 3.437 1.00 . A A . 22 ALA C 1 1 16 4369 1 1 22 ALA CA C 9.787 7.043 2.306 1.00 . A A . 22 ALA CA 1 1 16 4370 1 1 22 ALA CB C 9.705 8.481 2.809 1.00 . A A . 22 ALA CB 1 1 16 4371 1 1 22 ALA H H 9.235 6.662 0.299 1.00 . A A . 22 ALA H 1 1 16 4372 1 1 22 ALA HA H 10.789 6.880 1.944 1.00 . A A . 22 ALA HA 1 1 16 4373 1 1 22 ALA HB1 H 8.719 8.667 3.208 1.00 . A A . 22 ALA HB1 1 1 16 4374 1 1 22 ALA HB2 H 9.896 9.160 1.991 1.00 . A A . 22 ALA HB2 1 1 16 4375 1 1 22 ALA HB3 H 10.442 8.634 3.583 1.00 . A A . 22 ALA HB3 1 1 16 4376 1 1 22 ALA N N 8.865 6.844 1.186 1.00 . A A . 22 ALA N 1 1 16 4377 1 1 22 ALA O O 9.036 4.946 3.211 1.00 . A A . 22 ALA O 1 1 16 4378 1 1 23 GLY C C 8.176 5.483 6.154 1.00 . A A . 23 GLY C 1 1 16 4379 1 1 23 GLY CA C 9.643 5.625 5.807 1.00 . A A . 23 GLY CA 1 1 16 4380 1 1 23 GLY H H 10.231 7.361 4.758 1.00 . A A . 23 GLY H 1 1 16 4381 1 1 23 GLY HA2 H 10.052 4.646 5.603 1.00 . A A . 23 GLY HA2 1 1 16 4382 1 1 23 GLY HA3 H 10.162 6.054 6.651 1.00 . A A . 23 GLY HA3 1 1 16 4383 1 1 23 GLY N N 9.848 6.470 4.650 1.00 . A A . 23 GLY N 1 1 16 4384 1 1 23 GLY O O 7.508 6.465 6.467 1.00 . A A . 23 GLY O 1 1 17 4385 1 1 1 GLY C C 5.889 2.641 6.199 1.00 . A A . 1 GLY C 1 1 17 4386 1 1 1 GLY CA C 6.212 4.085 6.496 1.00 . A A . 1 GLY CA 1 1 17 4387 1 1 1 GLY H1 H 6.460 4.562 4.449 1.00 . A A . 1 GLY H1 1 1 17 4388 1 1 1 GLY HA2 H 7.213 4.146 6.895 1.00 . A A . 1 GLY HA2 1 1 17 4389 1 1 1 GLY HA3 H 5.515 4.456 7.233 1.00 . A A . 1 GLY HA3 1 1 17 4390 1 1 1 GLY N N 6.124 4.905 5.310 1.00 . A A . 1 GLY N 1 1 17 4391 1 1 1 GLY O O 6.500 2.030 5.326 1.00 . A A . 1 GLY O 1 1 17 4392 1 1 2 CYS C C 3.933 0.543 5.306 1.00 . A A . 2 CYS C 1 1 17 4393 1 1 2 CYS CA C 4.507 0.711 6.710 1.00 . A A . 2 CYS CA 1 1 17 4394 1 1 2 CYS CB C 3.471 0.296 7.759 1.00 . A A . 2 CYS CB 1 1 17 4395 1 1 2 CYS H H 4.459 2.635 7.590 1.00 . A A . 2 CYS H 1 1 17 4396 1 1 2 CYS HA H 5.383 0.085 6.806 1.00 . A A . 2 CYS HA 1 1 17 4397 1 1 2 CYS HB2 H 3.744 0.728 8.710 1.00 . A A . 2 CYS HB2 1 1 17 4398 1 1 2 CYS HB3 H 2.503 0.673 7.464 1.00 . A A . 2 CYS HB3 1 1 17 4399 1 1 2 CYS N N 4.916 2.094 6.914 1.00 . A A . 2 CYS N 1 1 17 4400 1 1 2 CYS O O 4.176 -0.460 4.641 1.00 . A A . 2 CYS O 1 1 17 4401 1 1 2 CYS SG S 3.315 -1.507 7.996 1.00 . A A . 2 CYS SG 1 1 17 4402 1 1 3 CYS C C 3.603 1.432 2.425 1.00 . A A . 3 CYS C 1 1 17 4403 1 1 3 CYS CA C 2.564 1.535 3.538 1.00 . A A . 3 CYS CA 1 1 17 4404 1 1 3 CYS CB C 1.711 2.787 3.346 1.00 . A A . 3 CYS CB 1 1 17 4405 1 1 3 CYS H H 3.036 2.322 5.441 1.00 . A A . 3 CYS H 1 1 17 4406 1 1 3 CYS HA H 1.922 0.669 3.486 1.00 . A A . 3 CYS HA 1 1 17 4407 1 1 3 CYS HB2 H 2.324 3.661 3.510 1.00 . A A . 3 CYS HB2 1 1 17 4408 1 1 3 CYS HB3 H 1.329 2.803 2.336 1.00 . A A . 3 CYS HB3 1 1 17 4409 1 1 3 CYS N N 3.180 1.546 4.862 1.00 . A A . 3 CYS N 1 1 17 4410 1 1 3 CYS O O 3.300 0.951 1.333 1.00 . A A . 3 CYS O 1 1 17 4411 1 1 3 CYS SG S 0.291 2.884 4.480 1.00 . A A . 3 CYS SG 1 1 17 4412 1 1 4 SER C C 6.284 0.361 1.454 1.00 . A A . 4 SER C 1 1 17 4413 1 1 4 SER CA C 5.907 1.814 1.740 1.00 . A A . 4 SER CA 1 1 17 4414 1 1 4 SER CB C 7.113 2.592 2.265 1.00 . A A . 4 SER CB 1 1 17 4415 1 1 4 SER H H 5.005 2.237 3.601 1.00 . A A . 4 SER H 1 1 17 4416 1 1 4 SER HA H 5.560 2.271 0.827 1.00 . A A . 4 SER HA 1 1 17 4417 1 1 4 SER HB2 H 7.533 2.074 3.115 1.00 . A A . 4 SER HB2 1 1 17 4418 1 1 4 SER HB3 H 7.857 2.669 1.485 1.00 . A A . 4 SER HB3 1 1 17 4419 1 1 4 SER HG H 6.486 4.411 1.888 1.00 . A A . 4 SER HG 1 1 17 4420 1 1 4 SER N N 4.823 1.872 2.711 1.00 . A A . 4 SER N 1 1 17 4421 1 1 4 SER O O 6.850 0.044 0.409 1.00 . A A . 4 SER O 1 1 17 4422 1 1 4 SER OG O 6.731 3.900 2.666 1.00 . A A . 4 SER OG 1 1 17 4423 1 1 5 ASN C C 5.062 -2.621 1.523 1.00 . A A . 5 ASN C 1 1 17 4424 1 1 5 ASN CA C 6.218 -1.940 2.242 1.00 . A A . 5 ASN CA 1 1 17 4425 1 1 5 ASN CB C 6.437 -2.591 3.610 1.00 . A A . 5 ASN CB 1 1 17 4426 1 1 5 ASN CG C 7.765 -2.209 4.231 1.00 . A A . 5 ASN CG 1 1 17 4427 1 1 5 ASN H H 5.471 -0.203 3.186 1.00 . A A . 5 ASN H 1 1 17 4428 1 1 5 ASN HA H 7.114 -2.049 1.648 1.00 . A A . 5 ASN HA 1 1 17 4429 1 1 5 ASN HB2 H 5.648 -2.280 4.280 1.00 . A A . 5 ASN HB2 1 1 17 4430 1 1 5 ASN HB3 H 6.407 -3.665 3.499 1.00 . A A . 5 ASN HB3 1 1 17 4431 1 1 5 ASN HD21 H 6.837 -1.307 5.736 1.00 . A A . 5 ASN HD21 1 1 17 4432 1 1 5 ASN HD22 H 8.563 -1.268 5.783 1.00 . A A . 5 ASN HD22 1 1 17 4433 1 1 5 ASN N N 5.942 -0.519 2.386 1.00 . A A . 5 ASN N 1 1 17 4434 1 1 5 ASN ND2 N 7.715 -1.527 5.366 1.00 . A A . 5 ASN ND2 1 1 17 4435 1 1 5 ASN O O 3.904 -2.471 1.918 1.00 . A A . 5 ASN O 1 1 17 4436 1 1 5 ASN OD1 O 8.824 -2.526 3.699 1.00 . A A . 5 ASN OD1 1 1 17 4437 1 1 6 PRO C C 3.450 -4.986 0.483 1.00 . A A . 6 PRO C 1 1 17 4438 1 1 6 PRO CA C 4.347 -4.070 -0.349 1.00 . A A . 6 PRO CA 1 1 17 4439 1 1 6 PRO CB C 5.171 -4.897 -1.350 1.00 . A A . 6 PRO CB 1 1 17 4440 1 1 6 PRO CD C 6.711 -3.580 -0.082 1.00 . A A . 6 PRO CD 1 1 17 4441 1 1 6 PRO CG C 6.573 -4.870 -0.836 1.00 . A A . 6 PRO CG 1 1 17 4442 1 1 6 PRO HA H 3.728 -3.370 -0.890 1.00 . A A . 6 PRO HA 1 1 17 4443 1 1 6 PRO HB2 H 4.786 -5.905 -1.387 1.00 . A A . 6 PRO HB2 1 1 17 4444 1 1 6 PRO HB3 H 5.103 -4.447 -2.329 1.00 . A A . 6 PRO HB3 1 1 17 4445 1 1 6 PRO HD2 H 7.433 -3.684 0.716 1.00 . A A . 6 PRO HD2 1 1 17 4446 1 1 6 PRO HD3 H 6.992 -2.779 -0.750 1.00 . A A . 6 PRO HD3 1 1 17 4447 1 1 6 PRO HG2 H 6.738 -5.708 -0.177 1.00 . A A . 6 PRO HG2 1 1 17 4448 1 1 6 PRO HG3 H 7.266 -4.898 -1.663 1.00 . A A . 6 PRO HG3 1 1 17 4449 1 1 6 PRO N N 5.359 -3.371 0.451 1.00 . A A . 6 PRO N 1 1 17 4450 1 1 6 PRO O O 2.240 -5.037 0.269 1.00 . A A . 6 PRO O 1 1 17 4451 1 1 7 VAL C C 2.289 -5.857 3.141 1.00 . A A . 7 VAL C 1 1 17 4452 1 1 7 VAL CA C 3.298 -6.617 2.286 1.00 . A A . 7 VAL CA 1 1 17 4453 1 1 7 VAL CB C 4.241 -7.423 3.206 1.00 . A A . 7 VAL CB 1 1 17 4454 1 1 7 VAL CG1 C 3.458 -8.434 4.033 1.00 . A A . 7 VAL CG1 1 1 17 4455 1 1 7 VAL CG2 C 5.320 -8.118 2.389 1.00 . A A . 7 VAL CG2 1 1 17 4456 1 1 7 VAL H H 5.012 -5.615 1.554 1.00 . A A . 7 VAL H 1 1 17 4457 1 1 7 VAL HA H 2.766 -7.311 1.650 1.00 . A A . 7 VAL HA 1 1 17 4458 1 1 7 VAL HB H 4.722 -6.735 3.885 1.00 . A A . 7 VAL HB 1 1 17 4459 1 1 7 VAL HG11 H 2.668 -7.928 4.566 1.00 . A A . 7 VAL HG11 1 1 17 4460 1 1 7 VAL HG12 H 4.122 -8.911 4.739 1.00 . A A . 7 VAL HG12 1 1 17 4461 1 1 7 VAL HG13 H 3.031 -9.180 3.379 1.00 . A A . 7 VAL HG13 1 1 17 4462 1 1 7 VAL HG21 H 5.975 -8.666 3.051 1.00 . A A . 7 VAL HG21 1 1 17 4463 1 1 7 VAL HG22 H 5.892 -7.380 1.846 1.00 . A A . 7 VAL HG22 1 1 17 4464 1 1 7 VAL HG23 H 4.860 -8.802 1.691 1.00 . A A . 7 VAL HG23 1 1 17 4465 1 1 7 VAL N N 4.047 -5.703 1.430 1.00 . A A . 7 VAL N 1 1 17 4466 1 1 7 VAL O O 1.112 -6.213 3.199 1.00 . A A . 7 VAL O 1 1 17 4467 1 1 8 CYS C C 0.842 -3.287 3.801 1.00 . A A . 8 CYS C 1 1 17 4468 1 1 8 CYS CA C 1.904 -3.980 4.638 1.00 . A A . 8 CYS CA 1 1 17 4469 1 1 8 CYS CB C 2.731 -2.935 5.375 1.00 . A A . 8 CYS CB 1 1 17 4470 1 1 8 CYS H H 3.704 -4.564 3.690 1.00 . A A . 8 CYS H 1 1 17 4471 1 1 8 CYS HA H 1.422 -4.625 5.357 1.00 . A A . 8 CYS HA 1 1 17 4472 1 1 8 CYS HB2 H 3.595 -3.410 5.801 1.00 . A A . 8 CYS HB2 1 1 17 4473 1 1 8 CYS HB3 H 3.054 -2.189 4.666 1.00 . A A . 8 CYS HB3 1 1 17 4474 1 1 8 CYS N N 2.759 -4.801 3.789 1.00 . A A . 8 CYS N 1 1 17 4475 1 1 8 CYS O O -0.319 -3.214 4.188 1.00 . A A . 8 CYS O 1 1 17 4476 1 1 8 CYS SG S 1.843 -2.069 6.714 1.00 . A A . 8 CYS SG 1 1 17 4477 1 1 9 HIS C C -0.765 -3.002 1.287 1.00 . A A . 9 HIS C 1 1 17 4478 1 1 9 HIS CA C 0.356 -2.079 1.742 1.00 . A A . 9 HIS CA 1 1 17 4479 1 1 9 HIS CB C 1.112 -1.567 0.517 1.00 . A A . 9 HIS CB 1 1 17 4480 1 1 9 HIS CD2 C 0.756 0.782 -0.534 1.00 . A A . 9 HIS CD2 1 1 17 4481 1 1 9 HIS CE1 C -1.266 0.479 -1.324 1.00 . A A . 9 HIS CE1 1 1 17 4482 1 1 9 HIS CG C 0.385 -0.483 -0.225 1.00 . A A . 9 HIS CG 1 1 17 4483 1 1 9 HIS H H 2.212 -2.867 2.413 1.00 . A A . 9 HIS H 1 1 17 4484 1 1 9 HIS HA H -0.070 -1.240 2.271 1.00 . A A . 9 HIS HA 1 1 17 4485 1 1 9 HIS HB2 H 2.066 -1.183 0.829 1.00 . A A . 9 HIS HB2 1 1 17 4486 1 1 9 HIS HB3 H 1.269 -2.389 -0.167 1.00 . A A . 9 HIS HB3 1 1 17 4487 1 1 9 HIS HD1 H -1.441 -1.449 -0.659 1.00 . A A . 9 HIS HD1 1 1 17 4488 1 1 9 HIS HD2 H 1.698 1.251 -0.288 1.00 . A A . 9 HIS HD2 1 1 17 4489 1 1 9 HIS HE1 H -2.215 0.645 -1.811 1.00 . A A . 9 HIS HE1 1 1 17 4490 1 1 9 HIS HE2 H -0.394 2.325 -1.370 1.00 . A A . 9 HIS HE2 1 1 17 4491 1 1 9 HIS N N 1.260 -2.776 2.652 1.00 . A A . 9 HIS N 1 1 17 4492 1 1 9 HIS ND1 N -0.888 -0.638 -0.735 1.00 . A A . 9 HIS ND1 1 1 17 4493 1 1 9 HIS NE2 N -0.289 1.361 -1.215 1.00 . A A . 9 HIS NE2 1 1 17 4494 1 1 9 HIS O O -1.902 -2.572 1.117 1.00 . A A . 9 HIS O 1 1 17 4495 1 1 10 LEU C C -2.443 -5.505 1.712 1.00 . A A . 10 LEU C 1 1 17 4496 1 1 10 LEU CA C -1.396 -5.256 0.627 1.00 . A A . 10 LEU CA 1 1 17 4497 1 1 10 LEU CB C -0.689 -6.564 0.265 1.00 . A A . 10 LEU CB 1 1 17 4498 1 1 10 LEU CD1 C -2.237 -7.242 -1.592 1.00 . A A . 10 LEU CD1 1 1 17 4499 1 1 10 LEU CD2 C -0.811 -8.960 -0.463 1.00 . A A . 10 LEU CD2 1 1 17 4500 1 1 10 LEU CG C -1.597 -7.670 -0.280 1.00 . A A . 10 LEU CG 1 1 17 4501 1 1 10 LEU H H 0.511 -4.531 1.211 1.00 . A A . 10 LEU H 1 1 17 4502 1 1 10 LEU HA H -1.890 -4.866 -0.250 1.00 . A A . 10 LEU HA 1 1 17 4503 1 1 10 LEU HB2 H 0.063 -6.347 -0.479 1.00 . A A . 10 LEU HB2 1 1 17 4504 1 1 10 LEU HB3 H -0.196 -6.939 1.149 1.00 . A A . 10 LEU HB3 1 1 17 4505 1 1 10 LEU HD11 H -2.759 -8.081 -2.029 1.00 . A A . 10 LEU HD11 1 1 17 4506 1 1 10 LEU HD12 H -1.470 -6.901 -2.272 1.00 . A A . 10 LEU HD12 1 1 17 4507 1 1 10 LEU HD13 H -2.936 -6.441 -1.407 1.00 . A A . 10 LEU HD13 1 1 17 4508 1 1 10 LEU HD21 H -0.748 -9.196 -1.514 1.00 . A A . 10 LEU HD21 1 1 17 4509 1 1 10 LEU HD22 H -1.312 -9.763 0.058 1.00 . A A . 10 LEU HD22 1 1 17 4510 1 1 10 LEU HD23 H 0.183 -8.835 -0.062 1.00 . A A . 10 LEU HD23 1 1 17 4511 1 1 10 LEU HG H -2.389 -7.858 0.431 1.00 . A A . 10 LEU HG 1 1 17 4512 1 1 10 LEU N N -0.425 -4.262 1.074 1.00 . A A . 10 LEU N 1 1 17 4513 1 1 10 LEU O O -3.646 -5.444 1.454 1.00 . A A . 10 LEU O 1 1 17 4514 1 1 11 GLU C C -3.635 -4.769 4.421 1.00 . A A . 11 GLU C 1 1 17 4515 1 1 11 GLU CA C -2.858 -6.032 4.055 1.00 . A A . 11 GLU CA 1 1 17 4516 1 1 11 GLU CB C -2.043 -6.513 5.260 1.00 . A A . 11 GLU CB 1 1 17 4517 1 1 11 GLU CD C -2.079 -6.638 7.787 1.00 . A A . 11 GLU CD 1 1 17 4518 1 1 11 GLU CG C -2.879 -6.774 6.504 1.00 . A A . 11 GLU CG 1 1 17 4519 1 1 11 GLU H H -1.000 -5.807 3.064 1.00 . A A . 11 GLU H 1 1 17 4520 1 1 11 GLU HA H -3.555 -6.801 3.768 1.00 . A A . 11 GLU HA 1 1 17 4521 1 1 11 GLU HB2 H -1.539 -7.431 4.995 1.00 . A A . 11 GLU HB2 1 1 17 4522 1 1 11 GLU HB3 H -1.303 -5.765 5.500 1.00 . A A . 11 GLU HB3 1 1 17 4523 1 1 11 GLU HG2 H -3.693 -6.065 6.531 1.00 . A A . 11 GLU HG2 1 1 17 4524 1 1 11 GLU HG3 H -3.278 -7.776 6.451 1.00 . A A . 11 GLU HG3 1 1 17 4525 1 1 11 GLU N N -1.972 -5.778 2.924 1.00 . A A . 11 GLU N 1 1 17 4526 1 1 11 GLU O O -4.857 -4.786 4.566 1.00 . A A . 11 GLU O 1 1 17 4527 1 1 11 GLU OE1 O -0.863 -6.356 7.708 1.00 . A A . 11 GLU OE1 1 1 17 4528 1 1 11 GLU OE2 O -2.671 -6.769 8.874 1.00 . A A . 11 GLU OE2 1 1 17 4529 1 1 12 HIS C C -3.870 -1.633 3.628 1.00 . A A . 12 HIS C 1 1 17 4530 1 1 12 HIS CA C -3.515 -2.385 4.902 1.00 . A A . 12 HIS CA 1 1 17 4531 1 1 12 HIS CB C -2.568 -1.516 5.762 1.00 . A A . 12 HIS CB 1 1 17 4532 1 1 12 HIS CD2 C -1.627 -3.506 7.145 1.00 . A A . 12 HIS CD2 1 1 17 4533 1 1 12 HIS CE1 C -1.032 -2.419 8.944 1.00 . A A . 12 HIS CE1 1 1 17 4534 1 1 12 HIS CG C -1.953 -2.210 6.948 1.00 . A A . 12 HIS CG 1 1 17 4535 1 1 12 HIS H H -1.940 -3.720 4.416 1.00 . A A . 12 HIS H 1 1 17 4536 1 1 12 HIS HA H -4.421 -2.580 5.457 1.00 . A A . 12 HIS HA 1 1 17 4537 1 1 12 HIS HB2 H -1.762 -1.162 5.140 1.00 . A A . 12 HIS HB2 1 1 17 4538 1 1 12 HIS HB3 H -3.123 -0.663 6.132 1.00 . A A . 12 HIS HB3 1 1 17 4539 1 1 12 HIS HD1 H -1.658 -0.590 8.266 1.00 . A A . 12 HIS HD1 1 1 17 4540 1 1 12 HIS HD2 H -1.770 -4.311 6.440 1.00 . A A . 12 HIS HD2 1 1 17 4541 1 1 12 HIS HE1 H -0.642 -2.190 9.925 1.00 . A A . 12 HIS HE1 1 1 17 4542 1 1 12 HIS HE2 H -0.849 -4.463 8.838 1.00 . A A . 12 HIS HE2 1 1 17 4543 1 1 12 HIS N N -2.912 -3.669 4.559 1.00 . A A . 12 HIS N 1 1 17 4544 1 1 12 HIS ND1 N -1.565 -1.550 8.099 1.00 . A A . 12 HIS ND1 1 1 17 4545 1 1 12 HIS NE2 N -1.062 -3.610 8.386 1.00 . A A . 12 HIS NE2 1 1 17 4546 1 1 12 HIS O O -3.599 -0.444 3.506 1.00 . A A . 12 HIS O 1 1 17 4547 1 1 13 SER C C -5.786 -0.582 1.550 1.00 . A A . 13 SER C 1 1 17 4548 1 1 13 SER CA C -4.838 -1.768 1.392 1.00 . A A . 13 SER CA 1 1 17 4549 1 1 13 SER CB C -5.476 -2.856 0.531 1.00 . A A . 13 SER CB 1 1 17 4550 1 1 13 SER H H -4.635 -3.297 2.837 1.00 . A A . 13 SER H 1 1 17 4551 1 1 13 SER HA H -3.937 -1.427 0.907 1.00 . A A . 13 SER HA 1 1 17 4552 1 1 13 SER HB2 H -6.222 -2.414 -0.112 1.00 . A A . 13 SER HB2 1 1 17 4553 1 1 13 SER HB3 H -4.715 -3.331 -0.071 1.00 . A A . 13 SER HB3 1 1 17 4554 1 1 13 SER HG H -5.580 -4.654 1.310 1.00 . A A . 13 SER HG 1 1 17 4555 1 1 13 SER N N -4.458 -2.343 2.677 1.00 . A A . 13 SER N 1 1 17 4556 1 1 13 SER O O -5.588 0.464 0.934 1.00 . A A . 13 SER O 1 1 17 4557 1 1 13 SER OG O -6.096 -3.838 1.348 1.00 . A A . 13 SER OG 1 1 17 4558 1 1 14 ASN C C -7.166 1.506 3.288 1.00 . A A . 14 ASN C 1 1 17 4559 1 1 14 ASN CA C -7.797 0.293 2.613 1.00 . A A . 14 ASN CA 1 1 17 4560 1 1 14 ASN CB C -8.948 -0.237 3.474 1.00 . A A . 14 ASN CB 1 1 17 4561 1 1 14 ASN CG C -9.744 -1.326 2.780 1.00 . A A . 14 ASN CG 1 1 17 4562 1 1 14 ASN H H -6.909 -1.620 2.829 1.00 . A A . 14 ASN H 1 1 17 4563 1 1 14 ASN HA H -8.188 0.597 1.657 1.00 . A A . 14 ASN HA 1 1 17 4564 1 1 14 ASN HB2 H -8.545 -0.643 4.390 1.00 . A A . 14 ASN HB2 1 1 17 4565 1 1 14 ASN HB3 H -9.616 0.578 3.710 1.00 . A A . 14 ASN HB3 1 1 17 4566 1 1 14 ASN HD21 H -9.316 -2.613 4.230 1.00 . A A . 14 ASN HD21 1 1 17 4567 1 1 14 ASN HD22 H -10.297 -3.223 2.947 1.00 . A A . 14 ASN HD22 1 1 17 4568 1 1 14 ASN N N -6.809 -0.758 2.375 1.00 . A A . 14 ASN N 1 1 17 4569 1 1 14 ASN ND2 N -9.790 -2.506 3.381 1.00 . A A . 14 ASN ND2 1 1 17 4570 1 1 14 ASN O O -7.490 2.648 2.971 1.00 . A A . 14 ASN O 1 1 17 4571 1 1 14 ASN OD1 O -10.316 -1.110 1.715 1.00 . A A . 14 ASN OD1 1 1 17 4572 1 1 15 LEU C C -4.574 3.021 4.076 1.00 . A A . 15 LEU C 1 1 17 4573 1 1 15 LEU CA C -5.592 2.311 4.957 1.00 . A A . 15 LEU CA 1 1 17 4574 1 1 15 LEU CB C -4.900 1.743 6.199 1.00 . A A . 15 LEU CB 1 1 17 4575 1 1 15 LEU CD1 C -5.017 0.452 8.344 1.00 . A A . 15 LEU CD1 1 1 17 4576 1 1 15 LEU CD2 C -6.873 2.009 7.726 1.00 . A A . 15 LEU CD2 1 1 17 4577 1 1 15 LEU CG C -5.824 1.041 7.197 1.00 . A A . 15 LEU CG 1 1 17 4578 1 1 15 LEU H H -6.056 0.316 4.429 1.00 . A A . 15 LEU H 1 1 17 4579 1 1 15 LEU HA H -6.338 3.022 5.266 1.00 . A A . 15 LEU HA 1 1 17 4580 1 1 15 LEU HB2 H -4.151 1.035 5.874 1.00 . A A . 15 LEU HB2 1 1 17 4581 1 1 15 LEU HB3 H -4.405 2.555 6.711 1.00 . A A . 15 LEU HB3 1 1 17 4582 1 1 15 LEU HD11 H -5.668 -0.128 8.981 1.00 . A A . 15 LEU HD11 1 1 17 4583 1 1 15 LEU HD12 H -4.571 1.251 8.918 1.00 . A A . 15 LEU HD12 1 1 17 4584 1 1 15 LEU HD13 H -4.239 -0.184 7.948 1.00 . A A . 15 LEU HD13 1 1 17 4585 1 1 15 LEU HD21 H -7.687 2.078 7.020 1.00 . A A . 15 LEU HD21 1 1 17 4586 1 1 15 LEU HD22 H -6.429 2.984 7.860 1.00 . A A . 15 LEU HD22 1 1 17 4587 1 1 15 LEU HD23 H -7.248 1.651 8.674 1.00 . A A . 15 LEU HD23 1 1 17 4588 1 1 15 LEU HG H -6.335 0.232 6.697 1.00 . A A . 15 LEU HG 1 1 17 4589 1 1 15 LEU N N -6.267 1.246 4.225 1.00 . A A . 15 LEU N 1 1 17 4590 1 1 15 LEU O O -4.539 4.248 4.004 1.00 . A A . 15 LEU O 1 1 17 4591 1 1 16 CYS C C -3.273 3.112 1.153 1.00 . A A . 16 CYS C 1 1 17 4592 1 1 16 CYS CA C -2.713 2.765 2.531 1.00 . A A . 16 CYS CA 1 1 17 4593 1 1 16 CYS CB C -1.586 1.746 2.392 1.00 . A A . 16 CYS CB 1 1 17 4594 1 1 16 CYS H H -3.833 1.264 3.513 1.00 . A A . 16 CYS H 1 1 17 4595 1 1 16 CYS HA H -2.320 3.663 2.983 1.00 . A A . 16 CYS HA 1 1 17 4596 1 1 16 CYS HB2 H -1.979 0.853 1.931 1.00 . A A . 16 CYS HB2 1 1 17 4597 1 1 16 CYS HB3 H -0.813 2.160 1.762 1.00 . A A . 16 CYS HB3 1 1 17 4598 1 1 16 CYS N N -3.748 2.237 3.409 1.00 . A A . 16 CYS N 1 1 17 4599 1 1 16 CYS O O -2.602 2.931 0.132 1.00 . A A . 16 CYS O 1 1 17 4600 1 1 16 CYS SG S -0.819 1.262 3.973 1.00 . A A . 16 CYS SG 1 1 17 4601 1 1 17 GLY C C -6.077 5.148 0.084 1.00 . A A . 17 GLY C 1 1 17 4602 1 1 17 GLY CA C -5.133 3.986 -0.109 1.00 . A A . 17 GLY CA 1 1 17 4603 1 1 17 GLY H H -4.976 3.733 1.982 1.00 . A A . 17 GLY H 1 1 17 4604 1 1 17 GLY HA2 H -4.376 4.260 -0.828 1.00 . A A . 17 GLY HA2 1 1 17 4605 1 1 17 GLY HA3 H -5.689 3.144 -0.484 1.00 . A A . 17 GLY HA3 1 1 17 4606 1 1 17 GLY N N -4.495 3.613 1.135 1.00 . A A . 17 GLY N 1 1 17 4607 1 1 17 GLY O O -7.024 5.332 -0.677 1.00 . A A . 17 GLY O 1 1 17 4608 1 1 18 ALA C C -5.772 8.133 2.169 1.00 . A A . 18 ALA C 1 1 17 4609 1 1 18 ALA CA C -6.613 7.097 1.437 1.00 . A A . 18 ALA CA 1 1 17 4610 1 1 18 ALA CB C -7.816 6.688 2.277 1.00 . A A . 18 ALA CB 1 1 17 4611 1 1 18 ALA H H -5.030 5.722 1.673 1.00 . A A . 18 ALA H 1 1 17 4612 1 1 18 ALA HA H -6.973 7.524 0.511 1.00 . A A . 18 ALA HA 1 1 17 4613 1 1 18 ALA HB1 H -7.476 6.254 3.205 1.00 . A A . 18 ALA HB1 1 1 17 4614 1 1 18 ALA HB2 H -8.404 5.963 1.735 1.00 . A A . 18 ALA HB2 1 1 17 4615 1 1 18 ALA HB3 H -8.420 7.559 2.487 1.00 . A A . 18 ALA HB3 1 1 17 4616 1 1 18 ALA N N -5.802 5.933 1.112 1.00 . A A . 18 ALA N 1 1 17 4617 1 1 18 ALA O O -6.219 8.753 3.133 1.00 . A A . 18 ALA O 1 1 17 4618 1 1 19 GLY C C -2.452 9.567 1.439 1.00 . A A . 19 GLY C 1 1 17 4619 1 1 19 GLY CA C -3.650 9.271 2.314 1.00 . A A . 19 GLY CA 1 1 17 4620 1 1 19 GLY H H -4.243 7.791 0.930 1.00 . A A . 19 GLY H 1 1 17 4621 1 1 19 GLY HA2 H -4.189 10.189 2.495 1.00 . A A . 19 GLY HA2 1 1 17 4622 1 1 19 GLY HA3 H -3.305 8.875 3.257 1.00 . A A . 19 GLY HA3 1 1 17 4623 1 1 19 GLY N N -4.545 8.314 1.702 1.00 . A A . 19 GLY N 1 1 17 4624 1 1 19 GLY O O -1.818 8.650 0.915 1.00 . A A . 19 GLY O 1 1 17 4625 1 1 20 GLY C C 0.288 11.160 1.206 1.00 . A A . 20 GLY C 1 1 17 4626 1 1 20 GLY CA C -1.025 11.245 0.457 1.00 . A A . 20 GLY CA 1 1 17 4627 1 1 20 GLY H H -2.696 11.527 1.719 1.00 . A A . 20 GLY H 1 1 17 4628 1 1 20 GLY HA2 H -0.976 10.602 -0.409 1.00 . A A . 20 GLY HA2 1 1 17 4629 1 1 20 GLY HA3 H -1.175 12.264 0.130 1.00 . A A . 20 GLY HA3 1 1 17 4630 1 1 20 GLY N N -2.149 10.846 1.276 1.00 . A A . 20 GLY N 1 1 17 4631 1 1 20 GLY O O 0.362 11.550 2.370 1.00 . A A . 20 GLY O 1 1 17 4632 1 1 21 ALA C C 2.633 9.632 2.360 1.00 . A A . 21 ALA C 1 1 17 4633 1 1 21 ALA CA C 2.654 10.511 1.111 1.00 . A A . 21 ALA CA 1 1 17 4634 1 1 21 ALA CB C 3.255 11.878 1.419 1.00 . A A . 21 ALA CB 1 1 17 4635 1 1 21 ALA H H 1.176 10.368 -0.396 1.00 . A A . 21 ALA H 1 1 17 4636 1 1 21 ALA HA H 3.281 10.035 0.370 1.00 . A A . 21 ALA HA 1 1 17 4637 1 1 21 ALA HB1 H 2.462 12.599 1.553 1.00 . A A . 21 ALA HB1 1 1 17 4638 1 1 21 ALA HB2 H 3.887 12.187 0.600 1.00 . A A . 21 ALA HB2 1 1 17 4639 1 1 21 ALA HB3 H 3.842 11.817 2.324 1.00 . A A . 21 ALA HB3 1 1 17 4640 1 1 21 ALA N N 1.318 10.653 0.529 1.00 . A A . 21 ALA N 1 1 17 4641 1 1 21 ALA O O 3.213 9.980 3.388 1.00 . A A . 21 ALA O 1 1 17 4642 1 1 22 ALA C C 3.171 6.774 3.569 1.00 . A A . 22 ALA C 1 1 17 4643 1 1 22 ALA CA C 1.862 7.545 3.366 1.00 . A A . 22 ALA CA 1 1 17 4644 1 1 22 ALA CB C 0.705 6.584 3.130 1.00 . A A . 22 ALA CB 1 1 17 4645 1 1 22 ALA H H 1.529 8.270 1.410 1.00 . A A . 22 ALA H 1 1 17 4646 1 1 22 ALA HA H 1.650 8.110 4.262 1.00 . A A . 22 ALA HA 1 1 17 4647 1 1 22 ALA HB1 H 0.519 6.016 4.029 1.00 . A A . 22 ALA HB1 1 1 17 4648 1 1 22 ALA HB2 H 0.956 5.910 2.324 1.00 . A A . 22 ALA HB2 1 1 17 4649 1 1 22 ALA HB3 H -0.180 7.144 2.868 1.00 . A A . 22 ALA HB3 1 1 17 4650 1 1 22 ALA N N 1.965 8.488 2.257 1.00 . A A . 22 ALA N 1 1 17 4651 1 1 22 ALA O O 3.208 5.546 3.466 1.00 . A A . 22 ALA O 1 1 17 4652 1 1 23 GLY C C 5.589 6.113 5.365 1.00 . A A . 23 GLY C 1 1 17 4653 1 1 23 GLY CA C 5.535 6.889 4.067 1.00 . A A . 23 GLY CA 1 1 17 4654 1 1 23 GLY H H 4.148 8.483 3.920 1.00 . A A . 23 GLY H 1 1 17 4655 1 1 23 GLY HA2 H 5.743 6.217 3.247 1.00 . A A . 23 GLY HA2 1 1 17 4656 1 1 23 GLY HA3 H 6.291 7.660 4.089 1.00 . A A . 23 GLY HA3 1 1 17 4657 1 1 23 GLY N N 4.241 7.505 3.852 1.00 . A A . 23 GLY N 1 1 17 4658 1 1 23 GLY O O 5.139 6.595 6.403 1.00 . A A . 23 GLY O 1 1 18 4659 1 1 1 GLY C C 5.592 2.080 6.427 1.00 . A A . 1 GLY C 1 1 18 4660 1 1 1 GLY CA C 6.180 3.379 6.934 1.00 . A A . 1 GLY CA 1 1 18 4661 1 1 1 GLY H1 H 7.041 3.769 5.041 1.00 . A A . 1 GLY H1 1 1 18 4662 1 1 1 GLY HA2 H 6.977 3.155 7.629 1.00 . A A . 1 GLY HA2 1 1 18 4663 1 1 1 GLY HA3 H 5.410 3.933 7.450 1.00 . A A . 1 GLY HA3 1 1 18 4664 1 1 1 GLY N N 6.707 4.195 5.864 1.00 . A A . 1 GLY N 1 1 18 4665 1 1 1 GLY O O 6.220 1.367 5.645 1.00 . A A . 1 GLY O 1 1 18 4666 1 1 2 CYS C C 3.430 0.553 4.970 1.00 . A A . 2 CYS C 1 1 18 4667 1 1 2 CYS CA C 3.681 0.566 6.470 1.00 . A A . 2 CYS CA 1 1 18 4668 1 1 2 CYS CB C 2.348 0.475 7.214 1.00 . A A . 2 CYS CB 1 1 18 4669 1 1 2 CYS H H 3.941 2.399 7.490 1.00 . A A . 2 CYS H 1 1 18 4670 1 1 2 CYS HA H 4.295 -0.281 6.735 1.00 . A A . 2 CYS HA 1 1 18 4671 1 1 2 CYS HB2 H 2.542 0.278 8.252 1.00 . A A . 2 CYS HB2 1 1 18 4672 1 1 2 CYS HB3 H 1.837 1.422 7.127 1.00 . A A . 2 CYS HB3 1 1 18 4673 1 1 2 CYS N N 4.382 1.781 6.872 1.00 . A A . 2 CYS N 1 1 18 4674 1 1 2 CYS O O 3.682 -0.440 4.293 1.00 . A A . 2 CYS O 1 1 18 4675 1 1 2 CYS SG S 1.214 -0.821 6.606 1.00 . A A . 2 CYS SG 1 1 18 4676 1 1 3 CYS C C 3.801 1.606 2.153 1.00 . A A . 3 CYS C 1 1 18 4677 1 1 3 CYS CA C 2.589 1.803 3.057 1.00 . A A . 3 CYS CA 1 1 18 4678 1 1 3 CYS CB C 1.951 3.166 2.812 1.00 . A A . 3 CYS CB 1 1 18 4679 1 1 3 CYS H H 2.725 2.406 5.079 1.00 . A A . 3 CYS H 1 1 18 4680 1 1 3 CYS HA H 1.871 1.038 2.819 1.00 . A A . 3 CYS HA 1 1 18 4681 1 1 3 CYS HB2 H 2.690 3.939 2.967 1.00 . A A . 3 CYS HB2 1 1 18 4682 1 1 3 CYS HB3 H 1.593 3.211 1.796 1.00 . A A . 3 CYS HB3 1 1 18 4683 1 1 3 CYS N N 2.914 1.661 4.472 1.00 . A A . 3 CYS N 1 1 18 4684 1 1 3 CYS O O 3.661 1.156 1.016 1.00 . A A . 3 CYS O 1 1 18 4685 1 1 3 CYS SG S 0.542 3.513 3.914 1.00 . A A . 3 CYS SG 1 1 18 4686 1 1 4 SER C C 6.516 0.301 1.663 1.00 . A A . 4 SER C 1 1 18 4687 1 1 4 SER CA C 6.212 1.780 1.888 1.00 . A A . 4 SER CA 1 1 18 4688 1 1 4 SER CB C 7.373 2.440 2.625 1.00 . A A . 4 SER CB 1 1 18 4689 1 1 4 SER H H 5.034 2.286 3.569 1.00 . A A . 4 SER H 1 1 18 4690 1 1 4 SER HA H 6.075 2.261 0.934 1.00 . A A . 4 SER HA 1 1 18 4691 1 1 4 SER HB2 H 7.706 1.795 3.424 1.00 . A A . 4 SER HB2 1 1 18 4692 1 1 4 SER HB3 H 8.187 2.609 1.935 1.00 . A A . 4 SER HB3 1 1 18 4693 1 1 4 SER HG H 6.526 4.208 2.501 1.00 . A A . 4 SER HG 1 1 18 4694 1 1 4 SER N N 4.983 1.935 2.656 1.00 . A A . 4 SER N 1 1 18 4695 1 1 4 SER O O 7.212 -0.070 0.721 1.00 . A A . 4 SER O 1 1 18 4696 1 1 4 SER OG O 6.977 3.683 3.176 1.00 . A A . 4 SER OG 1 1 18 4697 1 1 5 ASN C C 5.071 -2.609 1.622 1.00 . A A . 5 ASN C 1 1 18 4698 1 1 5 ASN CA C 6.178 -1.973 2.444 1.00 . A A . 5 ASN CA 1 1 18 4699 1 1 5 ASN CB C 6.223 -2.602 3.839 1.00 . A A . 5 ASN CB 1 1 18 4700 1 1 5 ASN CG C 7.560 -2.407 4.521 1.00 . A A . 5 ASN CG 1 1 18 4701 1 1 5 ASN H H 5.414 -0.174 3.258 1.00 . A A . 5 ASN H 1 1 18 4702 1 1 5 ASN HA H 7.122 -2.146 1.950 1.00 . A A . 5 ASN HA 1 1 18 4703 1 1 5 ASN HB2 H 5.458 -2.153 4.453 1.00 . A A . 5 ASN HB2 1 1 18 4704 1 1 5 ASN HB3 H 6.033 -3.662 3.753 1.00 . A A . 5 ASN HB3 1 1 18 4705 1 1 5 ASN HD21 H 6.745 -1.175 5.848 1.00 . A A . 5 ASN HD21 1 1 18 4706 1 1 5 ASN HD22 H 8.438 -1.460 6.026 1.00 . A A . 5 ASN HD22 1 1 18 4707 1 1 5 ASN N N 5.977 -0.535 2.538 1.00 . A A . 5 ASN N 1 1 18 4708 1 1 5 ASN ND2 N 7.582 -1.600 5.572 1.00 . A A . 5 ASN ND2 1 1 18 4709 1 1 5 ASN O O 3.892 -2.427 1.917 1.00 . A A . 5 ASN O 1 1 18 4710 1 1 5 ASN OD1 O 8.567 -2.970 4.104 1.00 . A A . 5 ASN OD1 1 1 18 4711 1 1 6 PRO C C 3.508 -4.935 0.463 1.00 . A A . 6 PRO C 1 1 18 4712 1 1 6 PRO CA C 4.464 -4.024 -0.302 1.00 . A A . 6 PRO CA 1 1 18 4713 1 1 6 PRO CB C 5.337 -4.848 -1.253 1.00 . A A . 6 PRO CB 1 1 18 4714 1 1 6 PRO CD C 6.823 -3.619 0.155 1.00 . A A . 6 PRO CD 1 1 18 4715 1 1 6 PRO CG C 6.666 -4.175 -1.232 1.00 . A A . 6 PRO CG 1 1 18 4716 1 1 6 PRO HA H 3.892 -3.304 -0.869 1.00 . A A . 6 PRO HA 1 1 18 4717 1 1 6 PRO HB2 H 5.403 -5.865 -0.895 1.00 . A A . 6 PRO HB2 1 1 18 4718 1 1 6 PRO HB3 H 4.906 -4.837 -2.244 1.00 . A A . 6 PRO HB3 1 1 18 4719 1 1 6 PRO HD2 H 7.295 -4.344 0.802 1.00 . A A . 6 PRO HD2 1 1 18 4720 1 1 6 PRO HD3 H 7.395 -2.702 0.132 1.00 . A A . 6 PRO HD3 1 1 18 4721 1 1 6 PRO HG2 H 7.445 -4.894 -1.438 1.00 . A A . 6 PRO HG2 1 1 18 4722 1 1 6 PRO HG3 H 6.685 -3.378 -1.959 1.00 . A A . 6 PRO HG3 1 1 18 4723 1 1 6 PRO N N 5.434 -3.363 0.575 1.00 . A A . 6 PRO N 1 1 18 4724 1 1 6 PRO O O 2.299 -4.905 0.242 1.00 . A A . 6 PRO O 1 1 18 4725 1 1 7 VAL C C 2.285 -5.897 3.067 1.00 . A A . 7 VAL C 1 1 18 4726 1 1 7 VAL CA C 3.257 -6.657 2.171 1.00 . A A . 7 VAL CA 1 1 18 4727 1 1 7 VAL CB C 4.151 -7.562 3.046 1.00 . A A . 7 VAL CB 1 1 18 4728 1 1 7 VAL CG1 C 3.308 -8.529 3.866 1.00 . A A . 7 VAL CG1 1 1 18 4729 1 1 7 VAL CG2 C 5.152 -8.317 2.185 1.00 . A A . 7 VAL CG2 1 1 18 4730 1 1 7 VAL H H 5.026 -5.705 1.505 1.00 . A A . 7 VAL H 1 1 18 4731 1 1 7 VAL HA H 2.694 -7.285 1.495 1.00 . A A . 7 VAL HA 1 1 18 4732 1 1 7 VAL HB H 4.702 -6.933 3.730 1.00 . A A . 7 VAL HB 1 1 18 4733 1 1 7 VAL HG11 H 2.568 -7.975 4.426 1.00 . A A . 7 VAL HG11 1 1 18 4734 1 1 7 VAL HG12 H 3.944 -9.072 4.548 1.00 . A A . 7 VAL HG12 1 1 18 4735 1 1 7 VAL HG13 H 2.811 -9.223 3.204 1.00 . A A . 7 VAL HG13 1 1 18 4736 1 1 7 VAL HG21 H 4.651 -9.129 1.680 1.00 . A A . 7 VAL HG21 1 1 18 4737 1 1 7 VAL HG22 H 5.939 -8.712 2.810 1.00 . A A . 7 VAL HG22 1 1 18 4738 1 1 7 VAL HG23 H 5.576 -7.645 1.453 1.00 . A A . 7 VAL HG23 1 1 18 4739 1 1 7 VAL N N 4.057 -5.736 1.370 1.00 . A A . 7 VAL N 1 1 18 4740 1 1 7 VAL O O 1.098 -6.211 3.122 1.00 . A A . 7 VAL O 1 1 18 4741 1 1 8 CYS C C 0.925 -3.329 3.858 1.00 . A A . 8 CYS C 1 1 18 4742 1 1 8 CYS CA C 1.980 -4.086 4.656 1.00 . A A . 8 CYS CA 1 1 18 4743 1 1 8 CYS CB C 2.848 -3.103 5.438 1.00 . A A . 8 CYS CB 1 1 18 4744 1 1 8 CYS H H 3.753 -4.689 3.667 1.00 . A A . 8 CYS H 1 1 18 4745 1 1 8 CYS HA H 1.486 -4.752 5.347 1.00 . A A . 8 CYS HA 1 1 18 4746 1 1 8 CYS HB2 H 3.807 -3.556 5.632 1.00 . A A . 8 CYS HB2 1 1 18 4747 1 1 8 CYS HB3 H 2.992 -2.218 4.840 1.00 . A A . 8 CYS HB3 1 1 18 4748 1 1 8 CYS N N 2.800 -4.893 3.761 1.00 . A A . 8 CYS N 1 1 18 4749 1 1 8 CYS O O -0.214 -3.194 4.295 1.00 . A A . 8 CYS O 1 1 18 4750 1 1 8 CYS SG S 2.143 -2.574 7.037 1.00 . A A . 8 CYS SG 1 1 18 4751 1 1 9 HIS C C -0.740 -2.975 1.359 1.00 . A A . 9 HIS C 1 1 18 4752 1 1 9 HIS CA C 0.418 -2.097 1.811 1.00 . A A . 9 HIS CA 1 1 18 4753 1 1 9 HIS CB C 1.164 -1.581 0.582 1.00 . A A . 9 HIS CB 1 1 18 4754 1 1 9 HIS CD2 C 0.850 0.786 -0.446 1.00 . A A . 9 HIS CD2 1 1 18 4755 1 1 9 HIS CE1 C -1.196 0.547 -1.190 1.00 . A A . 9 HIS CE1 1 1 18 4756 1 1 9 HIS CG C 0.449 -0.469 -0.134 1.00 . A A . 9 HIS CG 1 1 18 4757 1 1 9 HIS H H 2.251 -2.987 2.401 1.00 . A A . 9 HIS H 1 1 18 4758 1 1 9 HIS HA H 0.027 -1.259 2.367 1.00 . A A . 9 HIS HA 1 1 18 4759 1 1 9 HIS HB2 H 2.131 -1.220 0.885 1.00 . A A . 9 HIS HB2 1 1 18 4760 1 1 9 HIS HB3 H 1.293 -2.394 -0.116 1.00 . A A . 9 HIS HB3 1 1 18 4761 1 1 9 HIS HD1 H -1.414 -1.378 -0.528 1.00 . A A . 9 HIS HD1 1 1 18 4762 1 1 9 HIS HD2 H 1.812 1.226 -0.221 1.00 . A A . 9 HIS HD2 1 1 18 4763 1 1 9 HIS HE1 H -2.152 0.744 -1.654 1.00 . A A . 9 HIS HE1 1 1 18 4764 1 1 9 HIS HE2 H -0.263 2.362 -1.271 1.00 . A A . 9 HIS HE2 1 1 18 4765 1 1 9 HIS N N 1.319 -2.842 2.686 1.00 . A A . 9 HIS N 1 1 18 4766 1 1 9 HIS ND1 N -0.839 -0.584 -0.615 1.00 . A A . 9 HIS ND1 1 1 18 4767 1 1 9 HIS NE2 N -0.192 1.399 -1.102 1.00 . A A . 9 HIS NE2 1 1 18 4768 1 1 9 HIS O O -1.872 -2.515 1.260 1.00 . A A . 9 HIS O 1 1 18 4769 1 1 10 LEU C C -2.464 -5.438 1.733 1.00 . A A . 10 LEU C 1 1 18 4770 1 1 10 LEU CA C -1.459 -5.176 0.619 1.00 . A A . 10 LEU CA 1 1 18 4771 1 1 10 LEU CB C -0.822 -6.493 0.166 1.00 . A A . 10 LEU CB 1 1 18 4772 1 1 10 LEU CD1 C 0.662 -7.753 -1.413 1.00 . A A . 10 LEU CD1 1 1 18 4773 1 1 10 LEU CD2 C -0.785 -5.906 -2.272 1.00 . A A . 10 LEU CD2 1 1 18 4774 1 1 10 LEU CG C 0.041 -6.403 -1.094 1.00 . A A . 10 LEU CG 1 1 18 4775 1 1 10 LEU H H 0.494 -4.531 1.151 1.00 . A A . 10 LEU H 1 1 18 4776 1 1 10 LEU HA H -1.977 -4.731 -0.218 1.00 . A A . 10 LEU HA 1 1 18 4777 1 1 10 LEU HB2 H -0.205 -6.865 0.973 1.00 . A A . 10 LEU HB2 1 1 18 4778 1 1 10 LEU HB3 H -1.612 -7.206 -0.017 1.00 . A A . 10 LEU HB3 1 1 18 4779 1 1 10 LEU HD11 H 1.694 -7.615 -1.705 1.00 . A A . 10 LEU HD11 1 1 18 4780 1 1 10 LEU HD12 H 0.118 -8.219 -2.221 1.00 . A A . 10 LEU HD12 1 1 18 4781 1 1 10 LEU HD13 H 0.618 -8.385 -0.538 1.00 . A A . 10 LEU HD13 1 1 18 4782 1 1 10 LEU HD21 H -0.179 -5.261 -2.890 1.00 . A A . 10 LEU HD21 1 1 18 4783 1 1 10 LEU HD22 H -1.639 -5.354 -1.905 1.00 . A A . 10 LEU HD22 1 1 18 4784 1 1 10 LEU HD23 H -1.125 -6.749 -2.855 1.00 . A A . 10 LEU HD23 1 1 18 4785 1 1 10 LEU HG H 0.842 -5.697 -0.925 1.00 . A A . 10 LEU HG 1 1 18 4786 1 1 10 LEU N N -0.440 -4.233 1.067 1.00 . A A . 10 LEU N 1 1 18 4787 1 1 10 LEU O O -3.674 -5.338 1.526 1.00 . A A . 10 LEU O 1 1 18 4788 1 1 11 GLU C C -3.558 -4.766 4.466 1.00 . A A . 11 GLU C 1 1 18 4789 1 1 11 GLU CA C -2.784 -6.023 4.080 1.00 . A A . 11 GLU CA 1 1 18 4790 1 1 11 GLU CB C -1.907 -6.482 5.251 1.00 . A A . 11 GLU CB 1 1 18 4791 1 1 11 GLU CD C -3.453 -8.120 6.407 1.00 . A A . 11 GLU CD 1 1 18 4792 1 1 11 GLU CG C -2.682 -6.819 6.516 1.00 . A A . 11 GLU CG 1 1 18 4793 1 1 11 GLU H H -0.972 -5.812 3.008 1.00 . A A . 11 GLU H 1 1 18 4794 1 1 11 GLU HA H -3.480 -6.805 3.826 1.00 . A A . 11 GLU HA 1 1 18 4795 1 1 11 GLU HB2 H -1.358 -7.362 4.949 1.00 . A A . 11 GLU HB2 1 1 18 4796 1 1 11 GLU HB3 H -1.204 -5.696 5.486 1.00 . A A . 11 GLU HB3 1 1 18 4797 1 1 11 GLU HG2 H -1.985 -6.902 7.337 1.00 . A A . 11 GLU HG2 1 1 18 4798 1 1 11 GLU HG3 H -3.380 -6.019 6.717 1.00 . A A . 11 GLU HG3 1 1 18 4799 1 1 11 GLU N N -1.947 -5.758 2.915 1.00 . A A . 11 GLU N 1 1 18 4800 1 1 11 GLU O O -4.772 -4.787 4.656 1.00 . A A . 11 GLU O 1 1 18 4801 1 1 11 GLU OE1 O -4.303 -8.235 5.501 1.00 . A A . 11 GLU OE1 1 1 18 4802 1 1 11 GLU OE2 O -3.206 -9.021 7.233 1.00 . A A . 11 GLU OE2 1 1 18 4803 1 1 12 HIS C C -3.829 -1.644 3.631 1.00 . A A . 12 HIS C 1 1 18 4804 1 1 12 HIS CA C -3.441 -2.379 4.907 1.00 . A A . 12 HIS CA 1 1 18 4805 1 1 12 HIS CB C -2.480 -1.512 5.738 1.00 . A A . 12 HIS CB 1 1 18 4806 1 1 12 HIS CD2 C -1.723 -3.462 7.293 1.00 . A A . 12 HIS CD2 1 1 18 4807 1 1 12 HIS CE1 C -1.151 -2.274 9.041 1.00 . A A . 12 HIS CE1 1 1 18 4808 1 1 12 HIS CG C -1.962 -2.162 6.992 1.00 . A A . 12 HIS CG 1 1 18 4809 1 1 12 HIS H H -1.876 -3.704 4.377 1.00 . A A . 12 HIS H 1 1 18 4810 1 1 12 HIS HA H -4.334 -2.574 5.482 1.00 . A A . 12 HIS HA 1 1 18 4811 1 1 12 HIS HB2 H -1.627 -1.254 5.130 1.00 . A A . 12 HIS HB2 1 1 18 4812 1 1 12 HIS HB3 H -2.991 -0.605 6.025 1.00 . A A . 12 HIS HB3 1 1 18 4813 1 1 12 HIS HD1 H -1.625 -0.470 8.201 1.00 . A A . 12 HIS HD1 1 1 18 4814 1 1 12 HIS HD2 H -1.868 -4.307 6.635 1.00 . A A . 12 HIS HD2 1 1 18 4815 1 1 12 HIS HE1 H -0.795 -1.993 10.020 1.00 . A A . 12 HIS HE1 1 1 18 4816 1 1 12 HIS HE2 H -1.048 -4.319 9.085 1.00 . A A . 12 HIS HE2 1 1 18 4817 1 1 12 HIS N N -2.840 -3.659 4.561 1.00 . A A . 12 HIS N 1 1 18 4818 1 1 12 HIS ND1 N -1.589 -1.444 8.110 1.00 . A A . 12 HIS ND1 1 1 18 4819 1 1 12 HIS NE2 N -1.223 -3.503 8.569 1.00 . A A . 12 HIS NE2 1 1 18 4820 1 1 12 HIS O O -3.509 -0.466 3.456 1.00 . A A . 12 HIS O 1 1 18 4821 1 1 13 SER C C -5.829 -0.601 1.614 1.00 . A A . 13 SER C 1 1 18 4822 1 1 13 SER CA C -4.920 -1.817 1.456 1.00 . A A . 13 SER CA 1 1 18 4823 1 1 13 SER CB C -5.623 -2.912 0.656 1.00 . A A . 13 SER CB 1 1 18 4824 1 1 13 SER H H -4.702 -3.299 2.944 1.00 . A A . 13 SER H 1 1 18 4825 1 1 13 SER HA H -4.032 -1.514 0.921 1.00 . A A . 13 SER HA 1 1 18 4826 1 1 13 SER HB2 H -6.277 -2.460 -0.074 1.00 . A A . 13 SER HB2 1 1 18 4827 1 1 13 SER HB3 H -4.884 -3.519 0.154 1.00 . A A . 13 SER HB3 1 1 18 4828 1 1 13 SER HG H -5.924 -4.572 1.659 1.00 . A A . 13 SER HG 1 1 18 4829 1 1 13 SER N N -4.497 -2.359 2.739 1.00 . A A . 13 SER N 1 1 18 4830 1 1 13 SER O O -5.634 0.417 0.949 1.00 . A A . 13 SER O 1 1 18 4831 1 1 13 SER OG O -6.394 -3.741 1.510 1.00 . A A . 13 SER OG 1 1 18 4832 1 1 14 ASN C C -7.083 1.542 3.452 1.00 . A A . 14 ASN C 1 1 18 4833 1 1 14 ASN CA C -7.756 0.383 2.721 1.00 . A A . 14 ASN CA 1 1 18 4834 1 1 14 ASN CB C -8.991 -0.097 3.494 1.00 . A A . 14 ASN CB 1 1 18 4835 1 1 14 ASN CG C -8.666 -0.596 4.888 1.00 . A A . 14 ASN CG 1 1 18 4836 1 1 14 ASN H H -6.927 -1.551 2.989 1.00 . A A . 14 ASN H 1 1 18 4837 1 1 14 ASN HA H -8.074 0.739 1.753 1.00 . A A . 14 ASN HA 1 1 18 4838 1 1 14 ASN HB2 H -9.689 0.721 3.584 1.00 . A A . 14 ASN HB2 1 1 18 4839 1 1 14 ASN HB3 H -9.457 -0.902 2.945 1.00 . A A . 14 ASN HB3 1 1 18 4840 1 1 14 ASN HD21 H -9.881 0.754 5.688 1.00 . A A . 14 ASN HD21 1 1 18 4841 1 1 14 ASN HD22 H -9.076 -0.287 6.805 1.00 . A A . 14 ASN HD22 1 1 18 4842 1 1 14 ASN N N -6.820 -0.712 2.490 1.00 . A A . 14 ASN N 1 1 18 4843 1 1 14 ASN ND2 N -9.268 0.020 5.895 1.00 . A A . 14 ASN ND2 1 1 18 4844 1 1 14 ASN O O -7.433 2.700 3.240 1.00 . A A . 14 ASN O 1 1 18 4845 1 1 14 ASN OD1 O -7.881 -1.526 5.060 1.00 . A A . 14 ASN OD1 1 1 18 4846 1 1 15 LEU C C -4.486 3.047 4.124 1.00 . A A . 15 LEU C 1 1 18 4847 1 1 15 LEU CA C -5.403 2.262 5.051 1.00 . A A . 15 LEU CA 1 1 18 4848 1 1 15 LEU CB C -4.573 1.666 6.201 1.00 . A A . 15 LEU CB 1 1 18 4849 1 1 15 LEU CD1 C -6.481 2.093 7.786 1.00 . A A . 15 LEU CD1 1 1 18 4850 1 1 15 LEU CD2 C -5.898 -0.259 7.143 1.00 . A A . 15 LEU CD2 1 1 18 4851 1 1 15 LEU CG C -5.359 1.138 7.408 1.00 . A A . 15 LEU CG 1 1 18 4852 1 1 15 LEU H H -5.875 0.290 4.429 1.00 . A A . 15 LEU H 1 1 18 4853 1 1 15 LEU HA H -6.135 2.936 5.461 1.00 . A A . 15 LEU HA 1 1 18 4854 1 1 15 LEU HB2 H -3.988 0.852 5.801 1.00 . A A . 15 LEU HB2 1 1 18 4855 1 1 15 LEU HB3 H -3.894 2.429 6.551 1.00 . A A . 15 LEU HB3 1 1 18 4856 1 1 15 LEU HD11 H -7.401 1.769 7.321 1.00 . A A . 15 LEU HD11 1 1 18 4857 1 1 15 LEU HD12 H -6.238 3.088 7.446 1.00 . A A . 15 LEU HD12 1 1 18 4858 1 1 15 LEU HD13 H -6.604 2.099 8.859 1.00 . A A . 15 LEU HD13 1 1 18 4859 1 1 15 LEU HD21 H -5.074 -0.950 7.047 1.00 . A A . 15 LEU HD21 1 1 18 4860 1 1 15 LEU HD22 H -6.473 -0.255 6.229 1.00 . A A . 15 LEU HD22 1 1 18 4861 1 1 15 LEU HD23 H -6.529 -0.563 7.965 1.00 . A A . 15 LEU HD23 1 1 18 4862 1 1 15 LEU HG H -4.689 1.077 8.255 1.00 . A A . 15 LEU HG 1 1 18 4863 1 1 15 LEU N N -6.116 1.229 4.306 1.00 . A A . 15 LEU N 1 1 18 4864 1 1 15 LEU O O -4.492 4.277 4.114 1.00 . A A . 15 LEU O 1 1 18 4865 1 1 16 CYS C C -3.424 3.161 1.052 1.00 . A A . 16 CYS C 1 1 18 4866 1 1 16 CYS CA C -2.772 2.937 2.410 1.00 . A A . 16 CYS CA 1 1 18 4867 1 1 16 CYS CB C -1.533 2.062 2.256 1.00 . A A . 16 CYS CB 1 1 18 4868 1 1 16 CYS H H -3.750 1.345 3.402 1.00 . A A . 16 CYS H 1 1 18 4869 1 1 16 CYS HA H -2.476 3.892 2.815 1.00 . A A . 16 CYS HA 1 1 18 4870 1 1 16 CYS HB2 H -1.835 1.090 1.905 1.00 . A A . 16 CYS HB2 1 1 18 4871 1 1 16 CYS HB3 H -0.872 2.512 1.529 1.00 . A A . 16 CYS HB3 1 1 18 4872 1 1 16 CYS N N -3.702 2.325 3.346 1.00 . A A . 16 CYS N 1 1 18 4873 1 1 16 CYS O O -2.791 2.982 0.005 1.00 . A A . 16 CYS O 1 1 18 4874 1 1 16 CYS SG S -0.586 1.829 3.796 1.00 . A A . 16 CYS SG 1 1 18 4875 1 1 17 GLY C C -6.126 5.136 -0.107 1.00 . A A . 17 GLY C 1 1 18 4876 1 1 17 GLY CA C -5.405 3.809 -0.149 1.00 . A A . 17 GLY CA 1 1 18 4877 1 1 17 GLY H H -5.127 3.683 1.939 1.00 . A A . 17 GLY H 1 1 18 4878 1 1 17 GLY HA2 H -4.709 3.812 -0.976 1.00 . A A . 17 GLY HA2 1 1 18 4879 1 1 17 GLY HA3 H -6.128 3.022 -0.300 1.00 . A A . 17 GLY HA3 1 1 18 4880 1 1 17 GLY N N -4.682 3.557 1.075 1.00 . A A . 17 GLY N 1 1 18 4881 1 1 17 GLY O O -6.905 5.388 0.811 1.00 . A A . 17 GLY O 1 1 18 4882 1 1 18 ALA C C -6.211 8.143 0.062 1.00 . A A . 18 ALA C 1 1 18 4883 1 1 18 ALA CA C -6.461 7.311 -1.197 1.00 . A A . 18 ALA CA 1 1 18 4884 1 1 18 ALA CB C -7.956 7.195 -1.478 1.00 . A A . 18 ALA CB 1 1 18 4885 1 1 18 ALA H H -5.213 5.707 -1.785 1.00 . A A . 18 ALA H 1 1 18 4886 1 1 18 ALA HA H -6.006 7.816 -2.037 1.00 . A A . 18 ALA HA 1 1 18 4887 1 1 18 ALA HB1 H -8.498 7.860 -0.824 1.00 . A A . 18 ALA HB1 1 1 18 4888 1 1 18 ALA HB2 H -8.276 6.178 -1.303 1.00 . A A . 18 ALA HB2 1 1 18 4889 1 1 18 ALA HB3 H -8.151 7.462 -2.506 1.00 . A A . 18 ALA HB3 1 1 18 4890 1 1 18 ALA N N -5.851 5.983 -1.097 1.00 . A A . 18 ALA N 1 1 18 4891 1 1 18 ALA O O -7.054 8.941 0.470 1.00 . A A . 18 ALA O 1 1 18 4892 1 1 19 GLY C C -3.414 8.198 2.481 1.00 . A A . 19 GLY C 1 1 18 4893 1 1 19 GLY CA C -4.700 8.696 1.859 1.00 . A A . 19 GLY CA 1 1 18 4894 1 1 19 GLY H H -4.410 7.312 0.291 1.00 . A A . 19 GLY H 1 1 18 4895 1 1 19 GLY HA2 H -4.585 9.740 1.605 1.00 . A A . 19 GLY HA2 1 1 18 4896 1 1 19 GLY HA3 H -5.498 8.595 2.578 1.00 . A A . 19 GLY HA3 1 1 18 4897 1 1 19 GLY N N -5.044 7.957 0.664 1.00 . A A . 19 GLY N 1 1 18 4898 1 1 19 GLY O O -2.484 8.972 2.706 1.00 . A A . 19 GLY O 1 1 18 4899 1 1 20 GLY C C -1.007 6.293 2.378 1.00 . A A . 20 GLY C 1 1 18 4900 1 1 20 GLY CA C -2.172 6.316 3.343 1.00 . A A . 20 GLY CA 1 1 18 4901 1 1 20 GLY H H -4.132 6.332 2.548 1.00 . A A . 20 GLY H 1 1 18 4902 1 1 20 GLY HA2 H -1.894 6.892 4.214 1.00 . A A . 20 GLY HA2 1 1 18 4903 1 1 20 GLY HA3 H -2.392 5.304 3.648 1.00 . A A . 20 GLY HA3 1 1 18 4904 1 1 20 GLY N N -3.359 6.900 2.753 1.00 . A A . 20 GLY N 1 1 18 4905 1 1 20 GLY O O -1.135 5.810 1.249 1.00 . A A . 20 GLY O 1 1 18 4906 1 1 21 ALA C C 2.542 7.192 2.872 1.00 . A A . 21 ALA C 1 1 18 4907 1 1 21 ALA CA C 1.331 6.872 2.007 1.00 . A A . 21 ALA CA 1 1 18 4908 1 1 21 ALA CB C 1.171 7.913 0.903 1.00 . A A . 21 ALA CB 1 1 18 4909 1 1 21 ALA H H 0.155 7.182 3.731 1.00 . A A . 21 ALA H 1 1 18 4910 1 1 21 ALA HA H 1.478 5.912 1.544 1.00 . A A . 21 ALA HA 1 1 18 4911 1 1 21 ALA HB1 H 1.861 7.697 0.101 1.00 . A A . 21 ALA HB1 1 1 18 4912 1 1 21 ALA HB2 H 1.378 8.894 1.301 1.00 . A A . 21 ALA HB2 1 1 18 4913 1 1 21 ALA HB3 H 0.159 7.885 0.525 1.00 . A A . 21 ALA HB3 1 1 18 4914 1 1 21 ALA N N 0.127 6.816 2.822 1.00 . A A . 21 ALA N 1 1 18 4915 1 1 21 ALA O O 2.603 6.793 4.035 1.00 . A A . 21 ALA O 1 1 18 4916 1 1 22 ALA C C 5.576 7.116 3.353 1.00 . A A . 22 ALA C 1 1 18 4917 1 1 22 ALA CA C 4.724 8.319 2.958 1.00 . A A . 22 ALA CA 1 1 18 4918 1 1 22 ALA CB C 4.413 9.189 4.173 1.00 . A A . 22 ALA CB 1 1 18 4919 1 1 22 ALA H H 3.353 8.179 1.355 1.00 . A A . 22 ALA H 1 1 18 4920 1 1 22 ALA HA H 5.292 8.920 2.264 1.00 . A A . 22 ALA HA 1 1 18 4921 1 1 22 ALA HB1 H 4.235 10.205 3.852 1.00 . A A . 22 ALA HB1 1 1 18 4922 1 1 22 ALA HB2 H 5.251 9.169 4.854 1.00 . A A . 22 ALA HB2 1 1 18 4923 1 1 22 ALA HB3 H 3.534 8.810 4.672 1.00 . A A . 22 ALA HB3 1 1 18 4924 1 1 22 ALA N N 3.490 7.913 2.284 1.00 . A A . 22 ALA N 1 1 18 4925 1 1 22 ALA O O 5.452 6.033 2.776 1.00 . A A . 22 ALA O 1 1 18 4926 1 1 23 GLY C C 6.747 5.513 5.973 1.00 . A A . 23 GLY C 1 1 18 4927 1 1 23 GLY CA C 7.321 6.266 4.792 1.00 . A A . 23 GLY CA 1 1 18 4928 1 1 23 GLY H H 6.499 8.210 4.740 1.00 . A A . 23 GLY H 1 1 18 4929 1 1 23 GLY HA2 H 7.485 5.571 3.981 1.00 . A A . 23 GLY HA2 1 1 18 4930 1 1 23 GLY HA3 H 8.268 6.697 5.080 1.00 . A A . 23 GLY HA3 1 1 18 4931 1 1 23 GLY N N 6.447 7.324 4.330 1.00 . A A . 23 GLY N 1 1 18 4932 1 1 23 GLY O O 6.345 6.116 6.965 1.00 . A A . 23 GLY O 1 1 19 4933 1 1 1 GLY C C 5.418 2.932 6.237 1.00 . A A . 1 GLY C 1 1 19 4934 1 1 1 GLY CA C 5.530 4.410 6.542 1.00 . A A . 1 GLY CA 1 1 19 4935 1 1 1 GLY H1 H 6.170 5.781 5.066 1.00 . A A . 1 GLY H1 1 1 19 4936 1 1 1 GLY HA2 H 6.485 4.601 7.007 1.00 . A A . 1 GLY HA2 1 1 19 4937 1 1 1 GLY HA3 H 4.745 4.686 7.230 1.00 . A A . 1 GLY HA3 1 1 19 4938 1 1 1 GLY N N 5.416 5.225 5.349 1.00 . A A . 1 GLY N 1 1 19 4939 1 1 1 GLY O O 6.191 2.391 5.448 1.00 . A A . 1 GLY O 1 1 19 4940 1 1 2 CYS C C 3.772 0.607 5.213 1.00 . A A . 2 CYS C 1 1 19 4941 1 1 2 CYS CA C 4.221 0.859 6.647 1.00 . A A . 2 CYS CA 1 1 19 4942 1 1 2 CYS CB C 3.165 0.341 7.625 1.00 . A A . 2 CYS CB 1 1 19 4943 1 1 2 CYS H H 3.860 2.775 7.467 1.00 . A A . 2 CYS H 1 1 19 4944 1 1 2 CYS HA H 5.152 0.339 6.818 1.00 . A A . 2 CYS HA 1 1 19 4945 1 1 2 CYS HB2 H 3.286 0.846 8.570 1.00 . A A . 2 CYS HB2 1 1 19 4946 1 1 2 CYS HB3 H 2.184 0.562 7.230 1.00 . A A . 2 CYS HB3 1 1 19 4947 1 1 2 CYS N N 4.447 2.283 6.857 1.00 . A A . 2 CYS N 1 1 19 4948 1 1 2 CYS O O 4.083 -0.427 4.626 1.00 . A A . 2 CYS O 1 1 19 4949 1 1 2 CYS SG S 3.246 -1.454 7.939 1.00 . A A . 2 CYS SG 1 1 19 4950 1 1 3 CYS C C 3.675 1.334 2.278 1.00 . A A . 3 CYS C 1 1 19 4951 1 1 3 CYS CA C 2.541 1.474 3.288 1.00 . A A . 3 CYS CA 1 1 19 4952 1 1 3 CYS CB C 1.683 2.691 2.951 1.00 . A A . 3 CYS CB 1 1 19 4953 1 1 3 CYS H H 2.837 2.373 5.182 1.00 . A A . 3 CYS H 1 1 19 4954 1 1 3 CYS HA H 1.923 0.591 3.230 1.00 . A A . 3 CYS HA 1 1 19 4955 1 1 3 CYS HB2 H 2.274 3.587 3.072 1.00 . A A . 3 CYS HB2 1 1 19 4956 1 1 3 CYS HB3 H 1.352 2.617 1.925 1.00 . A A . 3 CYS HB3 1 1 19 4957 1 1 3 CYS N N 3.043 1.569 4.656 1.00 . A A . 3 CYS N 1 1 19 4958 1 1 3 CYS O O 3.475 0.788 1.192 1.00 . A A . 3 CYS O 1 1 19 4959 1 1 3 CYS SG S 0.205 2.853 3.999 1.00 . A A . 3 CYS SG 1 1 19 4960 1 1 4 SER C C 6.409 0.258 1.555 1.00 . A A . 4 SER C 1 1 19 4961 1 1 4 SER CA C 6.023 1.722 1.767 1.00 . A A . 4 SER CA 1 1 19 4962 1 1 4 SER CB C 7.193 2.506 2.365 1.00 . A A . 4 SER CB 1 1 19 4963 1 1 4 SER H H 4.960 2.231 3.521 1.00 . A A . 4 SER H 1 1 19 4964 1 1 4 SER HA H 5.758 2.153 0.815 1.00 . A A . 4 SER HA 1 1 19 4965 1 1 4 SER HB2 H 7.486 2.054 3.301 1.00 . A A . 4 SER HB2 1 1 19 4966 1 1 4 SER HB3 H 8.025 2.486 1.678 1.00 . A A . 4 SER HB3 1 1 19 4967 1 1 4 SER HG H 7.397 4.435 2.091 1.00 . A A . 4 SER HG 1 1 19 4968 1 1 4 SER N N 4.860 1.815 2.640 1.00 . A A . 4 SER N 1 1 19 4969 1 1 4 SER O O 7.033 -0.097 0.558 1.00 . A A . 4 SER O 1 1 19 4970 1 1 4 SER OG O 6.826 3.856 2.603 1.00 . A A . 4 SER OG 1 1 19 4971 1 1 5 ASN C C 5.147 -2.696 1.643 1.00 . A A . 5 ASN C 1 1 19 4972 1 1 5 ASN CA C 6.265 -2.012 2.414 1.00 . A A . 5 ASN CA 1 1 19 4973 1 1 5 ASN CB C 6.383 -2.618 3.817 1.00 . A A . 5 ASN CB 1 1 19 4974 1 1 5 ASN CG C 7.727 -2.344 4.460 1.00 . A A . 5 ASN CG 1 1 19 4975 1 1 5 ASN H H 5.481 -0.238 3.250 1.00 . A A . 5 ASN H 1 1 19 4976 1 1 5 ASN HA H 7.196 -2.152 1.886 1.00 . A A . 5 ASN HA 1 1 19 4977 1 1 5 ASN HB2 H 5.614 -2.196 4.450 1.00 . A A . 5 ASN HB2 1 1 19 4978 1 1 5 ASN HB3 H 6.244 -3.688 3.754 1.00 . A A . 5 ASN HB3 1 1 19 4979 1 1 5 ASN HD21 H 6.853 -1.327 5.923 1.00 . A A . 5 ASN HD21 1 1 19 4980 1 1 5 ASN HD22 H 8.573 -1.442 6.008 1.00 . A A . 5 ASN HD22 1 1 19 4981 1 1 5 ASN N N 6.000 -0.586 2.493 1.00 . A A . 5 ASN N 1 1 19 4982 1 1 5 ASN ND2 N 7.716 -1.633 5.577 1.00 . A A . 5 ASN ND2 1 1 19 4983 1 1 5 ASN O O 3.973 -2.541 1.977 1.00 . A A . 5 ASN O 1 1 19 4984 1 1 5 ASN OD1 O 8.763 -2.772 3.961 1.00 . A A . 5 ASN OD1 1 1 19 4985 1 1 6 PRO C C 3.555 -5.030 0.521 1.00 . A A . 6 PRO C 1 1 19 4986 1 1 6 PRO CA C 4.523 -4.146 -0.262 1.00 . A A . 6 PRO CA 1 1 19 4987 1 1 6 PRO CB C 5.394 -5.005 -1.194 1.00 . A A . 6 PRO CB 1 1 19 4988 1 1 6 PRO CD C 6.871 -3.659 0.120 1.00 . A A . 6 PRO CD 1 1 19 4989 1 1 6 PRO CG C 6.771 -4.963 -0.613 1.00 . A A . 6 PRO CG 1 1 19 4990 1 1 6 PRO HA H 3.955 -3.445 -0.856 1.00 . A A . 6 PRO HA 1 1 19 4991 1 1 6 PRO HB2 H 5.009 -6.013 -1.218 1.00 . A A . 6 PRO HB2 1 1 19 4992 1 1 6 PRO HB3 H 5.377 -4.587 -2.190 1.00 . A A . 6 PRO HB3 1 1 19 4993 1 1 6 PRO HD2 H 7.556 -3.743 0.952 1.00 . A A . 6 PRO HD2 1 1 19 4994 1 1 6 PRO HD3 H 7.178 -2.870 -0.549 1.00 . A A . 6 PRO HD3 1 1 19 4995 1 1 6 PRO HG2 H 6.905 -5.788 0.070 1.00 . A A . 6 PRO HG2 1 1 19 4996 1 1 6 PRO HG3 H 7.504 -5.006 -1.404 1.00 . A A . 6 PRO HG3 1 1 19 4997 1 1 6 PRO N N 5.496 -3.448 0.588 1.00 . A A . 6 PRO N 1 1 19 4998 1 1 6 PRO O O 2.353 -5.024 0.260 1.00 . A A . 6 PRO O 1 1 19 4999 1 1 7 VAL C C 2.237 -5.882 3.100 1.00 . A A . 7 VAL C 1 1 19 5000 1 1 7 VAL CA C 3.256 -6.674 2.291 1.00 . A A . 7 VAL CA 1 1 19 5001 1 1 7 VAL CB C 4.120 -7.522 3.249 1.00 . A A . 7 VAL CB 1 1 19 5002 1 1 7 VAL CG1 C 3.259 -8.508 4.027 1.00 . A A . 7 VAL CG1 1 1 19 5003 1 1 7 VAL CG2 C 5.212 -8.252 2.481 1.00 . A A . 7 VAL CG2 1 1 19 5004 1 1 7 VAL H H 5.043 -5.743 1.645 1.00 . A A . 7 VAL H 1 1 19 5005 1 1 7 VAL HA H 2.732 -7.343 1.624 1.00 . A A . 7 VAL HA 1 1 19 5006 1 1 7 VAL HB H 4.593 -6.857 3.957 1.00 . A A . 7 VAL HB 1 1 19 5007 1 1 7 VAL HG11 H 3.541 -8.486 5.069 1.00 . A A . 7 VAL HG11 1 1 19 5008 1 1 7 VAL HG12 H 3.408 -9.503 3.635 1.00 . A A . 7 VAL HG12 1 1 19 5009 1 1 7 VAL HG13 H 2.219 -8.234 3.929 1.00 . A A . 7 VAL HG13 1 1 19 5010 1 1 7 VAL HG21 H 5.760 -7.545 1.875 1.00 . A A . 7 VAL HG21 1 1 19 5011 1 1 7 VAL HG22 H 4.765 -9.001 1.845 1.00 . A A . 7 VAL HG22 1 1 19 5012 1 1 7 VAL HG23 H 5.887 -8.727 3.178 1.00 . A A . 7 VAL HG23 1 1 19 5013 1 1 7 VAL N N 4.080 -5.784 1.480 1.00 . A A . 7 VAL N 1 1 19 5014 1 1 7 VAL O O 1.045 -6.193 3.097 1.00 . A A . 7 VAL O 1 1 19 5015 1 1 8 CYS C C 0.852 -3.262 3.711 1.00 . A A . 8 CYS C 1 1 19 5016 1 1 8 CYS CA C 1.845 -4.003 4.589 1.00 . A A . 8 CYS CA 1 1 19 5017 1 1 8 CYS CB C 2.667 -2.995 5.382 1.00 . A A . 8 CYS CB 1 1 19 5018 1 1 8 CYS H H 3.670 -4.646 3.726 1.00 . A A . 8 CYS H 1 1 19 5019 1 1 8 CYS HA H 1.304 -4.637 5.275 1.00 . A A . 8 CYS HA 1 1 19 5020 1 1 8 CYS HB2 H 3.544 -3.482 5.768 1.00 . A A . 8 CYS HB2 1 1 19 5021 1 1 8 CYS HB3 H 2.968 -2.201 4.719 1.00 . A A . 8 CYS HB3 1 1 19 5022 1 1 8 CYS N N 2.712 -4.848 3.778 1.00 . A A . 8 CYS N 1 1 19 5023 1 1 8 CYS O O -0.305 -3.091 4.075 1.00 . A A . 8 CYS O 1 1 19 5024 1 1 8 CYS SG S 1.774 -2.234 6.778 1.00 . A A . 8 CYS SG 1 1 19 5025 1 1 9 HIS C C -0.710 -2.924 1.182 1.00 . A A . 9 HIS C 1 1 19 5026 1 1 9 HIS CA C 0.485 -2.082 1.612 1.00 . A A . 9 HIS CA 1 1 19 5027 1 1 9 HIS CB C 1.285 -1.682 0.375 1.00 . A A . 9 HIS CB 1 1 19 5028 1 1 9 HIS CD2 C 1.174 0.631 -0.794 1.00 . A A . 9 HIS CD2 1 1 19 5029 1 1 9 HIS CE1 C -0.903 0.548 -1.484 1.00 . A A . 9 HIS CE1 1 1 19 5030 1 1 9 HIS CG C 0.663 -0.557 -0.398 1.00 . A A . 9 HIS CG 1 1 19 5031 1 1 9 HIS H H 2.269 -2.979 2.336 1.00 . A A . 9 HIS H 1 1 19 5032 1 1 9 HIS HA H 0.128 -1.190 2.106 1.00 . A A . 9 HIS HA 1 1 19 5033 1 1 9 HIS HB2 H 2.273 -1.379 0.677 1.00 . A A . 9 HIS HB2 1 1 19 5034 1 1 9 HIS HB3 H 1.363 -2.535 -0.284 1.00 . A A . 9 HIS HB3 1 1 19 5035 1 1 9 HIS HD1 H -1.286 -1.307 -0.706 1.00 . A A . 9 HIS HD1 1 1 19 5036 1 1 9 HIS HD2 H 2.178 0.989 -0.614 1.00 . A A . 9 HIS HD2 1 1 19 5037 1 1 9 HIS HE1 H -1.845 0.810 -1.943 1.00 . A A . 9 HIS HE1 1 1 19 5038 1 1 9 HIS HE2 H 0.190 2.271 -1.660 1.00 . A A . 9 HIS HE2 1 1 19 5039 1 1 9 HIS N N 1.322 -2.817 2.555 1.00 . A A . 9 HIS N 1 1 19 5040 1 1 9 HIS ND1 N -0.640 -0.577 -0.848 1.00 . A A . 9 HIS ND1 1 1 19 5041 1 1 9 HIS NE2 N 0.181 1.301 -1.465 1.00 . A A . 9 HIS NE2 1 1 19 5042 1 1 9 HIS O O -1.821 -2.414 1.051 1.00 . A A . 9 HIS O 1 1 19 5043 1 1 10 LEU C C -2.486 -5.395 1.678 1.00 . A A . 10 LEU C 1 1 19 5044 1 1 10 LEU CA C -1.523 -5.118 0.528 1.00 . A A . 10 LEU CA 1 1 19 5045 1 1 10 LEU CB C -0.924 -6.431 0.015 1.00 . A A . 10 LEU CB 1 1 19 5046 1 1 10 LEU CD1 C 0.523 -7.657 -1.625 1.00 . A A . 10 LEU CD1 1 1 19 5047 1 1 10 LEU CD2 C -0.861 -5.723 -2.393 1.00 . A A . 10 LEU CD2 1 1 19 5048 1 1 10 LEU CG C -0.056 -6.305 -1.240 1.00 . A A . 10 LEU CG 1 1 19 5049 1 1 10 LEU H H 0.450 -4.543 1.061 1.00 . A A . 10 LEU H 1 1 19 5050 1 1 10 LEU HA H -2.067 -4.643 -0.274 1.00 . A A . 10 LEU HA 1 1 19 5051 1 1 10 LEU HB2 H -0.322 -6.859 0.803 1.00 . A A . 10 LEU HB2 1 1 19 5052 1 1 10 LEU HB3 H -1.735 -7.109 -0.203 1.00 . A A . 10 LEU HB3 1 1 19 5053 1 1 10 LEU HD11 H 0.737 -7.669 -2.683 1.00 . A A . 10 LEU HD11 1 1 19 5054 1 1 10 LEU HD12 H -0.193 -8.434 -1.393 1.00 . A A . 10 LEU HD12 1 1 19 5055 1 1 10 LEU HD13 H 1.433 -7.831 -1.071 1.00 . A A . 10 LEU HD13 1 1 19 5056 1 1 10 LEU HD21 H -1.915 -5.857 -2.199 1.00 . A A . 10 LEU HD21 1 1 19 5057 1 1 10 LEU HD22 H -0.597 -6.230 -3.309 1.00 . A A . 10 LEU HD22 1 1 19 5058 1 1 10 LEU HD23 H -0.643 -4.670 -2.488 1.00 . A A . 10 LEU HD23 1 1 19 5059 1 1 10 LEU HG H 0.767 -5.637 -1.034 1.00 . A A . 10 LEU HG 1 1 19 5060 1 1 10 LEU N N -0.466 -4.204 0.950 1.00 . A A . 10 LEU N 1 1 19 5061 1 1 10 LEU O O -3.705 -5.332 1.510 1.00 . A A . 10 LEU O 1 1 19 5062 1 1 11 GLU C C -3.518 -4.753 4.458 1.00 . A A . 11 GLU C 1 1 19 5063 1 1 11 GLU CA C -2.719 -5.983 4.034 1.00 . A A . 11 GLU CA 1 1 19 5064 1 1 11 GLU CB C -1.798 -6.435 5.174 1.00 . A A . 11 GLU CB 1 1 19 5065 1 1 11 GLU CD C -1.592 -7.152 7.590 1.00 . A A . 11 GLU CD 1 1 19 5066 1 1 11 GLU CG C -2.534 -6.860 6.437 1.00 . A A . 11 GLU CG 1 1 19 5067 1 1 11 GLU H H -0.945 -5.728 2.908 1.00 . A A . 11 GLU H 1 1 19 5068 1 1 11 GLU HA H -3.403 -6.780 3.795 1.00 . A A . 11 GLU HA 1 1 19 5069 1 1 11 GLU HB2 H -1.207 -7.271 4.832 1.00 . A A . 11 GLU HB2 1 1 19 5070 1 1 11 GLU HB3 H -1.136 -5.620 5.428 1.00 . A A . 11 GLU HB3 1 1 19 5071 1 1 11 GLU HG2 H -3.205 -6.067 6.731 1.00 . A A . 11 GLU HG2 1 1 19 5072 1 1 11 GLU HG3 H -3.105 -7.752 6.222 1.00 . A A . 11 GLU HG3 1 1 19 5073 1 1 11 GLU N N -1.925 -5.696 2.845 1.00 . A A . 11 GLU N 1 1 19 5074 1 1 11 GLU O O -4.710 -4.830 4.749 1.00 . A A . 11 GLU O 1 1 19 5075 1 1 11 GLU OE1 O -0.870 -6.222 8.021 1.00 . A A . 11 GLU OE1 1 1 19 5076 1 1 11 GLU OE2 O -1.576 -8.300 8.068 1.00 . A A . 11 GLU OE2 1 1 19 5077 1 1 12 HIS C C -3.876 -1.577 3.624 1.00 . A A . 12 HIS C 1 1 19 5078 1 1 12 HIS CA C -3.476 -2.355 4.869 1.00 . A A . 12 HIS CA 1 1 19 5079 1 1 12 HIS CB C -2.537 -1.490 5.736 1.00 . A A . 12 HIS CB 1 1 19 5080 1 1 12 HIS CD2 C -1.702 -3.504 7.148 1.00 . A A . 12 HIS CD2 1 1 19 5081 1 1 12 HIS CE1 C -1.000 -2.418 8.909 1.00 . A A . 12 HIS CE1 1 1 19 5082 1 1 12 HIS CG C -1.941 -2.194 6.926 1.00 . A A . 12 HIS CG 1 1 19 5083 1 1 12 HIS H H -1.897 -3.616 4.233 1.00 . A A . 12 HIS H 1 1 19 5084 1 1 12 HIS HA H -4.366 -2.587 5.436 1.00 . A A . 12 HIS HA 1 1 19 5085 1 1 12 HIS HB2 H -1.719 -1.143 5.123 1.00 . A A . 12 HIS HB2 1 1 19 5086 1 1 12 HIS HB3 H -3.088 -0.635 6.101 1.00 . A A . 12 HIS HB3 1 1 19 5087 1 1 12 HIS HD1 H -1.512 -0.566 8.197 1.00 . A A . 12 HIS HD1 1 1 19 5088 1 1 12 HIS HD2 H -1.902 -4.314 6.462 1.00 . A A . 12 HIS HD2 1 1 19 5089 1 1 12 HIS HE1 H -0.577 -2.194 9.876 1.00 . A A . 12 HIS HE1 1 1 19 5090 1 1 12 HIS HE2 H -0.775 -4.461 8.767 1.00 . A A . 12 HIS HE2 1 1 19 5091 1 1 12 HIS N N -2.848 -3.612 4.484 1.00 . A A . 12 HIS N 1 1 19 5092 1 1 12 HIS ND1 N -1.488 -1.534 8.052 1.00 . A A . 12 HIS ND1 1 1 19 5093 1 1 12 HIS NE2 N -1.123 -3.616 8.380 1.00 . A A . 12 HIS NE2 1 1 19 5094 1 1 12 HIS O O -3.665 -0.372 3.544 1.00 . A A . 12 HIS O 1 1 19 5095 1 1 13 SER C C -5.835 -0.517 1.620 1.00 . A A . 13 SER C 1 1 19 5096 1 1 13 SER CA C -4.867 -1.677 1.397 1.00 . A A . 13 SER CA 1 1 19 5097 1 1 13 SER CB C -5.505 -2.750 0.518 1.00 . A A . 13 SER CB 1 1 19 5098 1 1 13 SER H H -4.576 -3.245 2.782 1.00 . A A . 13 SER H 1 1 19 5099 1 1 13 SER HA H -3.986 -1.301 0.899 1.00 . A A . 13 SER HA 1 1 19 5100 1 1 13 SER HB2 H -6.225 -2.291 -0.144 1.00 . A A . 13 SER HB2 1 1 19 5101 1 1 13 SER HB3 H -4.740 -3.242 -0.063 1.00 . A A . 13 SER HB3 1 1 19 5102 1 1 13 SER HG H -5.687 -4.554 1.269 1.00 . A A . 13 SER HG 1 1 19 5103 1 1 13 SER N N -4.443 -2.281 2.655 1.00 . A A . 13 SER N 1 1 19 5104 1 1 13 SER O O -5.675 0.556 1.038 1.00 . A A . 13 SER O 1 1 19 5105 1 1 13 SER OG O -6.169 -3.718 1.316 1.00 . A A . 13 SER OG 1 1 19 5106 1 1 14 ASN C C -7.209 1.460 3.502 1.00 . A A . 14 ASN C 1 1 19 5107 1 1 14 ASN CA C -7.832 0.275 2.774 1.00 . A A . 14 ASN CA 1 1 19 5108 1 1 14 ASN CB C -8.960 -0.320 3.626 1.00 . A A . 14 ASN CB 1 1 19 5109 1 1 14 ASN CG C -9.756 -1.379 2.886 1.00 . A A . 14 ASN CG 1 1 19 5110 1 1 14 ASN H H -6.899 -1.623 2.892 1.00 . A A . 14 ASN H 1 1 19 5111 1 1 14 ASN HA H -8.246 0.622 1.841 1.00 . A A . 14 ASN HA 1 1 19 5112 1 1 14 ASN HB2 H -8.534 -0.771 4.509 1.00 . A A . 14 ASN HB2 1 1 19 5113 1 1 14 ASN HB3 H -9.634 0.472 3.920 1.00 . A A . 14 ASN HB3 1 1 19 5114 1 1 14 ASN HD21 H -9.295 -2.736 4.261 1.00 . A A . 14 ASN HD21 1 1 19 5115 1 1 14 ASN HD22 H -10.288 -3.288 2.962 1.00 . A A . 14 ASN HD22 1 1 19 5116 1 1 14 ASN N N -6.831 -0.744 2.467 1.00 . A A . 14 ASN N 1 1 19 5117 1 1 14 ASN ND2 N -9.782 -2.589 3.426 1.00 . A A . 14 ASN ND2 1 1 19 5118 1 1 14 ASN O O -7.597 2.607 3.294 1.00 . A A . 14 ASN O 1 1 19 5119 1 1 14 ASN OD1 O -10.347 -1.113 1.844 1.00 . A A . 14 ASN OD1 1 1 19 5120 1 1 15 LEU C C -4.628 3.015 4.239 1.00 . A A . 15 LEU C 1 1 19 5121 1 1 15 LEU CA C -5.558 2.202 5.131 1.00 . A A . 15 LEU CA 1 1 19 5122 1 1 15 LEU CB C -4.758 1.589 6.291 1.00 . A A . 15 LEU CB 1 1 19 5123 1 1 15 LEU CD1 C -6.648 1.977 7.908 1.00 . A A . 15 LEU CD1 1 1 19 5124 1 1 15 LEU CD2 C -6.210 -0.335 7.046 1.00 . A A . 15 LEU CD2 1 1 19 5125 1 1 15 LEU CG C -5.583 0.995 7.444 1.00 . A A . 15 LEU CG 1 1 19 5126 1 1 15 LEU H H -5.981 0.236 4.478 1.00 . A A . 15 LEU H 1 1 19 5127 1 1 15 LEU HA H -6.309 2.861 5.535 1.00 . A A . 15 LEU HA 1 1 19 5128 1 1 15 LEU HB2 H -4.134 0.805 5.889 1.00 . A A . 15 LEU HB2 1 1 19 5129 1 1 15 LEU HB3 H -4.117 2.356 6.700 1.00 . A A . 15 LEU HB3 1 1 19 5130 1 1 15 LEU HD11 H -6.213 2.961 8.004 1.00 . A A . 15 LEU HD11 1 1 19 5131 1 1 15 LEU HD12 H -7.037 1.660 8.865 1.00 . A A . 15 LEU HD12 1 1 19 5132 1 1 15 LEU HD13 H -7.450 2.006 7.186 1.00 . A A . 15 LEU HD13 1 1 19 5133 1 1 15 LEU HD21 H -6.808 -0.710 7.863 1.00 . A A . 15 LEU HD21 1 1 19 5134 1 1 15 LEU HD22 H -5.430 -1.046 6.816 1.00 . A A . 15 LEU HD22 1 1 19 5135 1 1 15 LEU HD23 H -6.836 -0.192 6.177 1.00 . A A . 15 LEU HD23 1 1 19 5136 1 1 15 LEU HG H -4.924 0.811 8.281 1.00 . A A . 15 LEU HG 1 1 19 5137 1 1 15 LEU N N -6.242 1.168 4.362 1.00 . A A . 15 LEU N 1 1 19 5138 1 1 15 LEU O O -4.556 4.237 4.343 1.00 . A A . 15 LEU O 1 1 19 5139 1 1 16 CYS C C -3.709 3.490 1.210 1.00 . A A . 16 CYS C 1 1 19 5140 1 1 16 CYS CA C -2.989 2.954 2.443 1.00 . A A . 16 CYS CA 1 1 19 5141 1 1 16 CYS CB C -1.913 1.960 2.028 1.00 . A A . 16 CYS CB 1 1 19 5142 1 1 16 CYS H H -4.032 1.347 3.334 1.00 . A A . 16 CYS H 1 1 19 5143 1 1 16 CYS HA H -2.522 3.780 2.959 1.00 . A A . 16 CYS HA 1 1 19 5144 1 1 16 CYS HB2 H -2.382 1.134 1.521 1.00 . A A . 16 CYS HB2 1 1 19 5145 1 1 16 CYS HB3 H -1.223 2.446 1.352 1.00 . A A . 16 CYS HB3 1 1 19 5146 1 1 16 CYS N N -3.922 2.322 3.364 1.00 . A A . 16 CYS N 1 1 19 5147 1 1 16 CYS O O -3.228 3.350 0.081 1.00 . A A . 16 CYS O 1 1 19 5148 1 1 16 CYS SG S -0.948 1.288 3.420 1.00 . A A . 16 CYS SG 1 1 19 5149 1 1 17 GLY C C -4.939 5.846 -0.280 1.00 . A A . 17 GLY C 1 1 19 5150 1 1 17 GLY CA C -5.640 4.673 0.372 1.00 . A A . 17 GLY CA 1 1 19 5151 1 1 17 GLY H H -5.166 4.178 2.371 1.00 . A A . 17 GLY H 1 1 19 5152 1 1 17 GLY HA2 H -5.819 3.910 -0.373 1.00 . A A . 17 GLY HA2 1 1 19 5153 1 1 17 GLY HA3 H -6.586 5.006 0.769 1.00 . A A . 17 GLY HA3 1 1 19 5154 1 1 17 GLY N N -4.854 4.103 1.445 1.00 . A A . 17 GLY N 1 1 19 5155 1 1 17 GLY O O -4.143 6.531 0.364 1.00 . A A . 17 GLY O 1 1 19 5156 1 1 18 ALA C C -3.107 7.008 -2.393 1.00 . A A . 18 ALA C 1 1 19 5157 1 1 18 ALA CA C -4.626 7.156 -2.327 1.00 . A A . 18 ALA CA 1 1 19 5158 1 1 18 ALA CB C -5.017 8.511 -1.746 1.00 . A A . 18 ALA CB 1 1 19 5159 1 1 18 ALA H H -5.865 5.472 -2.008 1.00 . A A . 18 ALA H 1 1 19 5160 1 1 18 ALA HA H -5.018 7.102 -3.334 1.00 . A A . 18 ALA HA 1 1 19 5161 1 1 18 ALA HB1 H -4.125 9.053 -1.466 1.00 . A A . 18 ALA HB1 1 1 19 5162 1 1 18 ALA HB2 H -5.638 8.363 -0.875 1.00 . A A . 18 ALA HB2 1 1 19 5163 1 1 18 ALA HB3 H -5.564 9.076 -2.486 1.00 . A A . 18 ALA HB3 1 1 19 5164 1 1 18 ALA N N -5.228 6.065 -1.562 1.00 . A A . 18 ALA N 1 1 19 5165 1 1 18 ALA O O -2.361 7.956 -2.160 1.00 . A A . 18 ALA O 1 1 19 5166 1 1 19 GLY C C -0.655 5.008 -1.512 1.00 . A A . 19 GLY C 1 1 19 5167 1 1 19 GLY CA C -1.239 5.534 -2.808 1.00 . A A . 19 GLY CA 1 1 19 5168 1 1 19 GLY H H -3.301 5.084 -2.882 1.00 . A A . 19 GLY H 1 1 19 5169 1 1 19 GLY HA2 H -1.073 4.805 -3.586 1.00 . A A . 19 GLY HA2 1 1 19 5170 1 1 19 GLY HA3 H -0.730 6.449 -3.072 1.00 . A A . 19 GLY HA3 1 1 19 5171 1 1 19 GLY N N -2.659 5.801 -2.712 1.00 . A A . 19 GLY N 1 1 19 5172 1 1 19 GLY O O 0.007 3.966 -1.503 1.00 . A A . 19 GLY O 1 1 19 5173 1 1 20 GLY C C -0.604 6.312 1.949 1.00 . A A . 20 GLY C 1 1 19 5174 1 1 20 GLY CA C -0.378 5.284 0.864 1.00 . A A . 20 GLY CA 1 1 19 5175 1 1 20 GLY H H -1.433 6.537 -0.479 1.00 . A A . 20 GLY H 1 1 19 5176 1 1 20 GLY HA2 H -0.867 4.364 1.147 1.00 . A A . 20 GLY HA2 1 1 19 5177 1 1 20 GLY HA3 H 0.683 5.104 0.769 1.00 . A A . 20 GLY HA3 1 1 19 5178 1 1 20 GLY N N -0.896 5.714 -0.417 1.00 . A A . 20 GLY N 1 1 19 5179 1 1 20 GLY O O -0.576 7.514 1.686 1.00 . A A . 20 GLY O 1 1 19 5180 1 1 21 ALA C C 0.254 7.373 4.769 1.00 . A A . 21 ALA C 1 1 19 5181 1 1 21 ALA CA C -1.048 6.713 4.315 1.00 . A A . 21 ALA CA 1 1 19 5182 1 1 21 ALA CB C -1.680 5.933 5.460 1.00 . A A . 21 ALA CB 1 1 19 5183 1 1 21 ALA H H -0.825 4.869 3.311 1.00 . A A . 21 ALA H 1 1 19 5184 1 1 21 ALA HA H -1.741 7.483 4.011 1.00 . A A . 21 ALA HA 1 1 19 5185 1 1 21 ALA HB1 H -2.138 6.620 6.154 1.00 . A A . 21 ALA HB1 1 1 19 5186 1 1 21 ALA HB2 H -0.919 5.360 5.968 1.00 . A A . 21 ALA HB2 1 1 19 5187 1 1 21 ALA HB3 H -2.431 5.263 5.066 1.00 . A A . 21 ALA HB3 1 1 19 5188 1 1 21 ALA N N -0.821 5.838 3.170 1.00 . A A . 21 ALA N 1 1 19 5189 1 1 21 ALA O O 0.789 7.047 5.829 1.00 . A A . 21 ALA O 1 1 19 5190 1 1 22 ALA C C 3.191 8.069 4.302 1.00 . A A . 22 ALA C 1 1 19 5191 1 1 22 ALA CA C 1.996 9.017 4.216 1.00 . A A . 22 ALA CA 1 1 19 5192 1 1 22 ALA CB C 1.869 9.851 5.486 1.00 . A A . 22 ALA CB 1 1 19 5193 1 1 22 ALA H H 0.270 8.483 3.109 1.00 . A A . 22 ALA H 1 1 19 5194 1 1 22 ALA HA H 2.162 9.697 3.391 1.00 . A A . 22 ALA HA 1 1 19 5195 1 1 22 ALA HB1 H 0.936 9.616 5.978 1.00 . A A . 22 ALA HB1 1 1 19 5196 1 1 22 ALA HB2 H 1.889 10.900 5.233 1.00 . A A . 22 ALA HB2 1 1 19 5197 1 1 22 ALA HB3 H 2.691 9.625 6.149 1.00 . A A . 22 ALA HB3 1 1 19 5198 1 1 22 ALA N N 0.755 8.292 3.943 1.00 . A A . 22 ALA N 1 1 19 5199 1 1 22 ALA O O 4.077 8.239 5.138 1.00 . A A . 22 ALA O 1 1 19 5200 1 1 23 GLY C C 4.300 5.229 4.630 1.00 . A A . 23 GLY C 1 1 19 5201 1 1 23 GLY CA C 4.297 6.119 3.403 1.00 . A A . 23 GLY CA 1 1 19 5202 1 1 23 GLY H H 2.478 6.998 2.776 1.00 . A A . 23 GLY H 1 1 19 5203 1 1 23 GLY HA2 H 4.204 5.500 2.522 1.00 . A A . 23 GLY HA2 1 1 19 5204 1 1 23 GLY HA3 H 5.233 6.654 3.358 1.00 . A A . 23 GLY HA3 1 1 19 5205 1 1 23 GLY N N 3.209 7.077 3.421 1.00 . A A . 23 GLY N 1 1 19 5206 1 1 23 GLY O O 3.308 4.554 4.918 1.00 . A A . 23 GLY O 1 1 20 5207 1 1 1 GLY C C 5.845 1.903 6.027 1.00 . A A . 1 GLY C 1 1 20 5208 1 1 1 GLY CA C 6.639 3.047 6.630 1.00 . A A . 1 GLY CA 1 1 20 5209 1 1 1 GLY H1 H 7.439 4.687 5.553 1.00 . A A . 1 GLY H1 1 1 20 5210 1 1 1 GLY HA2 H 7.665 2.735 6.736 1.00 . A A . 1 GLY HA2 1 1 20 5211 1 1 1 GLY HA3 H 6.241 3.266 7.609 1.00 . A A . 1 GLY HA3 1 1 20 5212 1 1 1 GLY N N 6.599 4.260 5.832 1.00 . A A . 1 GLY N 1 1 20 5213 1 1 1 GLY O O 6.160 1.421 4.939 1.00 . A A . 1 GLY O 1 1 20 5214 1 1 2 CYS C C 3.430 0.542 4.929 1.00 . A A . 2 CYS C 1 1 20 5215 1 1 2 CYS CA C 3.935 0.386 6.357 1.00 . A A . 2 CYS CA 1 1 20 5216 1 1 2 CYS CB C 2.738 0.339 7.309 1.00 . A A . 2 CYS CB 1 1 20 5217 1 1 2 CYS H H 4.648 1.929 7.611 1.00 . A A . 2 CYS H 1 1 20 5218 1 1 2 CYS HA H 4.485 -0.538 6.440 1.00 . A A . 2 CYS HA 1 1 20 5219 1 1 2 CYS HB2 H 3.082 0.057 8.286 1.00 . A A . 2 CYS HB2 1 1 20 5220 1 1 2 CYS HB3 H 2.300 1.326 7.366 1.00 . A A . 2 CYS HB3 1 1 20 5221 1 1 2 CYS N N 4.819 1.484 6.757 1.00 . A A . 2 CYS N 1 1 20 5222 1 1 2 CYS O O 3.441 -0.406 4.146 1.00 . A A . 2 CYS O 1 1 20 5223 1 1 2 CYS SG S 1.414 -0.821 6.829 1.00 . A A . 2 CYS SG 1 1 20 5224 1 1 3 CYS C C 3.446 1.782 2.168 1.00 . A A . 3 CYS C 1 1 20 5225 1 1 3 CYS CA C 2.430 2.022 3.284 1.00 . A A . 3 CYS CA 1 1 20 5226 1 1 3 CYS CB C 1.903 3.453 3.237 1.00 . A A . 3 CYS CB 1 1 20 5227 1 1 3 CYS H H 2.976 2.443 5.287 1.00 . A A . 3 CYS H 1 1 20 5228 1 1 3 CYS HA H 1.605 1.347 3.129 1.00 . A A . 3 CYS HA 1 1 20 5229 1 1 3 CYS HB2 H 2.723 4.140 3.388 1.00 . A A . 3 CYS HB2 1 1 20 5230 1 1 3 CYS HB3 H 1.456 3.635 2.270 1.00 . A A . 3 CYS HB3 1 1 20 5231 1 1 3 CYS N N 2.971 1.735 4.607 1.00 . A A . 3 CYS N 1 1 20 5232 1 1 3 CYS O O 3.073 1.428 1.051 1.00 . A A . 3 CYS O 1 1 20 5233 1 1 3 CYS SG S 0.643 3.802 4.507 1.00 . A A . 3 CYS SG 1 1 20 5234 1 1 4 SER C C 6.239 0.290 1.480 1.00 . A A . 4 SER C 1 1 20 5235 1 1 4 SER CA C 5.759 1.738 1.467 1.00 . A A . 4 SER CA 1 1 20 5236 1 1 4 SER CB C 6.914 2.705 1.690 1.00 . A A . 4 SER CB 1 1 20 5237 1 1 4 SER H H 4.979 2.227 3.374 1.00 . A A . 4 SER H 1 1 20 5238 1 1 4 SER HA H 5.321 1.942 0.500 1.00 . A A . 4 SER HA 1 1 20 5239 1 1 4 SER HB2 H 7.312 2.570 2.685 1.00 . A A . 4 SER HB2 1 1 20 5240 1 1 4 SER HB3 H 7.688 2.520 0.959 1.00 . A A . 4 SER HB3 1 1 20 5241 1 1 4 SER HG H 5.518 4.029 1.353 1.00 . A A . 4 SER HG 1 1 20 5242 1 1 4 SER N N 4.723 1.957 2.464 1.00 . A A . 4 SER N 1 1 20 5243 1 1 4 SER O O 7.040 -0.118 0.642 1.00 . A A . 4 SER O 1 1 20 5244 1 1 4 SER OG O 6.459 4.039 1.551 1.00 . A A . 4 SER OG 1 1 20 5245 1 1 5 ASN C C 5.078 -2.704 1.680 1.00 . A A . 5 ASN C 1 1 20 5246 1 1 5 ASN CA C 6.074 -1.905 2.500 1.00 . A A . 5 ASN CA 1 1 20 5247 1 1 5 ASN CB C 6.071 -2.391 3.954 1.00 . A A . 5 ASN CB 1 1 20 5248 1 1 5 ASN CG C 7.218 -1.836 4.782 1.00 . A A . 5 ASN CG 1 1 20 5249 1 1 5 ASN H H 5.055 -0.123 3.042 1.00 . A A . 5 ASN H 1 1 20 5250 1 1 5 ASN HA H 7.062 -2.032 2.081 1.00 . A A . 5 ASN HA 1 1 20 5251 1 1 5 ASN HB2 H 5.145 -2.091 4.421 1.00 . A A . 5 ASN HB2 1 1 20 5252 1 1 5 ASN HB3 H 6.136 -3.469 3.963 1.00 . A A . 5 ASN HB3 1 1 20 5253 1 1 5 ASN HD21 H 8.004 -0.941 3.191 1.00 . A A . 5 ASN HD21 1 1 20 5254 1 1 5 ASN HD22 H 8.864 -0.734 4.674 1.00 . A A . 5 ASN HD22 1 1 20 5255 1 1 5 ASN N N 5.720 -0.494 2.413 1.00 . A A . 5 ASN N 1 1 20 5256 1 1 5 ASN ND2 N 8.119 -1.096 4.151 1.00 . A A . 5 ASN ND2 1 1 20 5257 1 1 5 ASN O O 3.882 -2.581 1.887 1.00 . A A . 5 ASN O 1 1 20 5258 1 1 5 ASN OD1 O 7.297 -2.079 5.984 1.00 . A A . 5 ASN OD1 1 1 20 5259 1 1 6 PRO C C 3.638 -5.144 0.602 1.00 . A A . 6 PRO C 1 1 20 5260 1 1 6 PRO CA C 4.661 -4.296 -0.156 1.00 . A A . 6 PRO CA 1 1 20 5261 1 1 6 PRO CB C 5.633 -5.190 -0.929 1.00 . A A . 6 PRO CB 1 1 20 5262 1 1 6 PRO CD C 6.968 -3.692 0.374 1.00 . A A . 6 PRO CD 1 1 20 5263 1 1 6 PRO CG C 6.919 -4.436 -0.932 1.00 . A A . 6 PRO CG 1 1 20 5264 1 1 6 PRO HA H 4.136 -3.653 -0.849 1.00 . A A . 6 PRO HA 1 1 20 5265 1 1 6 PRO HB2 H 5.731 -6.139 -0.425 1.00 . A A . 6 PRO HB2 1 1 20 5266 1 1 6 PRO HB3 H 5.265 -5.344 -1.933 1.00 . A A . 6 PRO HB3 1 1 20 5267 1 1 6 PRO HD2 H 7.474 -4.279 1.126 1.00 . A A . 6 PRO HD2 1 1 20 5268 1 1 6 PRO HD3 H 7.457 -2.737 0.245 1.00 . A A . 6 PRO HD3 1 1 20 5269 1 1 6 PRO HG2 H 7.747 -5.126 -1.002 1.00 . A A . 6 PRO HG2 1 1 20 5270 1 1 6 PRO HG3 H 6.936 -3.743 -1.760 1.00 . A A . 6 PRO HG3 1 1 20 5271 1 1 6 PRO N N 5.546 -3.509 0.718 1.00 . A A . 6 PRO N 1 1 20 5272 1 1 6 PRO O O 2.445 -5.089 0.309 1.00 . A A . 6 PRO O 1 1 20 5273 1 1 7 VAL C C 2.237 -5.943 3.175 1.00 . A A . 7 VAL C 1 1 20 5274 1 1 7 VAL CA C 3.215 -6.777 2.355 1.00 . A A . 7 VAL CA 1 1 20 5275 1 1 7 VAL CB C 4.009 -7.698 3.305 1.00 . A A . 7 VAL CB 1 1 20 5276 1 1 7 VAL CG1 C 3.067 -8.530 4.167 1.00 . A A . 7 VAL CG1 1 1 20 5277 1 1 7 VAL CG2 C 4.949 -8.596 2.515 1.00 . A A . 7 VAL CG2 1 1 20 5278 1 1 7 VAL H H 5.062 -5.924 1.764 1.00 . A A . 7 VAL H 1 1 20 5279 1 1 7 VAL HA H 2.656 -7.396 1.668 1.00 . A A . 7 VAL HA 1 1 20 5280 1 1 7 VAL HB H 4.605 -7.079 3.960 1.00 . A A . 7 VAL HB 1 1 20 5281 1 1 7 VAL HG11 H 3.629 -9.013 4.952 1.00 . A A . 7 VAL HG11 1 1 20 5282 1 1 7 VAL HG12 H 2.586 -9.279 3.556 1.00 . A A . 7 VAL HG12 1 1 20 5283 1 1 7 VAL HG13 H 2.316 -7.887 4.604 1.00 . A A . 7 VAL HG13 1 1 20 5284 1 1 7 VAL HG21 H 5.963 -8.438 2.849 1.00 . A A . 7 VAL HG21 1 1 20 5285 1 1 7 VAL HG22 H 4.874 -8.359 1.464 1.00 . A A . 7 VAL HG22 1 1 20 5286 1 1 7 VAL HG23 H 4.675 -9.630 2.671 1.00 . A A . 7 VAL HG23 1 1 20 5287 1 1 7 VAL N N 4.103 -5.923 1.571 1.00 . A A . 7 VAL N 1 1 20 5288 1 1 7 VAL O O 1.033 -6.198 3.180 1.00 . A A . 7 VAL O 1 1 20 5289 1 1 8 CYS C C 0.964 -3.287 3.854 1.00 . A A . 8 CYS C 1 1 20 5290 1 1 8 CYS CA C 1.962 -4.074 4.703 1.00 . A A . 8 CYS CA 1 1 20 5291 1 1 8 CYS CB C 2.867 -3.126 5.490 1.00 . A A . 8 CYS CB 1 1 20 5292 1 1 8 CYS H H 3.737 -4.803 3.817 1.00 . A A . 8 CYS H 1 1 20 5293 1 1 8 CYS HA H 1.414 -4.695 5.398 1.00 . A A . 8 CYS HA 1 1 20 5294 1 1 8 CYS HB2 H 3.826 -3.597 5.637 1.00 . A A . 8 CYS HB2 1 1 20 5295 1 1 8 CYS HB3 H 3.004 -2.218 4.919 1.00 . A A . 8 CYS HB3 1 1 20 5296 1 1 8 CYS N N 2.770 -4.951 3.867 1.00 . A A . 8 CYS N 1 1 20 5297 1 1 8 CYS O O -0.172 -3.065 4.264 1.00 . A A . 8 CYS O 1 1 20 5298 1 1 8 CYS SG S 2.222 -2.657 7.129 1.00 . A A . 8 CYS SG 1 1 20 5299 1 1 9 HIS C C -0.605 -2.945 1.266 1.00 . A A . 9 HIS C 1 1 20 5300 1 1 9 HIS CA C 0.566 -2.106 1.752 1.00 . A A . 9 HIS CA 1 1 20 5301 1 1 9 HIS CB C 1.380 -1.638 0.541 1.00 . A A . 9 HIS CB 1 1 20 5302 1 1 9 HIS CD2 C -0.341 0.255 0.071 1.00 . A A . 9 HIS CD2 1 1 20 5303 1 1 9 HIS CE1 C 0.684 1.208 -1.613 1.00 . A A . 9 HIS CE1 1 1 20 5304 1 1 9 HIS CG C 0.803 -0.437 -0.153 1.00 . A A . 9 HIS CG 1 1 20 5305 1 1 9 HIS H H 2.327 -3.081 2.409 1.00 . A A . 9 HIS H 1 1 20 5306 1 1 9 HIS HA H 0.187 -1.244 2.278 1.00 . A A . 9 HIS HA 1 1 20 5307 1 1 9 HIS HB2 H 2.383 -1.399 0.857 1.00 . A A . 9 HIS HB2 1 1 20 5308 1 1 9 HIS HB3 H 1.424 -2.444 -0.178 1.00 . A A . 9 HIS HB3 1 1 20 5309 1 1 9 HIS HD1 H 2.279 -0.073 -1.611 1.00 . A A . 9 HIS HD1 1 1 20 5310 1 1 9 HIS HD2 H -1.079 0.044 0.833 1.00 . A A . 9 HIS HD2 1 1 20 5311 1 1 9 HIS HE1 H 0.921 1.879 -2.426 1.00 . A A . 9 HIS HE1 1 1 20 5312 1 1 9 HIS HE2 H -1.178 1.842 -1.030 1.00 . A A . 9 HIS HE2 1 1 20 5313 1 1 9 HIS N N 1.403 -2.870 2.672 1.00 . A A . 9 HIS N 1 1 20 5314 1 1 9 HIS ND1 N 1.421 0.187 -1.215 1.00 . A A . 9 HIS ND1 1 1 20 5315 1 1 9 HIS NE2 N -0.391 1.271 -0.851 1.00 . A A . 9 HIS NE2 1 1 20 5316 1 1 9 HIS O O -1.714 -2.446 1.126 1.00 . A A . 9 HIS O 1 1 20 5317 1 1 10 LEU C C -2.428 -5.370 1.575 1.00 . A A . 10 LEU C 1 1 20 5318 1 1 10 LEU CA C -1.368 -5.124 0.504 1.00 . A A . 10 LEU CA 1 1 20 5319 1 1 10 LEU CB C -0.737 -6.452 0.072 1.00 . A A . 10 LEU CB 1 1 20 5320 1 1 10 LEU CD1 C -2.320 -6.936 -1.815 1.00 . A A . 10 LEU CD1 1 1 20 5321 1 1 10 LEU CD2 C -0.996 -8.792 -0.786 1.00 . A A . 10 LEU CD2 1 1 20 5322 1 1 10 LEU CG C -1.708 -7.471 -0.530 1.00 . A A . 10 LEU CG 1 1 20 5323 1 1 10 LEU H H 0.577 -4.545 1.109 1.00 . A A . 10 LEU H 1 1 20 5324 1 1 10 LEU HA H -1.839 -4.664 -0.352 1.00 . A A . 10 LEU HA 1 1 20 5325 1 1 10 LEU HB2 H 0.029 -6.239 -0.660 1.00 . A A . 10 LEU HB2 1 1 20 5326 1 1 10 LEU HB3 H -0.270 -6.900 0.936 1.00 . A A . 10 LEU HB3 1 1 20 5327 1 1 10 LEU HD11 H -1.759 -7.303 -2.662 1.00 . A A . 10 LEU HD11 1 1 20 5328 1 1 10 LEU HD12 H -2.292 -5.856 -1.805 1.00 . A A . 10 LEU HD12 1 1 20 5329 1 1 10 LEU HD13 H -3.345 -7.268 -1.891 1.00 . A A . 10 LEU HD13 1 1 20 5330 1 1 10 LEU HD21 H -0.399 -8.711 -1.682 1.00 . A A . 10 LEU HD21 1 1 20 5331 1 1 10 LEU HD22 H -1.728 -9.576 -0.911 1.00 . A A . 10 LEU HD22 1 1 20 5332 1 1 10 LEU HD23 H -0.357 -9.025 0.053 1.00 . A A . 10 LEU HD23 1 1 20 5333 1 1 10 LEU HG H -2.509 -7.653 0.171 1.00 . A A . 10 LEU HG 1 1 20 5334 1 1 10 LEU N N -0.340 -4.214 0.991 1.00 . A A . 10 LEU N 1 1 20 5335 1 1 10 LEU O O -3.627 -5.281 1.308 1.00 . A A . 10 LEU O 1 1 20 5336 1 1 11 GLU C C -3.614 -4.676 4.303 1.00 . A A . 11 GLU C 1 1 20 5337 1 1 11 GLU CA C -2.873 -5.949 3.899 1.00 . A A . 11 GLU CA 1 1 20 5338 1 1 11 GLU CB C -2.060 -6.508 5.078 1.00 . A A . 11 GLU CB 1 1 20 5339 1 1 11 GLU CD C -3.441 -6.386 7.216 1.00 . A A . 11 GLU CD 1 1 20 5340 1 1 11 GLU CG C -2.879 -7.267 6.116 1.00 . A A . 11 GLU CG 1 1 20 5341 1 1 11 GLU H H -1.006 -5.739 2.926 1.00 . A A . 11 GLU H 1 1 20 5342 1 1 11 GLU HA H -3.591 -6.686 3.583 1.00 . A A . 11 GLU HA 1 1 20 5343 1 1 11 GLU HB2 H -1.308 -7.179 4.691 1.00 . A A . 11 GLU HB2 1 1 20 5344 1 1 11 GLU HB3 H -1.567 -5.685 5.576 1.00 . A A . 11 GLU HB3 1 1 20 5345 1 1 11 GLU HG2 H -3.701 -7.745 5.615 1.00 . A A . 11 GLU HG2 1 1 20 5346 1 1 11 GLU HG3 H -2.249 -8.022 6.567 1.00 . A A . 11 GLU HG3 1 1 20 5347 1 1 11 GLU N N -1.974 -5.682 2.782 1.00 . A A . 11 GLU N 1 1 20 5348 1 1 11 GLU O O -4.844 -4.636 4.351 1.00 . A A . 11 GLU O 1 1 20 5349 1 1 11 GLU OE1 O -3.265 -5.159 7.143 1.00 . A A . 11 GLU OE1 1 1 20 5350 1 1 11 GLU OE2 O -4.048 -6.925 8.160 1.00 . A A . 11 GLU OE2 1 1 20 5351 1 1 12 HIS C C -3.680 -1.475 3.759 1.00 . A A . 12 HIS C 1 1 20 5352 1 1 12 HIS CA C -3.407 -2.347 4.979 1.00 . A A . 12 HIS CA 1 1 20 5353 1 1 12 HIS CB C -2.438 -1.632 5.929 1.00 . A A . 12 HIS CB 1 1 20 5354 1 1 12 HIS CD2 C -1.135 -3.209 7.526 1.00 . A A . 12 HIS CD2 1 1 20 5355 1 1 12 HIS CE1 C -2.508 -3.156 9.226 1.00 . A A . 12 HIS CE1 1 1 20 5356 1 1 12 HIS CG C -2.160 -2.390 7.193 1.00 . A A . 12 HIS CG 1 1 20 5357 1 1 12 HIS H H -1.877 -3.730 4.506 1.00 . A A . 12 HIS H 1 1 20 5358 1 1 12 HIS HA H -4.337 -2.531 5.494 1.00 . A A . 12 HIS HA 1 1 20 5359 1 1 12 HIS HB2 H -1.497 -1.478 5.423 1.00 . A A . 12 HIS HB2 1 1 20 5360 1 1 12 HIS HB3 H -2.855 -0.673 6.200 1.00 . A A . 12 HIS HB3 1 1 20 5361 1 1 12 HIS HD1 H -3.852 -1.907 8.336 1.00 . A A . 12 HIS HD1 1 1 20 5362 1 1 12 HIS HD2 H -0.303 -3.480 6.892 1.00 . A A . 12 HIS HD2 1 1 20 5363 1 1 12 HIS HE1 H -2.959 -3.336 10.191 1.00 . A A . 12 HIS HE1 1 1 20 5364 1 1 12 HIS HE2 H -0.979 -4.495 9.163 1.00 . A A . 12 HIS HE2 1 1 20 5365 1 1 12 HIS N N -2.850 -3.633 4.578 1.00 . A A . 12 HIS N 1 1 20 5366 1 1 12 HIS ND1 N -3.004 -2.381 8.280 1.00 . A A . 12 HIS ND1 1 1 20 5367 1 1 12 HIS NE2 N -1.372 -3.676 8.798 1.00 . A A . 12 HIS NE2 1 1 20 5368 1 1 12 HIS O O -3.451 -0.265 3.786 1.00 . A A . 12 HIS O 1 1 20 5369 1 1 13 SER C C -5.550 -0.352 1.656 1.00 . A A . 13 SER C 1 1 20 5370 1 1 13 SER CA C -4.453 -1.390 1.451 1.00 . A A . 13 SER CA 1 1 20 5371 1 1 13 SER CB C -4.859 -2.387 0.361 1.00 . A A . 13 SER CB 1 1 20 5372 1 1 13 SER H H -4.312 -3.068 2.735 1.00 . A A . 13 SER H 1 1 20 5373 1 1 13 SER HA H -3.552 -0.884 1.142 1.00 . A A . 13 SER HA 1 1 20 5374 1 1 13 SER HB2 H -4.132 -3.184 0.319 1.00 . A A . 13 SER HB2 1 1 20 5375 1 1 13 SER HB3 H -5.829 -2.798 0.597 1.00 . A A . 13 SER HB3 1 1 20 5376 1 1 13 SER HG H -5.154 -2.418 -1.575 1.00 . A A . 13 SER HG 1 1 20 5377 1 1 13 SER N N -4.161 -2.097 2.691 1.00 . A A . 13 SER N 1 1 20 5378 1 1 13 SER O O -5.444 0.774 1.180 1.00 . A A . 13 SER O 1 1 20 5379 1 1 13 SER OG O -4.925 -1.763 -0.910 1.00 . A A . 13 SER OG 1 1 20 5380 1 1 14 ASN C C -7.299 1.356 3.473 1.00 . A A . 14 ASN C 1 1 20 5381 1 1 14 ASN CA C -7.727 0.151 2.635 1.00 . A A . 14 ASN CA 1 1 20 5382 1 1 14 ASN CB C -8.841 -0.611 3.357 1.00 . A A . 14 ASN CB 1 1 20 5383 1 1 14 ASN CG C -10.095 0.225 3.551 1.00 . A A . 14 ASN CG 1 1 20 5384 1 1 14 ASN H H -6.623 -1.654 2.719 1.00 . A A . 14 ASN H 1 1 20 5385 1 1 14 ASN HA H -8.100 0.504 1.688 1.00 . A A . 14 ASN HA 1 1 20 5386 1 1 14 ASN HB2 H -9.103 -1.485 2.779 1.00 . A A . 14 ASN HB2 1 1 20 5387 1 1 14 ASN HB3 H -8.485 -0.921 4.329 1.00 . A A . 14 ASN HB3 1 1 20 5388 1 1 14 ASN HD21 H -9.912 0.108 5.525 1.00 . A A . 14 ASN HD21 1 1 20 5389 1 1 14 ASN HD22 H -11.262 1.013 4.947 1.00 . A A . 14 ASN HD22 1 1 20 5390 1 1 14 ASN N N -6.600 -0.741 2.368 1.00 . A A . 14 ASN N 1 1 20 5391 1 1 14 ASN ND2 N -10.460 0.471 4.801 1.00 . A A . 14 ASN ND2 1 1 20 5392 1 1 14 ASN O O -7.856 2.442 3.347 1.00 . A A . 14 ASN O 1 1 20 5393 1 1 14 ASN OD1 O -10.732 0.639 2.588 1.00 . A A . 14 ASN OD1 1 1 20 5394 1 1 15 LEU C C -4.825 3.113 4.524 1.00 . A A . 15 LEU C 1 1 20 5395 1 1 15 LEU CA C -5.839 2.209 5.218 1.00 . A A . 15 LEU CA 1 1 20 5396 1 1 15 LEU CB C -5.220 1.608 6.482 1.00 . A A . 15 LEU CB 1 1 20 5397 1 1 15 LEU CD1 C -5.436 0.189 8.537 1.00 . A A . 15 LEU CD1 1 1 20 5398 1 1 15 LEU CD2 C -7.368 1.583 7.780 1.00 . A A . 15 LEU CD2 1 1 20 5399 1 1 15 LEU CG C -6.168 0.760 7.333 1.00 . A A . 15 LEU CG 1 1 20 5400 1 1 15 LEU H H -5.926 0.257 4.405 1.00 . A A . 15 LEU H 1 1 20 5401 1 1 15 LEU HA H -6.686 2.806 5.501 1.00 . A A . 15 LEU HA 1 1 20 5402 1 1 15 LEU HB2 H -4.383 0.991 6.187 1.00 . A A . 15 LEU HB2 1 1 20 5403 1 1 15 LEU HB3 H -4.849 2.417 7.095 1.00 . A A . 15 LEU HB3 1 1 20 5404 1 1 15 LEU HD11 H -5.716 0.740 9.423 1.00 . A A . 15 LEU HD11 1 1 20 5405 1 1 15 LEU HD12 H -4.370 0.273 8.384 1.00 . A A . 15 LEU HD12 1 1 20 5406 1 1 15 LEU HD13 H -5.702 -0.850 8.661 1.00 . A A . 15 LEU HD13 1 1 20 5407 1 1 15 LEU HD21 H -7.392 1.626 8.859 1.00 . A A . 15 LEU HD21 1 1 20 5408 1 1 15 LEU HD22 H -8.275 1.122 7.417 1.00 . A A . 15 LEU HD22 1 1 20 5409 1 1 15 LEU HD23 H -7.287 2.583 7.381 1.00 . A A . 15 LEU HD23 1 1 20 5410 1 1 15 LEU HG H -6.531 -0.068 6.740 1.00 . A A . 15 LEU HG 1 1 20 5411 1 1 15 LEU N N -6.323 1.147 4.343 1.00 . A A . 15 LEU N 1 1 20 5412 1 1 15 LEU O O -4.921 4.336 4.595 1.00 . A A . 15 LEU O 1 1 20 5413 1 1 16 CYS C C -3.248 3.850 1.879 1.00 . A A . 16 CYS C 1 1 20 5414 1 1 16 CYS CA C -2.791 3.264 3.209 1.00 . A A . 16 CYS CA 1 1 20 5415 1 1 16 CYS CB C -1.557 2.392 2.989 1.00 . A A . 16 CYS CB 1 1 20 5416 1 1 16 CYS H H -3.806 1.528 3.882 1.00 . A A . 16 CYS H 1 1 20 5417 1 1 16 CYS HA H -2.516 4.081 3.859 1.00 . A A . 16 CYS HA 1 1 20 5418 1 1 16 CYS HB2 H -1.870 1.418 2.645 1.00 . A A . 16 CYS HB2 1 1 20 5419 1 1 16 CYS HB3 H -0.932 2.849 2.235 1.00 . A A . 16 CYS HB3 1 1 20 5420 1 1 16 CYS N N -3.840 2.508 3.884 1.00 . A A . 16 CYS N 1 1 20 5421 1 1 16 CYS O O -2.852 4.960 1.520 1.00 . A A . 16 CYS O 1 1 20 5422 1 1 16 CYS SG S -0.538 2.150 4.479 1.00 . A A . 16 CYS SG 1 1 20 5423 1 1 17 GLY C C -3.340 3.788 -1.102 1.00 . A A . 17 GLY C 1 1 20 5424 1 1 17 GLY CA C -4.506 3.579 -0.157 1.00 . A A . 17 GLY CA 1 1 20 5425 1 1 17 GLY H H -4.329 2.215 1.452 1.00 . A A . 17 GLY H 1 1 20 5426 1 1 17 GLY HA2 H -5.184 2.853 -0.584 1.00 . A A . 17 GLY HA2 1 1 20 5427 1 1 17 GLY HA3 H -5.025 4.516 -0.027 1.00 . A A . 17 GLY HA3 1 1 20 5428 1 1 17 GLY N N -4.052 3.102 1.133 1.00 . A A . 17 GLY N 1 1 20 5429 1 1 17 GLY O O -2.519 2.886 -1.292 1.00 . A A . 17 GLY O 1 1 20 5430 1 1 18 ALA C C -0.981 5.931 -1.802 1.00 . A A . 18 ALA C 1 1 20 5431 1 1 18 ALA CA C -2.146 5.309 -2.572 1.00 . A A . 18 ALA CA 1 1 20 5432 1 1 18 ALA CB C -2.629 6.252 -3.666 1.00 . A A . 18 ALA CB 1 1 20 5433 1 1 18 ALA H H -3.909 5.667 -1.458 1.00 . A A . 18 ALA H 1 1 20 5434 1 1 18 ALA HA H -1.811 4.393 -3.038 1.00 . A A . 18 ALA HA 1 1 20 5435 1 1 18 ALA HB1 H -3.413 5.774 -4.233 1.00 . A A . 18 ALA HB1 1 1 20 5436 1 1 18 ALA HB2 H -1.805 6.492 -4.322 1.00 . A A . 18 ALA HB2 1 1 20 5437 1 1 18 ALA HB3 H -3.008 7.158 -3.218 1.00 . A A . 18 ALA HB3 1 1 20 5438 1 1 18 ALA N N -3.242 4.981 -1.668 1.00 . A A . 18 ALA N 1 1 20 5439 1 1 18 ALA O O -0.153 6.641 -2.369 1.00 . A A . 18 ALA O 1 1 20 5440 1 1 19 GLY C C 1.474 5.572 0.058 1.00 . A A . 19 GLY C 1 1 20 5441 1 1 19 GLY CA C 0.118 6.191 0.342 1.00 . A A . 19 GLY CA 1 1 20 5442 1 1 19 GLY H H -1.629 5.090 -0.108 1.00 . A A . 19 GLY H 1 1 20 5443 1 1 19 GLY HA2 H 0.183 7.257 0.185 1.00 . A A . 19 GLY HA2 1 1 20 5444 1 1 19 GLY HA3 H -0.139 6.007 1.374 1.00 . A A . 19 GLY HA3 1 1 20 5445 1 1 19 GLY N N -0.934 5.658 -0.502 1.00 . A A . 19 GLY N 1 1 20 5446 1 1 19 GLY O O 1.577 4.371 -0.201 1.00 . A A . 19 GLY O 1 1 20 5447 1 1 20 GLY C C 4.885 6.925 0.369 1.00 . A A . 20 GLY C 1 1 20 5448 1 1 20 GLY CA C 3.859 5.931 -0.130 1.00 . A A . 20 GLY CA 1 1 20 5449 1 1 20 GLY H H 2.357 7.340 0.333 1.00 . A A . 20 GLY H 1 1 20 5450 1 1 20 GLY HA2 H 4.004 4.988 0.377 1.00 . A A . 20 GLY HA2 1 1 20 5451 1 1 20 GLY HA3 H 3.996 5.787 -1.191 1.00 . A A . 20 GLY HA3 1 1 20 5452 1 1 20 GLY N N 2.509 6.397 0.116 1.00 . A A . 20 GLY N 1 1 20 5453 1 1 20 GLY O O 4.748 7.443 1.475 1.00 . A A . 20 GLY O 1 1 20 5454 1 1 21 ALA C C 7.646 7.795 1.212 1.00 . A A . 21 ALA C 1 1 20 5455 1 1 21 ALA CA C 6.962 8.150 -0.110 1.00 . A A . 21 ALA CA 1 1 20 5456 1 1 21 ALA CB C 6.411 9.571 -0.068 1.00 . A A . 21 ALA CB 1 1 20 5457 1 1 21 ALA H H 5.933 6.751 -1.322 1.00 . A A . 21 ALA H 1 1 20 5458 1 1 21 ALA HA H 7.702 8.108 -0.897 1.00 . A A . 21 ALA HA 1 1 20 5459 1 1 21 ALA HB1 H 5.333 9.540 -0.121 1.00 . A A . 21 ALA HB1 1 1 20 5460 1 1 21 ALA HB2 H 6.798 10.132 -0.906 1.00 . A A . 21 ALA HB2 1 1 20 5461 1 1 21 ALA HB3 H 6.712 10.046 0.854 1.00 . A A . 21 ALA HB3 1 1 20 5462 1 1 21 ALA N N 5.901 7.197 -0.452 1.00 . A A . 21 ALA N 1 1 20 5463 1 1 21 ALA O O 7.818 8.651 2.079 1.00 . A A . 21 ALA O 1 1 20 5464 1 1 22 ALA C C 7.801 6.162 3.783 1.00 . A A . 22 ALA C 1 1 20 5465 1 1 22 ALA CA C 8.691 6.016 2.551 1.00 . A A . 22 ALA CA 1 1 20 5466 1 1 22 ALA CB C 10.034 6.706 2.765 1.00 . A A . 22 ALA CB 1 1 20 5467 1 1 22 ALA H H 7.848 5.902 0.615 1.00 . A A . 22 ALA H 1 1 20 5468 1 1 22 ALA HA H 8.879 4.964 2.394 1.00 . A A . 22 ALA HA 1 1 20 5469 1 1 22 ALA HB1 H 10.228 6.794 3.824 1.00 . A A . 22 ALA HB1 1 1 20 5470 1 1 22 ALA HB2 H 10.008 7.689 2.321 1.00 . A A . 22 ALA HB2 1 1 20 5471 1 1 22 ALA HB3 H 10.815 6.122 2.302 1.00 . A A . 22 ALA HB3 1 1 20 5472 1 1 22 ALA N N 8.025 6.524 1.348 1.00 . A A . 22 ALA N 1 1 20 5473 1 1 22 ALA O O 8.277 6.404 4.891 1.00 . A A . 22 ALA O 1 1 20 5474 1 1 23 GLY C C 5.447 4.820 5.479 1.00 . A A . 23 GLY C 1 1 20 5475 1 1 23 GLY CA C 5.542 6.092 4.656 1.00 . A A . 23 GLY CA 1 1 20 5476 1 1 23 GLY H H 6.195 5.787 2.668 1.00 . A A . 23 GLY H 1 1 20 5477 1 1 23 GLY HA2 H 5.833 6.905 5.305 1.00 . A A . 23 GLY HA2 1 1 20 5478 1 1 23 GLY HA3 H 4.570 6.310 4.239 1.00 . A A . 23 GLY HA3 1 1 20 5479 1 1 23 GLY N N 6.502 5.992 3.574 1.00 . A A . 23 GLY N 1 1 20 5480 1 1 23 GLY O O 4.347 4.359 5.792 1.00 . A A . 23 GLY O 1 1 stop_ save_
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