NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
537744 | 2ler | 17726 | cing | 4-filtered-FRED | STAR | entry | full | 124 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2ler # This FRED archive file contains, for PDB entry <2ler>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396. save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.PDB_coordinate_file_version . _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_2ler _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2ler _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 1261.52 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 $Conotoxin_pc16a A . 1 1 stop_ save_ save_Conotoxin_pc16a _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Conotoxin pc16a" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code SCSCKRNFLCC _Entity.Number_of_monomers 11 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 SER . 1 1 2 CYS . 1 1 3 SER . 1 1 4 CYS . 1 1 5 LYS . 1 1 6 ARG . 1 1 7 ASN . 1 1 8 PHE . 1 1 9 LEU . 1 1 10 CYS . 1 1 11 CYS . 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 SER 1 1 1 1 CYS 2 2 1 1 SER 3 3 1 1 CYS 4 4 1 1 LYS 5 5 1 1 ARG 6 6 1 1 ASN 7 7 1 1 PHE 8 8 1 1 LEU 9 9 1 1 CYS 10 10 1 1 CYS 11 11 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 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 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 SER HB2 . 1 . HB2 1 1 1 1 2 1 1 2 CYS H . 2 . HN 1 1 2 1 1 1 1 1 SER HB3 . 1 . HB1 1 1 2 1 2 1 1 2 CYS H . 2 . HN 1 1 3 1 1 1 1 1 SER HB3 . 1 . HB1 1 1 3 1 2 1 1 11 CYS HA . 11 . HA 1 1 4 1 1 1 1 2 CYS H . 2 . HN 1 1 4 1 2 1 1 2 CYS HA . 2 . HA 1 1 5 1 1 1 1 2 CYS H . 2 . HN 1 1 5 1 2 1 1 2 CYS HB2 . 2 . HB2 1 1 6 1 1 1 1 2 CYS H . 2 . HN 1 1 6 1 2 1 1 2 CYS HB3 . 2 . HB1 1 1 7 1 1 1 1 2 CYS HA . 2 . HA 1 1 7 1 2 1 1 2 CYS HB2 . 2 . HB2 1 1 8 1 1 1 1 2 CYS HA . 2 . HA 1 1 8 1 2 1 1 2 CYS HB3 . 2 . HB1 1 1 9 1 1 1 1 2 CYS HA . 2 . HA 1 1 9 1 2 1 1 3 SER H . 3 . HN 1 1 10 1 1 1 1 2 CYS HB3 . 2 . HB1 1 1 10 1 2 1 1 3 SER H . 3 . HN 1 1 11 1 1 1 1 3 SER H . 3 . HN 1 1 11 1 2 1 1 3 SER HA . 3 . HA 1 1 12 1 1 1 1 3 SER H . 3 . HN 1 1 12 1 2 1 1 3 SER HB2 . 3 . HB2 1 1 13 1 1 1 1 3 SER H . 3 . HN 1 1 13 1 2 1 1 3 SER HB3 . 3 . HB1 1 1 14 1 1 1 1 3 SER HA . 3 . HA 1 1 14 1 2 1 1 3 SER HB2 . 3 . HB2 1 1 15 1 1 1 1 3 SER HA . 3 . HA 1 1 15 1 2 1 1 3 SER HB3 . 3 . HB1 1 1 16 1 1 1 1 3 SER HA . 3 . HA 1 1 16 1 2 1 1 4 CYS H . 4 . HN 1 1 17 1 1 1 1 3 SER HB2 . 3 . HB2 1 1 17 1 2 1 1 4 CYS H . 4 . HN 1 1 18 1 1 1 1 3 SER HB2 . 3 . HB2 1 1 18 1 2 1 1 5 LYS HB2 . 5 . HB2 1 1 19 1 1 1 1 3 SER HB2 . 3 . HB2 1 1 19 1 2 1 1 6 ARG QG . 6 . HG1 1 1 20 1 1 1 1 3 SER HB3 . 3 . HB1 1 1 20 1 2 1 1 4 CYS H . 4 . HN 1 1 21 1 1 1 1 4 CYS H . 4 . HN 1 1 21 1 2 1 1 4 CYS HB2 . 4 . HB2 1 1 22 1 1 1 1 4 CYS H . 4 . HN 1 1 22 1 2 1 1 4 CYS HB3 . 4 . HB1 1 1 23 1 1 1 1 4 CYS HA . 4 . HA 1 1 23 1 2 1 1 4 CYS HB2 . 4 . HB2 1 1 24 1 1 1 1 4 CYS HA . 4 . HA 1 1 24 1 2 1 1 4 CYS HB3 . 4 . HB1 1 1 25 1 1 1 1 4 CYS HA . 4 . HA 1 1 25 1 2 1 1 5 LYS H . 5 . HN 1 1 26 1 1 1 1 4 CYS HA . 4 . HA 1 1 26 1 2 1 1 7 ASN H . 7 . HN 1 1 27 1 1 1 1 4 CYS HA . 4 . HA 1 1 27 1 2 1 1 10 CYS H . 10 . HN 1 1 28 1 1 1 1 4 CYS HA . 4 . HA 1 1 28 1 2 1 1 10 CYS HB2 . 10 . HB2 1 1 29 1 1 1 1 4 CYS HA . 4 . HA 1 1 29 1 2 1 1 11 CYS H . 11 . HN 1 1 30 1 1 1 1 4 CYS HB2 . 4 . HB2 1 1 30 1 2 1 1 5 LYS H . 5 . HN 1 1 31 1 1 1 1 4 CYS HB3 . 4 . HB1 1 1 31 1 2 1 1 5 LYS H . 5 . HN 1 1 32 1 1 1 1 5 LYS H . 5 . HN 1 1 32 1 2 1 1 5 LYS HB2 . 5 . HB2 1 1 33 1 1 1 1 5 LYS H . 5 . HN 1 1 33 1 2 1 1 5 LYS HB3 . 5 . HB1 1 1 34 1 1 1 1 5 LYS H . 5 . HN 1 1 34 1 2 1 1 5 LYS QE . 5 . HE2 1 1 35 1 1 1 1 5 LYS H . 5 . HN 1 1 35 1 2 1 1 5 LYS QG . 5 . HG2 1 1 36 1 1 1 1 5 LYS H . 5 . HN 1 1 36 1 2 1 1 5 LYS QZ . 5 . HZ1 1 1 37 1 1 1 1 5 LYS HA . 5 . HA 1 1 37 1 2 1 1 5 LYS QE . 5 . HE2 1 1 38 1 1 1 1 5 LYS HA . 5 . HA 1 1 38 1 2 1 1 5 LYS QG . 5 . HG2 1 1 39 1 1 1 1 5 LYS HA . 5 . HA 1 1 39 1 2 1 1 5 LYS QZ . 5 . HZ1 1 1 40 1 1 1 1 5 LYS HB2 . 5 . HB2 1 1 40 1 2 1 1 5 LYS QG . 5 . HG2 1 1 41 1 1 1 1 5 LYS HB3 . 5 . HB1 1 1 41 1 2 1 1 5 LYS QG . 5 . HG2 1 1 42 1 1 1 1 5 LYS QE . 5 . HE2 1 1 42 1 2 1 1 5 LYS QZ . 5 . HZ1 1 1 43 1 1 1 1 6 ARG H . 6 . HN 1 1 43 1 2 1 1 6 ARG HA . 6 . HA 1 1 44 1 1 1 1 6 ARG H . 6 . HN 1 1 44 1 2 1 1 6 ARG HB3 . 6 . HB1 1 1 45 1 1 1 1 6 ARG H . 6 . HN 1 1 45 1 2 1 1 6 ARG QD . 6 . HD2 1 1 46 1 1 1 1 6 ARG H . 6 . HN 1 1 46 1 2 1 1 6 ARG QG . 6 . HG1 1 1 47 1 1 1 1 6 ARG HA . 6 . HA 1 1 47 1 2 1 1 6 ARG HB2 . 6 . HB2 1 1 48 1 1 1 1 6 ARG HA . 6 . HA 1 1 48 1 2 1 1 6 ARG QD . 6 . HD2 1 1 49 1 1 1 1 6 ARG HA . 6 . HA 1 1 49 1 2 1 1 6 ARG QG . 6 . HG1 1 1 50 1 1 1 1 6 ARG HA . 6 . HA 1 1 50 1 2 1 1 7 ASN H . 7 . HN 1 1 51 1 1 1 1 6 ARG HB2 . 6 . HB2 1 1 51 1 2 1 1 6 ARG QD . 6 . HD2 1 1 52 1 1 1 1 6 ARG HB2 . 6 . HB2 1 1 52 1 2 1 1 6 ARG QG . 6 . HG1 1 1 53 1 1 1 1 6 ARG HB3 . 6 . HB1 1 1 53 1 2 1 1 6 ARG QD . 6 . HD2 1 1 54 1 1 1 1 6 ARG HB3 . 6 . HB1 1 1 54 1 2 1 1 6 ARG QG . 6 . HG1 1 1 55 1 1 1 1 6 ARG QG . 6 . HG1 1 1 55 1 2 1 1 7 ASN H . 7 . HN 1 1 56 1 1 1 1 7 ASN H . 7 . HN 1 1 56 1 2 1 1 7 ASN HA . 7 . HA 1 1 57 1 1 1 1 7 ASN H . 7 . HN 1 1 57 1 2 1 1 7 ASN HB2 . 7 . HB2 1 1 58 1 1 1 1 7 ASN H . 7 . HN 1 1 58 1 2 1 1 7 ASN HB3 . 7 . HB1 1 1 59 1 1 1 1 7 ASN H . 7 . HN 1 1 59 1 2 1 1 10 CYS HB2 . 10 . HB2 1 1 60 1 1 1 1 7 ASN H . 7 . HN 1 1 60 1 2 1 1 10 CYS HB3 . 10 . HB1 1 1 61 1 1 1 1 7 ASN HA . 7 . HA 1 1 61 1 2 1 1 7 ASN HB2 . 7 . HB2 1 1 62 1 1 1 1 7 ASN HA . 7 . HA 1 1 62 1 2 1 1 7 ASN HB3 . 7 . HB1 1 1 63 1 1 1 1 7 ASN HB2 . 7 . HB2 1 1 63 1 2 1 1 8 PHE H . 8 . HN 1 1 64 1 1 1 1 7 ASN HB3 . 7 . HB1 1 1 64 1 2 1 1 8 PHE H . 8 . HN 1 1 65 1 1 1 1 7 ASN HB3 . 7 . HB1 1 1 65 1 2 1 1 9 LEU H . 9 . HN 1 1 66 1 1 1 1 7 ASN HB3 . 7 . HB1 1 1 66 1 2 1 1 10 CYS H . 10 . HN 1 1 67 1 1 1 1 8 PHE H . 8 . HN 1 1 67 1 2 1 1 8 PHE HA . 8 . HA 1 1 68 1 1 1 1 8 PHE H . 8 . HN 1 1 68 1 2 1 1 8 PHE HB2 . 8 . HB2 1 1 69 1 1 1 1 8 PHE H . 8 . HN 1 1 69 1 2 1 1 8 PHE HB3 . 8 . HB1 1 1 70 1 1 1 1 8 PHE H . 8 . HN 1 1 70 1 2 1 1 8 PHE QD . 8 . HD1 1 1 71 1 1 1 1 8 PHE H . 8 . HN 1 1 71 1 2 1 1 8 PHE QE . 8 . HE1 1 1 72 1 1 1 1 8 PHE H . 8 . HN 1 1 72 1 2 1 1 9 LEU H . 9 . HN 1 1 73 1 1 1 1 8 PHE H . 8 . HN 1 1 73 1 2 1 1 9 LEU HA . 9 . HA 1 1 74 1 1 1 1 8 PHE H . 8 . HN 1 1 74 1 2 1 1 10 CYS H . 10 . HN 1 1 75 1 1 1 1 8 PHE HA . 8 . HA 1 1 75 1 2 1 1 8 PHE HB2 . 8 . HB2 1 1 76 1 1 1 1 8 PHE HA . 8 . HA 1 1 76 1 2 1 1 8 PHE HB3 . 8 . HB1 1 1 77 1 1 1 1 8 PHE HA . 8 . HA 1 1 77 1 2 1 1 9 LEU H . 9 . HN 1 1 78 1 1 1 1 8 PHE HA . 8 . HA 1 1 78 1 2 1 1 9 LEU HA . 9 . HA 1 1 79 1 1 1 1 8 PHE HA . 8 . HA 1 1 79 1 2 1 1 11 CYS H . 11 . HN 1 1 80 1 1 1 1 8 PHE HB2 . 8 . HB2 1 1 80 1 2 1 1 8 PHE QD . 8 . HD1 1 1 81 1 1 1 1 8 PHE HB2 . 8 . HB2 1 1 81 1 2 1 1 9 LEU H . 9 . HN 1 1 82 1 1 1 1 8 PHE HB3 . 8 . HB1 1 1 82 1 2 1 1 8 PHE QD . 8 . HD1 1 1 83 1 1 1 1 8 PHE HB3 . 8 . HB1 1 1 83 1 2 1 1 8 PHE QE . 8 . HE1 1 1 84 1 1 1 1 8 PHE QD . 8 . HD1 1 1 84 1 2 1 1 9 LEU HG . 9 . HG 1 1 85 1 1 1 1 8 PHE QE . 8 . HE1 1 1 85 1 2 1 1 9 LEU QD . 9 . HD2# 1 1 86 1 1 1 1 9 LEU H . 9 . HN 1 1 86 1 2 1 1 9 LEU QB . 9 . HB1 1 1 87 1 1 1 1 9 LEU H . 9 . HN 1 1 87 1 2 1 1 9 LEU QD . 9 . HD1# 1 1 88 1 1 1 1 9 LEU H . 9 . HN 1 1 88 1 2 1 1 9 LEU HG . 9 . HG 1 1 89 1 1 1 1 9 LEU H . 9 . HN 1 1 89 1 2 1 1 10 CYS H . 10 . HN 1 1 90 1 1 1 1 9 LEU HA . 9 . HA 1 1 90 1 2 1 1 9 LEU QD . 9 . HD2# 1 1 91 1 1 1 1 9 LEU HA . 9 . HA 1 1 91 1 2 1 1 9 LEU HG . 9 . HG 1 1 92 1 1 1 1 9 LEU HA . 9 . HA 1 1 92 1 2 1 1 10 CYS H . 10 . HN 1 1 93 1 1 1 1 9 LEU HA . 9 . HA 1 1 93 1 2 1 1 11 CYS H . 11 . HN 1 1 94 1 1 1 1 9 LEU QB . 9 . HB1 1 1 94 1 2 1 1 10 CYS H . 10 . HN 1 1 95 1 1 1 1 9 LEU MD1 . 9 . HD1# 1 1 95 1 2 1 1 9 LEU MD2 . 9 . HD2# 1 1 96 1 1 1 1 9 LEU QD . 9 . HD2# 1 1 96 1 2 1 1 9 LEU HG . 9 . HG 1 1 97 1 1 1 1 10 CYS H . 10 . HN 1 1 97 1 2 1 1 10 CYS HA . 10 . HA 1 1 98 1 1 1 1 10 CYS H . 10 . HN 1 1 98 1 2 1 1 10 CYS HB2 . 10 . HB2 1 1 99 1 1 1 1 10 CYS H . 10 . HN 1 1 99 1 2 1 1 10 CYS HB3 . 10 . HB1 1 1 100 1 1 1 1 10 CYS H . 10 . HN 1 1 100 1 2 1 1 11 CYS H . 11 . HN 1 1 101 1 1 1 1 10 CYS H . 10 . HN 1 1 101 1 2 1 1 11 CYS HB3 . 11 . HB1 1 1 102 1 1 1 1 10 CYS HA . 10 . HA 1 1 102 1 2 1 1 10 CYS HB2 . 10 . HB2 1 1 103 1 1 1 1 10 CYS HA . 10 . HA 1 1 103 1 2 1 1 10 CYS HB3 . 10 . HB1 1 1 104 1 1 1 1 10 CYS HB2 . 10 . HB2 1 1 104 1 2 1 1 11 CYS H . 11 . HN 1 1 105 1 1 1 1 10 CYS HB3 . 10 . HB1 1 1 105 1 2 1 1 11 CYS H . 11 . HN 1 1 106 1 1 1 1 11 CYS H . 11 . HN 1 1 106 1 2 1 1 11 CYS HA . 11 . HA 1 1 107 1 1 1 1 11 CYS H . 11 . HN 1 1 107 1 2 1 1 11 CYS HB2 . 11 . HB2 1 1 108 1 1 1 1 11 CYS H . 11 . HN 1 1 108 1 2 1 1 11 CYS HB3 . 11 . HB1 1 1 109 1 1 1 1 11 CYS HA . 11 . HA 1 1 109 1 2 1 1 11 CYS HB2 . 11 . HB2 1 1 110 1 1 1 1 11 CYS HA . 11 . HA 1 1 110 1 2 1 1 11 CYS HB3 . 11 . HB1 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . . 3.5 4.0 1 1 2 1 . . . . . 2.7 2.4 3.2 1 1 3 1 . . . . . 3.8 3.0 4.2 1 1 4 1 . . . . . 3.0 2.4 3.6 1 1 5 1 . . . . . 3.4 2.7 4.1 1 1 6 1 . . . . . 3.6 3.0 4.3 1 1 7 1 . . . . . 2.9 2.3 3.5 1 1 8 1 . . . . . 3.1 2.5 3.7 1 1 9 1 . . . . . 2.6 2.1 3.1 1 1 10 1 . . . . . 3.7 3.2 4.4 1 1 11 1 . . . . . . 2.6 3.2 1 1 12 1 . . . . . 3.1 2.5 3.5 1 1 13 1 . . . . . 3.0 2.5 3.6 1 1 14 1 . . . . . . 2.8 3.1 1 1 15 1 . . . . . 2.7 2.5 3.2 1 1 16 1 . . . . . 3.1 2.1 4.1 1 1 17 1 . . . . . 4.2 3.4 5.0 1 1 18 1 . . . . . 3.4 2.8 4.1 1 1 19 1 . . . . . 3.4 3.4 3.8 1 1 20 1 . . . . . 3.8 3.0 4.4 1 1 21 1 . . . . . 2.6 2.3 3.1 1 1 22 1 . . . . . 2.6 2.4 3.1 1 1 23 1 . . . . . 3.0 2.4 3.4 1 1 24 1 . . . . . 3.2 2.6 3.8 1 1 25 1 . . . . . . 3.6 4.0 1 1 26 1 . . . . . . 4.1 4.7 1 1 27 1 . . . . . 4.4 3.5 5.3 1 1 28 1 . . . . . 4.2 3.4 4.6 1 1 29 1 . . . . . . 4.7 5.3 1 1 30 1 . . . . . 3.1 2.7 3.7 1 1 31 1 . . . . . 3.8 3.1 4.6 1 1 32 1 . . . . . 3.0 2.0 4.0 1 1 33 1 . . . . . 3.0 2.0 4.0 1 1 34 1 . . . . . 4.5 3.6 5.4 1 1 35 1 . . . . . . 3.6 4.4 1 1 36 1 . . . . . . 4.2 5.2 1 1 37 1 . . . . . 4.2 3.4 5.0 1 1 38 1 . . . . . 3.8 3.0 3.8 1 1 39 1 . . . . . 5.5 4.4 6.6 1 1 40 1 . . . . . 2.2 1.9 2.6 1 1 41 1 . . . . . 2.6 2.1 2.8 1 1 42 1 . . . . . 2.5 2.1 3.0 1 1 43 1 . . . . . 3.1 2.6 3.7 1 1 44 1 . . . . . 4.2 3.4 5.0 1 1 45 1 . . . . . 2.9 2.3 3.5 1 1 46 1 . . . . . 3.6 3.3 4.0 1 1 47 1 . . . . . 3.6 2.9 4.3 1 1 48 1 . . . . . 4.2 3.6 5.0 1 1 49 1 . . . . . 2.9 2.6 3.5 1 1 50 1 . . . . . 4.3 3.4 4.4 1 1 51 1 . . . . . 2.4 1.9 2.8 1 1 52 1 . . . . . 2.1 2.1 2.5 1 1 53 1 . . . . . 2.4 2.0 2.9 1 1 54 1 . . . . . 2.2 2.0 2.6 1 1 55 1 . . . . . 3.9 3.6 4.6 1 1 56 1 . . . . . 3.2 2.6 3.8 1 1 57 1 . . . . . 3.6 3.0 4.3 1 1 58 1 . . . . . 3.4 2.7 4.1 1 1 59 1 . . . . . 5.2 4.2 5.4 1 1 60 1 . . . . . 5.2 4.2 6.1 1 1 61 1 . . . . . . 3.0 3.6 1 1 62 1 . . . . . 3.0 2.4 3.1 1 1 63 1 . . . . . 5.3 4.2 5.8 1 1 64 1 . . . . . 4.7 3.8 5.6 1 1 65 1 . . . . . 4.2 3.4 5.0 1 1 66 1 . . . . . . 4.0 4.6 1 1 67 1 . . . . . 2.7 2.2 3.2 1 1 68 1 . . . . . 3.2 2.6 3.7 1 1 69 1 . . . . . 3.3 2.6 3.7 1 1 70 1 . . . . . 3.3 3.0 4.0 1 1 71 1 . . . . . 4.1 3.9 4.9 1 1 72 1 . . . . . 3.5 2.8 4.2 1 1 73 1 . . . . . 5.0 4.0 6.0 1 1 74 1 . . . . . 3.5 2.8 4.2 1 1 75 1 . . . . . 2.8 2.2 3.4 1 1 76 1 . . . . . 3.0 2.0 4.0 1 1 77 1 . . . . . 2.8 2.0 3.6 1 1 78 1 . . . . . 3.6 2.6 4.6 1 1 79 1 . . . . . 4.6 3.7 5.5 1 1 80 1 . . . . . 3.6 2.9 3.6 1 1 81 1 . . . . . 4.0 3.2 4.8 1 1 82 1 . . . . . 3.1 2.7 3.7 1 1 83 1 . . . . . 3.9 3.1 4.7 1 1 84 1 . . . . . 4.8 3.8 5.8 1 1 85 1 . . . . . 3.4 2.7 4.1 1 1 86 1 . . . . . . 3.3 3.5 1 1 87 1 . . . . . . 4.1 4.2 1 1 88 1 . . . . . 3.0 2.6 3.6 1 1 89 1 . . . . . 3.0 2.4 3.6 1 1 90 1 . . . . . 4.0 3.5 4.5 1 1 91 1 . . . . . 3.7 3.0 4.4 1 1 92 1 . . . . . 3.6 2.9 4.3 1 1 93 1 . . . . . 4.6 3.7 4.9 1 1 94 1 . . . . . 3.8 3.0 4.6 1 1 95 1 . . . . . 2.5 2.2 3.0 1 1 96 1 . . . . . 1.9 1.5 2.3 1 1 97 1 . . . . . 3.7 3.0 4.4 1 1 98 1 . . . . . 3.3 2.6 3.5 1 1 99 1 . . . . . 3.5 2.8 4.1 1 1 100 1 . . . . . 3.0 2.4 3.6 1 1 101 1 . . . . . 5.3 4.2 6.4 1 1 102 1 . . . . . 2.7 2.3 3.2 1 1 103 1 . . . . . 3.2 2.6 3.6 1 1 104 1 . . . . . . 4.0 4.7 1 1 105 1 . . . . . 4.1 3.5 4.9 1 1 106 1 . . . . . . 2.6 3.2 1 1 107 1 . . . . . 3.0 2.4 3.6 1 1 108 1 . . . . . 3.7 3.0 4.4 1 1 109 1 . . . . . 3.3 2.6 4.0 1 1 110 1 . . . . . 3.5 2.8 4.2 1 1 stop_ save_ save_CNS/XPLOR_dihedral_3 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 1 1 3 SER H 1 1 3 SER N 1 1 3 SER CA 1 1 3 SER HA -150.0 -89.99999 . 3 . HN . 3 . N . 3 . CA . 3 . HA 1 1 2 . 1 1 2 CYS H 1 1 2 CYS N 1 1 2 CYS CA 1 1 2 CYS HA -150.0 -89.99999 . 2 . HN . 2 . N . 2 . CA . 2 . HA 1 1 3 . 1 1 4 CYS H 1 1 4 CYS N 1 1 4 CYS CA 1 1 4 CYS HA -150.0 -89.99999 . 4 . HN . 4 . N . 4 . CA . 4 . HA 1 1 4 . 1 1 6 ARG H 1 1 6 ARG N 1 1 6 ARG CA 1 1 6 ARG HA -150.0 -89.99999 . 6 . HN . 6 . N . 6 . CA . 6 . HA 1 1 5 . 1 1 7 ASN H 1 1 7 ASN N 1 1 7 ASN CA 1 1 7 ASN HA -150.0 -89.99999 . 7 . HN . 7 . N . 7 . CA . 7 . HA 1 1 6 . 1 1 9 LEU H 1 1 9 LEU N 1 1 9 LEU CA 1 1 9 LEU HA -150.0 -89.99999 . 9 . HN . 9 . N . 9 . CA . 9 . HA 1 1 7 . 1 1 10 CYS H 1 1 10 CYS N 1 1 10 CYS CA 1 1 10 CYS HA -150.0 -89.99999 . 10 . HN . 10 . N . 10 . CA . 10 . HA 1 1 8 . 1 1 11 CYS H 1 1 11 CYS N 1 1 11 CYS CA 1 1 11 CYS HA -150.0 -89.99999 . 11 . HN . 11 . N . 11 . CA . 11 . HA 1 1 9 . 1 1 1 SER O 1 1 1 SER C 1 1 2 CYS N 1 1 2 CYS H 170.0 190.0 . 1 . O . 1 . C . 2 . N . 2 . HN 1 1 10 . 1 1 2 CYS O 1 1 2 CYS C 1 1 3 SER N 1 1 3 SER H 170.0 190.0 . 2 . O . 2 . C . 3 . N . 3 . HN 1 1 11 . 1 1 3 SER O 1 1 3 SER C 1 1 4 CYS N 1 1 4 CYS H 170.0 190.0 . 3 . O . 3 . C . 4 . N . 4 . HN 1 1 12 . 1 1 6 ARG O 1 1 6 ARG C 1 1 7 ASN N 1 1 7 ASN H 170.0 190.0 . 6 . O . 6 . C . 7 . N . 7 . HN 1 1 13 . 1 1 9 LEU O 1 1 9 LEU C 1 1 10 CYS N 1 1 10 CYS H 170.0 190.0 . 9 . O . 9 . C . 10 . N . 10 . HN 1 1 14 . 1 1 10 CYS O 1 1 10 CYS C 1 1 11 CYS N 1 1 11 CYS H 170.0 190.0 . 10 . O . 10 . C . 11 . N . 11 . HN 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 SER C C 13.451 23.393 13.163 1.00 . A A . 1 SER C 1 1 1 2 1 1 1 SER CA C 13.591 24.657 13.940 1.00 . A A . 1 SER CA 1 1 1 3 1 1 1 SER CB C 14.171 24.318 15.324 1.00 . A A . 1 SER CB 1 1 1 4 1 1 1 SER H1 H 12.003 25.661 13.093 1.00 . A A . 1 SER H1 1 1 1 5 1 1 1 SER H2 H 12.379 26.193 14.662 1.00 . A A . 1 SER H2 1 1 1 6 1 1 1 SER H3 H 11.572 24.725 14.447 1.00 . A A . 1 SER H3 1 1 1 7 1 1 1 SER HA H 14.264 25.310 13.405 1.00 . A A . 1 SER HA 1 1 1 8 1 1 1 SER HB2 H 13.511 23.606 15.864 1.00 . A A . 1 SER HB2 1 1 1 9 1 1 1 SER HB3 H 15.168 23.844 15.209 1.00 . A A . 1 SER HB3 1 1 1 10 1 1 1 SER HG H 15.104 25.326 16.660 1.00 . A A . 1 SER HG 1 1 1 11 1 1 1 SER N N 12.292 25.359 14.046 1.00 . A A . 1 SER N 1 1 1 12 1 1 1 SER O O 12.340 22.928 12.913 1.00 . A A . 1 SER O 1 1 1 13 1 1 1 SER OG O 14.330 25.487 16.116 1.00 . A A . 1 SER OG 1 1 1 14 1 1 2 CYS C C 14.397 20.403 13.257 1.00 . A A . 2 CYS C 1 1 1 15 1 1 2 CYS CA C 14.560 21.446 12.204 1.00 . A A . 2 CYS CA 1 1 1 16 1 1 2 CYS CB C 15.818 21.183 11.359 1.00 . A A . 2 CYS CB 1 1 1 17 1 1 2 CYS H H 15.461 23.182 12.914 1.00 . A A . 2 CYS H 1 1 1 18 1 1 2 CYS HA H 13.687 21.345 11.577 1.00 . A A . 2 CYS HA 1 1 1 19 1 1 2 CYS HB2 H 15.942 20.104 11.127 1.00 . A A . 2 CYS HB2 1 1 1 20 1 1 2 CYS HB3 H 15.722 21.681 10.372 1.00 . A A . 2 CYS HB3 1 1 1 21 1 1 2 CYS N N 14.570 22.760 12.768 1.00 . A A . 2 CYS N 1 1 1 22 1 1 2 CYS O O 14.277 20.689 14.446 1.00 . A A . 2 CYS O 1 1 1 23 1 1 2 CYS SG S 17.339 21.849 12.095 1.00 . A A . 2 CYS SG 1 1 1 24 1 1 3 SER C C 15.271 17.692 14.566 1.00 . A A . 3 SER C 1 1 1 25 1 1 3 SER CA C 14.094 17.999 13.706 1.00 . A A . 3 SER CA 1 1 1 26 1 1 3 SER CB C 13.698 16.744 12.909 1.00 . A A . 3 SER CB 1 1 1 27 1 1 3 SER H H 14.391 18.890 11.885 1.00 . A A . 3 SER H 1 1 1 28 1 1 3 SER HA H 13.294 18.289 14.371 1.00 . A A . 3 SER HA 1 1 1 29 1 1 3 SER HB2 H 13.684 15.820 13.526 1.00 . A A . 3 SER HB2 1 1 1 30 1 1 3 SER HB3 H 12.677 16.880 12.491 1.00 . A A . 3 SER HB3 1 1 1 31 1 1 3 SER HG H 14.324 17.093 11.115 1.00 . A A . 3 SER HG 1 1 1 32 1 1 3 SER N N 14.327 19.122 12.852 1.00 . A A . 3 SER N 1 1 1 33 1 1 3 SER O O 16.263 17.099 14.144 1.00 . A A . 3 SER O 1 1 1 34 1 1 3 SER OG O 14.562 16.480 11.814 1.00 . A A . 3 SER OG 1 1 1 35 1 1 4 CYS C C 16.195 16.572 17.409 1.00 . A A . 4 CYS C 1 1 1 36 1 1 4 CYS CA C 16.267 17.924 16.788 1.00 . A A . 4 CYS CA 1 1 1 37 1 1 4 CYS CB C 16.227 19.009 17.877 1.00 . A A . 4 CYS CB 1 1 1 38 1 1 4 CYS H H 14.341 18.481 16.167 1.00 . A A . 4 CYS H 1 1 1 39 1 1 4 CYS HA H 17.217 17.986 16.277 1.00 . A A . 4 CYS HA 1 1 1 40 1 1 4 CYS HB2 H 15.543 19.819 17.545 1.00 . A A . 4 CYS HB2 1 1 1 41 1 1 4 CYS HB3 H 15.848 18.615 18.844 1.00 . A A . 4 CYS HB3 1 1 1 42 1 1 4 CYS N N 15.199 18.081 15.851 1.00 . A A . 4 CYS N 1 1 1 43 1 1 4 CYS O O 17.203 15.969 17.774 1.00 . A A . 4 CYS O 1 1 1 44 1 1 4 CYS SG S 17.858 19.773 18.119 1.00 . A A . 4 CYS SG 1 1 1 45 1 1 5 LYS C C 15.359 13.649 17.108 1.00 . A A . 5 LYS C 1 1 1 46 1 1 5 LYS CA C 14.712 14.675 17.973 1.00 . A A . 5 LYS CA 1 1 1 47 1 1 5 LYS CB C 13.191 14.451 18.028 1.00 . A A . 5 LYS CB 1 1 1 48 1 1 5 LYS CD C 12.837 16.151 19.939 1.00 . A A . 5 LYS CD 1 1 1 49 1 1 5 LYS CE C 12.042 16.496 21.201 1.00 . A A . 5 LYS CE 1 1 1 50 1 1 5 LYS CG C 12.535 14.761 19.375 1.00 . A A . 5 LYS CG 1 1 1 51 1 1 5 LYS H H 14.166 16.532 17.294 1.00 . A A . 5 LYS H 1 1 1 52 1 1 5 LYS HA H 15.154 14.543 18.950 1.00 . A A . 5 LYS HA 1 1 1 53 1 1 5 LYS HB2 H 12.680 15.060 17.252 1.00 . A A . 5 LYS HB2 1 1 1 54 1 1 5 LYS HB3 H 12.948 13.390 17.806 1.00 . A A . 5 LYS HB3 1 1 1 55 1 1 5 LYS HD2 H 13.922 16.210 20.171 1.00 . A A . 5 LYS HD2 1 1 1 56 1 1 5 LYS HD3 H 12.611 16.914 19.163 1.00 . A A . 5 LYS HD3 1 1 1 57 1 1 5 LYS HE2 H 10.956 16.579 20.984 1.00 . A A . 5 LYS HE2 1 1 1 58 1 1 5 LYS HE3 H 12.202 15.730 21.989 1.00 . A A . 5 LYS HE3 1 1 1 59 1 1 5 LYS HG2 H 11.437 14.646 19.247 1.00 . A A . 5 LYS HG2 1 1 1 60 1 1 5 LYS HG3 H 12.865 13.998 20.112 1.00 . A A . 5 LYS HG3 1 1 1 61 1 1 5 LYS HZ1 H 13.551 17.759 21.838 1.00 . A A . 5 LYS HZ1 1 1 1 62 1 1 5 LYS HZ2 H 12.098 18.022 22.640 1.00 . A A . 5 LYS HZ2 1 1 1 63 1 1 5 LYS HZ3 H 12.327 18.567 21.041 1.00 . A A . 5 LYS HZ3 1 1 1 64 1 1 5 LYS N N 14.980 16.008 17.532 1.00 . A A . 5 LYS N 1 1 1 65 1 1 5 LYS NZ N 12.520 17.799 21.715 1.00 . A A . 5 LYS NZ 1 1 1 66 1 1 5 LYS O O 15.953 12.694 17.607 1.00 . A A . 5 LYS O 1 1 1 67 1 1 6 ARG C C 17.561 13.608 14.842 1.00 . A A . 6 ARG C 1 1 1 68 1 1 6 ARG CA C 16.151 13.126 14.842 1.00 . A A . 6 ARG CA 1 1 1 69 1 1 6 ARG CB C 15.556 13.352 13.443 1.00 . A A . 6 ARG CB 1 1 1 70 1 1 6 ARG CD C 13.459 13.254 12.090 1.00 . A A . 6 ARG CD 1 1 1 71 1 1 6 ARG CG C 14.343 12.494 13.079 1.00 . A A . 6 ARG CG 1 1 1 72 1 1 6 ARG CZ C 11.342 11.876 11.965 1.00 . A A . 6 ARG CZ 1 1 1 73 1 1 6 ARG H H 14.735 14.518 15.366 1.00 . A A . 6 ARG H 1 1 1 74 1 1 6 ARG HA H 16.169 12.071 15.075 1.00 . A A . 6 ARG HA 1 1 1 75 1 1 6 ARG HB2 H 15.221 14.408 13.352 1.00 . A A . 6 ARG HB2 1 1 1 76 1 1 6 ARG HB3 H 16.263 13.130 12.614 1.00 . A A . 6 ARG HB3 1 1 1 77 1 1 6 ARG HD2 H 12.869 14.094 12.516 1.00 . A A . 6 ARG HD2 1 1 1 78 1 1 6 ARG HD3 H 14.022 13.759 11.276 1.00 . A A . 6 ARG HD3 1 1 1 79 1 1 6 ARG HE H 12.935 11.633 10.768 1.00 . A A . 6 ARG HE 1 1 1 80 1 1 6 ARG HG2 H 14.792 11.554 12.692 1.00 . A A . 6 ARG HG2 1 1 1 81 1 1 6 ARG HG3 H 13.884 12.208 14.050 1.00 . A A . 6 ARG HG3 1 1 1 82 1 1 6 ARG HH11 H 11.384 13.113 13.584 1.00 . A A . 6 ARG HH11 1 1 1 83 1 1 6 ARG HH12 H 10.024 12.039 13.514 1.00 . A A . 6 ARG HH12 1 1 1 84 1 1 6 ARG HH21 H 11.015 10.357 10.598 1.00 . A A . 6 ARG HH21 1 1 1 85 1 1 6 ARG HH22 H 9.693 10.725 11.657 1.00 . A A . 6 ARG HH22 1 1 1 86 1 1 6 ARG N N 15.331 13.832 15.776 1.00 . A A . 6 ARG N 1 1 1 87 1 1 6 ARG NE N 12.562 12.237 11.472 1.00 . A A . 6 ARG NE 1 1 1 88 1 1 6 ARG NH1 N 10.814 12.469 13.076 1.00 . A A . 6 ARG NH1 1 1 1 89 1 1 6 ARG NH2 N 10.641 10.864 11.375 1.00 . A A . 6 ARG NH2 1 1 1 90 1 1 6 ARG O O 18.453 13.039 15.468 1.00 . A A . 6 ARG O 1 1 1 91 1 1 7 ASN C C 19.478 16.263 14.878 1.00 . A A . 7 ASN C 1 1 1 92 1 1 7 ASN CA C 19.158 15.203 13.881 1.00 . A A . 7 ASN CA 1 1 1 93 1 1 7 ASN CB C 19.419 15.743 12.465 1.00 . A A . 7 ASN CB 1 1 1 94 1 1 7 ASN CG C 18.780 14.846 11.416 1.00 . A A . 7 ASN CG 1 1 1 95 1 1 7 ASN H H 17.094 15.085 13.554 1.00 . A A . 7 ASN H 1 1 1 96 1 1 7 ASN HA H 19.857 14.398 14.045 1.00 . A A . 7 ASN HA 1 1 1 97 1 1 7 ASN HB2 H 19.027 16.769 12.304 1.00 . A A . 7 ASN HB2 1 1 1 98 1 1 7 ASN HB3 H 20.509 15.774 12.250 1.00 . A A . 7 ASN HB3 1 1 1 99 1 1 7 ASN HD21 H 20.336 13.528 11.526 1.00 . A A . 7 ASN HD21 1 1 1 100 1 1 7 ASN HD22 H 19.108 13.154 10.332 1.00 . A A . 7 ASN HD22 1 1 1 101 1 1 7 ASN N N 17.844 14.667 14.062 1.00 . A A . 7 ASN N 1 1 1 102 1 1 7 ASN ND2 N 19.492 13.751 11.037 1.00 . A A . 7 ASN ND2 1 1 1 103 1 1 7 ASN O O 19.305 17.461 14.654 1.00 . A A . 7 ASN O 1 1 1 104 1 1 7 ASN OD1 O 17.686 15.123 10.926 1.00 . A A . 7 ASN OD1 1 1 1 105 1 1 8 PHE C C 21.437 17.762 16.812 1.00 . A A . 8 PHE C 1 1 1 106 1 1 8 PHE CA C 20.348 16.791 17.110 1.00 . A A . 8 PHE CA 1 1 1 107 1 1 8 PHE CB C 20.653 16.018 18.404 1.00 . A A . 8 PHE CB 1 1 1 108 1 1 8 PHE CD1 C 22.959 15.084 18.233 1.00 . A A . 8 PHE CD1 1 1 1 109 1 1 8 PHE CD2 C 21.119 13.588 18.240 1.00 . A A . 8 PHE CD2 1 1 1 110 1 1 8 PHE CE1 C 23.825 14.018 18.187 1.00 . A A . 8 PHE CE1 1 1 1 111 1 1 8 PHE CE2 C 21.983 12.520 18.207 1.00 . A A . 8 PHE CE2 1 1 1 112 1 1 8 PHE CG C 21.600 14.876 18.255 1.00 . A A . 8 PHE CG 1 1 1 113 1 1 8 PHE CZ C 23.342 12.731 18.183 1.00 . A A . 8 PHE CZ 1 1 1 114 1 1 8 PHE H H 20.093 14.915 16.259 1.00 . A A . 8 PHE H 1 1 1 115 1 1 8 PHE HA H 19.477 17.406 17.284 1.00 . A A . 8 PHE HA 1 1 1 116 1 1 8 PHE HB2 H 21.028 16.693 19.202 1.00 . A A . 8 PHE HB2 1 1 1 117 1 1 8 PHE HB3 H 19.707 15.573 18.780 1.00 . A A . 8 PHE HB3 1 1 1 118 1 1 8 PHE HD1 H 23.377 16.078 18.298 1.00 . A A . 8 PHE HD1 1 1 1 119 1 1 8 PHE HD2 H 20.062 13.372 18.291 1.00 . A A . 8 PHE HD2 1 1 1 120 1 1 8 PHE HE1 H 24.891 14.198 18.182 1.00 . A A . 8 PHE HE1 1 1 1 121 1 1 8 PHE HE2 H 21.573 11.521 18.221 1.00 . A A . 8 PHE HE2 1 1 1 122 1 1 8 PHE HZ H 24.031 11.899 18.181 1.00 . A A . 8 PHE HZ 1 1 1 123 1 1 8 PHE N N 20.016 15.888 16.052 1.00 . A A . 8 PHE N 1 1 1 124 1 1 8 PHE O O 21.531 18.829 17.418 1.00 . A A . 8 PHE O 1 1 1 125 1 1 9 LEU C C 22.719 19.414 14.384 1.00 . A A . 9 LEU C 1 1 1 126 1 1 9 LEU CA C 23.269 18.356 15.277 1.00 . A A . 9 LEU CA 1 1 1 127 1 1 9 LEU CB C 24.451 17.671 14.570 1.00 . A A . 9 LEU CB 1 1 1 128 1 1 9 LEU CD1 C 25.956 15.697 14.107 1.00 . A A . 9 LEU CD1 1 1 1 129 1 1 9 LEU CD2 C 25.839 16.487 16.438 1.00 . A A . 9 LEU CD2 1 1 1 130 1 1 9 LEU CG C 25.029 16.364 15.137 1.00 . A A . 9 LEU CG 1 1 1 131 1 1 9 LEU H H 22.078 16.621 15.313 1.00 . A A . 9 LEU H 1 1 1 132 1 1 9 LEU HA H 23.671 18.899 16.120 1.00 . A A . 9 LEU HA 1 1 1 133 1 1 9 LEU HB2 H 24.275 17.531 13.482 1.00 . A A . 9 LEU HB2 1 1 1 134 1 1 9 LEU HB3 H 25.279 18.407 14.647 1.00 . A A . 9 LEU HB3 1 1 1 135 1 1 9 LEU HD11 H 25.397 15.475 13.173 1.00 . A A . 9 LEU HD11 1 1 1 136 1 1 9 LEU HD12 H 26.337 14.748 14.539 1.00 . A A . 9 LEU HD12 1 1 1 137 1 1 9 LEU HD13 H 26.814 16.366 13.883 1.00 . A A . 9 LEU HD13 1 1 1 138 1 1 9 LEU HD21 H 25.213 16.821 17.293 1.00 . A A . 9 LEU HD21 1 1 1 139 1 1 9 LEU HD22 H 26.712 17.158 16.298 1.00 . A A . 9 LEU HD22 1 1 1 140 1 1 9 LEU HD23 H 26.220 15.471 16.679 1.00 . A A . 9 LEU HD23 1 1 1 141 1 1 9 LEU HG H 24.251 15.603 15.360 1.00 . A A . 9 LEU HG 1 1 1 142 1 1 9 LEU N N 22.259 17.480 15.784 1.00 . A A . 9 LEU N 1 1 1 143 1 1 9 LEU O O 23.446 20.264 13.871 1.00 . A A . 9 LEU O 1 1 1 144 1 1 10 CYS C C 20.557 21.712 13.922 1.00 . A A . 10 CYS C 1 1 1 145 1 1 10 CYS CA C 20.763 20.382 13.284 1.00 . A A . 10 CYS CA 1 1 1 146 1 1 10 CYS CB C 19.455 19.827 12.697 1.00 . A A . 10 CYS CB 1 1 1 147 1 1 10 CYS H H 20.829 18.796 14.667 1.00 . A A . 10 CYS H 1 1 1 148 1 1 10 CYS HA H 21.423 20.563 12.449 1.00 . A A . 10 CYS HA 1 1 1 149 1 1 10 CYS HB2 H 19.651 18.781 12.375 1.00 . A A . 10 CYS HB2 1 1 1 150 1 1 10 CYS HB3 H 18.633 19.755 13.441 1.00 . A A . 10 CYS HB3 1 1 1 151 1 1 10 CYS N N 21.392 19.452 14.171 1.00 . A A . 10 CYS N 1 1 1 152 1 1 10 CYS O O 20.457 22.740 13.251 1.00 . A A . 10 CYS O 1 1 1 153 1 1 10 CYS SG S 18.817 20.737 11.261 1.00 . A A . 10 CYS SG 1 1 1 154 1 1 11 CYS C C 21.129 23.750 16.509 1.00 . A A . 11 CYS C 1 1 1 155 1 1 11 CYS CA C 19.997 22.855 16.025 1.00 . A A . 11 CYS CA 1 1 1 156 1 1 11 CYS CB C 19.224 22.326 17.244 1.00 . A A . 11 CYS CB 1 1 1 157 1 1 11 CYS H H 20.718 20.944 15.805 1.00 . A A . 11 CYS H 1 1 1 158 1 1 11 CYS HA H 19.349 23.436 15.385 1.00 . A A . 11 CYS HA 1 1 1 159 1 1 11 CYS HB2 H 19.917 21.746 17.889 1.00 . A A . 11 CYS HB2 1 1 1 160 1 1 11 CYS HB3 H 18.816 23.132 17.890 1.00 . A A . 11 CYS HB3 1 1 1 161 1 1 11 CYS N N 20.501 21.754 15.265 1.00 . A A . 11 CYS N 1 1 1 162 1 1 11 CYS O O 21.162 24.944 16.109 1.00 . A A . 11 CYS O 1 1 1 163 1 1 11 CYS OXT O 22.005 23.298 17.294 1.00 . A A . 11 CYS OXT 1 1 1 164 1 1 11 CYS SG S 17.880 21.228 16.706 1.00 . A A . 11 CYS SG 1 1 2 165 1 1 1 SER C C 13.304 23.240 12.922 1.00 . A A . 1 SER C 1 1 2 166 1 1 1 SER CA C 13.280 24.366 13.897 1.00 . A A . 1 SER CA 1 1 2 167 1 1 1 SER CB C 13.896 23.885 15.221 1.00 . A A . 1 SER CB 1 1 2 168 1 1 1 SER H1 H 11.361 24.188 14.714 1.00 . A A . 1 SER H1 1 1 2 169 1 1 1 SER H2 H 11.390 25.032 13.262 1.00 . A A . 1 SER H2 1 1 2 170 1 1 1 SER H3 H 11.965 25.767 14.665 1.00 . A A . 1 SER H3 1 1 2 171 1 1 1 SER HA H 13.860 25.180 13.486 1.00 . A A . 1 SER HA 1 1 2 172 1 1 1 SER HB2 H 13.322 23.018 15.613 1.00 . A A . 1 SER HB2 1 1 2 173 1 1 1 SER HB3 H 14.949 23.554 15.089 1.00 . A A . 1 SER HB3 1 1 2 174 1 1 1 SER HG H 14.366 24.564 16.951 1.00 . A A . 1 SER HG 1 1 2 175 1 1 1 SER N N 11.910 24.867 14.148 1.00 . A A . 1 SER N 1 1 2 176 1 1 1 SER O O 12.263 22.762 12.474 1.00 . A A . 1 SER O 1 1 2 177 1 1 1 SER OG O 13.880 24.914 16.200 1.00 . A A . 1 SER OG 1 1 2 178 1 1 2 CYS C C 14.347 20.412 13.129 1.00 . A A . 2 CYS C 1 1 2 179 1 1 2 CYS CA C 14.632 21.402 12.054 1.00 . A A . 2 CYS CA 1 1 2 180 1 1 2 CYS CB C 16.017 21.124 11.444 1.00 . A A . 2 CYS CB 1 1 2 181 1 1 2 CYS H H 15.343 23.198 12.808 1.00 . A A . 2 CYS H 1 1 2 182 1 1 2 CYS HA H 13.869 21.246 11.306 1.00 . A A . 2 CYS HA 1 1 2 183 1 1 2 CYS HB2 H 16.149 20.037 11.248 1.00 . A A . 2 CYS HB2 1 1 2 184 1 1 2 CYS HB3 H 16.085 21.611 10.448 1.00 . A A . 2 CYS HB3 1 1 2 185 1 1 2 CYS N N 14.497 22.729 12.570 1.00 . A A . 2 CYS N 1 1 2 186 1 1 2 CYS O O 14.200 20.759 14.300 1.00 . A A . 2 CYS O 1 1 2 187 1 1 2 CYS SG S 17.408 21.748 12.430 1.00 . A A . 2 CYS SG 1 1 2 188 1 1 3 SER C C 14.992 17.761 14.597 1.00 . A A . 3 SER C 1 1 2 189 1 1 3 SER CA C 13.840 18.092 13.713 1.00 . A A . 3 SER CA 1 1 2 190 1 1 3 SER CB C 13.372 16.827 12.975 1.00 . A A . 3 SER CB 1 1 2 191 1 1 3 SER H H 14.305 18.784 11.851 1.00 . A A . 3 SER H 1 1 2 192 1 1 3 SER HA H 13.061 18.480 14.351 1.00 . A A . 3 SER HA 1 1 2 193 1 1 3 SER HB2 H 13.395 15.933 13.635 1.00 . A A . 3 SER HB2 1 1 2 194 1 1 3 SER HB3 H 12.330 16.963 12.616 1.00 . A A . 3 SER HB3 1 1 2 195 1 1 3 SER HG H 13.671 16.113 11.180 1.00 . A A . 3 SER HG 1 1 2 196 1 1 3 SER N N 14.191 19.121 12.783 1.00 . A A . 3 SER N 1 1 2 197 1 1 3 SER O O 15.900 17.015 14.232 1.00 . A A . 3 SER O 1 1 2 198 1 1 3 SER OG O 14.185 16.591 11.834 1.00 . A A . 3 SER OG 1 1 2 199 1 1 4 CYS C C 16.271 17.034 17.404 1.00 . A A . 4 CYS C 1 1 2 200 1 1 4 CYS CA C 16.113 18.341 16.706 1.00 . A A . 4 CYS CA 1 1 2 201 1 1 4 CYS CB C 15.912 19.457 17.745 1.00 . A A . 4 CYS CB 1 1 2 202 1 1 4 CYS H H 14.180 18.834 16.088 1.00 . A A . 4 CYS H 1 1 2 203 1 1 4 CYS HA H 17.024 18.531 16.157 1.00 . A A . 4 CYS HA 1 1 2 204 1 1 4 CYS HB2 H 15.537 20.333 17.174 1.00 . A A . 4 CYS HB2 1 1 2 205 1 1 4 CYS HB3 H 15.135 19.185 18.491 1.00 . A A . 4 CYS HB3 1 1 2 206 1 1 4 CYS N N 14.992 18.322 15.818 1.00 . A A . 4 CYS N 1 1 2 207 1 1 4 CYS O O 17.352 16.648 17.845 1.00 . A A . 4 CYS O 1 1 2 208 1 1 4 CYS SG S 17.431 19.909 18.630 1.00 . A A . 4 CYS SG 1 1 2 209 1 1 5 LYS C C 15.717 13.951 17.165 1.00 . A A . 5 LYS C 1 1 2 210 1 1 5 LYS CA C 15.169 14.969 18.104 1.00 . A A . 5 LYS CA 1 1 2 211 1 1 5 LYS CB C 13.751 14.560 18.536 1.00 . A A . 5 LYS CB 1 1 2 212 1 1 5 LYS CD C 12.630 16.658 19.591 1.00 . A A . 5 LYS CD 1 1 2 213 1 1 5 LYS CE C 11.260 16.658 18.911 1.00 . A A . 5 LYS CE 1 1 2 214 1 1 5 LYS CG C 13.181 15.243 19.780 1.00 . A A . 5 LYS CG 1 1 2 215 1 1 5 LYS H H 14.303 16.625 17.168 1.00 . A A . 5 LYS H 1 1 2 216 1 1 5 LYS HA H 15.832 14.973 18.956 1.00 . A A . 5 LYS HA 1 1 2 217 1 1 5 LYS HB2 H 13.042 14.715 17.695 1.00 . A A . 5 LYS HB2 1 1 2 218 1 1 5 LYS HB3 H 13.756 13.474 18.771 1.00 . A A . 5 LYS HB3 1 1 2 219 1 1 5 LYS HD2 H 12.508 17.114 20.598 1.00 . A A . 5 LYS HD2 1 1 2 220 1 1 5 LYS HD3 H 13.354 17.294 19.038 1.00 . A A . 5 LYS HD3 1 1 2 221 1 1 5 LYS HE2 H 11.312 16.142 17.930 1.00 . A A . 5 LYS HE2 1 1 2 222 1 1 5 LYS HE3 H 10.530 16.128 19.559 1.00 . A A . 5 LYS HE3 1 1 2 223 1 1 5 LYS HG2 H 12.337 14.612 20.132 1.00 . A A . 5 LYS HG2 1 1 2 224 1 1 5 LYS HG3 H 13.936 15.244 20.595 1.00 . A A . 5 LYS HG3 1 1 2 225 1 1 5 LYS HZ1 H 10.558 18.495 19.599 1.00 . A A . 5 LYS HZ1 1 1 2 226 1 1 5 LYS HZ2 H 9.904 18.021 18.111 1.00 . A A . 5 LYS HZ2 1 1 2 227 1 1 5 LYS HZ3 H 11.489 18.593 18.188 1.00 . A A . 5 LYS HZ3 1 1 2 228 1 1 5 LYS N N 15.168 16.272 17.513 1.00 . A A . 5 LYS N 1 1 2 229 1 1 5 LYS NZ N 10.769 18.036 18.690 1.00 . A A . 5 LYS NZ 1 1 2 230 1 1 5 LYS O O 16.480 13.071 17.564 1.00 . A A . 5 LYS O 1 1 2 231 1 1 6 ARG C C 17.376 13.566 14.537 1.00 . A A . 6 ARG C 1 1 2 232 1 1 6 ARG CA C 15.962 13.212 14.849 1.00 . A A . 6 ARG CA 1 1 2 233 1 1 6 ARG CB C 15.119 13.374 13.572 1.00 . A A . 6 ARG CB 1 1 2 234 1 1 6 ARG CD C 12.754 13.322 12.740 1.00 . A A . 6 ARG CD 1 1 2 235 1 1 6 ARG CG C 13.821 12.565 13.533 1.00 . A A . 6 ARG CG 1 1 2 236 1 1 6 ARG CZ C 10.524 12.134 12.990 1.00 . A A . 6 ARG CZ 1 1 2 237 1 1 6 ARG H H 14.738 14.725 15.547 1.00 . A A . 6 ARG H 1 1 2 238 1 1 6 ARG HA H 15.955 12.182 15.172 1.00 . A A . 6 ARG HA 1 1 2 239 1 1 6 ARG HB2 H 14.819 14.439 13.469 1.00 . A A . 6 ARG HB2 1 1 2 240 1 1 6 ARG HB3 H 15.637 13.055 12.643 1.00 . A A . 6 ARG HB3 1 1 2 241 1 1 6 ARG HD2 H 12.286 14.188 13.254 1.00 . A A . 6 ARG HD2 1 1 2 242 1 1 6 ARG HD3 H 13.152 13.781 11.810 1.00 . A A . 6 ARG HD3 1 1 2 243 1 1 6 ARG HE H 11.792 11.827 11.487 1.00 . A A . 6 ARG HE 1 1 2 244 1 1 6 ARG HG2 H 14.125 11.585 13.105 1.00 . A A . 6 ARG HG2 1 1 2 245 1 1 6 ARG HG3 H 13.597 12.346 14.600 1.00 . A A . 6 ARG HG3 1 1 2 246 1 1 6 ARG HH11 H 11.018 12.980 14.776 1.00 . A A . 6 ARG HH11 1 1 2 247 1 1 6 ARG HH12 H 9.473 12.306 14.723 1.00 . A A . 6 ARG HH12 1 1 2 248 1 1 6 ARG HH21 H 9.787 10.939 11.511 1.00 . A A . 6 ARG HH21 1 1 2 249 1 1 6 ARG HH22 H 8.730 11.137 12.886 1.00 . A A . 6 ARG HH22 1 1 2 250 1 1 6 ARG N N 15.388 14.039 15.865 1.00 . A A . 6 ARG N 1 1 2 251 1 1 6 ARG NE N 11.710 12.335 12.345 1.00 . A A . 6 ARG NE 1 1 2 252 1 1 6 ARG NH1 N 10.248 12.678 14.212 1.00 . A A . 6 ARG NH1 1 1 2 253 1 1 6 ARG NH2 N 9.595 11.316 12.416 1.00 . A A . 6 ARG NH2 1 1 2 254 1 1 6 ARG O O 18.295 12.766 14.695 1.00 . A A . 6 ARG O 1 1 2 255 1 1 7 ASN C C 19.385 16.213 14.824 1.00 . A A . 7 ASN C 1 1 2 256 1 1 7 ASN CA C 18.864 15.363 13.716 1.00 . A A . 7 ASN CA 1 1 2 257 1 1 7 ASN CB C 18.852 16.197 12.423 1.00 . A A . 7 ASN CB 1 1 2 258 1 1 7 ASN CG C 18.168 15.451 11.288 1.00 . A A . 7 ASN CG 1 1 2 259 1 1 7 ASN H H 16.768 15.321 13.834 1.00 . A A . 7 ASN H 1 1 2 260 1 1 7 ASN HA H 19.558 14.556 13.533 1.00 . A A . 7 ASN HA 1 1 2 261 1 1 7 ASN HB2 H 18.413 17.213 12.519 1.00 . A A . 7 ASN HB2 1 1 2 262 1 1 7 ASN HB3 H 19.896 16.346 12.072 1.00 . A A . 7 ASN HB3 1 1 2 263 1 1 7 ASN HD21 H 16.336 16.349 11.625 1.00 . A A . 7 ASN HD21 1 1 2 264 1 1 7 ASN HD22 H 16.426 15.296 10.250 1.00 . A A . 7 ASN HD22 1 1 2 265 1 1 7 ASN N N 17.591 14.800 14.044 1.00 . A A . 7 ASN N 1 1 2 266 1 1 7 ASN ND2 N 16.861 15.735 11.036 1.00 . A A . 7 ASN ND2 1 1 2 267 1 1 7 ASN O O 19.160 17.421 14.873 1.00 . A A . 7 ASN O 1 1 2 268 1 1 7 ASN OD1 O 18.785 14.636 10.603 1.00 . A A . 7 ASN OD1 1 1 2 269 1 1 8 PHE C C 21.643 17.358 16.756 1.00 . A A . 8 PHE C 1 1 2 270 1 1 8 PHE CA C 20.580 16.332 16.950 1.00 . A A . 8 PHE CA 1 1 2 271 1 1 8 PHE CB C 20.936 15.362 18.090 1.00 . A A . 8 PHE CB 1 1 2 272 1 1 8 PHE CD1 C 23.338 14.661 18.030 1.00 . A A . 8 PHE CD1 1 1 2 273 1 1 8 PHE CD2 C 21.665 13.088 17.457 1.00 . A A . 8 PHE CD2 1 1 2 274 1 1 8 PHE CE1 C 24.303 13.690 17.894 1.00 . A A . 8 PHE CE1 1 1 2 275 1 1 8 PHE CE2 C 22.624 12.115 17.295 1.00 . A A . 8 PHE CE2 1 1 2 276 1 1 8 PHE CG C 22.013 14.370 17.812 1.00 . A A . 8 PHE CG 1 1 2 277 1 1 8 PHE CZ C 23.946 12.417 17.518 1.00 . A A . 8 PHE CZ 1 1 2 278 1 1 8 PHE H H 20.348 14.669 15.719 1.00 . A A . 8 PHE H 1 1 2 279 1 1 8 PHE HA H 19.735 16.912 17.289 1.00 . A A . 8 PHE HA 1 1 2 280 1 1 8 PHE HB2 H 21.216 15.923 19.006 1.00 . A A . 8 PHE HB2 1 1 2 281 1 1 8 PHE HB3 H 20.034 14.763 18.341 1.00 . A A . 8 PHE HB3 1 1 2 282 1 1 8 PHE HD1 H 23.655 15.640 18.359 1.00 . A A . 8 PHE HD1 1 1 2 283 1 1 8 PHE HD2 H 20.633 12.797 17.330 1.00 . A A . 8 PHE HD2 1 1 2 284 1 1 8 PHE HE1 H 25.337 13.930 18.088 1.00 . A A . 8 PHE HE1 1 1 2 285 1 1 8 PHE HE2 H 22.313 11.118 17.019 1.00 . A A . 8 PHE HE2 1 1 2 286 1 1 8 PHE HZ H 24.707 11.658 17.414 1.00 . A A . 8 PHE HZ 1 1 2 287 1 1 8 PHE N N 20.144 15.643 15.776 1.00 . A A . 8 PHE N 1 1 2 288 1 1 8 PHE O O 21.727 18.319 17.518 1.00 . A A . 8 PHE O 1 1 2 289 1 1 9 LEU C C 22.983 19.314 14.546 1.00 . A A . 9 LEU C 1 1 2 290 1 1 9 LEU CA C 23.502 18.198 15.385 1.00 . A A . 9 LEU CA 1 1 2 291 1 1 9 LEU CB C 24.750 17.634 14.687 1.00 . A A . 9 LEU CB 1 1 2 292 1 1 9 LEU CD1 C 26.274 15.713 14.062 1.00 . A A . 9 LEU CD1 1 1 2 293 1 1 9 LEU CD2 C 26.125 16.326 16.458 1.00 . A A . 9 LEU CD2 1 1 2 294 1 1 9 LEU CG C 25.336 16.285 15.138 1.00 . A A . 9 LEU CG 1 1 2 295 1 1 9 LEU H H 22.375 16.457 15.115 1.00 . A A . 9 LEU H 1 1 2 296 1 1 9 LEU HA H 23.835 18.664 16.301 1.00 . A A . 9 LEU HA 1 1 2 297 1 1 9 LEU HB2 H 24.658 17.609 13.579 1.00 . A A . 9 LEU HB2 1 1 2 298 1 1 9 LEU HB3 H 25.551 18.376 14.895 1.00 . A A . 9 LEU HB3 1 1 2 299 1 1 9 LEU HD11 H 26.680 14.745 14.426 1.00 . A A . 9 LEU HD11 1 1 2 300 1 1 9 LEU HD12 H 27.128 16.405 13.897 1.00 . A A . 9 LEU HD12 1 1 2 301 1 1 9 LEU HD13 H 25.726 15.550 13.110 1.00 . A A . 9 LEU HD13 1 1 2 302 1 1 9 LEU HD21 H 26.536 15.306 16.616 1.00 . A A . 9 LEU HD21 1 1 2 303 1 1 9 LEU HD22 H 25.450 16.562 17.308 1.00 . A A . 9 LEU HD22 1 1 2 304 1 1 9 LEU HD23 H 26.970 17.045 16.393 1.00 . A A . 9 LEU HD23 1 1 2 305 1 1 9 LEU HG H 24.563 15.506 15.306 1.00 . A A . 9 LEU HG 1 1 2 306 1 1 9 LEU N N 22.486 17.246 15.713 1.00 . A A . 9 LEU N 1 1 2 307 1 1 9 LEU O O 23.733 20.137 14.025 1.00 . A A . 9 LEU O 1 1 2 308 1 1 10 CYS C C 20.789 21.696 14.206 1.00 . A A . 10 CYS C 1 1 2 309 1 1 10 CYS CA C 21.022 20.383 13.542 1.00 . A A . 10 CYS CA 1 1 2 310 1 1 10 CYS CB C 19.707 19.859 12.942 1.00 . A A . 10 CYS CB 1 1 2 311 1 1 10 CYS H H 21.094 18.767 14.899 1.00 . A A . 10 CYS H 1 1 2 312 1 1 10 CYS HA H 21.675 20.588 12.707 1.00 . A A . 10 CYS HA 1 1 2 313 1 1 10 CYS HB2 H 19.909 18.841 12.545 1.00 . A A . 10 CYS HB2 1 1 2 314 1 1 10 CYS HB3 H 18.904 19.739 13.701 1.00 . A A . 10 CYS HB3 1 1 2 315 1 1 10 CYS N N 21.651 19.425 14.398 1.00 . A A . 10 CYS N 1 1 2 316 1 1 10 CYS O O 20.626 22.716 13.538 1.00 . A A . 10 CYS O 1 1 2 317 1 1 10 CYS SG S 19.031 20.866 11.589 1.00 . A A . 10 CYS SG 1 1 2 318 1 1 11 CYS C C 20.783 23.906 16.637 1.00 . A A . 11 CYS C 1 1 2 319 1 1 11 CYS CA C 19.913 22.727 16.229 1.00 . A A . 11 CYS CA 1 1 2 320 1 1 11 CYS CB C 19.247 22.096 17.463 1.00 . A A . 11 CYS CB 1 1 2 321 1 1 11 CYS H H 20.969 20.972 16.122 1.00 . A A . 11 CYS H 1 1 2 322 1 1 11 CYS HA H 19.182 23.094 15.524 1.00 . A A . 11 CYS HA 1 1 2 323 1 1 11 CYS HB2 H 20.004 22.001 18.270 1.00 . A A . 11 CYS HB2 1 1 2 324 1 1 11 CYS HB3 H 18.422 22.696 17.903 1.00 . A A . 11 CYS HB3 1 1 2 325 1 1 11 CYS N N 20.689 21.737 15.547 1.00 . A A . 11 CYS N 1 1 2 326 1 1 11 CYS O O 20.692 24.985 15.990 1.00 . A A . 11 CYS O 1 1 2 327 1 1 11 CYS OXT O 21.583 23.791 17.604 1.00 . A A . 11 CYS OXT 1 1 2 328 1 1 11 CYS SG S 18.700 20.399 17.124 1.00 . A A . 11 CYS SG 1 1 3 329 1 1 1 SER C C 13.477 23.534 12.771 1.00 . A A . 1 SER C 1 1 3 330 1 1 1 SER CA C 13.803 24.965 13.024 1.00 . A A . 1 SER CA 1 1 3 331 1 1 1 SER CB C 14.203 25.089 14.504 1.00 . A A . 1 SER CB 1 1 3 332 1 1 1 SER H1 H 11.967 25.873 13.378 1.00 . A A . 1 SER H1 1 1 3 333 1 1 1 SER H2 H 12.329 25.744 11.726 1.00 . A A . 1 SER H2 1 1 3 334 1 1 1 SER H3 H 13.087 26.895 12.667 1.00 . A A . 1 SER H3 1 1 3 335 1 1 1 SER HA H 14.656 25.209 12.408 1.00 . A A . 1 SER HA 1 1 3 336 1 1 1 SER HB2 H 13.334 24.859 15.156 1.00 . A A . 1 SER HB2 1 1 3 337 1 1 1 SER HB3 H 15.006 24.365 14.762 1.00 . A A . 1 SER HB3 1 1 3 338 1 1 1 SER HG H 14.618 26.438 15.782 1.00 . A A . 1 SER HG 1 1 3 339 1 1 1 SER N N 12.727 25.919 12.671 1.00 . A A . 1 SER N 1 1 3 340 1 1 1 SER O O 12.318 23.143 12.638 1.00 . A A . 1 SER O 1 1 3 341 1 1 1 SER OG O 14.681 26.388 14.826 1.00 . A A . 1 SER OG 1 1 3 342 1 1 2 CYS C C 14.173 20.394 13.482 1.00 . A A . 2 CYS C 1 1 3 343 1 1 2 CYS CA C 14.447 21.303 12.333 1.00 . A A . 2 CYS CA 1 1 3 344 1 1 2 CYS CB C 15.766 20.867 11.671 1.00 . A A . 2 CYS CB 1 1 3 345 1 1 2 CYS H H 15.450 23.015 12.822 1.00 . A A . 2 CYS H 1 1 3 346 1 1 2 CYS HA H 13.616 21.163 11.658 1.00 . A A . 2 CYS HA 1 1 3 347 1 1 2 CYS HB2 H 15.913 19.766 11.709 1.00 . A A . 2 CYS HB2 1 1 3 348 1 1 2 CYS HB3 H 15.748 21.121 10.590 1.00 . A A . 2 CYS HB3 1 1 3 349 1 1 2 CYS N N 14.518 22.685 12.691 1.00 . A A . 2 CYS N 1 1 3 350 1 1 2 CYS O O 14.201 20.781 14.649 1.00 . A A . 2 CYS O 1 1 3 351 1 1 2 CYS SG S 17.207 21.720 12.373 1.00 . A A . 2 CYS SG 1 1 3 352 1 1 3 SER C C 14.853 17.689 14.870 1.00 . A A . 3 SER C 1 1 3 353 1 1 3 SER CA C 13.670 18.006 14.022 1.00 . A A . 3 SER CA 1 1 3 354 1 1 3 SER CB C 13.339 16.735 13.224 1.00 . A A . 3 SER CB 1 1 3 355 1 1 3 SER H H 13.799 18.884 12.189 1.00 . A A . 3 SER H 1 1 3 356 1 1 3 SER HA H 12.868 18.278 14.693 1.00 . A A . 3 SER HA 1 1 3 357 1 1 3 SER HB2 H 13.450 15.792 13.800 1.00 . A A . 3 SER HB2 1 1 3 358 1 1 3 SER HB3 H 12.281 16.781 12.885 1.00 . A A . 3 SER HB3 1 1 3 359 1 1 3 SER HG H 15.028 16.491 12.282 1.00 . A A . 3 SER HG 1 1 3 360 1 1 3 SER N N 13.887 19.122 13.153 1.00 . A A . 3 SER N 1 1 3 361 1 1 3 SER O O 15.790 17.019 14.438 1.00 . A A . 3 SER O 1 1 3 362 1 1 3 SER OG O 14.111 16.630 12.035 1.00 . A A . 3 SER OG 1 1 3 363 1 1 4 CYS C C 15.983 16.621 17.632 1.00 . A A . 4 CYS C 1 1 3 364 1 1 4 CYS CA C 15.905 17.998 17.067 1.00 . A A . 4 CYS CA 1 1 3 365 1 1 4 CYS CB C 15.761 19.008 18.219 1.00 . A A . 4 CYS CB 1 1 3 366 1 1 4 CYS H H 13.980 18.554 16.459 1.00 . A A . 4 CYS H 1 1 3 367 1 1 4 CYS HA H 16.833 18.172 16.546 1.00 . A A . 4 CYS HA 1 1 3 368 1 1 4 CYS HB2 H 15.114 19.846 17.882 1.00 . A A . 4 CYS HB2 1 1 3 369 1 1 4 CYS HB3 H 15.293 18.560 19.122 1.00 . A A . 4 CYS HB3 1 1 3 370 1 1 4 CYS N N 14.821 18.124 16.143 1.00 . A A . 4 CYS N 1 1 3 371 1 1 4 CYS O O 17.060 16.137 17.974 1.00 . A A . 4 CYS O 1 1 3 372 1 1 4 CYS SG S 17.354 19.756 18.670 1.00 . A A . 4 CYS SG 1 1 3 373 1 1 5 LYS C C 15.423 13.606 17.205 1.00 . A A . 5 LYS C 1 1 3 374 1 1 5 LYS CA C 14.762 14.547 18.151 1.00 . A A . 5 LYS CA 1 1 3 375 1 1 5 LYS CB C 13.293 14.123 18.323 1.00 . A A . 5 LYS CB 1 1 3 376 1 1 5 LYS CD C 12.849 15.542 20.453 1.00 . A A . 5 LYS CD 1 1 3 377 1 1 5 LYS CE C 12.322 15.459 21.887 1.00 . A A . 5 LYS CE 1 1 3 378 1 1 5 LYS CG C 12.761 14.184 19.755 1.00 . A A . 5 LYS CG 1 1 3 379 1 1 5 LYS H H 13.968 16.338 17.518 1.00 . A A . 5 LYS H 1 1 3 380 1 1 5 LYS HA H 15.312 14.444 19.074 1.00 . A A . 5 LYS HA 1 1 3 381 1 1 5 LYS HB2 H 12.622 14.724 17.674 1.00 . A A . 5 LYS HB2 1 1 3 382 1 1 5 LYS HB3 H 13.156 13.061 18.022 1.00 . A A . 5 LYS HB3 1 1 3 383 1 1 5 LYS HD2 H 13.905 15.886 20.474 1.00 . A A . 5 LYS HD2 1 1 3 384 1 1 5 LYS HD3 H 12.256 16.288 19.882 1.00 . A A . 5 LYS HD3 1 1 3 385 1 1 5 LYS HE2 H 11.257 15.142 21.899 1.00 . A A . 5 LYS HE2 1 1 3 386 1 1 5 LYS HE3 H 12.918 14.725 22.472 1.00 . A A . 5 LYS HE3 1 1 3 387 1 1 5 LYS HG2 H 11.695 13.873 19.729 1.00 . A A . 5 LYS HG2 1 1 3 388 1 1 5 LYS HG3 H 13.304 13.435 20.371 1.00 . A A . 5 LYS HG3 1 1 3 389 1 1 5 LYS HZ1 H 11.790 17.464 22.123 1.00 . A A . 5 LYS HZ1 1 1 3 390 1 1 5 LYS HZ2 H 13.394 17.135 22.507 1.00 . A A . 5 LYS HZ2 1 1 3 391 1 1 5 LYS HZ3 H 12.165 16.667 23.571 1.00 . A A . 5 LYS HZ3 1 1 3 392 1 1 5 LYS N N 14.844 15.911 17.731 1.00 . A A . 5 LYS N 1 1 3 393 1 1 5 LYS NZ N 12.422 16.769 22.569 1.00 . A A . 5 LYS NZ 1 1 3 394 1 1 5 LYS O O 16.001 12.598 17.606 1.00 . A A . 5 LYS O 1 1 3 395 1 1 6 ARG C C 17.542 13.702 14.796 1.00 . A A . 6 ARG C 1 1 3 396 1 1 6 ARG CA C 16.150 13.182 14.912 1.00 . A A . 6 ARG CA 1 1 3 397 1 1 6 ARG CB C 15.412 13.333 13.571 1.00 . A A . 6 ARG CB 1 1 3 398 1 1 6 ARG CD C 13.130 13.143 12.560 1.00 . A A . 6 ARG CD 1 1 3 399 1 1 6 ARG CG C 14.168 12.450 13.443 1.00 . A A . 6 ARG CG 1 1 3 400 1 1 6 ARG CZ C 11.109 11.627 12.813 1.00 . A A . 6 ARG CZ 1 1 3 401 1 1 6 ARG H H 14.831 14.642 15.541 1.00 . A A . 6 ARG H 1 1 3 402 1 1 6 ARG HA H 16.213 12.134 15.169 1.00 . A A . 6 ARG HA 1 1 3 403 1 1 6 ARG HB2 H 15.059 14.380 13.454 1.00 . A A . 6 ARG HB2 1 1 3 404 1 1 6 ARG HB3 H 16.013 13.052 12.681 1.00 . A A . 6 ARG HB3 1 1 3 405 1 1 6 ARG HD2 H 12.574 13.987 13.022 1.00 . A A . 6 ARG HD2 1 1 3 406 1 1 6 ARG HD3 H 13.567 13.618 11.655 1.00 . A A . 6 ARG HD3 1 1 3 407 1 1 6 ARG HE H 12.489 11.419 11.409 1.00 . A A . 6 ARG HE 1 1 3 408 1 1 6 ARG HG2 H 14.562 11.488 13.049 1.00 . A A . 6 ARG HG2 1 1 3 409 1 1 6 ARG HG3 H 13.863 12.222 14.487 1.00 . A A . 6 ARG HG3 1 1 3 410 1 1 6 ARG HH11 H 10.973 13.170 14.149 1.00 . A A . 6 ARG HH11 1 1 3 411 1 1 6 ARG HH12 H 9.685 12.038 14.193 1.00 . A A . 6 ARG HH12 1 1 3 412 1 1 6 ARG HH21 H 10.929 10.019 11.601 1.00 . A A . 6 ARG HH21 1 1 3 413 1 1 6 ARG HH22 H 9.717 10.086 12.849 1.00 . A A . 6 ARG HH22 1 1 3 414 1 1 6 ARG N N 15.393 13.897 15.892 1.00 . A A . 6 ARG N 1 1 3 415 1 1 6 ARG NE N 12.206 12.057 12.125 1.00 . A A . 6 ARG NE 1 1 3 416 1 1 6 ARG NH1 N 10.620 12.263 13.918 1.00 . A A . 6 ARG NH1 1 1 3 417 1 1 6 ARG NH2 N 10.505 10.482 12.379 1.00 . A A . 6 ARG NH2 1 1 3 418 1 1 6 ARG O O 18.493 13.126 15.322 1.00 . A A . 6 ARG O 1 1 3 419 1 1 7 ASN C C 19.639 16.128 14.817 1.00 . A A . 7 ASN C 1 1 3 420 1 1 7 ASN CA C 18.962 15.403 13.706 1.00 . A A . 7 ASN CA 1 1 3 421 1 1 7 ASN CB C 18.857 16.311 12.469 1.00 . A A . 7 ASN CB 1 1 3 422 1 1 7 ASN CG C 17.944 15.697 11.416 1.00 . A A . 7 ASN CG 1 1 3 423 1 1 7 ASN H H 16.868 15.258 13.756 1.00 . A A . 7 ASN H 1 1 3 424 1 1 7 ASN HA H 19.604 14.578 13.436 1.00 . A A . 7 ASN HA 1 1 3 425 1 1 7 ASN HB2 H 18.454 17.319 12.702 1.00 . A A . 7 ASN HB2 1 1 3 426 1 1 7 ASN HB3 H 19.858 16.482 12.020 1.00 . A A . 7 ASN HB3 1 1 3 427 1 1 7 ASN HD21 H 19.532 14.843 10.436 1.00 . A A . 7 ASN HD21 1 1 3 428 1 1 7 ASN HD22 H 17.966 14.611 9.695 1.00 . A A . 7 ASN HD22 1 1 3 429 1 1 7 ASN N N 17.706 14.832 14.087 1.00 . A A . 7 ASN N 1 1 3 430 1 1 7 ASN ND2 N 18.541 14.979 10.427 1.00 . A A . 7 ASN ND2 1 1 3 431 1 1 7 ASN O O 19.273 17.244 15.184 1.00 . A A . 7 ASN O 1 1 3 432 1 1 7 ASN OD1 O 16.725 15.853 11.466 1.00 . A A . 7 ASN OD1 1 1 3 433 1 1 8 PHE C C 22.370 17.060 16.387 1.00 . A A . 8 PHE C 1 1 3 434 1 1 8 PHE CA C 21.357 15.985 16.580 1.00 . A A . 8 PHE CA 1 1 3 435 1 1 8 PHE CB C 21.986 14.817 17.358 1.00 . A A . 8 PHE CB 1 1 3 436 1 1 8 PHE CD1 C 24.165 14.212 16.306 1.00 . A A . 8 PHE CD1 1 1 3 437 1 1 8 PHE CD2 C 22.348 12.703 16.112 1.00 . A A . 8 PHE CD2 1 1 3 438 1 1 8 PHE CE1 C 24.963 13.350 15.590 1.00 . A A . 8 PHE CE1 1 1 3 439 1 1 8 PHE CE2 C 23.144 11.824 15.418 1.00 . A A . 8 PHE CE2 1 1 3 440 1 1 8 PHE CG C 22.848 13.906 16.553 1.00 . A A . 8 PHE CG 1 1 3 441 1 1 8 PHE CZ C 24.452 12.152 15.149 1.00 . A A . 8 PHE CZ 1 1 3 442 1 1 8 PHE H H 20.950 14.604 15.111 1.00 . A A . 8 PHE H 1 1 3 443 1 1 8 PHE HA H 20.616 16.443 17.218 1.00 . A A . 8 PHE HA 1 1 3 444 1 1 8 PHE HB2 H 22.581 15.174 18.226 1.00 . A A . 8 PHE HB2 1 1 3 445 1 1 8 PHE HB3 H 21.186 14.162 17.765 1.00 . A A . 8 PHE HB3 1 1 3 446 1 1 8 PHE HD1 H 24.609 15.120 16.687 1.00 . A A . 8 PHE HD1 1 1 3 447 1 1 8 PHE HD2 H 21.333 12.399 16.326 1.00 . A A . 8 PHE HD2 1 1 3 448 1 1 8 PHE HE1 H 25.988 13.615 15.378 1.00 . A A . 8 PHE HE1 1 1 3 449 1 1 8 PHE HE2 H 22.724 10.882 15.097 1.00 . A A . 8 PHE HE2 1 1 3 450 1 1 8 PHE HZ H 25.084 11.477 14.592 1.00 . A A . 8 PHE HZ 1 1 3 451 1 1 8 PHE N N 20.675 15.514 15.414 1.00 . A A . 8 PHE N 1 1 3 452 1 1 8 PHE O O 22.836 17.646 17.362 1.00 . A A . 8 PHE O 1 1 3 453 1 1 9 LEU C C 22.834 19.684 14.409 1.00 . A A . 9 LEU C 1 1 3 454 1 1 9 LEU CA C 23.616 18.486 14.827 1.00 . A A . 9 LEU CA 1 1 3 455 1 1 9 LEU CB C 24.648 18.241 13.714 1.00 . A A . 9 LEU CB 1 1 3 456 1 1 9 LEU CD1 C 26.043 16.731 12.254 1.00 . A A . 9 LEU CD1 1 1 3 457 1 1 9 LEU CD2 C 26.458 16.660 14.700 1.00 . A A . 9 LEU CD2 1 1 3 458 1 1 9 LEU CG C 25.376 16.889 13.631 1.00 . A A . 9 LEU CG 1 1 3 459 1 1 9 LEU H H 22.513 16.762 14.399 1.00 . A A . 9 LEU H 1 1 3 460 1 1 9 LEU HA H 24.167 18.769 15.711 1.00 . A A . 9 LEU HA 1 1 3 461 1 1 9 LEU HB2 H 24.265 18.475 12.698 1.00 . A A . 9 LEU HB2 1 1 3 462 1 1 9 LEU HB3 H 25.453 18.982 13.912 1.00 . A A . 9 LEU HB3 1 1 3 463 1 1 9 LEU HD11 H 26.764 17.559 12.082 1.00 . A A . 9 LEU HD11 1 1 3 464 1 1 9 LEU HD12 H 25.277 16.720 11.449 1.00 . A A . 9 LEU HD12 1 1 3 465 1 1 9 LEU HD13 H 26.597 15.768 12.248 1.00 . A A . 9 LEU HD13 1 1 3 466 1 1 9 LEU HD21 H 27.235 17.453 14.656 1.00 . A A . 9 LEU HD21 1 1 3 467 1 1 9 LEU HD22 H 26.935 15.683 14.471 1.00 . A A . 9 LEU HD22 1 1 3 468 1 1 9 LEU HD23 H 26.004 16.586 15.712 1.00 . A A . 9 LEU HD23 1 1 3 469 1 1 9 LEU HG H 24.696 16.017 13.729 1.00 . A A . 9 LEU HG 1 1 3 470 1 1 9 LEU N N 22.767 17.379 15.141 1.00 . A A . 9 LEU N 1 1 3 471 1 1 9 LEU O O 23.406 20.666 13.940 1.00 . A A . 9 LEU O 1 1 3 472 1 1 10 CYS C C 20.275 21.770 14.489 1.00 . A A . 10 CYS C 1 1 3 473 1 1 10 CYS CA C 20.667 20.538 13.749 1.00 . A A . 10 CYS CA 1 1 3 474 1 1 10 CYS CB C 19.427 19.845 13.160 1.00 . A A . 10 CYS CB 1 1 3 475 1 1 10 CYS H H 21.069 18.890 15.000 1.00 . A A . 10 CYS H 1 1 3 476 1 1 10 CYS HA H 21.229 20.900 12.902 1.00 . A A . 10 CYS HA 1 1 3 477 1 1 10 CYS HB2 H 19.743 18.824 12.860 1.00 . A A . 10 CYS HB2 1 1 3 478 1 1 10 CYS HB3 H 18.617 19.697 13.906 1.00 . A A . 10 CYS HB3 1 1 3 479 1 1 10 CYS N N 21.492 19.627 14.479 1.00 . A A . 10 CYS N 1 1 3 480 1 1 10 CYS O O 19.996 22.801 13.876 1.00 . A A . 10 CYS O 1 1 3 481 1 1 10 CYS SG S 18.793 20.668 11.670 1.00 . A A . 10 CYS SG 1 1 3 482 1 1 11 CYS C C 20.633 23.840 17.015 1.00 . A A . 11 CYS C 1 1 3 483 1 1 11 CYS CA C 19.593 22.824 16.565 1.00 . A A . 11 CYS CA 1 1 3 484 1 1 11 CYS CB C 18.832 22.265 17.780 1.00 . A A . 11 CYS CB 1 1 3 485 1 1 11 CYS H H 20.521 20.985 16.372 1.00 . A A . 11 CYS H 1 1 3 486 1 1 11 CYS HA H 18.891 23.323 15.914 1.00 . A A . 11 CYS HA 1 1 3 487 1 1 11 CYS HB2 H 19.555 21.719 18.423 1.00 . A A . 11 CYS HB2 1 1 3 488 1 1 11 CYS HB3 H 18.375 23.050 18.420 1.00 . A A . 11 CYS HB3 1 1 3 489 1 1 11 CYS N N 20.211 21.763 15.832 1.00 . A A . 11 CYS N 1 1 3 490 1 1 11 CYS O O 21.538 23.505 17.824 1.00 . A A . 11 CYS O 1 1 3 491 1 1 11 CYS OXT O 20.571 25.017 16.567 1.00 . A A . 11 CYS OXT 1 1 3 492 1 1 11 CYS SG S 17.558 21.119 17.181 1.00 . A A . 11 CYS SG 1 1 4 493 1 1 1 SER C C 13.351 23.407 13.027 1.00 . A A . 1 SER C 1 1 4 494 1 1 1 SER CA C 13.337 24.865 13.332 1.00 . A A . 1 SER CA 1 1 4 495 1 1 1 SER CB C 14.172 25.138 14.594 1.00 . A A . 1 SER CB 1 1 4 496 1 1 1 SER H1 H 11.250 24.830 12.987 1.00 . A A . 1 SER H1 1 1 4 497 1 1 1 SER H2 H 11.918 26.369 13.038 1.00 . A A . 1 SER H2 1 1 4 498 1 1 1 SER H3 H 11.698 25.520 14.455 1.00 . A A . 1 SER H3 1 1 4 499 1 1 1 SER HA H 13.801 25.361 12.492 1.00 . A A . 1 SER HA 1 1 4 500 1 1 1 SER HB2 H 13.709 24.663 15.485 1.00 . A A . 1 SER HB2 1 1 4 501 1 1 1 SER HB3 H 15.201 24.730 14.502 1.00 . A A . 1 SER HB3 1 1 4 502 1 1 1 SER HG H 14.936 26.667 15.512 1.00 . A A . 1 SER HG 1 1 4 503 1 1 1 SER N N 11.969 25.417 13.456 1.00 . A A . 1 SER N 1 1 4 504 1 1 1 SER O O 12.333 22.721 13.123 1.00 . A A . 1 SER O 1 1 4 505 1 1 1 SER OG O 14.281 26.535 14.822 1.00 . A A . 1 SER OG 1 1 4 506 1 1 2 CYS C C 14.540 20.533 13.391 1.00 . A A . 2 CYS C 1 1 4 507 1 1 2 CYS CA C 14.668 21.492 12.258 1.00 . A A . 2 CYS CA 1 1 4 508 1 1 2 CYS CB C 15.976 21.234 11.489 1.00 . A A . 2 CYS CB 1 1 4 509 1 1 2 CYS H H 15.319 23.447 12.528 1.00 . A A . 2 CYS H 1 1 4 510 1 1 2 CYS HA H 13.840 21.252 11.609 1.00 . A A . 2 CYS HA 1 1 4 511 1 1 2 CYS HB2 H 16.185 20.145 11.418 1.00 . A A . 2 CYS HB2 1 1 4 512 1 1 2 CYS HB3 H 15.890 21.571 10.434 1.00 . A A . 2 CYS HB3 1 1 4 513 1 1 2 CYS N N 14.515 22.864 12.627 1.00 . A A . 2 CYS N 1 1 4 514 1 1 2 CYS O O 14.504 20.895 14.566 1.00 . A A . 2 CYS O 1 1 4 515 1 1 2 CYS SG S 17.443 22.050 12.182 1.00 . A A . 2 CYS SG 1 1 4 516 1 1 3 SER C C 15.326 17.798 14.778 1.00 . A A . 3 SER C 1 1 4 517 1 1 3 SER CA C 14.144 18.157 13.944 1.00 . A A . 3 SER CA 1 1 4 518 1 1 3 SER CB C 13.659 16.914 13.179 1.00 . A A . 3 SER CB 1 1 4 519 1 1 3 SER H H 14.466 18.981 12.086 1.00 . A A . 3 SER H 1 1 4 520 1 1 3 SER HA H 13.386 18.519 14.622 1.00 . A A . 3 SER HA 1 1 4 521 1 1 3 SER HB2 H 13.555 16.015 13.823 1.00 . A A . 3 SER HB2 1 1 4 522 1 1 3 SER HB3 H 12.660 17.127 12.742 1.00 . A A . 3 SER HB3 1 1 4 523 1 1 3 SER HG H 14.434 17.194 11.427 1.00 . A A . 3 SER HG 1 1 4 524 1 1 3 SER N N 14.420 19.237 13.049 1.00 . A A . 3 SER N 1 1 4 525 1 1 3 SER O O 16.275 17.152 14.336 1.00 . A A . 3 SER O 1 1 4 526 1 1 3 SER OG O 14.526 16.536 12.120 1.00 . A A . 3 SER OG 1 1 4 527 1 1 4 CYS C C 16.273 16.652 17.612 1.00 . A A . 4 CYS C 1 1 4 528 1 1 4 CYS CA C 16.374 18.000 16.986 1.00 . A A . 4 CYS CA 1 1 4 529 1 1 4 CYS CB C 16.343 19.079 18.081 1.00 . A A . 4 CYS CB 1 1 4 530 1 1 4 CYS H H 14.489 18.668 16.401 1.00 . A A . 4 CYS H 1 1 4 531 1 1 4 CYS HA H 17.316 18.032 16.458 1.00 . A A . 4 CYS HA 1 1 4 532 1 1 4 CYS HB2 H 16.028 20.021 17.582 1.00 . A A . 4 CYS HB2 1 1 4 533 1 1 4 CYS HB3 H 15.606 18.847 18.879 1.00 . A A . 4 CYS HB3 1 1 4 534 1 1 4 CYS N N 15.302 18.202 16.060 1.00 . A A . 4 CYS N 1 1 4 535 1 1 4 CYS O O 17.270 16.044 17.999 1.00 . A A . 4 CYS O 1 1 4 536 1 1 4 CYS SG S 17.972 19.314 18.849 1.00 . A A . 4 CYS SG 1 1 4 537 1 1 5 LYS C C 15.459 13.776 17.163 1.00 . A A . 5 LYS C 1 1 4 538 1 1 5 LYS CA C 14.773 14.751 18.058 1.00 . A A . 5 LYS CA 1 1 4 539 1 1 5 LYS CB C 13.266 14.450 17.998 1.00 . A A . 5 LYS CB 1 1 4 540 1 1 5 LYS CD C 12.332 16.346 19.507 1.00 . A A . 5 LYS CD 1 1 4 541 1 1 5 LYS CE C 11.257 16.629 20.560 1.00 . A A . 5 LYS CE 1 1 4 542 1 1 5 LYS CG C 12.443 14.847 19.225 1.00 . A A . 5 LYS CG 1 1 4 543 1 1 5 LYS H H 14.252 16.637 17.404 1.00 . A A . 5 LYS H 1 1 4 544 1 1 5 LYS HA H 15.175 14.584 19.046 1.00 . A A . 5 LYS HA 1 1 4 545 1 1 5 LYS HB2 H 12.804 14.930 17.110 1.00 . A A . 5 LYS HB2 1 1 4 546 1 1 5 LYS HB3 H 13.106 13.355 17.896 1.00 . A A . 5 LYS HB3 1 1 4 547 1 1 5 LYS HD2 H 13.314 16.725 19.858 1.00 . A A . 5 LYS HD2 1 1 4 548 1 1 5 LYS HD3 H 12.063 16.878 18.570 1.00 . A A . 5 LYS HD3 1 1 4 549 1 1 5 LYS HE2 H 10.248 16.378 20.167 1.00 . A A . 5 LYS HE2 1 1 4 550 1 1 5 LYS HE3 H 11.441 16.010 21.464 1.00 . A A . 5 LYS HE3 1 1 4 551 1 1 5 LYS HG2 H 11.417 14.460 19.045 1.00 . A A . 5 LYS HG2 1 1 4 552 1 1 5 LYS HG3 H 12.835 14.321 20.122 1.00 . A A . 5 LYS HG3 1 1 4 553 1 1 5 LYS HZ1 H 12.196 18.294 21.345 1.00 . A A . 5 LYS HZ1 1 1 4 554 1 1 5 LYS HZ2 H 10.554 18.191 21.733 1.00 . A A . 5 LYS HZ2 1 1 4 555 1 1 5 LYS HZ3 H 11.024 18.683 20.186 1.00 . A A . 5 LYS HZ3 1 1 4 556 1 1 5 LYS N N 15.048 16.102 17.679 1.00 . A A . 5 LYS N 1 1 4 557 1 1 5 LYS NZ N 11.255 18.048 20.977 1.00 . A A . 5 LYS NZ 1 1 4 558 1 1 5 LYS O O 16.103 12.835 17.621 1.00 . A A . 5 LYS O 1 1 4 559 1 1 6 ARG C C 17.497 13.585 14.730 1.00 . A A . 6 ARG C 1 1 4 560 1 1 6 ARG CA C 16.067 13.188 14.868 1.00 . A A . 6 ARG CA 1 1 4 561 1 1 6 ARG CB C 15.342 13.412 13.530 1.00 . A A . 6 ARG CB 1 1 4 562 1 1 6 ARG CD C 13.099 13.476 12.419 1.00 . A A . 6 ARG CD 1 1 4 563 1 1 6 ARG CG C 14.007 12.685 13.364 1.00 . A A . 6 ARG CG 1 1 4 564 1 1 6 ARG CZ C 12.219 11.534 11.075 1.00 . A A . 6 ARG CZ 1 1 4 565 1 1 6 ARG H H 14.828 14.726 15.461 1.00 . A A . 6 ARG H 1 1 4 566 1 1 6 ARG HA H 16.037 12.142 15.131 1.00 . A A . 6 ARG HA 1 1 4 567 1 1 6 ARG HB2 H 15.106 14.491 13.409 1.00 . A A . 6 ARG HB2 1 1 4 568 1 1 6 ARG HB3 H 15.918 13.065 12.645 1.00 . A A . 6 ARG HB3 1 1 4 569 1 1 6 ARG HD2 H 12.622 14.377 12.858 1.00 . A A . 6 ARG HD2 1 1 4 570 1 1 6 ARG HD3 H 13.606 13.900 11.526 1.00 . A A . 6 ARG HD3 1 1 4 571 1 1 6 ARG HE H 11.149 12.517 12.461 1.00 . A A . 6 ARG HE 1 1 4 572 1 1 6 ARG HG2 H 14.297 11.681 12.989 1.00 . A A . 6 ARG HG2 1 1 4 573 1 1 6 ARG HG3 H 13.627 12.491 14.390 1.00 . A A . 6 ARG HG3 1 1 4 574 1 1 6 ARG HH11 H 13.984 12.220 10.269 1.00 . A A . 6 ARG HH11 1 1 4 575 1 1 6 ARG HH12 H 13.521 10.619 9.793 1.00 . A A . 6 ARG HH12 1 1 4 576 1 1 6 ARG HH21 H 10.542 10.489 11.632 1.00 . A A . 6 ARG HH21 1 1 4 577 1 1 6 ARG HH22 H 11.300 9.957 10.155 1.00 . A A . 6 ARG HH22 1 1 4 578 1 1 6 ARG N N 15.374 13.982 15.836 1.00 . A A . 6 ARG N 1 1 4 579 1 1 6 ARG NE N 12.028 12.535 11.984 1.00 . A A . 6 ARG NE 1 1 4 580 1 1 6 ARG NH1 N 13.318 11.476 10.267 1.00 . A A . 6 ARG NH1 1 1 4 581 1 1 6 ARG NH2 N 11.282 10.547 10.962 1.00 . A A . 6 ARG NH2 1 1 4 582 1 1 6 ARG O O 18.416 12.937 15.227 1.00 . A A . 6 ARG O 1 1 4 583 1 1 7 ASN C C 19.557 16.133 14.655 1.00 . A A . 7 ASN C 1 1 4 584 1 1 7 ASN CA C 19.031 15.174 13.643 1.00 . A A . 7 ASN CA 1 1 4 585 1 1 7 ASN CB C 19.082 15.784 12.232 1.00 . A A . 7 ASN CB 1 1 4 586 1 1 7 ASN CG C 18.307 14.876 11.288 1.00 . A A . 7 ASN CG 1 1 4 587 1 1 7 ASN H H 16.932 15.180 13.667 1.00 . A A . 7 ASN H 1 1 4 588 1 1 7 ASN HA H 19.699 14.327 13.634 1.00 . A A . 7 ASN HA 1 1 4 589 1 1 7 ASN HB2 H 18.707 16.828 12.172 1.00 . A A . 7 ASN HB2 1 1 4 590 1 1 7 ASN HB3 H 20.132 15.816 11.869 1.00 . A A . 7 ASN HB3 1 1 4 591 1 1 7 ASN HD21 H 16.684 16.145 11.266 1.00 . A A . 7 ASN HD21 1 1 4 592 1 1 7 ASN HD22 H 16.516 14.690 10.346 1.00 . A A . 7 ASN HD22 1 1 4 593 1 1 7 ASN N N 17.734 14.695 14.010 1.00 . A A . 7 ASN N 1 1 4 594 1 1 7 ASN ND2 N 17.083 15.310 10.887 1.00 . A A . 7 ASN ND2 1 1 4 595 1 1 7 ASN O O 19.438 17.351 14.534 1.00 . A A . 7 ASN O 1 1 4 596 1 1 7 ASN OD1 O 18.742 13.777 10.945 1.00 . A A . 7 ASN OD1 1 1 4 597 1 1 8 PHE C C 21.663 17.376 16.682 1.00 . A A . 8 PHE C 1 1 4 598 1 1 8 PHE CA C 20.592 16.359 16.881 1.00 . A A . 8 PHE CA 1 1 4 599 1 1 8 PHE CB C 20.960 15.392 18.019 1.00 . A A . 8 PHE CB 1 1 4 600 1 1 8 PHE CD1 C 23.277 14.564 17.565 1.00 . A A . 8 PHE CD1 1 1 4 601 1 1 8 PHE CD2 C 21.479 13.028 17.496 1.00 . A A . 8 PHE CD2 1 1 4 602 1 1 8 PHE CE1 C 24.158 13.541 17.303 1.00 . A A . 8 PHE CE1 1 1 4 603 1 1 8 PHE CE2 C 22.357 11.999 17.255 1.00 . A A . 8 PHE CE2 1 1 4 604 1 1 8 PHE CG C 21.929 14.317 17.660 1.00 . A A . 8 PHE CG 1 1 4 605 1 1 8 PHE CZ C 23.705 12.253 17.149 1.00 . A A . 8 PHE CZ 1 1 4 606 1 1 8 PHE H H 20.296 14.633 15.791 1.00 . A A . 8 PHE H 1 1 4 607 1 1 8 PHE HA H 19.733 16.935 17.193 1.00 . A A . 8 PHE HA 1 1 4 608 1 1 8 PHE HB2 H 21.352 15.937 18.904 1.00 . A A . 8 PHE HB2 1 1 4 609 1 1 8 PHE HB3 H 20.040 14.866 18.353 1.00 . A A . 8 PHE HB3 1 1 4 610 1 1 8 PHE HD1 H 23.688 15.553 17.707 1.00 . A A . 8 PHE HD1 1 1 4 611 1 1 8 PHE HD2 H 20.431 12.779 17.583 1.00 . A A . 8 PHE HD2 1 1 4 612 1 1 8 PHE HE1 H 25.212 13.763 17.224 1.00 . A A . 8 PHE HE1 1 1 4 613 1 1 8 PHE HE2 H 21.968 10.997 17.154 1.00 . A A . 8 PHE HE2 1 1 4 614 1 1 8 PHE HZ H 24.400 11.449 16.952 1.00 . A A . 8 PHE HZ 1 1 4 615 1 1 8 PHE N N 20.200 15.623 15.721 1.00 . A A . 8 PHE N 1 1 4 616 1 1 8 PHE O O 21.862 18.271 17.501 1.00 . A A . 8 PHE O 1 1 4 617 1 1 9 LEU C C 22.766 19.466 14.494 1.00 . A A . 9 LEU C 1 1 4 618 1 1 9 LEU CA C 23.368 18.289 15.181 1.00 . A A . 9 LEU CA 1 1 4 619 1 1 9 LEU CB C 24.523 17.801 14.291 1.00 . A A . 9 LEU CB 1 1 4 620 1 1 9 LEU CD1 C 26.112 16.067 13.422 1.00 . A A . 9 LEU CD1 1 1 4 621 1 1 9 LEU CD2 C 26.058 16.388 15.861 1.00 . A A . 9 LEU CD2 1 1 4 622 1 1 9 LEU CG C 25.190 16.448 14.591 1.00 . A A . 9 LEU CG 1 1 4 623 1 1 9 LEU H H 22.225 16.528 14.960 1.00 . A A . 9 LEU H 1 1 4 624 1 1 9 LEU HA H 23.800 18.702 16.081 1.00 . A A . 9 LEU HA 1 1 4 625 1 1 9 LEU HB2 H 24.280 17.825 13.208 1.00 . A A . 9 LEU HB2 1 1 4 626 1 1 9 LEU HB3 H 25.328 18.553 14.434 1.00 . A A . 9 LEU HB3 1 1 4 627 1 1 9 LEU HD11 H 26.856 16.875 13.250 1.00 . A A . 9 LEU HD11 1 1 4 628 1 1 9 LEU HD12 H 25.514 15.900 12.500 1.00 . A A . 9 LEU HD12 1 1 4 629 1 1 9 LEU HD13 H 26.653 15.136 13.696 1.00 . A A . 9 LEU HD13 1 1 4 630 1 1 9 LEU HD21 H 26.511 15.374 15.886 1.00 . A A . 9 LEU HD21 1 1 4 631 1 1 9 LEU HD22 H 25.450 16.507 16.782 1.00 . A A . 9 LEU HD22 1 1 4 632 1 1 9 LEU HD23 H 26.875 17.139 15.819 1.00 . A A . 9 LEU HD23 1 1 4 633 1 1 9 LEU HG H 24.464 15.615 14.699 1.00 . A A . 9 LEU HG 1 1 4 634 1 1 9 LEU N N 22.404 17.303 15.562 1.00 . A A . 9 LEU N 1 1 4 635 1 1 9 LEU O O 23.462 20.435 14.196 1.00 . A A . 9 LEU O 1 1 4 636 1 1 10 CYS C C 20.565 21.727 14.162 1.00 . A A . 10 CYS C 1 1 4 637 1 1 10 CYS CA C 20.814 20.457 13.425 1.00 . A A . 10 CYS CA 1 1 4 638 1 1 10 CYS CB C 19.498 19.962 12.800 1.00 . A A . 10 CYS CB 1 1 4 639 1 1 10 CYS H H 20.912 18.681 14.552 1.00 . A A . 10 CYS H 1 1 4 640 1 1 10 CYS HA H 21.472 20.713 12.607 1.00 . A A . 10 CYS HA 1 1 4 641 1 1 10 CYS HB2 H 19.626 18.919 12.442 1.00 . A A . 10 CYS HB2 1 1 4 642 1 1 10 CYS HB3 H 18.681 19.909 13.551 1.00 . A A . 10 CYS HB3 1 1 4 643 1 1 10 CYS N N 21.450 19.449 14.214 1.00 . A A . 10 CYS N 1 1 4 644 1 1 10 CYS O O 20.337 22.778 13.564 1.00 . A A . 10 CYS O 1 1 4 645 1 1 10 CYS SG S 18.966 20.970 11.387 1.00 . A A . 10 CYS SG 1 1 4 646 1 1 11 CYS C C 20.365 23.795 16.749 1.00 . A A . 11 CYS C 1 1 4 647 1 1 11 CYS CA C 19.690 22.506 16.304 1.00 . A A . 11 CYS CA 1 1 4 648 1 1 11 CYS CB C 19.292 21.745 17.580 1.00 . A A . 11 CYS CB 1 1 4 649 1 1 11 CYS H H 20.876 20.878 15.997 1.00 . A A . 11 CYS H 1 1 4 650 1 1 11 CYS HA H 18.846 22.775 15.684 1.00 . A A . 11 CYS HA 1 1 4 651 1 1 11 CYS HB2 H 20.133 21.804 18.302 1.00 . A A . 11 CYS HB2 1 1 4 652 1 1 11 CYS HB3 H 18.409 22.169 18.104 1.00 . A A . 11 CYS HB3 1 1 4 653 1 1 11 CYS N N 20.538 21.676 15.506 1.00 . A A . 11 CYS N 1 1 4 654 1 1 11 CYS O O 19.648 24.730 17.196 1.00 . A A . 11 CYS O 1 1 4 655 1 1 11 CYS OXT O 21.620 23.902 16.709 1.00 . A A . 11 CYS OXT 1 1 4 656 1 1 11 CYS SG S 19.061 19.970 17.268 1.00 . A A . 11 CYS SG 1 1 5 657 1 1 1 SER C C 13.528 23.428 12.913 1.00 . A A . 1 SER C 1 1 5 658 1 1 1 SER CA C 13.659 24.738 13.611 1.00 . A A . 1 SER CA 1 1 5 659 1 1 1 SER CB C 13.960 24.443 15.090 1.00 . A A . 1 SER CB 1 1 5 660 1 1 1 SER H1 H 12.450 26.361 14.138 1.00 . A A . 1 SER H1 1 1 5 661 1 1 1 SER H2 H 11.577 25.032 13.612 1.00 . A A . 1 SER H2 1 1 5 662 1 1 1 SER H3 H 12.367 25.976 12.498 1.00 . A A . 1 SER H3 1 1 5 663 1 1 1 SER HA H 14.489 25.278 13.179 1.00 . A A . 1 SER HA 1 1 5 664 1 1 1 SER HB2 H 13.122 23.886 15.561 1.00 . A A . 1 SER HB2 1 1 5 665 1 1 1 SER HB3 H 14.878 23.824 15.189 1.00 . A A . 1 SER HB3 1 1 5 666 1 1 1 SER HG H 14.543 25.374 16.682 1.00 . A A . 1 SER HG 1 1 5 667 1 1 1 SER N N 12.449 25.577 13.455 1.00 . A A . 1 SER N 1 1 5 668 1 1 1 SER O O 12.417 22.968 12.657 1.00 . A A . 1 SER O 1 1 5 669 1 1 1 SER OG O 14.187 25.633 15.829 1.00 . A A . 1 SER OG 1 1 5 670 1 1 2 CYS C C 14.607 20.418 13.204 1.00 . A A . 2 CYS C 1 1 5 671 1 1 2 CYS CA C 14.647 21.406 12.089 1.00 . A A . 2 CYS CA 1 1 5 672 1 1 2 CYS CB C 15.874 21.155 11.195 1.00 . A A . 2 CYS CB 1 1 5 673 1 1 2 CYS H H 15.548 23.138 12.715 1.00 . A A . 2 CYS H 1 1 5 674 1 1 2 CYS HA H 13.748 21.238 11.515 1.00 . A A . 2 CYS HA 1 1 5 675 1 1 2 CYS HB2 H 16.074 20.068 11.083 1.00 . A A . 2 CYS HB2 1 1 5 676 1 1 2 CYS HB3 H 15.677 21.536 10.170 1.00 . A A . 2 CYS HB3 1 1 5 677 1 1 2 CYS N N 14.641 22.748 12.585 1.00 . A A . 2 CYS N 1 1 5 678 1 1 2 CYS O O 14.918 20.745 14.347 1.00 . A A . 2 CYS O 1 1 5 679 1 1 2 CYS SG S 17.363 22.038 11.742 1.00 . A A . 2 CYS SG 1 1 5 680 1 1 3 SER C C 15.194 17.712 14.631 1.00 . A A . 3 SER C 1 1 5 681 1 1 3 SER CA C 13.982 18.122 13.868 1.00 . A A . 3 SER CA 1 1 5 682 1 1 3 SER CB C 13.347 16.857 13.270 1.00 . A A . 3 SER CB 1 1 5 683 1 1 3 SER H H 14.004 18.905 11.976 1.00 . A A . 3 SER H 1 1 5 684 1 1 3 SER HA H 13.314 18.553 14.601 1.00 . A A . 3 SER HA 1 1 5 685 1 1 3 SER HB2 H 13.540 15.939 13.866 1.00 . A A . 3 SER HB2 1 1 5 686 1 1 3 SER HB3 H 12.243 16.973 13.211 1.00 . A A . 3 SER HB3 1 1 5 687 1 1 3 SER HG H 13.086 16.052 11.543 1.00 . A A . 3 SER HG 1 1 5 688 1 1 3 SER N N 14.208 19.166 12.917 1.00 . A A . 3 SER N 1 1 5 689 1 1 3 SER O O 16.098 17.059 14.112 1.00 . A A . 3 SER O 1 1 5 690 1 1 3 SER OG O 13.774 16.588 11.943 1.00 . A A . 3 SER OG 1 1 5 691 1 1 4 CYS C C 16.397 16.637 17.508 1.00 . A A . 4 CYS C 1 1 5 692 1 1 4 CYS CA C 16.411 17.915 16.743 1.00 . A A . 4 CYS CA 1 1 5 693 1 1 4 CYS CB C 16.568 19.097 17.714 1.00 . A A . 4 CYS CB 1 1 5 694 1 1 4 CYS H H 14.461 18.547 16.313 1.00 . A A . 4 CYS H 1 1 5 695 1 1 4 CYS HA H 17.302 17.900 16.132 1.00 . A A . 4 CYS HA 1 1 5 696 1 1 4 CYS HB2 H 15.889 19.904 17.364 1.00 . A A . 4 CYS HB2 1 1 5 697 1 1 4 CYS HB3 H 16.254 18.816 18.743 1.00 . A A . 4 CYS HB3 1 1 5 698 1 1 4 CYS N N 15.252 18.083 15.922 1.00 . A A . 4 CYS N 1 1 5 699 1 1 4 CYS O O 17.425 16.181 18.005 1.00 . A A . 4 CYS O 1 1 5 700 1 1 4 CYS SG S 18.267 19.735 17.765 1.00 . A A . 4 CYS SG 1 1 5 701 1 1 5 LYS C C 15.694 13.647 17.291 1.00 . A A . 5 LYS C 1 1 5 702 1 1 5 LYS CA C 15.144 14.672 18.222 1.00 . A A . 5 LYS CA 1 1 5 703 1 1 5 LYS CB C 13.690 14.318 18.576 1.00 . A A . 5 LYS CB 1 1 5 704 1 1 5 LYS CD C 13.133 16.391 20.057 1.00 . A A . 5 LYS CD 1 1 5 705 1 1 5 LYS CE C 12.618 16.816 21.434 1.00 . A A . 5 LYS CE 1 1 5 706 1 1 5 LYS CG C 13.170 14.870 19.905 1.00 . A A . 5 LYS CG 1 1 5 707 1 1 5 LYS H H 14.381 16.377 17.315 1.00 . A A . 5 LYS H 1 1 5 708 1 1 5 LYS HA H 15.770 14.634 19.102 1.00 . A A . 5 LYS HA 1 1 5 709 1 1 5 LYS HB2 H 12.998 14.635 17.767 1.00 . A A . 5 LYS HB2 1 1 5 710 1 1 5 LYS HB3 H 13.595 13.214 18.662 1.00 . A A . 5 LYS HB3 1 1 5 711 1 1 5 LYS HD2 H 14.158 16.797 19.929 1.00 . A A . 5 LYS HD2 1 1 5 712 1 1 5 LYS HD3 H 12.487 16.822 19.261 1.00 . A A . 5 LYS HD3 1 1 5 713 1 1 5 LYS HE2 H 11.578 16.458 21.587 1.00 . A A . 5 LYS HE2 1 1 5 714 1 1 5 LYS HE3 H 13.271 16.393 22.228 1.00 . A A . 5 LYS HE3 1 1 5 715 1 1 5 LYS HG2 H 12.133 14.488 20.019 1.00 . A A . 5 LYS HG2 1 1 5 716 1 1 5 LYS HG3 H 13.772 14.439 20.734 1.00 . A A . 5 LYS HG3 1 1 5 717 1 1 5 LYS HZ1 H 11.658 18.664 21.467 1.00 . A A . 5 LYS HZ1 1 1 5 718 1 1 5 LYS HZ2 H 13.230 18.742 20.875 1.00 . A A . 5 LYS HZ2 1 1 5 719 1 1 5 LYS HZ3 H 12.982 18.578 22.517 1.00 . A A . 5 LYS HZ3 1 1 5 720 1 1 5 LYS N N 15.234 15.974 17.637 1.00 . A A . 5 LYS N 1 1 5 721 1 1 5 LYS NZ N 12.621 18.289 21.585 1.00 . A A . 5 LYS NZ 1 1 5 722 1 1 5 LYS O O 16.333 12.682 17.706 1.00 . A A . 5 LYS O 1 1 5 723 1 1 6 ARG C C 17.566 13.615 14.730 1.00 . A A . 6 ARG C 1 1 5 724 1 1 6 ARG CA C 16.178 13.117 14.941 1.00 . A A . 6 ARG CA 1 1 5 725 1 1 6 ARG CB C 15.385 13.321 13.640 1.00 . A A . 6 ARG CB 1 1 5 726 1 1 6 ARG CD C 13.058 13.292 12.747 1.00 . A A . 6 ARG CD 1 1 5 727 1 1 6 ARG CG C 14.103 12.492 13.527 1.00 . A A . 6 ARG CG 1 1 5 728 1 1 6 ARG CZ C 10.718 12.405 12.537 1.00 . A A . 6 ARG CZ 1 1 5 729 1 1 6 ARG H H 14.905 14.578 15.666 1.00 . A A . 6 ARG H 1 1 5 730 1 1 6 ARG HA H 16.236 12.069 15.195 1.00 . A A . 6 ARG HA 1 1 5 731 1 1 6 ARG HB2 H 15.059 14.381 13.572 1.00 . A A . 6 ARG HB2 1 1 5 732 1 1 6 ARG HB3 H 15.935 13.036 12.717 1.00 . A A . 6 ARG HB3 1 1 5 733 1 1 6 ARG HD2 H 12.577 14.125 13.304 1.00 . A A . 6 ARG HD2 1 1 5 734 1 1 6 ARG HD3 H 13.483 13.811 11.861 1.00 . A A . 6 ARG HD3 1 1 5 735 1 1 6 ARG HE H 12.312 11.675 11.532 1.00 . A A . 6 ARG HE 1 1 5 736 1 1 6 ARG HG2 H 14.425 11.544 13.046 1.00 . A A . 6 ARG HG2 1 1 5 737 1 1 6 ARG HG3 H 13.847 12.208 14.570 1.00 . A A . 6 ARG HG3 1 1 5 738 1 1 6 ARG HH11 H 10.878 13.330 14.317 1.00 . A A . 6 ARG HH11 1 1 5 739 1 1 6 ARG HH12 H 9.274 12.995 13.811 1.00 . A A . 6 ARG HH12 1 1 5 740 1 1 6 ARG HH21 H 10.217 11.363 10.901 1.00 . A A . 6 ARG HH21 1 1 5 741 1 1 6 ARG HH22 H 8.917 12.208 11.681 1.00 . A A . 6 ARG HH22 1 1 5 742 1 1 6 ARG N N 15.509 13.847 15.974 1.00 . A A . 6 ARG N 1 1 5 743 1 1 6 ARG NE N 12.051 12.309 12.259 1.00 . A A . 6 ARG NE 1 1 5 744 1 1 6 ARG NH1 N 10.234 13.148 13.575 1.00 . A A . 6 ARG NH1 1 1 5 745 1 1 6 ARG NH2 N 9.821 11.782 11.718 1.00 . A A . 6 ARG NH2 1 1 5 746 1 1 6 ARG O O 18.542 13.107 15.279 1.00 . A A . 6 ARG O 1 1 5 747 1 1 7 ASN C C 19.370 16.243 14.696 1.00 . A A . 7 ASN C 1 1 5 748 1 1 7 ASN CA C 18.949 15.316 13.607 1.00 . A A . 7 ASN CA 1 1 5 749 1 1 7 ASN CB C 18.950 16.070 12.267 1.00 . A A . 7 ASN CB 1 1 5 750 1 1 7 ASN CG C 18.219 15.249 11.214 1.00 . A A . 7 ASN CG 1 1 5 751 1 1 7 ASN H H 16.882 15.003 13.460 1.00 . A A . 7 ASN H 1 1 5 752 1 1 7 ASN HA H 19.703 14.544 13.550 1.00 . A A . 7 ASN HA 1 1 5 753 1 1 7 ASN HB2 H 18.466 17.069 12.314 1.00 . A A . 7 ASN HB2 1 1 5 754 1 1 7 ASN HB3 H 19.991 16.226 11.910 1.00 . A A . 7 ASN HB3 1 1 5 755 1 1 7 ASN HD21 H 19.830 14.000 11.040 1.00 . A A . 7 ASN HD21 1 1 5 756 1 1 7 ASN HD22 H 18.481 13.610 10.024 1.00 . A A . 7 ASN HD22 1 1 5 757 1 1 7 ASN N N 17.709 14.669 13.905 1.00 . A A . 7 ASN N 1 1 5 758 1 1 7 ASN ND2 N 18.934 14.233 10.660 1.00 . A A . 7 ASN ND2 1 1 5 759 1 1 7 ASN O O 19.210 17.461 14.627 1.00 . A A . 7 ASN O 1 1 5 760 1 1 7 ASN OD1 O 17.052 15.470 10.892 1.00 . A A . 7 ASN OD1 1 1 5 761 1 1 8 PHE C C 21.449 17.462 16.679 1.00 . A A . 8 PHE C 1 1 5 762 1 1 8 PHE CA C 20.413 16.420 16.928 1.00 . A A . 8 PHE CA 1 1 5 763 1 1 8 PHE CB C 20.841 15.455 18.045 1.00 . A A . 8 PHE CB 1 1 5 764 1 1 8 PHE CD1 C 23.171 14.692 17.564 1.00 . A A . 8 PHE CD1 1 1 5 765 1 1 8 PHE CD2 C 21.395 13.139 17.359 1.00 . A A . 8 PHE CD2 1 1 5 766 1 1 8 PHE CE1 C 24.068 13.718 17.192 1.00 . A A . 8 PHE CE1 1 1 5 767 1 1 8 PHE CE2 C 22.286 12.162 16.984 1.00 . A A . 8 PHE CE2 1 1 5 768 1 1 8 PHE CG C 21.826 14.417 17.630 1.00 . A A . 8 PHE CG 1 1 5 769 1 1 8 PHE CZ C 23.626 12.451 16.889 1.00 . A A . 8 PHE CZ 1 1 5 770 1 1 8 PHE H H 20.062 14.714 15.815 1.00 . A A . 8 PHE H 1 1 5 771 1 1 8 PHE HA H 19.561 16.987 17.274 1.00 . A A . 8 PHE HA 1 1 5 772 1 1 8 PHE HB2 H 21.255 16.002 18.920 1.00 . A A . 8 PHE HB2 1 1 5 773 1 1 8 PHE HB3 H 19.950 14.895 18.399 1.00 . A A . 8 PHE HB3 1 1 5 774 1 1 8 PHE HD1 H 23.556 15.670 17.812 1.00 . A A . 8 PHE HD1 1 1 5 775 1 1 8 PHE HD2 H 20.359 12.853 17.458 1.00 . A A . 8 PHE HD2 1 1 5 776 1 1 8 PHE HE1 H 25.123 13.946 17.149 1.00 . A A . 8 PHE HE1 1 1 5 777 1 1 8 PHE HE2 H 21.905 11.171 16.786 1.00 . A A . 8 PHE HE2 1 1 5 778 1 1 8 PHE HZ H 24.337 11.693 16.594 1.00 . A A . 8 PHE HZ 1 1 5 779 1 1 8 PHE N N 19.987 15.707 15.763 1.00 . A A . 8 PHE N 1 1 5 780 1 1 8 PHE O O 21.551 18.445 17.411 1.00 . A A . 8 PHE O 1 1 5 781 1 1 9 LEU C C 22.534 19.465 14.420 1.00 . A A . 9 LEU C 1 1 5 782 1 1 9 LEU CA C 23.155 18.314 15.133 1.00 . A A . 9 LEU CA 1 1 5 783 1 1 9 LEU CB C 24.281 17.771 14.238 1.00 . A A . 9 LEU CB 1 1 5 784 1 1 9 LEU CD1 C 25.806 15.956 13.396 1.00 . A A . 9 LEU CD1 1 1 5 785 1 1 9 LEU CD2 C 25.865 16.450 15.822 1.00 . A A . 9 LEU CD2 1 1 5 786 1 1 9 LEU CG C 24.953 16.431 14.584 1.00 . A A . 9 LEU CG 1 1 5 787 1 1 9 LEU H H 22.029 16.526 15.025 1.00 . A A . 9 LEU H 1 1 5 788 1 1 9 LEU HA H 23.600 18.752 16.014 1.00 . A A . 9 LEU HA 1 1 5 789 1 1 9 LEU HB2 H 24.016 17.758 13.159 1.00 . A A . 9 LEU HB2 1 1 5 790 1 1 9 LEU HB3 H 25.096 18.520 14.337 1.00 . A A . 9 LEU HB3 1 1 5 791 1 1 9 LEU HD11 H 26.598 16.708 13.192 1.00 . A A . 9 LEU HD11 1 1 5 792 1 1 9 LEU HD12 H 25.172 15.814 12.496 1.00 . A A . 9 LEU HD12 1 1 5 793 1 1 9 LEU HD13 H 26.287 14.992 13.671 1.00 . A A . 9 LEU HD13 1 1 5 794 1 1 9 LEU HD21 H 26.627 17.254 15.732 1.00 . A A . 9 LEU HD21 1 1 5 795 1 1 9 LEU HD22 H 26.389 15.470 15.855 1.00 . A A . 9 LEU HD22 1 1 5 796 1 1 9 LEU HD23 H 25.280 16.554 16.761 1.00 . A A . 9 LEU HD23 1 1 5 797 1 1 9 LEU HG H 24.232 15.607 14.774 1.00 . A A . 9 LEU HG 1 1 5 798 1 1 9 LEU N N 22.205 17.340 15.574 1.00 . A A . 9 LEU N 1 1 5 799 1 1 9 LEU O O 23.227 20.341 13.904 1.00 . A A . 9 LEU O 1 1 5 800 1 1 10 CYS C C 20.083 21.711 14.378 1.00 . A A . 10 CYS C 1 1 5 801 1 1 10 CYS CA C 20.521 20.542 13.566 1.00 . A A . 10 CYS CA 1 1 5 802 1 1 10 CYS CB C 19.342 19.949 12.778 1.00 . A A . 10 CYS CB 1 1 5 803 1 1 10 CYS H H 20.657 18.817 14.761 1.00 . A A . 10 CYS H 1 1 5 804 1 1 10 CYS HA H 21.193 20.919 12.808 1.00 . A A . 10 CYS HA 1 1 5 805 1 1 10 CYS HB2 H 19.645 18.936 12.439 1.00 . A A . 10 CYS HB2 1 1 5 806 1 1 10 CYS HB3 H 18.447 19.811 13.423 1.00 . A A . 10 CYS HB3 1 1 5 807 1 1 10 CYS N N 21.194 19.546 14.341 1.00 . A A . 10 CYS N 1 1 5 808 1 1 10 CYS O O 19.517 22.665 13.847 1.00 . A A . 10 CYS O 1 1 5 809 1 1 10 CYS SG S 18.926 20.840 11.250 1.00 . A A . 10 CYS SG 1 1 5 810 1 1 11 CYS C C 21.059 23.890 16.577 1.00 . A A . 11 CYS C 1 1 5 811 1 1 11 CYS CA C 19.946 22.853 16.525 1.00 . A A . 11 CYS CA 1 1 5 812 1 1 11 CYS CB C 19.626 22.453 17.976 1.00 . A A . 11 CYS CB 1 1 5 813 1 1 11 CYS H H 20.754 20.968 16.152 1.00 . A A . 11 CYS H 1 1 5 814 1 1 11 CYS HA H 19.071 23.321 16.099 1.00 . A A . 11 CYS HA 1 1 5 815 1 1 11 CYS HB2 H 20.402 21.752 18.352 1.00 . A A . 11 CYS HB2 1 1 5 816 1 1 11 CYS HB3 H 19.664 23.329 18.658 1.00 . A A . 11 CYS HB3 1 1 5 817 1 1 11 CYS N N 20.300 21.736 15.706 1.00 . A A . 11 CYS N 1 1 5 818 1 1 11 CYS O O 22.230 23.627 16.193 1.00 . A A . 11 CYS O 1 1 5 819 1 1 11 CYS OXT O 20.770 25.025 17.040 1.00 . A A . 11 CYS OXT 1 1 5 820 1 1 11 CYS SG S 17.982 21.705 18.159 1.00 . A A . 11 CYS SG 1 1 6 821 1 1 1 SER C C 13.668 23.491 12.948 1.00 . A A . 1 SER C 1 1 6 822 1 1 1 SER CA C 13.861 24.879 13.456 1.00 . A A . 1 SER CA 1 1 6 823 1 1 1 SER CB C 14.211 24.744 14.948 1.00 . A A . 1 SER CB 1 1 6 824 1 1 1 SER H1 H 12.999 26.736 13.143 1.00 . A A . 1 SER H1 1 1 6 825 1 1 1 SER H2 H 12.072 25.721 14.110 1.00 . A A . 1 SER H2 1 1 6 826 1 1 1 SER H3 H 12.088 25.468 12.463 1.00 . A A . 1 SER H3 1 1 6 827 1 1 1 SER HA H 14.684 25.325 12.916 1.00 . A A . 1 SER HA 1 1 6 828 1 1 1 SER HB2 H 13.372 24.273 15.501 1.00 . A A . 1 SER HB2 1 1 6 829 1 1 1 SER HB3 H 15.105 24.099 15.080 1.00 . A A . 1 SER HB3 1 1 6 830 1 1 1 SER HG H 14.725 25.816 16.451 1.00 . A A . 1 SER HG 1 1 6 831 1 1 1 SER N N 12.682 25.753 13.268 1.00 . A A . 1 SER N 1 1 6 832 1 1 1 SER O O 12.544 23.000 12.867 1.00 . A A . 1 SER O 1 1 6 833 1 1 1 SER OG O 14.492 26.005 15.538 1.00 . A A . 1 SER OG 1 1 6 834 1 1 2 CYS C C 14.552 20.495 13.368 1.00 . A A . 2 CYS C 1 1 6 835 1 1 2 CYS CA C 14.668 21.403 12.192 1.00 . A A . 2 CYS CA 1 1 6 836 1 1 2 CYS CB C 15.826 20.970 11.277 1.00 . A A . 2 CYS CB 1 1 6 837 1 1 2 CYS H H 15.674 23.139 12.649 1.00 . A A . 2 CYS H 1 1 6 838 1 1 2 CYS HA H 13.739 21.273 11.658 1.00 . A A . 2 CYS HA 1 1 6 839 1 1 2 CYS HB2 H 15.968 19.868 11.295 1.00 . A A . 2 CYS HB2 1 1 6 840 1 1 2 CYS HB3 H 15.597 21.214 10.218 1.00 . A A . 2 CYS HB3 1 1 6 841 1 1 2 CYS N N 14.748 22.774 12.591 1.00 . A A . 2 CYS N 1 1 6 842 1 1 2 CYS O O 14.691 20.900 14.520 1.00 . A A . 2 CYS O 1 1 6 843 1 1 2 CYS SG S 17.396 21.807 11.641 1.00 . A A . 2 CYS SG 1 1 6 844 1 1 3 SER C C 15.249 17.764 14.778 1.00 . A A . 3 SER C 1 1 6 845 1 1 3 SER CA C 14.000 18.195 14.089 1.00 . A A . 3 SER CA 1 1 6 846 1 1 3 SER CB C 13.301 16.957 13.500 1.00 . A A . 3 SER CB 1 1 6 847 1 1 3 SER H H 14.060 18.899 12.181 1.00 . A A . 3 SER H 1 1 6 848 1 1 3 SER HA H 13.389 18.643 14.858 1.00 . A A . 3 SER HA 1 1 6 849 1 1 3 SER HB2 H 13.471 16.026 14.083 1.00 . A A . 3 SER HB2 1 1 6 850 1 1 3 SER HB3 H 12.202 17.116 13.483 1.00 . A A . 3 SER HB3 1 1 6 851 1 1 3 SER HG H 12.893 16.549 11.670 1.00 . A A . 3 SER HG 1 1 6 852 1 1 3 SER N N 14.226 19.214 13.112 1.00 . A A . 3 SER N 1 1 6 853 1 1 3 SER O O 15.939 16.843 14.345 1.00 . A A . 3 SER O 1 1 6 854 1 1 3 SER OG O 13.701 16.722 12.159 1.00 . A A . 3 SER OG 1 1 6 855 1 1 4 CYS C C 16.606 16.879 17.480 1.00 . A A . 4 CYS C 1 1 6 856 1 1 4 CYS CA C 16.722 18.142 16.700 1.00 . A A . 4 CYS CA 1 1 6 857 1 1 4 CYS CB C 17.031 19.319 17.641 1.00 . A A . 4 CYS CB 1 1 6 858 1 1 4 CYS H H 14.934 19.121 16.235 1.00 . A A . 4 CYS H 1 1 6 859 1 1 4 CYS HA H 17.580 18.035 16.052 1.00 . A A . 4 CYS HA 1 1 6 860 1 1 4 CYS HB2 H 16.726 20.240 17.099 1.00 . A A . 4 CYS HB2 1 1 6 861 1 1 4 CYS HB3 H 16.425 19.244 18.569 1.00 . A A . 4 CYS HB3 1 1 6 862 1 1 4 CYS N N 15.547 18.397 15.926 1.00 . A A . 4 CYS N 1 1 6 863 1 1 4 CYS O O 17.596 16.287 17.906 1.00 . A A . 4 CYS O 1 1 6 864 1 1 4 CYS SG S 18.791 19.422 18.076 1.00 . A A . 4 CYS SG 1 1 6 865 1 1 5 LYS C C 15.622 14.020 17.181 1.00 . A A . 5 LYS C 1 1 6 866 1 1 5 LYS CA C 15.090 15.057 18.108 1.00 . A A . 5 LYS CA 1 1 6 867 1 1 5 LYS CB C 13.587 14.790 18.300 1.00 . A A . 5 LYS CB 1 1 6 868 1 1 5 LYS CD C 12.881 16.742 19.830 1.00 . A A . 5 LYS CD 1 1 6 869 1 1 5 LYS CE C 12.256 17.138 21.170 1.00 . A A . 5 LYS CE 1 1 6 870 1 1 5 LYS CG C 12.967 15.228 19.628 1.00 . A A . 5 LYS CG 1 1 6 871 1 1 5 LYS H H 14.589 16.987 17.486 1.00 . A A . 5 LYS H 1 1 6 872 1 1 5 LYS HA H 15.624 14.901 19.033 1.00 . A A . 5 LYS HA 1 1 6 873 1 1 5 LYS HB2 H 12.983 15.218 17.472 1.00 . A A . 5 LYS HB2 1 1 6 874 1 1 5 LYS HB3 H 13.421 13.691 18.281 1.00 . A A . 5 LYS HB3 1 1 6 875 1 1 5 LYS HD2 H 13.904 17.173 19.779 1.00 . A A . 5 LYS HD2 1 1 6 876 1 1 5 LYS HD3 H 12.277 17.168 19.000 1.00 . A A . 5 LYS HD3 1 1 6 877 1 1 5 LYS HE2 H 11.247 16.688 21.295 1.00 . A A . 5 LYS HE2 1 1 6 878 1 1 5 LYS HE3 H 12.905 16.819 22.013 1.00 . A A . 5 LYS HE3 1 1 6 879 1 1 5 LYS HG2 H 11.932 14.825 19.643 1.00 . A A . 5 LYS HG2 1 1 6 880 1 1 5 LYS HG3 H 13.510 14.758 20.477 1.00 . A A . 5 LYS HG3 1 1 6 881 1 1 5 LYS HZ1 H 11.856 18.946 22.172 1.00 . A A . 5 LYS HZ1 1 1 6 882 1 1 5 LYS HZ2 H 11.384 18.910 20.552 1.00 . A A . 5 LYS HZ2 1 1 6 883 1 1 5 LYS HZ3 H 12.996 19.071 20.907 1.00 . A A . 5 LYS HZ3 1 1 6 884 1 1 5 LYS N N 15.367 16.391 17.671 1.00 . A A . 5 LYS N 1 1 6 885 1 1 5 LYS NZ N 12.119 18.610 21.224 1.00 . A A . 5 LYS NZ 1 1 6 886 1 1 5 LYS O O 16.193 13.032 17.639 1.00 . A A . 5 LYS O 1 1 6 887 1 1 6 ARG C C 17.513 13.534 14.674 1.00 . A A . 6 ARG C 1 1 6 888 1 1 6 ARG CA C 16.071 13.251 14.921 1.00 . A A . 6 ARG CA 1 1 6 889 1 1 6 ARG CB C 15.325 13.368 13.581 1.00 . A A . 6 ARG CB 1 1 6 890 1 1 6 ARG CD C 13.133 13.420 12.433 1.00 . A A . 6 ARG CD 1 1 6 891 1 1 6 ARG CG C 13.940 12.720 13.529 1.00 . A A . 6 ARG CG 1 1 6 892 1 1 6 ARG CZ C 11.931 11.507 11.297 1.00 . A A . 6 ARG CZ 1 1 6 893 1 1 6 ARG H H 14.998 14.928 15.432 1.00 . A A . 6 ARG H 1 1 6 894 1 1 6 ARG HA H 15.996 12.239 15.289 1.00 . A A . 6 ARG HA 1 1 6 895 1 1 6 ARG HB2 H 15.164 14.438 13.331 1.00 . A A . 6 ARG HB2 1 1 6 896 1 1 6 ARG HB3 H 15.871 12.864 12.756 1.00 . A A . 6 ARG HB3 1 1 6 897 1 1 6 ARG HD2 H 12.795 14.435 12.731 1.00 . A A . 6 ARG HD2 1 1 6 898 1 1 6 ARG HD3 H 13.694 13.630 11.497 1.00 . A A . 6 ARG HD3 1 1 6 899 1 1 6 ARG HE H 11.024 13.017 12.239 1.00 . A A . 6 ARG HE 1 1 6 900 1 1 6 ARG HG2 H 14.137 11.639 13.370 1.00 . A A . 6 ARG HG2 1 1 6 901 1 1 6 ARG HG3 H 13.535 12.759 14.563 1.00 . A A . 6 ARG HG3 1 1 6 902 1 1 6 ARG HH11 H 13.812 10.830 11.711 1.00 . A A . 6 ARG HH11 1 1 6 903 1 1 6 ARG HH12 H 12.890 9.844 10.688 1.00 . A A . 6 ARG HH12 1 1 6 904 1 1 6 ARG HH21 H 10.026 11.775 10.637 1.00 . A A . 6 ARG HH21 1 1 6 905 1 1 6 ARG HH22 H 10.822 10.398 10.009 1.00 . A A . 6 ARG HH22 1 1 6 906 1 1 6 ARG N N 15.480 14.162 15.851 1.00 . A A . 6 ARG N 1 1 6 907 1 1 6 ARG NE N 11.928 12.612 12.098 1.00 . A A . 6 ARG NE 1 1 6 908 1 1 6 ARG NH1 N 13.047 10.753 11.071 1.00 . A A . 6 ARG NH1 1 1 6 909 1 1 6 ARG NH2 N 10.763 11.105 10.714 1.00 . A A . 6 ARG NH2 1 1 6 910 1 1 6 ARG O O 18.410 12.845 15.157 1.00 . A A . 6 ARG O 1 1 6 911 1 1 7 ASN C C 19.673 15.877 14.632 1.00 . A A . 7 ASN C 1 1 6 912 1 1 7 ASN CA C 19.141 14.988 13.563 1.00 . A A . 7 ASN CA 1 1 6 913 1 1 7 ASN CB C 19.317 15.611 12.168 1.00 . A A . 7 ASN CB 1 1 6 914 1 1 7 ASN CG C 18.697 14.676 11.139 1.00 . A A . 7 ASN CG 1 1 6 915 1 1 7 ASN H H 17.029 15.069 13.497 1.00 . A A . 7 ASN H 1 1 6 916 1 1 7 ASN HA H 19.763 14.104 13.567 1.00 . A A . 7 ASN HA 1 1 6 917 1 1 7 ASN HB2 H 18.882 16.627 12.057 1.00 . A A . 7 ASN HB2 1 1 6 918 1 1 7 ASN HB3 H 20.397 15.707 11.925 1.00 . A A . 7 ASN HB3 1 1 6 919 1 1 7 ASN HD21 H 20.516 13.791 10.834 1.00 . A A . 7 ASN HD21 1 1 6 920 1 1 7 ASN HD22 H 19.186 13.025 10.027 1.00 . A A . 7 ASN HD22 1 1 6 921 1 1 7 ASN N N 17.808 14.564 13.859 1.00 . A A . 7 ASN N 1 1 6 922 1 1 7 ASN ND2 N 19.535 13.723 10.650 1.00 . A A . 7 ASN ND2 1 1 6 923 1 1 7 ASN O O 19.359 17.065 14.705 1.00 . A A . 7 ASN O 1 1 6 924 1 1 7 ASN OD1 O 17.522 14.745 10.785 1.00 . A A . 7 ASN OD1 1 1 6 925 1 1 8 PHE C C 21.836 17.139 16.613 1.00 . A A . 8 PHE C 1 1 6 926 1 1 8 PHE CA C 20.912 15.978 16.754 1.00 . A A . 8 PHE CA 1 1 6 927 1 1 8 PHE CB C 21.459 14.957 17.766 1.00 . A A . 8 PHE CB 1 1 6 928 1 1 8 PHE CD1 C 23.775 14.407 16.996 1.00 . A A . 8 PHE CD1 1 1 6 929 1 1 8 PHE CD2 C 22.155 12.687 17.056 1.00 . A A . 8 PHE CD2 1 1 6 930 1 1 8 PHE CE1 C 24.716 13.512 16.543 1.00 . A A . 8 PHE CE1 1 1 6 931 1 1 8 PHE CE2 C 23.088 11.784 16.602 1.00 . A A . 8 PHE CE2 1 1 6 932 1 1 8 PHE CG C 22.481 14.010 17.238 1.00 . A A . 8 PHE CG 1 1 6 933 1 1 8 PHE CZ C 24.371 12.197 16.330 1.00 . A A . 8 PHE CZ 1 1 6 934 1 1 8 PHE H H 20.801 14.394 15.431 1.00 . A A . 8 PHE H 1 1 6 935 1 1 8 PHE HA H 20.021 16.415 17.181 1.00 . A A . 8 PHE HA 1 1 6 936 1 1 8 PHE HB2 H 21.883 15.457 18.662 1.00 . A A . 8 PHE HB2 1 1 6 937 1 1 8 PHE HB3 H 20.615 14.325 18.115 1.00 . A A . 8 PHE HB3 1 1 6 938 1 1 8 PHE HD1 H 24.103 15.419 17.185 1.00 . A A . 8 PHE HD1 1 1 6 939 1 1 8 PHE HD2 H 21.166 12.314 17.278 1.00 . A A . 8 PHE HD2 1 1 6 940 1 1 8 PHE HE1 H 25.732 13.839 16.379 1.00 . A A . 8 PHE HE1 1 1 6 941 1 1 8 PHE HE2 H 22.795 10.751 16.490 1.00 . A A . 8 PHE HE2 1 1 6 942 1 1 8 PHE HZ H 25.110 11.489 15.987 1.00 . A A . 8 PHE HZ 1 1 6 943 1 1 8 PHE N N 20.511 15.342 15.539 1.00 . A A . 8 PHE N 1 1 6 944 1 1 8 PHE O O 22.021 17.914 17.550 1.00 . A A . 8 PHE O 1 1 6 945 1 1 9 LEU C C 22.325 19.639 14.627 1.00 . A A . 9 LEU C 1 1 6 946 1 1 9 LEU CA C 23.186 18.528 15.121 1.00 . A A . 9 LEU CA 1 1 6 947 1 1 9 LEU CB C 24.378 18.355 14.164 1.00 . A A . 9 LEU CB 1 1 6 948 1 1 9 LEU CD1 C 26.219 17.045 13.080 1.00 . A A . 9 LEU CD1 1 1 6 949 1 1 9 LEU CD2 C 26.182 17.027 15.547 1.00 . A A . 9 LEU CD2 1 1 6 950 1 1 9 LEU CG C 25.286 17.122 14.299 1.00 . A A . 9 LEU CG 1 1 6 951 1 1 9 LEU H H 22.343 16.647 14.726 1.00 . A A . 9 LEU H 1 1 6 952 1 1 9 LEU HA H 23.606 18.902 16.043 1.00 . A A . 9 LEU HA 1 1 6 953 1 1 9 LEU HB2 H 24.081 18.460 13.098 1.00 . A A . 9 LEU HB2 1 1 6 954 1 1 9 LEU HB3 H 25.036 19.225 14.380 1.00 . A A . 9 LEU HB3 1 1 6 955 1 1 9 LEU HD11 H 25.632 17.001 12.137 1.00 . A A . 9 LEU HD11 1 1 6 956 1 1 9 LEU HD12 H 26.848 16.132 13.166 1.00 . A A . 9 LEU HD12 1 1 6 957 1 1 9 LEU HD13 H 26.885 17.934 13.065 1.00 . A A . 9 LEU HD13 1 1 6 958 1 1 9 LEU HD21 H 26.807 16.117 15.422 1.00 . A A . 9 LEU HD21 1 1 6 959 1 1 9 LEU HD22 H 25.587 16.907 16.477 1.00 . A A . 9 LEU HD22 1 1 6 960 1 1 9 LEU HD23 H 26.864 17.900 15.612 1.00 . A A . 9 LEU HD23 1 1 6 961 1 1 9 LEU HG H 24.709 16.174 14.292 1.00 . A A . 9 LEU HG 1 1 6 962 1 1 9 LEU N N 22.436 17.350 15.428 1.00 . A A . 9 LEU N 1 1 6 963 1 1 9 LEU O O 22.787 20.766 14.457 1.00 . A A . 9 LEU O 1 1 6 964 1 1 10 CYS C C 19.346 21.124 14.691 1.00 . A A . 10 CYS C 1 1 6 965 1 1 10 CYS CA C 20.134 20.297 13.733 1.00 . A A . 10 CYS CA 1 1 6 966 1 1 10 CYS CB C 19.205 19.552 12.760 1.00 . A A . 10 CYS CB 1 1 6 967 1 1 10 CYS H H 20.691 18.486 14.635 1.00 . A A . 10 CYS H 1 1 6 968 1 1 10 CYS HA H 20.712 20.967 13.112 1.00 . A A . 10 CYS HA 1 1 6 969 1 1 10 CYS HB2 H 19.738 18.649 12.392 1.00 . A A . 10 CYS HB2 1 1 6 970 1 1 10 CYS HB3 H 18.286 19.186 13.267 1.00 . A A . 10 CYS HB3 1 1 6 971 1 1 10 CYS N N 21.021 19.398 14.403 1.00 . A A . 10 CYS N 1 1 6 972 1 1 10 CYS O O 18.160 21.395 14.517 1.00 . A A . 10 CYS O 1 1 6 973 1 1 10 CYS SG S 18.819 20.424 11.215 1.00 . A A . 10 CYS SG 1 1 6 974 1 1 11 CYS C C 19.771 23.919 16.276 1.00 . A A . 11 CYS C 1 1 6 975 1 1 11 CYS CA C 19.413 22.505 16.714 1.00 . A A . 11 CYS CA 1 1 6 976 1 1 11 CYS CB C 19.917 22.311 18.154 1.00 . A A . 11 CYS CB 1 1 6 977 1 1 11 CYS H H 20.922 21.278 15.937 1.00 . A A . 11 CYS H 1 1 6 978 1 1 11 CYS HA H 18.341 22.383 16.723 1.00 . A A . 11 CYS HA 1 1 6 979 1 1 11 CYS HB2 H 20.984 22.002 18.157 1.00 . A A . 11 CYS HB2 1 1 6 980 1 1 11 CYS HB3 H 19.889 23.272 18.710 1.00 . A A . 11 CYS HB3 1 1 6 981 1 1 11 CYS N N 19.988 21.590 15.777 1.00 . A A . 11 CYS N 1 1 6 982 1 1 11 CYS O O 20.966 24.181 15.977 1.00 . A A . 11 CYS O 1 1 6 983 1 1 11 CYS OXT O 18.879 24.806 16.235 1.00 . A A . 11 CYS OXT 1 1 6 984 1 1 11 CYS SG S 18.962 21.133 19.153 1.00 . A A . 11 CYS SG 1 1 7 985 1 1 1 SER C C 13.310 23.292 12.889 1.00 . A A . 1 SER C 1 1 7 986 1 1 1 SER CA C 13.386 24.665 13.463 1.00 . A A . 1 SER CA 1 1 7 987 1 1 1 SER CB C 14.282 24.614 14.711 1.00 . A A . 1 SER CB 1 1 7 988 1 1 1 SER H1 H 11.434 25.207 12.953 1.00 . A A . 1 SER H1 1 1 7 989 1 1 1 SER H2 H 12.167 26.228 14.085 1.00 . A A . 1 SER H2 1 1 7 990 1 1 1 SER H3 H 11.611 24.708 14.556 1.00 . A A . 1 SER H3 1 1 7 991 1 1 1 SER HA H 13.833 25.304 12.715 1.00 . A A . 1 SER HA 1 1 7 992 1 1 1 SER HB2 H 13.800 24.012 15.511 1.00 . A A . 1 SER HB2 1 1 7 993 1 1 1 SER HB3 H 15.270 24.151 14.499 1.00 . A A . 1 SER HB3 1 1 7 994 1 1 1 SER HG H 15.076 25.791 16.007 1.00 . A A . 1 SER HG 1 1 7 995 1 1 1 SER N N 12.060 25.239 13.783 1.00 . A A . 1 SER N 1 1 7 996 1 1 1 SER O O 12.263 22.646 12.913 1.00 . A A . 1 SER O 1 1 7 997 1 1 1 SER OG O 14.556 25.915 15.210 1.00 . A A . 1 SER OG 1 1 7 998 1 1 2 CYS C C 14.417 20.469 13.130 1.00 . A A . 2 CYS C 1 1 7 999 1 1 2 CYS CA C 14.583 21.403 11.981 1.00 . A A . 2 CYS CA 1 1 7 1000 1 1 2 CYS CB C 15.935 21.096 11.313 1.00 . A A . 2 CYS CB 1 1 7 1001 1 1 2 CYS H H 15.247 23.346 12.290 1.00 . A A . 2 CYS H 1 1 7 1002 1 1 2 CYS HA H 13.779 21.174 11.298 1.00 . A A . 2 CYS HA 1 1 7 1003 1 1 2 CYS HB2 H 16.113 20.000 11.264 1.00 . A A . 2 CYS HB2 1 1 7 1004 1 1 2 CYS HB3 H 15.941 21.426 10.251 1.00 . A A . 2 CYS HB3 1 1 7 1005 1 1 2 CYS N N 14.435 22.771 12.369 1.00 . A A . 2 CYS N 1 1 7 1006 1 1 2 CYS O O 14.616 20.827 14.290 1.00 . A A . 2 CYS O 1 1 7 1007 1 1 2 CYS SG S 17.320 21.906 12.163 1.00 . A A . 2 CYS SG 1 1 7 1008 1 1 3 SER C C 14.998 17.766 14.507 1.00 . A A . 3 SER C 1 1 7 1009 1 1 3 SER CA C 13.777 18.150 13.745 1.00 . A A . 3 SER CA 1 1 7 1010 1 1 3 SER CB C 13.247 16.893 13.036 1.00 . A A . 3 SER CB 1 1 7 1011 1 1 3 SER H H 13.879 18.955 11.877 1.00 . A A . 3 SER H 1 1 7 1012 1 1 3 SER HA H 13.074 18.525 14.474 1.00 . A A . 3 SER HA 1 1 7 1013 1 1 3 SER HB2 H 13.453 15.969 13.617 1.00 . A A . 3 SER HB2 1 1 7 1014 1 1 3 SER HB3 H 12.144 16.960 12.917 1.00 . A A . 3 SER HB3 1 1 7 1015 1 1 3 SER HG H 13.699 15.864 11.443 1.00 . A A . 3 SER HG 1 1 7 1016 1 1 3 SER N N 14.029 19.218 12.828 1.00 . A A . 3 SER N 1 1 7 1017 1 1 3 SER O O 15.877 17.064 14.009 1.00 . A A . 3 SER O 1 1 7 1018 1 1 3 SER OG O 13.784 16.777 11.726 1.00 . A A . 3 SER OG 1 1 7 1019 1 1 4 CYS C C 16.390 16.858 17.268 1.00 . A A . 4 CYS C 1 1 7 1020 1 1 4 CYS CA C 16.298 18.150 16.531 1.00 . A A . 4 CYS CA 1 1 7 1021 1 1 4 CYS CB C 16.402 19.312 17.533 1.00 . A A . 4 CYS CB 1 1 7 1022 1 1 4 CYS H H 14.322 18.721 16.167 1.00 . A A . 4 CYS H 1 1 7 1023 1 1 4 CYS HA H 17.155 18.209 15.876 1.00 . A A . 4 CYS HA 1 1 7 1024 1 1 4 CYS HB2 H 15.960 20.191 17.016 1.00 . A A . 4 CYS HB2 1 1 7 1025 1 1 4 CYS HB3 H 15.801 19.132 18.449 1.00 . A A . 4 CYS HB3 1 1 7 1026 1 1 4 CYS N N 15.092 18.230 15.766 1.00 . A A . 4 CYS N 1 1 7 1027 1 1 4 CYS O O 17.476 16.345 17.535 1.00 . A A . 4 CYS O 1 1 7 1028 1 1 4 CYS SG S 18.126 19.654 17.995 1.00 . A A . 4 CYS SG 1 1 7 1029 1 1 5 LYS C C 15.763 13.913 17.391 1.00 . A A . 5 LYS C 1 1 7 1030 1 1 5 LYS CA C 15.161 14.974 18.246 1.00 . A A . 5 LYS CA 1 1 7 1031 1 1 5 LYS CB C 13.704 14.566 18.520 1.00 . A A . 5 LYS CB 1 1 7 1032 1 1 5 LYS CD C 12.746 16.802 19.446 1.00 . A A . 5 LYS CD 1 1 7 1033 1 1 5 LYS CE C 11.936 17.438 20.577 1.00 . A A . 5 LYS CE 1 1 7 1034 1 1 5 LYS CG C 13.004 15.309 19.661 1.00 . A A . 5 LYS CG 1 1 7 1035 1 1 5 LYS H H 14.370 16.687 17.381 1.00 . A A . 5 LYS H 1 1 7 1036 1 1 5 LYS HA H 15.736 15.020 19.161 1.00 . A A . 5 LYS HA 1 1 7 1037 1 1 5 LYS HB2 H 13.089 14.667 17.601 1.00 . A A . 5 LYS HB2 1 1 7 1038 1 1 5 LYS HB3 H 13.678 13.494 18.810 1.00 . A A . 5 LYS HB3 1 1 7 1039 1 1 5 LYS HD2 H 13.714 17.341 19.363 1.00 . A A . 5 LYS HD2 1 1 7 1040 1 1 5 LYS HD3 H 12.197 16.930 18.490 1.00 . A A . 5 LYS HD3 1 1 7 1041 1 1 5 LYS HE2 H 10.956 16.929 20.697 1.00 . A A . 5 LYS HE2 1 1 7 1042 1 1 5 LYS HE3 H 12.494 17.373 21.537 1.00 . A A . 5 LYS HE3 1 1 7 1043 1 1 5 LYS HG2 H 12.016 14.816 19.780 1.00 . A A . 5 LYS HG2 1 1 7 1044 1 1 5 LYS HG3 H 13.568 15.154 20.605 1.00 . A A . 5 LYS HG3 1 1 7 1045 1 1 5 LYS HZ1 H 12.586 19.398 20.309 1.00 . A A . 5 LYS HZ1 1 1 7 1046 1 1 5 LYS HZ2 H 11.084 19.276 21.022 1.00 . A A . 5 LYS HZ2 1 1 7 1047 1 1 5 LYS HZ3 H 11.213 19.011 19.371 1.00 . A A . 5 LYS HZ3 1 1 7 1048 1 1 5 LYS N N 15.239 16.244 17.593 1.00 . A A . 5 LYS N 1 1 7 1049 1 1 5 LYS NZ N 11.692 18.867 20.283 1.00 . A A . 5 LYS NZ 1 1 7 1050 1 1 5 LYS O O 16.457 13.014 17.861 1.00 . A A . 5 LYS O 1 1 7 1051 1 1 6 ARG C C 17.497 13.615 14.741 1.00 . A A . 6 ARG C 1 1 7 1052 1 1 6 ARG CA C 16.103 13.191 15.057 1.00 . A A . 6 ARG CA 1 1 7 1053 1 1 6 ARG CB C 15.142 13.320 13.864 1.00 . A A . 6 ARG CB 1 1 7 1054 1 1 6 ARG CD C 12.664 13.329 13.425 1.00 . A A . 6 ARG CD 1 1 7 1055 1 1 6 ARG CG C 13.825 12.569 14.070 1.00 . A A . 6 ARG CG 1 1 7 1056 1 1 6 ARG CZ C 10.419 12.384 12.739 1.00 . A A . 6 ARG CZ 1 1 7 1057 1 1 6 ARG H H 15.015 14.817 15.751 1.00 . A A . 6 ARG H 1 1 7 1058 1 1 6 ARG HA H 16.143 12.170 15.406 1.00 . A A . 6 ARG HA 1 1 7 1059 1 1 6 ARG HB2 H 14.864 14.388 13.730 1.00 . A A . 6 ARG HB2 1 1 7 1060 1 1 6 ARG HB3 H 15.507 12.918 12.894 1.00 . A A . 6 ARG HB3 1 1 7 1061 1 1 6 ARG HD2 H 12.406 14.302 13.895 1.00 . A A . 6 ARG HD2 1 1 7 1062 1 1 6 ARG HD3 H 12.832 13.584 12.357 1.00 . A A . 6 ARG HD3 1 1 7 1063 1 1 6 ARG HE H 11.433 11.847 14.396 1.00 . A A . 6 ARG HE 1 1 7 1064 1 1 6 ARG HG2 H 14.018 11.550 13.671 1.00 . A A . 6 ARG HG2 1 1 7 1065 1 1 6 ARG HG3 H 13.745 12.426 15.168 1.00 . A A . 6 ARG HG3 1 1 7 1066 1 1 6 ARG HH11 H 10.929 13.942 11.447 1.00 . A A . 6 ARG HH11 1 1 7 1067 1 1 6 ARG HH12 H 9.478 13.116 11.072 1.00 . A A . 6 ARG HH12 1 1 7 1068 1 1 6 ARG HH21 H 9.510 10.842 13.756 1.00 . A A . 6 ARG HH21 1 1 7 1069 1 1 6 ARG HH22 H 8.611 11.461 12.414 1.00 . A A . 6 ARG HH22 1 1 7 1070 1 1 6 ARG N N 15.549 14.037 16.068 1.00 . A A . 6 ARG N 1 1 7 1071 1 1 6 ARG NE N 11.494 12.421 13.579 1.00 . A A . 6 ARG NE 1 1 7 1072 1 1 6 ARG NH1 N 10.265 13.232 11.679 1.00 . A A . 6 ARG NH1 1 1 7 1073 1 1 6 ARG NH2 N 9.437 11.468 12.978 1.00 . A A . 6 ARG NH2 1 1 7 1074 1 1 6 ARG O O 18.473 13.011 15.186 1.00 . A A . 6 ARG O 1 1 7 1075 1 1 7 ASN C C 19.441 16.166 14.718 1.00 . A A . 7 ASN C 1 1 7 1076 1 1 7 ASN CA C 18.884 15.321 13.625 1.00 . A A . 7 ASN CA 1 1 7 1077 1 1 7 ASN CB C 18.800 16.167 12.343 1.00 . A A . 7 ASN CB 1 1 7 1078 1 1 7 ASN CG C 17.874 15.521 11.322 1.00 . A A . 7 ASN CG 1 1 7 1079 1 1 7 ASN H H 16.806 15.067 13.553 1.00 . A A . 7 ASN H 1 1 7 1080 1 1 7 ASN HA H 19.590 14.523 13.452 1.00 . A A . 7 ASN HA 1 1 7 1081 1 1 7 ASN HB2 H 18.449 17.205 12.525 1.00 . A A . 7 ASN HB2 1 1 7 1082 1 1 7 ASN HB3 H 19.803 16.244 11.872 1.00 . A A . 7 ASN HB3 1 1 7 1083 1 1 7 ASN HD21 H 16.281 16.648 11.971 1.00 . A A . 7 ASN HD21 1 1 7 1084 1 1 7 ASN HD22 H 15.926 15.490 10.726 1.00 . A A . 7 ASN HD22 1 1 7 1085 1 1 7 ASN N N 17.640 14.701 13.961 1.00 . A A . 7 ASN N 1 1 7 1086 1 1 7 ASN ND2 N 16.587 15.959 11.314 1.00 . A A . 7 ASN ND2 1 1 7 1087 1 1 7 ASN O O 19.242 17.378 14.781 1.00 . A A . 7 ASN O 1 1 7 1088 1 1 7 ASN OD1 O 18.251 14.635 10.557 1.00 . A A . 7 ASN OD1 1 1 7 1089 1 1 8 PHE C C 21.747 17.231 16.654 1.00 . A A . 8 PHE C 1 1 7 1090 1 1 8 PHE CA C 20.707 16.182 16.838 1.00 . A A . 8 PHE CA 1 1 7 1091 1 1 8 PHE CB C 21.175 15.123 17.852 1.00 . A A . 8 PHE CB 1 1 7 1092 1 1 8 PHE CD1 C 23.478 14.356 17.264 1.00 . A A . 8 PHE CD1 1 1 7 1093 1 1 8 PHE CD2 C 21.664 12.862 16.968 1.00 . A A . 8 PHE CD2 1 1 7 1094 1 1 8 PHE CE1 C 24.353 13.386 16.837 1.00 . A A . 8 PHE CE1 1 1 7 1095 1 1 8 PHE CE2 C 22.531 11.888 16.533 1.00 . A A . 8 PHE CE2 1 1 7 1096 1 1 8 PHE CG C 22.127 14.107 17.323 1.00 . A A . 8 PHE CG 1 1 7 1097 1 1 8 PHE CZ C 23.880 12.149 16.466 1.00 . A A . 8 PHE CZ 1 1 7 1098 1 1 8 PHE H H 20.374 14.588 15.557 1.00 . A A . 8 PHE H 1 1 7 1099 1 1 8 PHE HA H 19.881 16.721 17.276 1.00 . A A . 8 PHE HA 1 1 7 1100 1 1 8 PHE HB2 H 21.622 15.594 18.754 1.00 . A A . 8 PHE HB2 1 1 7 1101 1 1 8 PHE HB3 H 20.290 14.542 18.189 1.00 . A A . 8 PHE HB3 1 1 7 1102 1 1 8 PHE HD1 H 23.885 15.307 17.576 1.00 . A A . 8 PHE HD1 1 1 7 1103 1 1 8 PHE HD2 H 20.621 12.597 17.049 1.00 . A A . 8 PHE HD2 1 1 7 1104 1 1 8 PHE HE1 H 25.413 13.592 16.810 1.00 . A A . 8 PHE HE1 1 1 7 1105 1 1 8 PHE HE2 H 22.143 10.917 16.265 1.00 . A A . 8 PHE HE2 1 1 7 1106 1 1 8 PHE HZ H 24.556 11.377 16.131 1.00 . A A . 8 PHE HZ 1 1 7 1107 1 1 8 PHE N N 20.206 15.566 15.648 1.00 . A A . 8 PHE N 1 1 7 1108 1 1 8 PHE O O 21.920 18.109 17.499 1.00 . A A . 8 PHE O 1 1 7 1109 1 1 9 LEU C C 22.727 19.470 14.561 1.00 . A A . 9 LEU C 1 1 7 1110 1 1 9 LEU CA C 23.382 18.282 15.179 1.00 . A A . 9 LEU CA 1 1 7 1111 1 1 9 LEU CB C 24.573 17.872 14.297 1.00 . A A . 9 LEU CB 1 1 7 1112 1 1 9 LEU CD1 C 26.247 16.246 13.343 1.00 . A A . 9 LEU CD1 1 1 7 1113 1 1 9 LEU CD2 C 26.138 16.394 15.790 1.00 . A A . 9 LEU CD2 1 1 7 1114 1 1 9 LEU CG C 25.289 16.529 14.514 1.00 . A A . 9 LEU CG 1 1 7 1115 1 1 9 LEU H H 22.310 16.490 14.876 1.00 . A A . 9 LEU H 1 1 7 1116 1 1 9 LEU HA H 23.795 18.667 16.100 1.00 . A A . 9 LEU HA 1 1 7 1117 1 1 9 LEU HB2 H 24.344 17.954 13.213 1.00 . A A . 9 LEU HB2 1 1 7 1118 1 1 9 LEU HB3 H 25.347 18.643 14.500 1.00 . A A . 9 LEU HB3 1 1 7 1119 1 1 9 LEU HD11 H 25.684 16.196 12.386 1.00 . A A . 9 LEU HD11 1 1 7 1120 1 1 9 LEU HD12 H 26.749 15.271 13.523 1.00 . A A . 9 LEU HD12 1 1 7 1121 1 1 9 LEU HD13 H 27.019 17.042 13.287 1.00 . A A . 9 LEU HD13 1 1 7 1122 1 1 9 LEU HD21 H 26.986 17.109 15.756 1.00 . A A . 9 LEU HD21 1 1 7 1123 1 1 9 LEU HD22 H 26.552 15.363 15.801 1.00 . A A . 9 LEU HD22 1 1 7 1124 1 1 9 LEU HD23 H 25.535 16.537 16.712 1.00 . A A . 9 LEU HD23 1 1 7 1125 1 1 9 LEU HG H 24.586 15.670 14.555 1.00 . A A . 9 LEU HG 1 1 7 1126 1 1 9 LEU N N 22.455 17.245 15.511 1.00 . A A . 9 LEU N 1 1 7 1127 1 1 9 LEU O O 23.400 20.435 14.203 1.00 . A A . 9 LEU O 1 1 7 1128 1 1 10 CYS C C 20.301 21.682 14.513 1.00 . A A . 10 CYS C 1 1 7 1129 1 1 10 CYS CA C 20.714 20.517 13.681 1.00 . A A . 10 CYS CA 1 1 7 1130 1 1 10 CYS CB C 19.519 19.959 12.889 1.00 . A A . 10 CYS CB 1 1 7 1131 1 1 10 CYS H H 20.865 18.724 14.774 1.00 . A A . 10 CYS H 1 1 7 1132 1 1 10 CYS HA H 21.389 20.920 12.941 1.00 . A A . 10 CYS HA 1 1 7 1133 1 1 10 CYS HB2 H 19.831 18.986 12.453 1.00 . A A . 10 CYS HB2 1 1 7 1134 1 1 10 CYS HB3 H 18.654 19.752 13.555 1.00 . A A . 10 CYS HB3 1 1 7 1135 1 1 10 CYS N N 21.391 19.488 14.408 1.00 . A A . 10 CYS N 1 1 7 1136 1 1 10 CYS O O 19.947 22.732 13.980 1.00 . A A . 10 CYS O 1 1 7 1137 1 1 10 CYS SG S 18.997 20.987 11.487 1.00 . A A . 10 CYS SG 1 1 7 1138 1 1 11 CYS C C 21.118 23.713 16.818 1.00 . A A . 11 CYS C 1 1 7 1139 1 1 11 CYS CA C 20.002 22.684 16.716 1.00 . A A . 11 CYS CA 1 1 7 1140 1 1 11 CYS CB C 19.721 22.251 18.165 1.00 . A A . 11 CYS CB 1 1 7 1141 1 1 11 CYS H H 20.821 20.817 16.270 1.00 . A A . 11 CYS H 1 1 7 1142 1 1 11 CYS HA H 19.130 23.161 16.293 1.00 . A A . 11 CYS HA 1 1 7 1143 1 1 11 CYS HB2 H 20.480 21.508 18.493 1.00 . A A . 11 CYS HB2 1 1 7 1144 1 1 11 CYS HB3 H 19.828 23.111 18.860 1.00 . A A . 11 CYS HB3 1 1 7 1145 1 1 11 CYS N N 20.371 21.605 15.854 1.00 . A A . 11 CYS N 1 1 7 1146 1 1 11 CYS O O 20.847 24.852 17.283 1.00 . A A . 11 CYS O 1 1 7 1147 1 1 11 CYS OXT O 22.295 23.424 16.473 1.00 . A A . 11 CYS OXT 1 1 7 1148 1 1 11 CYS SG S 18.060 21.611 18.525 1.00 . A A . 11 CYS SG 1 1 8 1149 1 1 1 SER C C 13.489 23.471 12.721 1.00 . A A . 1 SER C 1 1 8 1150 1 1 1 SER CA C 13.649 24.774 13.426 1.00 . A A . 1 SER CA 1 1 8 1151 1 1 1 SER CB C 14.216 24.504 14.829 1.00 . A A . 1 SER CB 1 1 8 1152 1 1 1 SER H1 H 12.044 25.816 12.553 1.00 . A A . 1 SER H1 1 1 8 1153 1 1 1 SER H2 H 12.521 26.453 14.022 1.00 . A A . 1 SER H2 1 1 8 1154 1 1 1 SER H3 H 11.628 25.032 13.949 1.00 . A A . 1 SER H3 1 1 8 1155 1 1 1 SER HA H 14.368 25.352 12.863 1.00 . A A . 1 SER HA 1 1 8 1156 1 1 1 SER HB2 H 13.440 24.051 15.482 1.00 . A A . 1 SER HB2 1 1 8 1157 1 1 1 SER HB3 H 15.074 23.797 14.799 1.00 . A A . 1 SER HB3 1 1 8 1158 1 1 1 SER HG H 15.216 25.453 16.183 1.00 . A A . 1 SER HG 1 1 8 1159 1 1 1 SER N N 12.399 25.563 13.497 1.00 . A A . 1 SER N 1 1 8 1160 1 1 1 SER O O 12.378 23.055 12.399 1.00 . A A . 1 SER O 1 1 8 1161 1 1 1 SER OG O 14.695 25.704 15.418 1.00 . A A . 1 SER OG 1 1 8 1162 1 1 2 CYS C C 14.417 20.523 13.333 1.00 . A A . 2 CYS C 1 1 8 1163 1 1 2 CYS CA C 14.588 21.364 12.115 1.00 . A A . 2 CYS CA 1 1 8 1164 1 1 2 CYS CB C 15.855 20.943 11.351 1.00 . A A . 2 CYS CB 1 1 8 1165 1 1 2 CYS H H 15.496 23.165 12.574 1.00 . A A . 2 CYS H 1 1 8 1166 1 1 2 CYS HA H 13.717 21.166 11.508 1.00 . A A . 2 CYS HA 1 1 8 1167 1 1 2 CYS HB2 H 15.945 19.837 11.292 1.00 . A A . 2 CYS HB2 1 1 8 1168 1 1 2 CYS HB3 H 15.791 21.300 10.301 1.00 . A A . 2 CYS HB3 1 1 8 1169 1 1 2 CYS N N 14.595 22.753 12.454 1.00 . A A . 2 CYS N 1 1 8 1170 1 1 2 CYS O O 14.415 21.012 14.461 1.00 . A A . 2 CYS O 1 1 8 1171 1 1 2 CYS SG S 17.369 21.666 12.045 1.00 . A A . 2 CYS SG 1 1 8 1172 1 1 3 SER C C 15.169 17.831 14.943 1.00 . A A . 3 SER C 1 1 8 1173 1 1 3 SER CA C 13.950 18.269 14.208 1.00 . A A . 3 SER CA 1 1 8 1174 1 1 3 SER CB C 13.228 17.020 13.673 1.00 . A A . 3 SER CB 1 1 8 1175 1 1 3 SER H H 14.220 18.781 12.258 1.00 . A A . 3 SER H 1 1 8 1176 1 1 3 SER HA H 13.331 18.776 14.934 1.00 . A A . 3 SER HA 1 1 8 1177 1 1 3 SER HB2 H 13.462 16.089 14.231 1.00 . A A . 3 SER HB2 1 1 8 1178 1 1 3 SER HB3 H 12.128 17.159 13.746 1.00 . A A . 3 SER HB3 1 1 8 1179 1 1 3 SER HG H 12.668 16.656 11.880 1.00 . A A . 3 SER HG 1 1 8 1180 1 1 3 SER N N 14.229 19.203 13.161 1.00 . A A . 3 SER N 1 1 8 1181 1 1 3 SER O O 16.005 17.094 14.424 1.00 . A A . 3 SER O 1 1 8 1182 1 1 3 SER OG O 13.520 16.790 12.302 1.00 . A A . 3 SER OG 1 1 8 1183 1 1 4 CYS C C 16.443 16.635 17.635 1.00 . A A . 4 CYS C 1 1 8 1184 1 1 4 CYS CA C 16.436 17.999 17.036 1.00 . A A . 4 CYS CA 1 1 8 1185 1 1 4 CYS CB C 16.457 19.019 18.186 1.00 . A A . 4 CYS CB 1 1 8 1186 1 1 4 CYS H H 14.564 18.811 16.600 1.00 . A A . 4 CYS H 1 1 8 1187 1 1 4 CYS HA H 17.335 18.086 16.444 1.00 . A A . 4 CYS HA 1 1 8 1188 1 1 4 CYS HB2 H 16.125 19.984 17.748 1.00 . A A . 4 CYS HB2 1 1 8 1189 1 1 4 CYS HB3 H 15.733 18.757 18.987 1.00 . A A . 4 CYS HB3 1 1 8 1190 1 1 4 CYS N N 15.288 18.243 16.218 1.00 . A A . 4 CYS N 1 1 8 1191 1 1 4 CYS O O 17.477 16.119 18.056 1.00 . A A . 4 CYS O 1 1 8 1192 1 1 4 CYS SG S 18.100 19.245 18.926 1.00 . A A . 4 CYS SG 1 1 8 1193 1 1 5 LYS C C 15.673 13.687 17.080 1.00 . A A . 5 LYS C 1 1 8 1194 1 1 5 LYS CA C 15.168 14.616 18.130 1.00 . A A . 5 LYS CA 1 1 8 1195 1 1 5 LYS CB C 13.721 14.234 18.484 1.00 . A A . 5 LYS CB 1 1 8 1196 1 1 5 LYS CD C 13.321 16.178 20.160 1.00 . A A . 5 LYS CD 1 1 8 1197 1 1 5 LYS CE C 12.528 16.573 21.408 1.00 . A A . 5 LYS CE 1 1 8 1198 1 1 5 LYS CG C 13.244 14.679 19.869 1.00 . A A . 5 LYS CG 1 1 8 1199 1 1 5 LYS H H 14.426 16.461 17.493 1.00 . A A . 5 LYS H 1 1 8 1200 1 1 5 LYS HA H 15.811 14.463 18.985 1.00 . A A . 5 LYS HA 1 1 8 1201 1 1 5 LYS HB2 H 13.011 14.627 17.726 1.00 . A A . 5 LYS HB2 1 1 8 1202 1 1 5 LYS HB3 H 13.624 13.127 18.480 1.00 . A A . 5 LYS HB3 1 1 8 1203 1 1 5 LYS HD2 H 14.388 16.456 20.294 1.00 . A A . 5 LYS HD2 1 1 8 1204 1 1 5 LYS HD3 H 12.922 16.751 19.296 1.00 . A A . 5 LYS HD3 1 1 8 1205 1 1 5 LYS HE2 H 11.436 16.486 21.229 1.00 . A A . 5 LYS HE2 1 1 8 1206 1 1 5 LYS HE3 H 12.804 15.938 22.277 1.00 . A A . 5 LYS HE3 1 1 8 1207 1 1 5 LYS HG2 H 12.187 14.349 19.962 1.00 . A A . 5 LYS HG2 1 1 8 1208 1 1 5 LYS HG3 H 13.833 14.147 20.647 1.00 . A A . 5 LYS HG3 1 1 8 1209 1 1 5 LYS HZ1 H 13.832 18.085 22.032 1.00 . A A . 5 LYS HZ1 1 1 8 1210 1 1 5 LYS HZ2 H 12.233 18.276 22.543 1.00 . A A . 5 LYS HZ2 1 1 8 1211 1 1 5 LYS HZ3 H 12.681 18.606 20.934 1.00 . A A . 5 LYS HZ3 1 1 8 1212 1 1 5 LYS N N 15.272 15.979 17.711 1.00 . A A . 5 LYS N 1 1 8 1213 1 1 5 LYS NZ N 12.837 17.980 21.750 1.00 . A A . 5 LYS NZ 1 1 8 1214 1 1 5 LYS O O 16.329 12.693 17.386 1.00 . A A . 5 LYS O 1 1 8 1215 1 1 6 ARG C C 17.409 13.626 14.483 1.00 . A A . 6 ARG C 1 1 8 1216 1 1 6 ARG CA C 15.981 13.256 14.695 1.00 . A A . 6 ARG CA 1 1 8 1217 1 1 6 ARG CB C 15.122 13.549 13.454 1.00 . A A . 6 ARG CB 1 1 8 1218 1 1 6 ARG CD C 12.738 13.570 12.661 1.00 . A A . 6 ARG CD 1 1 8 1219 1 1 6 ARG CG C 13.805 12.770 13.412 1.00 . A A . 6 ARG CG 1 1 8 1220 1 1 6 ARG CZ C 10.624 12.764 11.525 1.00 . A A . 6 ARG CZ 1 1 8 1221 1 1 6 ARG H H 14.840 14.752 15.540 1.00 . A A . 6 ARG H 1 1 8 1222 1 1 6 ARG HA H 15.957 12.196 14.903 1.00 . A A . 6 ARG HA 1 1 8 1223 1 1 6 ARG HB2 H 14.849 14.626 13.432 1.00 . A A . 6 ARG HB2 1 1 8 1224 1 1 6 ARG HB3 H 15.604 13.271 12.492 1.00 . A A . 6 ARG HB3 1 1 8 1225 1 1 6 ARG HD2 H 12.376 14.473 13.198 1.00 . A A . 6 ARG HD2 1 1 8 1226 1 1 6 ARG HD3 H 13.082 13.974 11.685 1.00 . A A . 6 ARG HD3 1 1 8 1227 1 1 6 ARG HE H 11.638 11.711 12.873 1.00 . A A . 6 ARG HE 1 1 8 1228 1 1 6 ARG HG2 H 14.083 11.793 12.961 1.00 . A A . 6 ARG HG2 1 1 8 1229 1 1 6 ARG HG3 H 13.577 12.520 14.470 1.00 . A A . 6 ARG HG3 1 1 8 1230 1 1 6 ARG HH11 H 10.824 14.779 11.106 1.00 . A A . 6 ARG HH11 1 1 8 1231 1 1 6 ARG HH12 H 9.685 13.918 10.135 1.00 . A A . 6 ARG HH12 1 1 8 1232 1 1 6 ARG HH21 H 9.963 10.848 11.743 1.00 . A A . 6 ARG HH21 1 1 8 1233 1 1 6 ARG HH22 H 9.102 11.851 10.558 1.00 . A A . 6 ARG HH22 1 1 8 1234 1 1 6 ARG N N 15.414 13.977 15.792 1.00 . A A . 6 ARG N 1 1 8 1235 1 1 6 ARG NE N 11.604 12.624 12.466 1.00 . A A . 6 ARG NE 1 1 8 1236 1 1 6 ARG NH1 N 10.412 13.913 10.820 1.00 . A A . 6 ARG NH1 1 1 8 1237 1 1 6 ARG NH2 N 9.815 11.701 11.244 1.00 . A A . 6 ARG NH2 1 1 8 1238 1 1 6 ARG O O 18.319 12.883 14.843 1.00 . A A . 6 ARG O 1 1 8 1239 1 1 7 ASN C C 19.431 16.204 14.743 1.00 . A A . 7 ASN C 1 1 8 1240 1 1 7 ASN CA C 18.991 15.289 13.652 1.00 . A A . 7 ASN CA 1 1 8 1241 1 1 7 ASN CB C 19.228 15.929 12.273 1.00 . A A . 7 ASN CB 1 1 8 1242 1 1 7 ASN CG C 18.766 14.957 11.196 1.00 . A A . 7 ASN CG 1 1 8 1243 1 1 7 ASN H H 16.883 15.303 13.521 1.00 . A A . 7 ASN H 1 1 8 1244 1 1 7 ASN HA H 19.662 14.443 13.653 1.00 . A A . 7 ASN HA 1 1 8 1245 1 1 7 ASN HB2 H 18.731 16.911 12.122 1.00 . A A . 7 ASN HB2 1 1 8 1246 1 1 7 ASN HB3 H 20.312 16.094 12.097 1.00 . A A . 7 ASN HB3 1 1 8 1247 1 1 7 ASN HD21 H 20.384 13.757 11.563 1.00 . A A . 7 ASN HD21 1 1 8 1248 1 1 7 ASN HD22 H 19.288 13.180 10.337 1.00 . A A . 7 ASN HD22 1 1 8 1249 1 1 7 ASN N N 17.667 14.794 13.869 1.00 . A A . 7 ASN N 1 1 8 1250 1 1 7 ASN ND2 N 19.555 13.865 11.015 1.00 . A A . 7 ASN ND2 1 1 8 1251 1 1 7 ASN O O 19.195 17.410 14.741 1.00 . A A . 7 ASN O 1 1 8 1252 1 1 7 ASN OD1 O 17.754 15.153 10.526 1.00 . A A . 7 ASN OD1 1 1 8 1253 1 1 8 PHE C C 21.679 17.298 16.767 1.00 . A A . 8 PHE C 1 1 8 1254 1 1 8 PHE CA C 20.550 16.342 16.938 1.00 . A A . 8 PHE CA 1 1 8 1255 1 1 8 PHE CB C 20.821 15.336 18.071 1.00 . A A . 8 PHE CB 1 1 8 1256 1 1 8 PHE CD1 C 22.966 14.142 17.593 1.00 . A A . 8 PHE CD1 1 1 8 1257 1 1 8 PHE CD2 C 20.922 12.962 17.378 1.00 . A A . 8 PHE CD2 1 1 8 1258 1 1 8 PHE CE1 C 23.657 13.014 17.219 1.00 . A A . 8 PHE CE1 1 1 8 1259 1 1 8 PHE CE2 C 21.606 11.832 16.998 1.00 . A A . 8 PHE CE2 1 1 8 1260 1 1 8 PHE CG C 21.593 14.130 17.658 1.00 . A A . 8 PHE CG 1 1 8 1261 1 1 8 PHE CZ C 22.978 11.858 16.913 1.00 . A A . 8 PHE CZ 1 1 8 1262 1 1 8 PHE H H 20.327 14.682 15.723 1.00 . A A . 8 PHE H 1 1 8 1263 1 1 8 PHE HA H 19.729 16.972 17.242 1.00 . A A . 8 PHE HA 1 1 8 1264 1 1 8 PHE HB2 H 21.326 15.811 18.938 1.00 . A A . 8 PHE HB2 1 1 8 1265 1 1 8 PHE HB3 H 19.847 14.947 18.435 1.00 . A A . 8 PHE HB3 1 1 8 1266 1 1 8 PHE HD1 H 23.536 15.023 17.849 1.00 . A A . 8 PHE HD1 1 1 8 1267 1 1 8 PHE HD2 H 19.849 12.884 17.467 1.00 . A A . 8 PHE HD2 1 1 8 1268 1 1 8 PHE HE1 H 24.735 13.043 17.170 1.00 . A A . 8 PHE HE1 1 1 8 1269 1 1 8 PHE HE2 H 21.046 10.932 16.792 1.00 . A A . 8 PHE HE2 1 1 8 1270 1 1 8 PHE HZ H 23.518 10.971 16.613 1.00 . A A . 8 PHE HZ 1 1 8 1271 1 1 8 PHE N N 20.132 15.659 15.753 1.00 . A A . 8 PHE N 1 1 8 1272 1 1 8 PHE O O 21.982 18.079 17.668 1.00 . A A . 8 PHE O 1 1 8 1273 1 1 9 LEU C C 22.796 19.474 14.557 1.00 . A A . 9 LEU C 1 1 8 1274 1 1 9 LEU CA C 23.353 18.302 15.289 1.00 . A A . 9 LEU CA 1 1 8 1275 1 1 9 LEU CB C 24.561 17.750 14.514 1.00 . A A . 9 LEU CB 1 1 8 1276 1 1 9 LEU CD1 C 26.082 15.893 13.759 1.00 . A A . 9 LEU CD1 1 1 8 1277 1 1 9 LEU CD2 C 25.855 16.211 16.195 1.00 . A A . 9 LEU CD2 1 1 8 1278 1 1 9 LEU CG C 25.109 16.355 14.857 1.00 . A A . 9 LEU CG 1 1 8 1279 1 1 9 LEU H H 22.156 16.600 14.951 1.00 . A A . 9 LEU H 1 1 8 1280 1 1 9 LEU HA H 23.761 18.692 16.210 1.00 . A A . 9 LEU HA 1 1 8 1281 1 1 9 LEU HB2 H 24.426 17.800 13.413 1.00 . A A . 9 LEU HB2 1 1 8 1282 1 1 9 LEU HB3 H 25.390 18.451 14.750 1.00 . A A . 9 LEU HB3 1 1 8 1283 1 1 9 LEU HD11 H 26.470 14.888 14.030 1.00 . A A . 9 LEU HD11 1 1 8 1284 1 1 9 LEU HD12 H 26.936 16.599 13.686 1.00 . A A . 9 LEU HD12 1 1 8 1285 1 1 9 LEU HD13 H 25.557 15.835 12.780 1.00 . A A . 9 LEU HD13 1 1 8 1286 1 1 9 LEU HD21 H 26.209 15.160 16.255 1.00 . A A . 9 LEU HD21 1 1 8 1287 1 1 9 LEU HD22 H 25.186 16.388 17.063 1.00 . A A . 9 LEU HD22 1 1 8 1288 1 1 9 LEU HD23 H 26.742 16.882 16.226 1.00 . A A . 9 LEU HD23 1 1 8 1289 1 1 9 LEU HG H 24.323 15.572 14.899 1.00 . A A . 9 LEU HG 1 1 8 1290 1 1 9 LEU N N 22.347 17.334 15.599 1.00 . A A . 9 LEU N 1 1 8 1291 1 1 9 LEU O O 23.508 20.399 14.168 1.00 . A A . 9 LEU O 1 1 8 1292 1 1 10 CYS C C 20.383 21.656 14.138 1.00 . A A . 10 CYS C 1 1 8 1293 1 1 10 CYS CA C 20.809 20.405 13.450 1.00 . A A . 10 CYS CA 1 1 8 1294 1 1 10 CYS CB C 19.564 19.762 12.816 1.00 . A A . 10 CYS CB 1 1 8 1295 1 1 10 CYS H H 20.939 18.794 14.803 1.00 . A A . 10 CYS H 1 1 8 1296 1 1 10 CYS HA H 21.483 20.692 12.655 1.00 . A A . 10 CYS HA 1 1 8 1297 1 1 10 CYS HB2 H 19.823 18.719 12.534 1.00 . A A . 10 CYS HB2 1 1 8 1298 1 1 10 CYS HB3 H 18.736 19.680 13.551 1.00 . A A . 10 CYS HB3 1 1 8 1299 1 1 10 CYS N N 21.470 19.496 14.333 1.00 . A A . 10 CYS N 1 1 8 1300 1 1 10 CYS O O 19.968 22.633 13.517 1.00 . A A . 10 CYS O 1 1 8 1301 1 1 10 CYS SG S 18.921 20.575 11.326 1.00 . A A . 10 CYS SG 1 1 8 1302 1 1 11 CYS C C 20.001 23.878 16.559 1.00 . A A . 11 CYS C 1 1 8 1303 1 1 11 CYS CA C 19.544 22.453 16.276 1.00 . A A . 11 CYS CA 1 1 8 1304 1 1 11 CYS CB C 19.346 21.717 17.612 1.00 . A A . 11 CYS CB 1 1 8 1305 1 1 11 CYS H H 20.933 20.963 15.973 1.00 . A A . 11 CYS H 1 1 8 1306 1 1 11 CYS HA H 18.627 22.532 15.711 1.00 . A A . 11 CYS HA 1 1 8 1307 1 1 11 CYS HB2 H 20.257 21.861 18.232 1.00 . A A . 11 CYS HB2 1 1 8 1308 1 1 11 CYS HB3 H 18.502 22.102 18.223 1.00 . A A . 11 CYS HB3 1 1 8 1309 1 1 11 CYS N N 20.452 21.685 15.481 1.00 . A A . 11 CYS N 1 1 8 1310 1 1 11 CYS O O 19.190 24.653 17.133 1.00 . A A . 11 CYS O 1 1 8 1311 1 1 11 CYS OXT O 21.154 24.270 16.238 1.00 . A A . 11 CYS OXT 1 1 8 1312 1 1 11 CYS SG S 19.186 19.926 17.353 1.00 . A A . 11 CYS SG 1 1 9 1313 1 1 1 SER C C 14.495 23.085 12.365 1.00 . A A . 1 SER C 1 1 9 1314 1 1 1 SER CA C 15.169 24.375 12.684 1.00 . A A . 1 SER CA 1 1 9 1315 1 1 1 SER CB C 15.520 24.340 14.180 1.00 . A A . 1 SER CB 1 1 9 1316 1 1 1 SER H1 H 13.589 25.686 13.021 1.00 . A A . 1 SER H1 1 1 9 1317 1 1 1 SER H2 H 13.922 25.423 11.380 1.00 . A A . 1 SER H2 1 1 9 1318 1 1 1 SER H3 H 14.919 26.420 12.323 1.00 . A A . 1 SER H3 1 1 9 1319 1 1 1 SER HA H 16.070 24.435 12.092 1.00 . A A . 1 SER HA 1 1 9 1320 1 1 1 SER HB2 H 14.596 24.266 14.792 1.00 . A A . 1 SER HB2 1 1 9 1321 1 1 1 SER HB3 H 16.134 23.445 14.421 1.00 . A A . 1 SER HB3 1 1 9 1322 1 1 1 SER HG H 16.344 25.432 15.531 1.00 . A A . 1 SER HG 1 1 9 1323 1 1 1 SER N N 14.347 25.552 12.321 1.00 . A A . 1 SER N 1 1 9 1324 1 1 1 SER O O 13.277 22.964 12.493 1.00 . A A . 1 SER O 1 1 9 1325 1 1 1 SER OG O 16.243 25.497 14.579 1.00 . A A . 1 SER OG 1 1 9 1326 1 1 2 CYS C C 14.769 20.148 13.310 1.00 . A A . 2 CYS C 1 1 9 1327 1 1 2 CYS CA C 14.821 20.700 11.926 1.00 . A A . 2 CYS CA 1 1 9 1328 1 1 2 CYS CB C 15.661 19.806 10.999 1.00 . A A . 2 CYS CB 1 1 9 1329 1 1 2 CYS H H 16.239 22.194 11.789 1.00 . A A . 2 CYS H 1 1 9 1330 1 1 2 CYS HA H 13.789 20.707 11.608 1.00 . A A . 2 CYS HA 1 1 9 1331 1 1 2 CYS HB2 H 15.835 18.801 11.441 1.00 . A A . 2 CYS HB2 1 1 9 1332 1 1 2 CYS HB3 H 15.113 19.619 10.051 1.00 . A A . 2 CYS HB3 1 1 9 1333 1 1 2 CYS N N 15.270 22.056 11.976 1.00 . A A . 2 CYS N 1 1 9 1334 1 1 2 CYS O O 15.243 20.763 14.264 1.00 . A A . 2 CYS O 1 1 9 1335 1 1 2 CYS SG S 17.243 20.531 10.483 1.00 . A A . 2 CYS SG 1 1 9 1336 1 1 3 SER C C 15.235 17.832 15.347 1.00 . A A . 3 SER C 1 1 9 1337 1 1 3 SER CA C 13.974 18.419 14.815 1.00 . A A . 3 SER CA 1 1 9 1338 1 1 3 SER CB C 12.948 17.274 14.856 1.00 . A A . 3 SER CB 1 1 9 1339 1 1 3 SER H H 13.682 18.507 12.758 1.00 . A A . 3 SER H 1 1 9 1340 1 1 3 SER HA H 13.652 19.213 15.473 1.00 . A A . 3 SER HA 1 1 9 1341 1 1 3 SER HB2 H 13.372 16.379 14.353 1.00 . A A . 3 SER HB2 1 1 9 1342 1 1 3 SER HB3 H 12.707 16.987 15.902 1.00 . A A . 3 SER HB3 1 1 9 1343 1 1 3 SER HG H 11.523 18.513 14.393 1.00 . A A . 3 SER HG 1 1 9 1344 1 1 3 SER N N 14.140 18.975 13.508 1.00 . A A . 3 SER N 1 1 9 1345 1 1 3 SER O O 15.837 16.959 14.725 1.00 . A A . 3 SER O 1 1 9 1346 1 1 3 SER OG O 11.748 17.607 14.173 1.00 . A A . 3 SER OG 1 1 9 1347 1 1 4 CYS C C 16.740 16.450 17.786 1.00 . A A . 4 CYS C 1 1 9 1348 1 1 4 CYS CA C 16.863 17.809 17.187 1.00 . A A . 4 CYS CA 1 1 9 1349 1 1 4 CYS CB C 17.275 18.828 18.262 1.00 . A A . 4 CYS CB 1 1 9 1350 1 1 4 CYS H H 15.073 18.884 17.051 1.00 . A A . 4 CYS H 1 1 9 1351 1 1 4 CYS HA H 17.669 17.729 16.473 1.00 . A A . 4 CYS HA 1 1 9 1352 1 1 4 CYS HB2 H 16.989 19.829 17.872 1.00 . A A . 4 CYS HB2 1 1 9 1353 1 1 4 CYS HB3 H 16.717 18.674 19.210 1.00 . A A . 4 CYS HB3 1 1 9 1354 1 1 4 CYS N N 15.658 18.249 16.554 1.00 . A A . 4 CYS N 1 1 9 1355 1 1 4 CYS O O 17.727 15.738 17.968 1.00 . A A . 4 CYS O 1 1 9 1356 1 1 4 CYS SG S 19.060 18.805 18.597 1.00 . A A . 4 CYS SG 1 1 9 1357 1 1 5 LYS C C 15.563 13.706 17.282 1.00 . A A . 5 LYS C 1 1 9 1358 1 1 5 LYS CA C 15.218 14.637 18.392 1.00 . A A . 5 LYS CA 1 1 9 1359 1 1 5 LYS CB C 13.738 14.439 18.761 1.00 . A A . 5 LYS CB 1 1 9 1360 1 1 5 LYS CD C 13.808 15.852 20.909 1.00 . A A . 5 LYS CD 1 1 9 1361 1 1 5 LYS CE C 13.430 15.918 22.391 1.00 . A A . 5 LYS CE 1 1 9 1362 1 1 5 LYS CG C 13.441 14.516 20.260 1.00 . A A . 5 LYS CG 1 1 9 1363 1 1 5 LYS H H 14.746 16.647 18.069 1.00 . A A . 5 LYS H 1 1 9 1364 1 1 5 LYS HA H 15.862 14.341 19.208 1.00 . A A . 5 LYS HA 1 1 9 1365 1 1 5 LYS HB2 H 13.087 15.173 18.241 1.00 . A A . 5 LYS HB2 1 1 9 1366 1 1 5 LYS HB3 H 13.394 13.430 18.448 1.00 . A A . 5 LYS HB3 1 1 9 1367 1 1 5 LYS HD2 H 14.902 16.009 20.798 1.00 . A A . 5 LYS HD2 1 1 9 1368 1 1 5 LYS HD3 H 13.283 16.667 20.364 1.00 . A A . 5 LYS HD3 1 1 9 1369 1 1 5 LYS HE2 H 12.329 15.858 22.525 1.00 . A A . 5 LYS HE2 1 1 9 1370 1 1 5 LYS HE3 H 13.912 15.082 22.943 1.00 . A A . 5 LYS HE3 1 1 9 1371 1 1 5 LYS HG2 H 12.348 14.358 20.382 1.00 . A A . 5 LYS HG2 1 1 9 1372 1 1 5 LYS HG3 H 13.949 13.683 20.790 1.00 . A A . 5 LYS HG3 1 1 9 1373 1 1 5 LYS HZ1 H 14.899 17.369 22.655 1.00 . A A . 5 LYS HZ1 1 1 9 1374 1 1 5 LYS HZ2 H 13.901 17.166 23.996 1.00 . A A . 5 LYS HZ2 1 1 9 1375 1 1 5 LYS HZ3 H 13.323 17.980 22.631 1.00 . A A . 5 LYS HZ3 1 1 9 1376 1 1 5 LYS N N 15.506 16.003 18.081 1.00 . A A . 5 LYS N 1 1 9 1377 1 1 5 LYS NZ N 13.919 17.194 22.957 1.00 . A A . 5 LYS NZ 1 1 9 1378 1 1 5 LYS O O 16.077 12.616 17.527 1.00 . A A . 5 LYS O 1 1 9 1379 1 1 6 ARG C C 17.230 13.770 14.547 1.00 . A A . 6 ARG C 1 1 9 1380 1 1 6 ARG CA C 15.817 13.418 14.859 1.00 . A A . 6 ARG CA 1 1 9 1381 1 1 6 ARG CB C 14.881 13.779 13.693 1.00 . A A . 6 ARG CB 1 1 9 1382 1 1 6 ARG CD C 12.456 14.049 13.173 1.00 . A A . 6 ARG CD 1 1 9 1383 1 1 6 ARG CG C 13.513 13.097 13.736 1.00 . A A . 6 ARG CG 1 1 9 1384 1 1 6 ARG CZ C 11.101 12.578 11.640 1.00 . A A . 6 ARG CZ 1 1 9 1385 1 1 6 ARG H H 14.883 14.975 15.831 1.00 . A A . 6 ARG H 1 1 9 1386 1 1 6 ARG HA H 15.777 12.352 15.030 1.00 . A A . 6 ARG HA 1 1 9 1387 1 1 6 ARG HB2 H 14.682 14.872 13.708 1.00 . A A . 6 ARG HB2 1 1 9 1388 1 1 6 ARG HB3 H 15.265 13.489 12.691 1.00 . A A . 6 ARG HB3 1 1 9 1389 1 1 6 ARG HD2 H 12.125 14.859 13.857 1.00 . A A . 6 ARG HD2 1 1 9 1390 1 1 6 ARG HD3 H 12.801 14.614 12.280 1.00 . A A . 6 ARG HD3 1 1 9 1391 1 1 6 ARG HE H 10.554 13.036 13.510 1.00 . A A . 6 ARG HE 1 1 9 1392 1 1 6 ARG HG2 H 13.648 12.150 13.171 1.00 . A A . 6 ARG HG2 1 1 9 1393 1 1 6 ARG HG3 H 13.400 12.779 14.795 1.00 . A A . 6 ARG HG3 1 1 9 1394 1 1 6 ARG HH11 H 12.799 13.269 10.717 1.00 . A A . 6 ARG HH11 1 1 9 1395 1 1 6 ARG HH12 H 11.790 12.225 9.751 1.00 . A A . 6 ARG HH12 1 1 9 1396 1 1 6 ARG HH21 H 9.351 11.775 12.245 1.00 . A A . 6 ARG HH21 1 1 9 1397 1 1 6 ARG HH22 H 9.886 11.238 10.659 1.00 . A A . 6 ARG HH22 1 1 9 1398 1 1 6 ARG N N 15.345 14.112 16.018 1.00 . A A . 6 ARG N 1 1 9 1399 1 1 6 ARG NE N 11.260 13.231 12.828 1.00 . A A . 6 ARG NE 1 1 9 1400 1 1 6 ARG NH1 N 12.009 12.663 10.624 1.00 . A A . 6 ARG NH1 1 1 9 1401 1 1 6 ARG NH2 N 9.979 11.820 11.469 1.00 . A A . 6 ARG NH2 1 1 9 1402 1 1 6 ARG O O 18.168 13.119 15.006 1.00 . A A . 6 ARG O 1 1 9 1403 1 1 7 ASN C C 19.355 16.187 14.332 1.00 . A A . 7 ASN C 1 1 9 1404 1 1 7 ASN CA C 18.739 15.284 13.320 1.00 . A A . 7 ASN CA 1 1 9 1405 1 1 7 ASN CB C 18.751 15.965 11.941 1.00 . A A . 7 ASN CB 1 1 9 1406 1 1 7 ASN CG C 17.837 15.229 10.972 1.00 . A A . 7 ASN CG 1 1 9 1407 1 1 7 ASN H H 16.648 15.322 13.426 1.00 . A A . 7 ASN H 1 1 9 1408 1 1 7 ASN HA H 19.377 14.417 13.239 1.00 . A A . 7 ASN HA 1 1 9 1409 1 1 7 ASN HB2 H 18.412 17.022 11.976 1.00 . A A . 7 ASN HB2 1 1 9 1410 1 1 7 ASN HB3 H 19.776 15.987 11.515 1.00 . A A . 7 ASN HB3 1 1 9 1411 1 1 7 ASN HD21 H 19.404 14.146 10.196 1.00 . A A . 7 ASN HD21 1 1 9 1412 1 1 7 ASN HD22 H 17.839 13.715 9.597 1.00 . A A . 7 ASN HD22 1 1 9 1413 1 1 7 ASN N N 17.452 14.821 13.738 1.00 . A A . 7 ASN N 1 1 9 1414 1 1 7 ASN ND2 N 18.417 14.300 10.166 1.00 . A A . 7 ASN ND2 1 1 9 1415 1 1 7 ASN O O 19.014 17.364 14.449 1.00 . A A . 7 ASN O 1 1 9 1416 1 1 7 ASN OD1 O 16.632 15.467 10.904 1.00 . A A . 7 ASN OD1 1 1 9 1417 1 1 8 PHE C C 21.715 17.556 15.978 1.00 . A A . 8 PHE C 1 1 9 1418 1 1 8 PHE CA C 20.909 16.333 16.254 1.00 . A A . 8 PHE CA 1 1 9 1419 1 1 8 PHE CB C 21.781 15.348 17.052 1.00 . A A . 8 PHE CB 1 1 9 1420 1 1 8 PHE CD1 C 23.984 15.154 15.866 1.00 . A A . 8 PHE CD1 1 1 9 1421 1 1 8 PHE CD2 C 22.602 13.245 16.053 1.00 . A A . 8 PHE CD2 1 1 9 1422 1 1 8 PHE CE1 C 24.939 14.399 15.226 1.00 . A A . 8 PHE CE1 1 1 9 1423 1 1 8 PHE CE2 C 23.555 12.481 15.422 1.00 . A A . 8 PHE CE2 1 1 9 1424 1 1 8 PHE CG C 22.803 14.587 16.281 1.00 . A A . 8 PHE CG 1 1 9 1425 1 1 8 PHE CZ C 24.730 13.059 15.001 1.00 . A A . 8 PHE CZ 1 1 9 1426 1 1 8 PHE H H 20.618 14.745 14.979 1.00 . A A . 8 PHE H 1 1 9 1427 1 1 8 PHE HA H 20.099 16.673 16.881 1.00 . A A . 8 PHE HA 1 1 9 1428 1 1 8 PHE HB2 H 22.300 15.863 17.889 1.00 . A A . 8 PHE HB2 1 1 9 1429 1 1 8 PHE HB3 H 21.117 14.591 17.521 1.00 . A A . 8 PHE HB3 1 1 9 1430 1 1 8 PHE HD1 H 24.202 16.200 16.023 1.00 . A A . 8 PHE HD1 1 1 9 1431 1 1 8 PHE HD2 H 21.694 12.749 16.360 1.00 . A A . 8 PHE HD2 1 1 9 1432 1 1 8 PHE HE1 H 25.861 14.869 14.914 1.00 . A A . 8 PHE HE1 1 1 9 1433 1 1 8 PHE HE2 H 23.365 11.429 15.269 1.00 . A A . 8 PHE HE2 1 1 9 1434 1 1 8 PHE HZ H 25.481 12.465 14.503 1.00 . A A . 8 PHE HZ 1 1 9 1435 1 1 8 PHE N N 20.320 15.685 15.123 1.00 . A A . 8 PHE N 1 1 9 1436 1 1 8 PHE O O 22.072 18.315 16.876 1.00 . A A . 8 PHE O 1 1 9 1437 1 1 9 LEU C C 21.832 20.139 14.126 1.00 . A A . 9 LEU C 1 1 9 1438 1 1 9 LEU CA C 22.727 18.951 14.219 1.00 . A A . 9 LEU CA 1 1 9 1439 1 1 9 LEU CB C 23.439 18.756 12.870 1.00 . A A . 9 LEU CB 1 1 9 1440 1 1 9 LEU CD1 C 24.469 17.231 11.120 1.00 . A A . 9 LEU CD1 1 1 9 1441 1 1 9 LEU CD2 C 25.544 17.314 13.350 1.00 . A A . 9 LEU CD2 1 1 9 1442 1 1 9 LEU CG C 24.196 17.442 12.619 1.00 . A A . 9 LEU CG 1 1 9 1443 1 1 9 LEU H H 21.653 17.137 14.044 1.00 . A A . 9 LEU H 1 1 9 1444 1 1 9 LEU HA H 23.455 19.217 14.972 1.00 . A A . 9 LEU HA 1 1 9 1445 1 1 9 LEU HB2 H 22.792 18.964 11.990 1.00 . A A . 9 LEU HB2 1 1 9 1446 1 1 9 LEU HB3 H 24.220 19.547 12.850 1.00 . A A . 9 LEU HB3 1 1 9 1447 1 1 9 LEU HD11 H 25.096 16.322 11.007 1.00 . A A . 9 LEU HD11 1 1 9 1448 1 1 9 LEU HD12 H 25.026 18.098 10.706 1.00 . A A . 9 LEU HD12 1 1 9 1449 1 1 9 LEU HD13 H 23.511 17.097 10.572 1.00 . A A . 9 LEU HD13 1 1 9 1450 1 1 9 LEU HD21 H 26.251 18.112 13.037 1.00 . A A . 9 LEU HD21 1 1 9 1451 1 1 9 LEU HD22 H 25.965 16.330 13.052 1.00 . A A . 9 LEU HD22 1 1 9 1452 1 1 9 LEU HD23 H 25.420 17.302 14.454 1.00 . A A . 9 LEU HD23 1 1 9 1453 1 1 9 LEU HG H 23.644 16.533 12.939 1.00 . A A . 9 LEU HG 1 1 9 1454 1 1 9 LEU N N 22.024 17.798 14.692 1.00 . A A . 9 LEU N 1 1 9 1455 1 1 9 LEU O O 22.291 21.269 13.968 1.00 . A A . 9 LEU O 1 1 9 1456 1 1 10 CYS C C 19.088 21.641 15.305 1.00 . A A . 10 CYS C 1 1 9 1457 1 1 10 CYS CA C 19.557 21.001 14.044 1.00 . A A . 10 CYS CA 1 1 9 1458 1 1 10 CYS CB C 18.306 20.507 13.299 1.00 . A A . 10 CYS CB 1 1 9 1459 1 1 10 CYS H H 20.164 19.016 14.342 1.00 . A A . 10 CYS H 1 1 9 1460 1 1 10 CYS HA H 20.010 21.787 13.456 1.00 . A A . 10 CYS HA 1 1 9 1461 1 1 10 CYS HB2 H 17.748 19.775 13.921 1.00 . A A . 10 CYS HB2 1 1 9 1462 1 1 10 CYS HB3 H 17.595 21.346 13.138 1.00 . A A . 10 CYS HB3 1 1 9 1463 1 1 10 CYS N N 20.505 19.945 14.224 1.00 . A A . 10 CYS N 1 1 9 1464 1 1 10 CYS O O 18.036 22.275 15.317 1.00 . A A . 10 CYS O 1 1 9 1465 1 1 10 CYS SG S 18.652 19.722 11.699 1.00 . A A . 10 CYS SG 1 1 9 1466 1 1 11 CYS C C 19.569 23.675 17.646 1.00 . A A . 11 CYS C 1 1 9 1467 1 1 11 CYS CA C 19.399 22.163 17.652 1.00 . A A . 11 CYS CA 1 1 9 1468 1 1 11 CYS CB C 20.116 21.662 18.917 1.00 . A A . 11 CYS CB 1 1 9 1469 1 1 11 CYS H H 20.742 21.171 16.376 1.00 . A A . 11 CYS H 1 1 9 1470 1 1 11 CYS HA H 18.339 21.974 17.740 1.00 . A A . 11 CYS HA 1 1 9 1471 1 1 11 CYS HB2 H 21.143 21.320 18.667 1.00 . A A . 11 CYS HB2 1 1 9 1472 1 1 11 CYS HB3 H 20.255 22.491 19.643 1.00 . A A . 11 CYS HB3 1 1 9 1473 1 1 11 CYS N N 19.825 21.560 16.427 1.00 . A A . 11 CYS N 1 1 9 1474 1 1 11 CYS O O 18.789 24.346 18.373 1.00 . A A . 11 CYS O 1 1 9 1475 1 1 11 CYS OXT O 20.469 24.220 16.952 1.00 . A A . 11 CYS OXT 1 1 9 1476 1 1 11 CYS SG S 19.295 20.359 19.880 1.00 . A A . 11 CYS SG 1 1 10 1477 1 1 1 SER C C 13.730 23.691 12.994 1.00 . A A . 1 SER C 1 1 10 1478 1 1 1 SER CA C 14.093 25.047 13.493 1.00 . A A . 1 SER CA 1 1 10 1479 1 1 1 SER CB C 14.490 24.947 14.975 1.00 . A A . 1 SER CB 1 1 10 1480 1 1 1 SER H1 H 12.633 26.026 12.359 1.00 . A A . 1 SER H1 1 1 10 1481 1 1 1 SER H2 H 13.390 27.003 13.500 1.00 . A A . 1 SER H2 1 1 10 1482 1 1 1 SER H3 H 12.257 25.869 14.013 1.00 . A A . 1 SER H3 1 1 10 1483 1 1 1 SER HA H 14.935 25.389 12.909 1.00 . A A . 1 SER HA 1 1 10 1484 1 1 1 SER HB2 H 13.618 24.636 15.588 1.00 . A A . 1 SER HB2 1 1 10 1485 1 1 1 SER HB3 H 15.278 24.177 15.123 1.00 . A A . 1 SER HB3 1 1 10 1486 1 1 1 SER HG H 15.276 26.060 16.357 1.00 . A A . 1 SER HG 1 1 10 1487 1 1 1 SER N N 13.016 26.048 13.325 1.00 . A A . 1 SER N 1 1 10 1488 1 1 1 SER O O 12.554 23.337 12.926 1.00 . A A . 1 SER O 1 1 10 1489 1 1 1 SER OG O 14.983 26.191 15.452 1.00 . A A . 1 SER OG 1 1 10 1490 1 1 2 CYS C C 14.509 20.574 13.288 1.00 . A A . 2 CYS C 1 1 10 1491 1 1 2 CYS CA C 14.547 21.533 12.149 1.00 . A A . 2 CYS CA 1 1 10 1492 1 1 2 CYS CB C 15.634 21.138 11.135 1.00 . A A . 2 CYS CB 1 1 10 1493 1 1 2 CYS H H 15.678 23.176 12.650 1.00 . A A . 2 CYS H 1 1 10 1494 1 1 2 CYS HA H 13.585 21.455 11.663 1.00 . A A . 2 CYS HA 1 1 10 1495 1 1 2 CYS HB2 H 15.638 20.044 10.945 1.00 . A A . 2 CYS HB2 1 1 10 1496 1 1 2 CYS HB3 H 15.418 21.602 10.150 1.00 . A A . 2 CYS HB3 1 1 10 1497 1 1 2 CYS N N 14.727 22.874 12.610 1.00 . A A . 2 CYS N 1 1 10 1498 1 1 2 CYS O O 14.625 20.946 14.455 1.00 . A A . 2 CYS O 1 1 10 1499 1 1 2 CYS SG S 17.296 21.708 11.597 1.00 . A A . 2 CYS SG 1 1 10 1500 1 1 3 SER C C 15.425 17.860 14.649 1.00 . A A . 3 SER C 1 1 10 1501 1 1 3 SER CA C 14.146 18.247 13.989 1.00 . A A . 3 SER CA 1 1 10 1502 1 1 3 SER CB C 13.481 16.988 13.405 1.00 . A A . 3 SER CB 1 1 10 1503 1 1 3 SER H H 14.167 18.980 12.065 1.00 . A A . 3 SER H 1 1 10 1504 1 1 3 SER HA H 13.532 18.669 14.769 1.00 . A A . 3 SER HA 1 1 10 1505 1 1 3 SER HB2 H 13.557 16.095 14.062 1.00 . A A . 3 SER HB2 1 1 10 1506 1 1 3 SER HB3 H 12.399 17.179 13.241 1.00 . A A . 3 SER HB3 1 1 10 1507 1 1 3 SER HG H 13.667 17.201 11.496 1.00 . A A . 3 SER HG 1 1 10 1508 1 1 3 SER N N 14.299 19.275 13.008 1.00 . A A . 3 SER N 1 1 10 1509 1 1 3 SER O O 16.241 17.113 14.113 1.00 . A A . 3 SER O 1 1 10 1510 1 1 3 SER OG O 14.043 16.613 12.156 1.00 . A A . 3 SER OG 1 1 10 1511 1 1 4 CYS C C 16.592 16.741 17.426 1.00 . A A . 4 CYS C 1 1 10 1512 1 1 4 CYS CA C 16.806 17.998 16.653 1.00 . A A . 4 CYS CA 1 1 10 1513 1 1 4 CYS CB C 17.184 19.144 17.605 1.00 . A A . 4 CYS CB 1 1 10 1514 1 1 4 CYS H H 14.958 18.919 16.314 1.00 . A A . 4 CYS H 1 1 10 1515 1 1 4 CYS HA H 17.651 17.839 16.000 1.00 . A A . 4 CYS HA 1 1 10 1516 1 1 4 CYS HB2 H 16.944 20.083 17.061 1.00 . A A . 4 CYS HB2 1 1 10 1517 1 1 4 CYS HB3 H 16.561 19.124 18.524 1.00 . A A . 4 CYS HB3 1 1 10 1518 1 1 4 CYS N N 15.641 18.326 15.893 1.00 . A A . 4 CYS N 1 1 10 1519 1 1 4 CYS O O 17.538 16.055 17.810 1.00 . A A . 4 CYS O 1 1 10 1520 1 1 4 CYS SG S 18.947 19.112 18.042 1.00 . A A . 4 CYS SG 1 1 10 1521 1 1 5 LYS C C 15.402 13.990 17.264 1.00 . A A . 5 LYS C 1 1 10 1522 1 1 5 LYS CA C 14.923 15.089 18.149 1.00 . A A . 5 LYS CA 1 1 10 1523 1 1 5 LYS CB C 13.395 14.970 18.278 1.00 . A A . 5 LYS CB 1 1 10 1524 1 1 5 LYS CD C 12.801 17.089 19.655 1.00 . A A . 5 LYS CD 1 1 10 1525 1 1 5 LYS CE C 12.053 17.577 20.897 1.00 . A A . 5 LYS CE 1 1 10 1526 1 1 5 LYS CG C 12.763 15.564 19.538 1.00 . A A . 5 LYS CG 1 1 10 1527 1 1 5 LYS H H 14.594 17.028 17.468 1.00 . A A . 5 LYS H 1 1 10 1528 1 1 5 LYS HA H 15.409 14.926 19.100 1.00 . A A . 5 LYS HA 1 1 10 1529 1 1 5 LYS HB2 H 12.877 15.402 17.395 1.00 . A A . 5 LYS HB2 1 1 10 1530 1 1 5 LYS HB3 H 13.122 13.893 18.310 1.00 . A A . 5 LYS HB3 1 1 10 1531 1 1 5 LYS HD2 H 13.852 17.450 19.695 1.00 . A A . 5 LYS HD2 1 1 10 1532 1 1 5 LYS HD3 H 12.317 17.513 18.749 1.00 . A A . 5 LYS HD3 1 1 10 1533 1 1 5 LYS HE2 H 11.024 17.158 20.898 1.00 . A A . 5 LYS HE2 1 1 10 1534 1 1 5 LYS HE3 H 12.572 17.255 21.826 1.00 . A A . 5 LYS HE3 1 1 10 1535 1 1 5 LYS HG2 H 11.697 15.253 19.523 1.00 . A A . 5 LYS HG2 1 1 10 1536 1 1 5 LYS HG3 H 13.224 15.108 20.440 1.00 . A A . 5 LYS HG3 1 1 10 1537 1 1 5 LYS HZ1 H 11.307 19.328 21.700 1.00 . A A . 5 LYS HZ1 1 1 10 1538 1 1 5 LYS HZ2 H 11.514 19.396 20.023 1.00 . A A . 5 LYS HZ2 1 1 10 1539 1 1 5 LYS HZ3 H 12.847 19.512 21.072 1.00 . A A . 5 LYS HZ3 1 1 10 1540 1 1 5 LYS N N 15.319 16.373 17.659 1.00 . A A . 5 LYS N 1 1 10 1541 1 1 5 LYS NZ N 11.928 19.052 20.912 1.00 . A A . 5 LYS NZ 1 1 10 1542 1 1 5 LYS O O 15.891 12.963 17.732 1.00 . A A . 5 LYS O 1 1 10 1543 1 1 6 ARG C C 17.496 13.608 14.948 1.00 . A A . 6 ARG C 1 1 10 1544 1 1 6 ARG CA C 16.030 13.347 14.997 1.00 . A A . 6 ARG CA 1 1 10 1545 1 1 6 ARG CB C 15.358 13.538 13.627 1.00 . A A . 6 ARG CB 1 1 10 1546 1 1 6 ARG CD C 13.082 13.529 12.582 1.00 . A A . 6 ARG CD 1 1 10 1547 1 1 6 ARG CG C 14.032 12.782 13.522 1.00 . A A . 6 ARG CG 1 1 10 1548 1 1 6 ARG CZ C 10.919 12.190 12.437 1.00 . A A . 6 ARG CZ 1 1 10 1549 1 1 6 ARG H H 14.868 14.960 15.533 1.00 . A A . 6 ARG H 1 1 10 1550 1 1 6 ARG HA H 15.913 12.310 15.280 1.00 . A A . 6 ARG HA 1 1 10 1551 1 1 6 ARG HB2 H 15.126 14.612 13.471 1.00 . A A . 6 ARG HB2 1 1 10 1552 1 1 6 ARG HB3 H 15.938 13.142 12.767 1.00 . A A . 6 ARG HB3 1 1 10 1553 1 1 6 ARG HD2 H 12.508 14.379 13.009 1.00 . A A . 6 ARG HD2 1 1 10 1554 1 1 6 ARG HD3 H 13.620 13.995 11.729 1.00 . A A . 6 ARG HD3 1 1 10 1555 1 1 6 ARG HE H 12.604 11.818 11.390 1.00 . A A . 6 ARG HE 1 1 10 1556 1 1 6 ARG HG2 H 14.341 11.771 13.183 1.00 . A A . 6 ARG HG2 1 1 10 1557 1 1 6 ARG HG3 H 13.687 12.622 14.567 1.00 . A A . 6 ARG HG3 1 1 10 1558 1 1 6 ARG HH11 H 10.703 13.714 13.797 1.00 . A A . 6 ARG HH11 1 1 10 1559 1 1 6 ARG HH12 H 9.300 12.709 13.565 1.00 . A A . 6 ARG HH12 1 1 10 1560 1 1 6 ARG HH21 H 10.905 10.350 11.582 1.00 . A A . 6 ARG HH21 1 1 10 1561 1 1 6 ARG HH22 H 9.503 10.735 12.431 1.00 . A A . 6 ARG HH22 1 1 10 1562 1 1 6 ARG N N 15.347 14.183 15.934 1.00 . A A . 6 ARG N 1 1 10 1563 1 1 6 ARG NE N 12.196 12.462 12.038 1.00 . A A . 6 ARG NE 1 1 10 1564 1 1 6 ARG NH1 N 10.231 12.975 13.316 1.00 . A A . 6 ARG NH1 1 1 10 1565 1 1 6 ARG NH2 N 10.315 11.068 11.949 1.00 . A A . 6 ARG NH2 1 1 10 1566 1 1 6 ARG O O 18.247 13.106 15.781 1.00 . A A . 6 ARG O 1 1 10 1567 1 1 7 ASN C C 19.878 15.651 14.718 1.00 . A A . 7 ASN C 1 1 10 1568 1 1 7 ASN CA C 19.395 14.589 13.791 1.00 . A A . 7 ASN CA 1 1 10 1569 1 1 7 ASN CB C 19.794 14.862 12.331 1.00 . A A . 7 ASN CB 1 1 10 1570 1 1 7 ASN CG C 21.312 14.862 12.218 1.00 . A A . 7 ASN CG 1 1 10 1571 1 1 7 ASN H H 17.339 14.817 13.348 1.00 . A A . 7 ASN H 1 1 10 1572 1 1 7 ASN HA H 19.884 13.695 14.148 1.00 . A A . 7 ASN HA 1 1 10 1573 1 1 7 ASN HB2 H 19.455 14.125 11.573 1.00 . A A . 7 ASN HB2 1 1 10 1574 1 1 7 ASN HB3 H 19.387 15.832 11.972 1.00 . A A . 7 ASN HB3 1 1 10 1575 1 1 7 ASN HD21 H 21.314 16.511 11.001 1.00 . A A . 7 ASN HD21 1 1 10 1576 1 1 7 ASN HD22 H 22.859 15.785 11.286 1.00 . A A . 7 ASN HD22 1 1 10 1577 1 1 7 ASN N N 17.990 14.384 13.966 1.00 . A A . 7 ASN N 1 1 10 1578 1 1 7 ASN ND2 N 21.890 15.871 11.512 1.00 . A A . 7 ASN ND2 1 1 10 1579 1 1 7 ASN O O 19.454 16.805 14.687 1.00 . A A . 7 ASN O 1 1 10 1580 1 1 7 ASN OD1 O 21.977 13.981 12.759 1.00 . A A . 7 ASN OD1 1 1 10 1581 1 1 8 PHE C C 21.980 17.291 16.511 1.00 . A A . 8 PHE C 1 1 10 1582 1 1 8 PHE CA C 21.256 16.011 16.753 1.00 . A A . 8 PHE CA 1 1 10 1583 1 1 8 PHE CB C 22.081 15.093 17.671 1.00 . A A . 8 PHE CB 1 1 10 1584 1 1 8 PHE CD1 C 24.407 14.978 16.747 1.00 . A A . 8 PHE CD1 1 1 10 1585 1 1 8 PHE CD2 C 23.057 13.040 16.689 1.00 . A A . 8 PHE CD2 1 1 10 1586 1 1 8 PHE CE1 C 25.440 14.279 16.168 1.00 . A A . 8 PHE CE1 1 1 10 1587 1 1 8 PHE CE2 C 24.082 12.331 16.104 1.00 . A A . 8 PHE CE2 1 1 10 1588 1 1 8 PHE CG C 23.199 14.371 17.001 1.00 . A A . 8 PHE CG 1 1 10 1589 1 1 8 PHE CZ C 25.277 12.955 15.835 1.00 . A A . 8 PHE CZ 1 1 10 1590 1 1 8 PHE H H 21.227 14.377 15.506 1.00 . A A . 8 PHE H 1 1 10 1591 1 1 8 PHE HA H 20.359 16.308 17.276 1.00 . A A . 8 PHE HA 1 1 10 1592 1 1 8 PHE HB2 H 22.495 15.658 18.533 1.00 . A A . 8 PHE HB2 1 1 10 1593 1 1 8 PHE HB3 H 21.422 14.303 18.090 1.00 . A A . 8 PHE HB3 1 1 10 1594 1 1 8 PHE HD1 H 24.585 16.009 17.014 1.00 . A A . 8 PHE HD1 1 1 10 1595 1 1 8 PHE HD2 H 22.149 12.501 16.914 1.00 . A A . 8 PHE HD2 1 1 10 1596 1 1 8 PHE HE1 H 26.384 14.771 15.982 1.00 . A A . 8 PHE HE1 1 1 10 1597 1 1 8 PHE HE2 H 23.930 11.287 15.873 1.00 . A A . 8 PHE HE2 1 1 10 1598 1 1 8 PHE HZ H 26.085 12.410 15.370 1.00 . A A . 8 PHE HZ 1 1 10 1599 1 1 8 PHE N N 20.831 15.288 15.595 1.00 . A A . 8 PHE N 1 1 10 1600 1 1 8 PHE O O 22.088 18.136 17.398 1.00 . A A . 8 PHE O 1 1 10 1601 1 1 9 LEU C C 22.147 19.775 14.506 1.00 . A A . 9 LEU C 1 1 10 1602 1 1 9 LEU CA C 23.131 18.720 14.878 1.00 . A A . 9 LEU CA 1 1 10 1603 1 1 9 LEU CB C 24.151 18.577 13.735 1.00 . A A . 9 LEU CB 1 1 10 1604 1 1 9 LEU CD1 C 25.848 17.287 12.381 1.00 . A A . 9 LEU CD1 1 1 10 1605 1 1 9 LEU CD2 C 26.269 17.477 14.793 1.00 . A A . 9 LEU CD2 1 1 10 1606 1 1 9 LEU CG C 25.146 17.405 13.745 1.00 . A A . 9 LEU CG 1 1 10 1607 1 1 9 LEU H H 22.390 16.756 14.640 1.00 . A A . 9 LEU H 1 1 10 1608 1 1 9 LEU HA H 23.642 19.130 15.737 1.00 . A A . 9 LEU HA 1 1 10 1609 1 1 9 LEU HB2 H 23.688 18.637 12.727 1.00 . A A . 9 LEU HB2 1 1 10 1610 1 1 9 LEU HB3 H 24.790 19.482 13.818 1.00 . A A . 9 LEU HB3 1 1 10 1611 1 1 9 LEU HD11 H 25.088 17.184 11.578 1.00 . A A . 9 LEU HD11 1 1 10 1612 1 1 9 LEU HD12 H 26.503 16.391 12.392 1.00 . A A . 9 LEU HD12 1 1 10 1613 1 1 9 LEU HD13 H 26.470 18.190 12.199 1.00 . A A . 9 LEU HD13 1 1 10 1614 1 1 9 LEU HD21 H 25.866 17.357 15.822 1.00 . A A . 9 LEU HD21 1 1 10 1615 1 1 9 LEU HD22 H 26.849 18.421 14.691 1.00 . A A . 9 LEU HD22 1 1 10 1616 1 1 9 LEU HD23 H 26.952 16.622 14.601 1.00 . A A . 9 LEU HD23 1 1 10 1617 1 1 9 LEU HG H 24.664 16.419 13.916 1.00 . A A . 9 LEU HG 1 1 10 1618 1 1 9 LEU N N 22.495 17.506 15.288 1.00 . A A . 9 LEU N 1 1 10 1619 1 1 9 LEU O O 22.455 20.963 14.437 1.00 . A A . 9 LEU O 1 1 10 1620 1 1 10 CYS C C 19.083 20.944 14.693 1.00 . A A . 10 CYS C 1 1 10 1621 1 1 10 CYS CA C 19.867 20.195 13.670 1.00 . A A . 10 CYS CA 1 1 10 1622 1 1 10 CYS CB C 18.950 19.381 12.743 1.00 . A A . 10 CYS CB 1 1 10 1623 1 1 10 CYS H H 20.690 18.435 14.506 1.00 . A A . 10 CYS H 1 1 10 1624 1 1 10 CYS HA H 20.350 20.936 13.049 1.00 . A A . 10 CYS HA 1 1 10 1625 1 1 10 CYS HB2 H 19.476 18.457 12.418 1.00 . A A . 10 CYS HB2 1 1 10 1626 1 1 10 CYS HB3 H 18.035 19.034 13.270 1.00 . A A . 10 CYS HB3 1 1 10 1627 1 1 10 CYS N N 20.880 19.385 14.272 1.00 . A A . 10 CYS N 1 1 10 1628 1 1 10 CYS O O 17.862 21.071 14.631 1.00 . A A . 10 CYS O 1 1 10 1629 1 1 10 CYS SG S 18.550 20.174 11.159 1.00 . A A . 10 CYS SG 1 1 10 1630 1 1 11 CYS C C 19.212 23.738 16.484 1.00 . A A . 11 CYS C 1 1 10 1631 1 1 11 CYS CA C 19.211 22.248 16.788 1.00 . A A . 11 CYS CA 1 1 10 1632 1 1 11 CYS CB C 19.948 22.025 18.121 1.00 . A A . 11 CYS CB 1 1 10 1633 1 1 11 CYS H H 20.754 21.338 15.701 1.00 . A A . 11 CYS H 1 1 10 1634 1 1 11 CYS HA H 18.186 21.933 16.923 1.00 . A A . 11 CYS HA 1 1 10 1635 1 1 11 CYS HB2 H 21.024 21.800 17.964 1.00 . A A . 11 CYS HB2 1 1 10 1636 1 1 11 CYS HB3 H 19.931 22.955 18.728 1.00 . A A . 11 CYS HB3 1 1 10 1637 1 1 11 CYS N N 19.772 21.511 15.699 1.00 . A A . 11 CYS N 1 1 10 1638 1 1 11 CYS O O 18.123 24.371 16.515 1.00 . A A . 11 CYS O 1 1 10 1639 1 1 11 CYS OXT O 20.300 24.320 16.224 1.00 . A A . 11 CYS OXT 1 1 10 1640 1 1 11 CYS SG S 19.219 20.757 19.198 1.00 . A A . 11 CYS SG 1 1 11 1641 1 1 1 SER C C 13.441 23.275 12.786 1.00 . A A . 1 SER C 1 1 11 1642 1 1 1 SER CA C 13.496 24.655 13.344 1.00 . A A . 1 SER CA 1 1 11 1643 1 1 1 SER CB C 14.073 24.514 14.763 1.00 . A A . 1 SER CB 1 1 11 1644 1 1 1 SER H1 H 12.210 26.230 13.869 1.00 . A A . 1 SER H1 1 1 11 1645 1 1 1 SER H2 H 11.445 24.742 13.763 1.00 . A A . 1 SER H2 1 1 11 1646 1 1 1 SER H3 H 11.897 25.542 12.356 1.00 . A A . 1 SER H3 1 1 11 1647 1 1 1 SER HA H 14.158 25.241 12.725 1.00 . A A . 1 SER HA 1 1 11 1648 1 1 1 SER HB2 H 13.386 23.929 15.410 1.00 . A A . 1 SER HB2 1 1 11 1649 1 1 1 SER HB3 H 15.048 23.981 14.726 1.00 . A A . 1 SER HB3 1 1 11 1650 1 1 1 SER HG H 14.772 25.588 16.198 1.00 . A A . 1 SER HG 1 1 11 1651 1 1 1 SER N N 12.183 25.338 13.335 1.00 . A A . 1 SER N 1 1 11 1652 1 1 1 SER O O 12.389 22.637 12.791 1.00 . A A . 1 SER O 1 1 11 1653 1 1 1 SER OG O 14.326 25.773 15.369 1.00 . A A . 1 SER OG 1 1 11 1654 1 1 2 CYS C C 14.645 20.461 13.133 1.00 . A A . 2 CYS C 1 1 11 1655 1 1 2 CYS CA C 14.704 21.357 11.945 1.00 . A A . 2 CYS CA 1 1 11 1656 1 1 2 CYS CB C 15.988 21.073 11.146 1.00 . A A . 2 CYS CB 1 1 11 1657 1 1 2 CYS H H 15.427 23.259 12.324 1.00 . A A . 2 CYS H 1 1 11 1658 1 1 2 CYS HA H 13.842 21.100 11.347 1.00 . A A . 2 CYS HA 1 1 11 1659 1 1 2 CYS HB2 H 16.199 19.983 11.104 1.00 . A A . 2 CYS HB2 1 1 11 1660 1 1 2 CYS HB3 H 15.861 21.393 10.090 1.00 . A A . 2 CYS HB3 1 1 11 1661 1 1 2 CYS N N 14.583 22.728 12.333 1.00 . A A . 2 CYS N 1 1 11 1662 1 1 2 CYS O O 14.908 20.874 14.262 1.00 . A A . 2 CYS O 1 1 11 1663 1 1 2 CYS SG S 17.430 21.979 11.777 1.00 . A A . 2 CYS SG 1 1 11 1664 1 1 3 SER C C 15.203 17.859 14.756 1.00 . A A . 3 SER C 1 1 11 1665 1 1 3 SER CA C 13.984 18.267 14.002 1.00 . A A . 3 SER CA 1 1 11 1666 1 1 3 SER CB C 13.334 16.979 13.468 1.00 . A A . 3 SER CB 1 1 11 1667 1 1 3 SER H H 14.033 18.850 12.031 1.00 . A A . 3 SER H 1 1 11 1668 1 1 3 SER HA H 13.341 18.775 14.705 1.00 . A A . 3 SER HA 1 1 11 1669 1 1 3 SER HB2 H 13.314 16.149 14.206 1.00 . A A . 3 SER HB2 1 1 11 1670 1 1 3 SER HB3 H 12.287 17.206 13.171 1.00 . A A . 3 SER HB3 1 1 11 1671 1 1 3 SER HG H 14.919 16.517 12.486 1.00 . A A . 3 SER HG 1 1 11 1672 1 1 3 SER N N 14.255 19.188 12.942 1.00 . A A . 3 SER N 1 1 11 1673 1 1 3 SER O O 16.003 17.070 14.257 1.00 . A A . 3 SER O 1 1 11 1674 1 1 3 SER OG O 13.978 16.491 12.300 1.00 . A A . 3 SER OG 1 1 11 1675 1 1 4 CYS C C 16.580 16.933 17.538 1.00 . A A . 4 CYS C 1 1 11 1676 1 1 4 CYS CA C 16.556 18.211 16.773 1.00 . A A . 4 CYS CA 1 1 11 1677 1 1 4 CYS CB C 16.713 19.386 17.752 1.00 . A A . 4 CYS CB 1 1 11 1678 1 1 4 CYS H H 14.633 18.918 16.374 1.00 . A A . 4 CYS H 1 1 11 1679 1 1 4 CYS HA H 17.424 18.214 16.131 1.00 . A A . 4 CYS HA 1 1 11 1680 1 1 4 CYS HB2 H 16.249 20.264 17.253 1.00 . A A . 4 CYS HB2 1 1 11 1681 1 1 4 CYS HB3 H 16.144 19.202 18.689 1.00 . A A . 4 CYS HB3 1 1 11 1682 1 1 4 CYS N N 15.367 18.363 15.992 1.00 . A A . 4 CYS N 1 1 11 1683 1 1 4 CYS O O 17.636 16.464 17.961 1.00 . A A . 4 CYS O 1 1 11 1684 1 1 4 CYS SG S 18.448 19.751 18.146 1.00 . A A . 4 CYS SG 1 1 11 1685 1 1 5 LYS C C 15.931 13.954 17.357 1.00 . A A . 5 LYS C 1 1 11 1686 1 1 5 LYS CA C 15.354 14.963 18.288 1.00 . A A . 5 LYS CA 1 1 11 1687 1 1 5 LYS CB C 13.914 14.517 18.593 1.00 . A A . 5 LYS CB 1 1 11 1688 1 1 5 LYS CD C 13.257 16.467 20.179 1.00 . A A . 5 LYS CD 1 1 11 1689 1 1 5 LYS CE C 12.603 16.797 21.523 1.00 . A A . 5 LYS CE 1 1 11 1690 1 1 5 LYS CG C 13.348 14.958 19.944 1.00 . A A . 5 LYS CG 1 1 11 1691 1 1 5 LYS H H 14.566 16.739 17.504 1.00 . A A . 5 LYS H 1 1 11 1692 1 1 5 LYS HA H 15.967 14.928 19.176 1.00 . A A . 5 LYS HA 1 1 11 1693 1 1 5 LYS HB2 H 13.210 14.836 17.794 1.00 . A A . 5 LYS HB2 1 1 11 1694 1 1 5 LYS HB3 H 13.868 13.408 18.632 1.00 . A A . 5 LYS HB3 1 1 11 1695 1 1 5 LYS HD2 H 14.277 16.906 20.154 1.00 . A A . 5 LYS HD2 1 1 11 1696 1 1 5 LYS HD3 H 12.662 16.924 19.360 1.00 . A A . 5 LYS HD3 1 1 11 1697 1 1 5 LYS HE2 H 11.565 16.404 21.566 1.00 . A A . 5 LYS HE2 1 1 11 1698 1 1 5 LYS HE3 H 13.196 16.369 22.360 1.00 . A A . 5 LYS HE3 1 1 11 1699 1 1 5 LYS HG2 H 12.327 14.526 20.025 1.00 . A A . 5 LYS HG2 1 1 11 1700 1 1 5 LYS HG3 H 13.964 14.511 20.753 1.00 . A A . 5 LYS HG3 1 1 11 1701 1 1 5 LYS HZ1 H 12.126 18.477 22.634 1.00 . A A . 5 LYS HZ1 1 1 11 1702 1 1 5 LYS HZ2 H 11.962 18.696 20.961 1.00 . A A . 5 LYS HZ2 1 1 11 1703 1 1 5 LYS HZ3 H 13.505 18.664 21.679 1.00 . A A . 5 LYS HZ3 1 1 11 1704 1 1 5 LYS N N 15.420 16.284 17.743 1.00 . A A . 5 LYS N 1 1 11 1705 1 1 5 LYS NZ N 12.545 18.264 21.707 1.00 . A A . 5 LYS NZ 1 1 11 1706 1 1 5 LYS O O 16.605 13.013 17.774 1.00 . A A . 5 LYS O 1 1 11 1707 1 1 6 ARG C C 17.459 13.600 14.497 1.00 . A A . 6 ARG C 1 1 11 1708 1 1 6 ARG CA C 16.110 13.228 15.008 1.00 . A A . 6 ARG CA 1 1 11 1709 1 1 6 ARG CB C 15.076 13.356 13.878 1.00 . A A . 6 ARG CB 1 1 11 1710 1 1 6 ARG CD C 12.630 13.527 13.430 1.00 . A A . 6 ARG CD 1 1 11 1711 1 1 6 ARG CG C 13.711 12.721 14.153 1.00 . A A . 6 ARG CG 1 1 11 1712 1 1 6 ARG CZ C 10.835 12.518 11.976 1.00 . A A . 6 ARG CZ 1 1 11 1713 1 1 6 ARG H H 15.137 14.899 15.758 1.00 . A A . 6 ARG H 1 1 11 1714 1 1 6 ARG HA H 16.158 12.211 15.371 1.00 . A A . 6 ARG HA 1 1 11 1715 1 1 6 ARG HB2 H 14.859 14.432 13.708 1.00 . A A . 6 ARG HB2 1 1 11 1716 1 1 6 ARG HB3 H 15.397 12.878 12.928 1.00 . A A . 6 ARG HB3 1 1 11 1717 1 1 6 ARG HD2 H 12.237 14.416 13.967 1.00 . A A . 6 ARG HD2 1 1 11 1718 1 1 6 ARG HD3 H 12.998 13.959 12.475 1.00 . A A . 6 ARG HD3 1 1 11 1719 1 1 6 ARG HE H 10.982 12.188 13.925 1.00 . A A . 6 ARG HE 1 1 11 1720 1 1 6 ARG HG2 H 13.820 11.676 13.792 1.00 . A A . 6 ARG HG2 1 1 11 1721 1 1 6 ARG HG3 H 13.637 12.610 15.256 1.00 . A A . 6 ARG HG3 1 1 11 1722 1 1 6 ARG HH11 H 12.348 12.854 10.724 1.00 . A A . 6 ARG HH11 1 1 11 1723 1 1 6 ARG HH12 H 10.814 12.797 9.989 1.00 . A A . 6 ARG HH12 1 1 11 1724 1 1 6 ARG HH21 H 9.291 11.510 12.824 1.00 . A A . 6 ARG HH21 1 1 11 1725 1 1 6 ARG HH22 H 9.053 11.877 11.139 1.00 . A A . 6 ARG HH22 1 1 11 1726 1 1 6 ARG N N 15.678 14.113 16.045 1.00 . A A . 6 ARG N 1 1 11 1727 1 1 6 ARG NE N 11.492 12.601 13.170 1.00 . A A . 6 ARG NE 1 1 11 1728 1 1 6 ARG NH1 N 11.360 12.985 10.806 1.00 . A A . 6 ARG NH1 1 1 11 1729 1 1 6 ARG NH2 N 9.622 11.892 11.961 1.00 . A A . 6 ARG NH2 1 1 11 1730 1 1 6 ARG O O 18.457 12.908 14.692 1.00 . A A . 6 ARG O 1 1 11 1731 1 1 7 ASN C C 19.387 16.094 14.507 1.00 . A A . 7 ASN C 1 1 11 1732 1 1 7 ASN CA C 18.760 15.361 13.371 1.00 . A A . 7 ASN CA 1 1 11 1733 1 1 7 ASN CB C 18.618 16.292 12.155 1.00 . A A . 7 ASN CB 1 1 11 1734 1 1 7 ASN CG C 17.769 15.601 11.098 1.00 . A A . 7 ASN CG 1 1 11 1735 1 1 7 ASN H H 16.680 15.224 13.648 1.00 . A A . 7 ASN H 1 1 11 1736 1 1 7 ASN HA H 19.437 14.567 13.095 1.00 . A A . 7 ASN HA 1 1 11 1737 1 1 7 ASN HB2 H 18.194 17.289 12.399 1.00 . A A . 7 ASN HB2 1 1 11 1738 1 1 7 ASN HB3 H 19.616 16.473 11.702 1.00 . A A . 7 ASN HB3 1 1 11 1739 1 1 7 ASN HD21 H 16.503 17.204 10.902 1.00 . A A . 7 ASN HD21 1 1 11 1740 1 1 7 ASN HD22 H 16.036 15.774 10.049 1.00 . A A . 7 ASN HD22 1 1 11 1741 1 1 7 ASN N N 17.542 14.747 13.799 1.00 . A A . 7 ASN N 1 1 11 1742 1 1 7 ASN ND2 N 16.623 16.228 10.720 1.00 . A A . 7 ASN ND2 1 1 11 1743 1 1 7 ASN O O 19.207 17.296 14.698 1.00 . A A . 7 ASN O 1 1 11 1744 1 1 7 ASN OD1 O 18.103 14.520 10.616 1.00 . A A . 7 ASN OD1 1 1 11 1745 1 1 8 PHE C C 21.597 16.959 16.573 1.00 . A A . 8 PHE C 1 1 11 1746 1 1 8 PHE CA C 20.666 15.796 16.601 1.00 . A A . 8 PHE CA 1 1 11 1747 1 1 8 PHE CB C 21.238 14.604 17.386 1.00 . A A . 8 PHE CB 1 1 11 1748 1 1 8 PHE CD1 C 23.599 14.177 16.714 1.00 . A A . 8 PHE CD1 1 1 11 1749 1 1 8 PHE CD2 C 21.941 12.626 16.052 1.00 . A A . 8 PHE CD2 1 1 11 1750 1 1 8 PHE CE1 C 24.568 13.401 16.121 1.00 . A A . 8 PHE CE1 1 1 11 1751 1 1 8 PHE CE2 C 22.903 11.846 15.455 1.00 . A A . 8 PHE CE2 1 1 11 1752 1 1 8 PHE CG C 22.276 13.807 16.673 1.00 . A A . 8 PHE CG 1 1 11 1753 1 1 8 PHE CZ C 24.221 12.234 15.482 1.00 . A A . 8 PHE CZ 1 1 11 1754 1 1 8 PHE H H 20.327 14.419 15.093 1.00 . A A . 8 PHE H 1 1 11 1755 1 1 8 PHE HA H 19.809 16.170 17.141 1.00 . A A . 8 PHE HA 1 1 11 1756 1 1 8 PHE HB2 H 21.655 14.931 18.362 1.00 . A A . 8 PHE HB2 1 1 11 1757 1 1 8 PHE HB3 H 20.422 13.885 17.613 1.00 . A A . 8 PHE HB3 1 1 11 1758 1 1 8 PHE HD1 H 23.917 15.072 17.228 1.00 . A A . 8 PHE HD1 1 1 11 1759 1 1 8 PHE HD2 H 20.930 12.247 16.052 1.00 . A A . 8 PHE HD2 1 1 11 1760 1 1 8 PHE HE1 H 25.601 13.713 16.163 1.00 . A A . 8 PHE HE1 1 1 11 1761 1 1 8 PHE HE2 H 22.607 10.915 14.993 1.00 . A A . 8 PHE HE2 1 1 11 1762 1 1 8 PHE HZ H 24.983 11.629 15.014 1.00 . A A . 8 PHE HZ 1 1 11 1763 1 1 8 PHE N N 20.189 15.380 15.318 1.00 . A A . 8 PHE N 1 1 11 1764 1 1 8 PHE O O 21.694 17.722 17.534 1.00 . A A . 8 PHE O 1 1 11 1765 1 1 9 LEU C C 22.449 19.529 14.831 1.00 . A A . 9 LEU C 1 1 11 1766 1 1 9 LEU CA C 23.169 18.294 15.249 1.00 . A A . 9 LEU CA 1 1 11 1767 1 1 9 LEU CB C 24.302 18.064 14.234 1.00 . A A . 9 LEU CB 1 1 11 1768 1 1 9 LEU CD1 C 25.842 16.589 12.894 1.00 . A A . 9 LEU CD1 1 1 11 1769 1 1 9 LEU CD2 C 26.042 16.508 15.366 1.00 . A A . 9 LEU CD2 1 1 11 1770 1 1 9 LEU CG C 25.054 16.723 14.208 1.00 . A A . 9 LEU CG 1 1 11 1771 1 1 9 LEU H H 22.148 16.520 14.713 1.00 . A A . 9 LEU H 1 1 11 1772 1 1 9 LEU HA H 23.604 18.548 16.204 1.00 . A A . 9 LEU HA 1 1 11 1773 1 1 9 LEU HB2 H 24.003 18.312 13.192 1.00 . A A . 9 LEU HB2 1 1 11 1774 1 1 9 LEU HB3 H 25.073 18.815 14.509 1.00 . A A . 9 LEU HB3 1 1 11 1775 1 1 9 LEU HD11 H 26.572 17.422 12.807 1.00 . A A . 9 LEU HD11 1 1 11 1776 1 1 9 LEU HD12 H 25.158 16.597 12.018 1.00 . A A . 9 LEU HD12 1 1 11 1777 1 1 9 LEU HD13 H 26.396 15.626 12.913 1.00 . A A . 9 LEU HD13 1 1 11 1778 1 1 9 LEU HD21 H 26.806 17.315 15.389 1.00 . A A . 9 LEU HD21 1 1 11 1779 1 1 9 LEU HD22 H 26.546 15.537 15.172 1.00 . A A . 9 LEU HD22 1 1 11 1780 1 1 9 LEU HD23 H 25.501 16.419 16.332 1.00 . A A . 9 LEU HD23 1 1 11 1781 1 1 9 LEU HG H 24.384 15.838 14.229 1.00 . A A . 9 LEU HG 1 1 11 1782 1 1 9 LEU N N 22.303 17.174 15.449 1.00 . A A . 9 LEU N 1 1 11 1783 1 1 9 LEU O O 23.064 20.582 14.667 1.00 . A A . 9 LEU O 1 1 11 1784 1 1 10 CYS C C 19.793 21.502 14.753 1.00 . A A . 10 CYS C 1 1 11 1785 1 1 10 CYS CA C 20.430 20.490 13.864 1.00 . A A . 10 CYS CA 1 1 11 1786 1 1 10 CYS CB C 19.393 19.882 12.904 1.00 . A A . 10 CYS CB 1 1 11 1787 1 1 10 CYS H H 20.636 18.644 14.845 1.00 . A A . 10 CYS H 1 1 11 1788 1 1 10 CYS HA H 21.122 21.028 13.234 1.00 . A A . 10 CYS HA 1 1 11 1789 1 1 10 CYS HB2 H 19.816 18.931 12.517 1.00 . A A . 10 CYS HB2 1 1 11 1790 1 1 10 CYS HB3 H 18.450 19.626 13.434 1.00 . A A . 10 CYS HB3 1 1 11 1791 1 1 10 CYS N N 21.129 19.469 14.581 1.00 . A A . 10 CYS N 1 1 11 1792 1 1 10 CYS O O 18.854 22.192 14.359 1.00 . A A . 10 CYS O 1 1 11 1793 1 1 10 CYS SG S 19.053 20.825 11.389 1.00 . A A . 10 CYS SG 1 1 11 1794 1 1 11 CYS C C 20.733 23.973 16.525 1.00 . A A . 11 CYS C 1 1 11 1795 1 1 11 CYS CA C 19.815 22.792 16.805 1.00 . A A . 11 CYS CA 1 1 11 1796 1 1 11 CYS CB C 19.842 22.501 18.315 1.00 . A A . 11 CYS CB 1 1 11 1797 1 1 11 CYS H H 20.967 21.100 16.370 1.00 . A A . 11 CYS H 1 1 11 1798 1 1 11 CYS HA H 18.800 23.051 16.542 1.00 . A A . 11 CYS HA 1 1 11 1799 1 1 11 CYS HB2 H 20.767 21.939 18.568 1.00 . A A . 11 CYS HB2 1 1 11 1800 1 1 11 CYS HB3 H 19.908 23.444 18.899 1.00 . A A . 11 CYS HB3 1 1 11 1801 1 1 11 CYS N N 20.263 21.700 15.998 1.00 . A A . 11 CYS N 1 1 11 1802 1 1 11 CYS O O 21.950 23.886 16.839 1.00 . A A . 11 CYS O 1 1 11 1803 1 1 11 CYS OXT O 20.268 25.016 15.993 1.00 . A A . 11 CYS OXT 1 1 11 1804 1 1 11 CYS SG S 18.398 21.609 18.961 1.00 . A A . 11 CYS SG 1 1 12 1805 1 1 1 SER C C 14.544 22.883 12.449 1.00 . A A . 1 SER C 1 1 12 1806 1 1 1 SER CA C 15.067 24.271 12.584 1.00 . A A . 1 SER CA 1 1 12 1807 1 1 1 SER CB C 16.028 24.293 13.785 1.00 . A A . 1 SER CB 1 1 12 1808 1 1 1 SER H1 H 14.415 26.234 12.801 1.00 . A A . 1 SER H1 1 1 12 1809 1 1 1 SER H2 H 13.436 25.094 13.597 1.00 . A A . 1 SER H2 1 1 12 1810 1 1 1 SER H3 H 13.367 25.260 11.916 1.00 . A A . 1 SER H3 1 1 12 1811 1 1 1 SER HA H 15.600 24.511 11.676 1.00 . A A . 1 SER HA 1 1 12 1812 1 1 1 SER HB2 H 15.479 24.101 14.732 1.00 . A A . 1 SER HB2 1 1 12 1813 1 1 1 SER HB3 H 16.798 23.500 13.682 1.00 . A A . 1 SER HB3 1 1 12 1814 1 1 1 SER HG H 17.331 25.469 14.588 1.00 . A A . 1 SER HG 1 1 12 1815 1 1 1 SER N N 13.998 25.283 12.743 1.00 . A A . 1 SER N 1 1 12 1816 1 1 1 SER O O 13.390 22.615 12.779 1.00 . A A . 1 SER O 1 1 12 1817 1 1 1 SER OG O 16.701 25.541 13.868 1.00 . A A . 1 SER OG 1 1 12 1818 1 1 2 CYS C C 14.953 19.973 13.299 1.00 . A A . 2 CYS C 1 1 12 1819 1 1 2 CYS CA C 15.051 20.542 11.926 1.00 . A A . 2 CYS CA 1 1 12 1820 1 1 2 CYS CB C 16.032 19.710 11.081 1.00 . A A . 2 CYS CB 1 1 12 1821 1 1 2 CYS H H 16.276 22.179 11.632 1.00 . A A . 2 CYS H 1 1 12 1822 1 1 2 CYS HA H 14.056 20.480 11.513 1.00 . A A . 2 CYS HA 1 1 12 1823 1 1 2 CYS HB2 H 16.512 18.914 11.691 1.00 . A A . 2 CYS HB2 1 1 12 1824 1 1 2 CYS HB3 H 15.515 19.186 10.249 1.00 . A A . 2 CYS HB3 1 1 12 1825 1 1 2 CYS N N 15.371 21.934 11.974 1.00 . A A . 2 CYS N 1 1 12 1826 1 1 2 CYS O O 15.511 20.522 14.249 1.00 . A A . 2 CYS O 1 1 12 1827 1 1 2 CYS SG S 17.360 20.661 10.289 1.00 . A A . 2 CYS SG 1 1 12 1828 1 1 3 SER C C 14.971 17.831 15.590 1.00 . A A . 3 SER C 1 1 12 1829 1 1 3 SER CA C 13.843 18.368 14.780 1.00 . A A . 3 SER CA 1 1 12 1830 1 1 3 SER CB C 12.846 17.203 14.663 1.00 . A A . 3 SER CB 1 1 12 1831 1 1 3 SER H H 13.738 18.422 12.732 1.00 . A A . 3 SER H 1 1 12 1832 1 1 3 SER HA H 13.388 19.173 15.337 1.00 . A A . 3 SER HA 1 1 12 1833 1 1 3 SER HB2 H 13.283 16.301 14.183 1.00 . A A . 3 SER HB2 1 1 12 1834 1 1 3 SER HB3 H 12.499 16.891 15.671 1.00 . A A . 3 SER HB3 1 1 12 1835 1 1 3 SER HG H 11.028 16.966 14.050 1.00 . A A . 3 SER HG 1 1 12 1836 1 1 3 SER N N 14.199 18.875 13.491 1.00 . A A . 3 SER N 1 1 12 1837 1 1 3 SER O O 15.777 17.064 15.064 1.00 . A A . 3 SER O 1 1 12 1838 1 1 3 SER OG O 11.716 17.621 13.912 1.00 . A A . 3 SER OG 1 1 12 1839 1 1 4 CYS C C 16.064 16.288 18.103 1.00 . A A . 4 CYS C 1 1 12 1840 1 1 4 CYS CA C 16.139 17.733 17.742 1.00 . A A . 4 CYS CA 1 1 12 1841 1 1 4 CYS CB C 16.133 18.566 19.035 1.00 . A A . 4 CYS CB 1 1 12 1842 1 1 4 CYS H H 14.442 18.811 17.308 1.00 . A A . 4 CYS H 1 1 12 1843 1 1 4 CYS HA H 17.103 17.832 17.266 1.00 . A A . 4 CYS HA 1 1 12 1844 1 1 4 CYS HB2 H 15.097 18.767 19.385 1.00 . A A . 4 CYS HB2 1 1 12 1845 1 1 4 CYS HB3 H 16.629 17.981 19.839 1.00 . A A . 4 CYS HB3 1 1 12 1846 1 1 4 CYS N N 15.083 18.175 16.885 1.00 . A A . 4 CYS N 1 1 12 1847 1 1 4 CYS O O 17.059 15.669 18.475 1.00 . A A . 4 CYS O 1 1 12 1848 1 1 4 CYS SG S 17.054 20.123 18.879 1.00 . A A . 4 CYS SG 1 1 12 1849 1 1 5 LYS C C 15.236 13.466 17.128 1.00 . A A . 5 LYS C 1 1 12 1850 1 1 5 LYS CA C 14.698 14.271 18.261 1.00 . A A . 5 LYS CA 1 1 12 1851 1 1 5 LYS CB C 13.217 13.982 18.557 1.00 . A A . 5 LYS CB 1 1 12 1852 1 1 5 LYS CD C 13.052 15.773 20.421 1.00 . A A . 5 LYS CD 1 1 12 1853 1 1 5 LYS CE C 12.452 16.195 21.763 1.00 . A A . 5 LYS CE 1 1 12 1854 1 1 5 LYS CG C 12.757 14.340 19.972 1.00 . A A . 5 LYS CG 1 1 12 1855 1 1 5 LYS H H 14.043 16.160 17.765 1.00 . A A . 5 LYS H 1 1 12 1856 1 1 5 LYS HA H 15.291 13.981 19.116 1.00 . A A . 5 LYS HA 1 1 12 1857 1 1 5 LYS HB2 H 12.562 14.513 17.834 1.00 . A A . 5 LYS HB2 1 1 12 1858 1 1 5 LYS HB3 H 13.026 12.894 18.433 1.00 . A A . 5 LYS HB3 1 1 12 1859 1 1 5 LYS HD2 H 14.154 15.899 20.487 1.00 . A A . 5 LYS HD2 1 1 12 1860 1 1 5 LYS HD3 H 12.688 16.468 19.634 1.00 . A A . 5 LYS HD3 1 1 12 1861 1 1 5 LYS HE2 H 11.341 16.198 21.718 1.00 . A A . 5 LYS HE2 1 1 12 1862 1 1 5 LYS HE3 H 12.796 15.511 22.568 1.00 . A A . 5 LYS HE3 1 1 12 1863 1 1 5 LYS HG2 H 11.660 14.178 20.018 1.00 . A A . 5 LYS HG2 1 1 12 1864 1 1 5 LYS HG3 H 13.225 13.639 20.694 1.00 . A A . 5 LYS HG3 1 1 12 1865 1 1 5 LYS HZ1 H 12.659 18.219 21.334 1.00 . A A . 5 LYS HZ1 1 1 12 1866 1 1 5 LYS HZ2 H 13.946 17.568 22.226 1.00 . A A . 5 LYS HZ2 1 1 12 1867 1 1 5 LYS HZ3 H 12.454 17.878 22.975 1.00 . A A . 5 LYS HZ3 1 1 12 1868 1 1 5 LYS N N 14.877 15.666 18.000 1.00 . A A . 5 LYS N 1 1 12 1869 1 1 5 LYS NZ N 12.914 17.561 22.099 1.00 . A A . 5 LYS NZ 1 1 12 1870 1 1 5 LYS O O 15.883 12.437 17.316 1.00 . A A . 5 LYS O 1 1 12 1871 1 1 6 ARG C C 17.226 13.980 14.655 1.00 . A A . 6 ARG C 1 1 12 1872 1 1 6 ARG CA C 15.825 13.481 14.750 1.00 . A A . 6 ARG CA 1 1 12 1873 1 1 6 ARG CB C 15.023 13.863 13.494 1.00 . A A . 6 ARG CB 1 1 12 1874 1 1 6 ARG CD C 12.730 13.691 12.473 1.00 . A A . 6 ARG CD 1 1 12 1875 1 1 6 ARG CG C 13.830 12.943 13.228 1.00 . A A . 6 ARG CG 1 1 12 1876 1 1 6 ARG CZ C 10.457 12.653 12.073 1.00 . A A . 6 ARG CZ 1 1 12 1877 1 1 6 ARG H H 14.448 14.691 15.694 1.00 . A A . 6 ARG H 1 1 12 1878 1 1 6 ARG HA H 15.903 12.405 14.791 1.00 . A A . 6 ARG HA 1 1 12 1879 1 1 6 ARG HB2 H 14.616 14.890 13.607 1.00 . A A . 6 ARG HB2 1 1 12 1880 1 1 6 ARG HB3 H 15.599 13.780 12.548 1.00 . A A . 6 ARG HB3 1 1 12 1881 1 1 6 ARG HD2 H 12.210 14.458 13.086 1.00 . A A . 6 ARG HD2 1 1 12 1882 1 1 6 ARG HD3 H 13.089 14.278 11.602 1.00 . A A . 6 ARG HD3 1 1 12 1883 1 1 6 ARG HE H 12.196 11.699 11.866 1.00 . A A . 6 ARG HE 1 1 12 1884 1 1 6 ARG HG2 H 14.294 12.093 12.683 1.00 . A A . 6 ARG HG2 1 1 12 1885 1 1 6 ARG HG3 H 13.551 12.517 14.216 1.00 . A A . 6 ARG HG3 1 1 12 1886 1 1 6 ARG HH11 H 10.261 14.671 12.319 1.00 . A A . 6 ARG HH11 1 1 12 1887 1 1 6 ARG HH12 H 8.783 13.773 12.501 1.00 . A A . 6 ARG HH12 1 1 12 1888 1 1 6 ARG HH21 H 10.203 10.792 11.299 1.00 . A A . 6 ARG HH21 1 1 12 1889 1 1 6 ARG HH22 H 8.746 11.580 11.783 1.00 . A A . 6 ARG HH22 1 1 12 1890 1 1 6 ARG N N 15.091 13.952 15.883 1.00 . A A . 6 ARG N 1 1 12 1891 1 1 6 ARG NE N 11.819 12.618 11.987 1.00 . A A . 6 ARG NE 1 1 12 1892 1 1 6 ARG NH1 N 9.769 13.801 12.343 1.00 . A A . 6 ARG NH1 1 1 12 1893 1 1 6 ARG NH2 N 9.744 11.519 11.809 1.00 . A A . 6 ARG NH2 1 1 12 1894 1 1 6 ARG O O 18.178 13.340 15.099 1.00 . A A . 6 ARG O 1 1 12 1895 1 1 7 ASN C C 19.367 16.508 14.422 1.00 . A A . 7 ASN C 1 1 12 1896 1 1 7 ASN CA C 18.677 15.581 13.481 1.00 . A A . 7 ASN CA 1 1 12 1897 1 1 7 ASN CB C 18.539 16.233 12.095 1.00 . A A . 7 ASN CB 1 1 12 1898 1 1 7 ASN CG C 17.634 15.350 11.246 1.00 . A A . 7 ASN CG 1 1 12 1899 1 1 7 ASN H H 16.613 15.696 13.822 1.00 . A A . 7 ASN H 1 1 12 1900 1 1 7 ASN HA H 19.307 14.716 13.337 1.00 . A A . 7 ASN HA 1 1 12 1901 1 1 7 ASN HB2 H 18.189 17.287 12.100 1.00 . A A . 7 ASN HB2 1 1 12 1902 1 1 7 ASN HB3 H 19.519 16.250 11.573 1.00 . A A . 7 ASN HB3 1 1 12 1903 1 1 7 ASN HD21 H 16.217 16.813 11.090 1.00 . A A . 7 ASN HD21 1 1 12 1904 1 1 7 ASN HD22 H 15.853 15.337 10.262 1.00 . A A . 7 ASN HD22 1 1 12 1905 1 1 7 ASN N N 17.422 15.142 14.007 1.00 . A A . 7 ASN N 1 1 12 1906 1 1 7 ASN ND2 N 16.413 15.848 10.914 1.00 . A A . 7 ASN ND2 1 1 12 1907 1 1 7 ASN O O 19.000 17.672 14.578 1.00 . A A . 7 ASN O 1 1 12 1908 1 1 7 ASN OD1 O 18.000 14.229 10.894 1.00 . A A . 7 ASN OD1 1 1 12 1909 1 1 8 PHE C C 21.830 17.870 15.915 1.00 . A A . 8 PHE C 1 1 12 1910 1 1 8 PHE CA C 21.007 16.673 16.248 1.00 . A A . 8 PHE CA 1 1 12 1911 1 1 8 PHE CB C 21.825 15.687 17.099 1.00 . A A . 8 PHE CB 1 1 12 1912 1 1 8 PHE CD1 C 24.089 15.285 16.099 1.00 . A A . 8 PHE CD1 1 1 12 1913 1 1 8 PHE CD2 C 22.513 13.522 16.128 1.00 . A A . 8 PHE CD2 1 1 12 1914 1 1 8 PHE CE1 C 25.036 14.444 15.563 1.00 . A A . 8 PHE CE1 1 1 12 1915 1 1 8 PHE CE2 C 23.451 12.671 15.595 1.00 . A A . 8 PHE CE2 1 1 12 1916 1 1 8 PHE CG C 22.824 14.835 16.395 1.00 . A A . 8 PHE CG 1 1 12 1917 1 1 8 PHE CZ C 24.713 13.133 15.304 1.00 . A A . 8 PHE CZ 1 1 12 1918 1 1 8 PHE H H 20.696 15.078 14.972 1.00 . A A . 8 PHE H 1 1 12 1919 1 1 8 PHE HA H 20.211 17.064 16.867 1.00 . A A . 8 PHE HA 1 1 12 1920 1 1 8 PHE HB2 H 22.357 16.220 17.915 1.00 . A A . 8 PHE HB2 1 1 12 1921 1 1 8 PHE HB3 H 21.130 14.979 17.599 1.00 . A A . 8 PHE HB3 1 1 12 1922 1 1 8 PHE HD1 H 24.383 16.299 16.329 1.00 . A A . 8 PHE HD1 1 1 12 1923 1 1 8 PHE HD2 H 21.539 13.117 16.362 1.00 . A A . 8 PHE HD2 1 1 12 1924 1 1 8 PHE HE1 H 26.028 14.813 15.353 1.00 . A A . 8 PHE HE1 1 1 12 1925 1 1 8 PHE HE2 H 23.186 11.637 15.429 1.00 . A A . 8 PHE HE2 1 1 12 1926 1 1 8 PHE HZ H 25.459 12.466 14.897 1.00 . A A . 8 PHE HZ 1 1 12 1927 1 1 8 PHE N N 20.390 16.011 15.141 1.00 . A A . 8 PHE N 1 1 12 1928 1 1 8 PHE O O 22.017 18.753 16.751 1.00 . A A . 8 PHE O 1 1 12 1929 1 1 9 LEU C C 22.285 20.266 13.958 1.00 . A A . 9 LEU C 1 1 12 1930 1 1 9 LEU CA C 23.141 19.081 14.246 1.00 . A A . 9 LEU CA 1 1 12 1931 1 1 9 LEU CB C 24.075 18.839 13.048 1.00 . A A . 9 LEU CB 1 1 12 1932 1 1 9 LEU CD1 C 25.417 17.282 11.553 1.00 . A A . 9 LEU CD1 1 1 12 1933 1 1 9 LEU CD2 C 26.078 17.436 13.919 1.00 . A A . 9 LEU CD2 1 1 12 1934 1 1 9 LEU CG C 24.871 17.526 12.970 1.00 . A A . 9 LEU CG 1 1 12 1935 1 1 9 LEU H H 22.118 17.268 14.013 1.00 . A A . 9 LEU H 1 1 12 1936 1 1 9 LEU HA H 23.767 19.394 15.070 1.00 . A A . 9 LEU HA 1 1 12 1937 1 1 9 LEU HB2 H 23.572 18.991 12.070 1.00 . A A . 9 LEU HB2 1 1 12 1938 1 1 9 LEU HB3 H 24.841 19.641 13.115 1.00 . A A . 9 LEU HB3 1 1 12 1939 1 1 9 LEU HD11 H 26.097 18.111 11.260 1.00 . A A . 9 LEU HD11 1 1 12 1940 1 1 9 LEU HD12 H 24.571 17.191 10.838 1.00 . A A . 9 LEU HD12 1 1 12 1941 1 1 9 LEU HD13 H 25.978 16.324 11.564 1.00 . A A . 9 LEU HD13 1 1 12 1942 1 1 9 LEU HD21 H 26.792 18.267 13.735 1.00 . A A . 9 LEU HD21 1 1 12 1943 1 1 9 LEU HD22 H 26.601 16.479 13.705 1.00 . A A . 9 LEU HD22 1 1 12 1944 1 1 9 LEU HD23 H 25.769 17.410 14.986 1.00 . A A . 9 LEU HD23 1 1 12 1945 1 1 9 LEU HG H 24.270 16.627 13.223 1.00 . A A . 9 LEU HG 1 1 12 1946 1 1 9 LEU N N 22.354 17.969 14.681 1.00 . A A . 9 LEU N 1 1 12 1947 1 1 9 LEU O O 22.799 21.373 13.803 1.00 . A A . 9 LEU O 1 1 12 1948 1 1 10 CYS C C 19.683 21.921 14.923 1.00 . A A . 10 CYS C 1 1 12 1949 1 1 10 CYS CA C 20.048 21.195 13.675 1.00 . A A . 10 CYS CA 1 1 12 1950 1 1 10 CYS CB C 18.777 20.775 12.916 1.00 . A A . 10 CYS CB 1 1 12 1951 1 1 10 CYS H H 20.564 19.197 14.013 1.00 . A A . 10 CYS H 1 1 12 1952 1 1 10 CYS HA H 20.540 21.931 13.056 1.00 . A A . 10 CYS HA 1 1 12 1953 1 1 10 CYS HB2 H 18.209 19.973 13.434 1.00 . A A . 10 CYS HB2 1 1 12 1954 1 1 10 CYS HB3 H 18.061 21.623 12.851 1.00 . A A . 10 CYS HB3 1 1 12 1955 1 1 10 CYS N N 20.951 20.106 13.886 1.00 . A A . 10 CYS N 1 1 12 1956 1 1 10 CYS O O 19.018 22.953 14.839 1.00 . A A . 10 CYS O 1 1 12 1957 1 1 10 CYS SG S 19.063 20.118 11.248 1.00 . A A . 10 CYS SG 1 1 12 1958 1 1 11 CYS C C 20.120 23.329 17.723 1.00 . A A . 11 CYS C 1 1 12 1959 1 1 11 CYS CA C 19.579 21.951 17.367 1.00 . A A . 11 CYS CA 1 1 12 1960 1 1 11 CYS CB C 19.925 21.023 18.542 1.00 . A A . 11 CYS CB 1 1 12 1961 1 1 11 CYS H H 20.677 20.664 16.208 1.00 . A A . 11 CYS H 1 1 12 1962 1 1 11 CYS HA H 18.510 22.037 17.247 1.00 . A A . 11 CYS HA 1 1 12 1963 1 1 11 CYS HB2 H 21.009 20.783 18.539 1.00 . A A . 11 CYS HB2 1 1 12 1964 1 1 11 CYS HB3 H 19.744 21.525 19.517 1.00 . A A . 11 CYS HB3 1 1 12 1965 1 1 11 CYS N N 20.085 21.462 16.121 1.00 . A A . 11 CYS N 1 1 12 1966 1 1 11 CYS O O 21.357 23.549 17.811 1.00 . A A . 11 CYS O 1 1 12 1967 1 1 11 CYS OXT O 19.282 24.239 17.962 1.00 . A A . 11 CYS OXT 1 1 12 1968 1 1 11 CYS SG S 18.958 19.486 18.583 1.00 . A A . 11 CYS SG 1 1 13 1969 1 1 1 SER C C 13.551 23.413 13.235 1.00 . A A . 1 SER C 1 1 13 1970 1 1 1 SER CA C 13.776 24.542 14.181 1.00 . A A . 1 SER CA 1 1 13 1971 1 1 1 SER CB C 14.457 23.975 15.438 1.00 . A A . 1 SER CB 1 1 13 1972 1 1 1 SER H1 H 12.754 26.254 14.753 1.00 . A A . 1 SER H1 1 1 13 1973 1 1 1 SER H2 H 12.108 24.865 15.412 1.00 . A A . 1 SER H2 1 1 13 1974 1 1 1 SER H3 H 11.830 25.273 13.783 1.00 . A A . 1 SER H3 1 1 13 1975 1 1 1 SER HA H 14.427 25.251 13.693 1.00 . A A . 1 SER HA 1 1 13 1976 1 1 1 SER HB2 H 13.783 23.258 15.952 1.00 . A A . 1 SER HB2 1 1 13 1977 1 1 1 SER HB3 H 15.391 23.426 15.193 1.00 . A A . 1 SER HB3 1 1 13 1978 1 1 1 SER HG H 15.662 25.337 16.106 1.00 . A A . 1 SER HG 1 1 13 1979 1 1 1 SER N N 12.534 25.258 14.548 1.00 . A A . 1 SER N 1 1 13 1980 1 1 1 SER O O 12.412 23.053 12.941 1.00 . A A . 1 SER O 1 1 13 1981 1 1 1 SER OG O 14.794 25.007 16.353 1.00 . A A . 1 SER OG 1 1 13 1982 1 1 2 CYS C C 14.337 20.421 13.085 1.00 . A A . 2 CYS C 1 1 13 1983 1 1 2 CYS CA C 14.580 21.507 12.095 1.00 . A A . 2 CYS CA 1 1 13 1984 1 1 2 CYS CB C 15.844 21.228 11.264 1.00 . A A . 2 CYS CB 1 1 13 1985 1 1 2 CYS H H 15.542 23.168 12.864 1.00 . A A . 2 CYS H 1 1 13 1986 1 1 2 CYS HA H 13.715 21.496 11.447 1.00 . A A . 2 CYS HA 1 1 13 1987 1 1 2 CYS HB2 H 15.913 20.160 10.966 1.00 . A A . 2 CYS HB2 1 1 13 1988 1 1 2 CYS HB3 H 15.807 21.792 10.309 1.00 . A A . 2 CYS HB3 1 1 13 1989 1 1 2 CYS N N 14.631 22.781 12.742 1.00 . A A . 2 CYS N 1 1 13 1990 1 1 2 CYS O O 14.058 20.675 14.255 1.00 . A A . 2 CYS O 1 1 13 1991 1 1 2 CYS SG S 17.373 21.742 12.101 1.00 . A A . 2 CYS SG 1 1 13 1992 1 1 3 SER C C 15.126 17.699 14.496 1.00 . A A . 3 SER C 1 1 13 1993 1 1 3 SER CA C 14.052 18.026 13.518 1.00 . A A . 3 SER CA 1 1 13 1994 1 1 3 SER CB C 13.796 16.753 12.694 1.00 . A A . 3 SER CB 1 1 13 1995 1 1 3 SER H H 14.536 18.905 11.722 1.00 . A A . 3 SER H 1 1 13 1996 1 1 3 SER HA H 13.181 18.295 14.096 1.00 . A A . 3 SER HA 1 1 13 1997 1 1 3 SER HB2 H 13.753 15.826 13.308 1.00 . A A . 3 SER HB2 1 1 13 1998 1 1 3 SER HB3 H 12.811 16.855 12.191 1.00 . A A . 3 SER HB3 1 1 13 1999 1 1 3 SER HG H 15.594 16.369 12.091 1.00 . A A . 3 SER HG 1 1 13 2000 1 1 3 SER N N 14.363 19.139 12.676 1.00 . A A . 3 SER N 1 1 13 2001 1 1 3 SER O O 16.017 16.898 14.218 1.00 . A A . 3 SER O 1 1 13 2002 1 1 3 SER OG O 14.764 16.597 11.667 1.00 . A A . 3 SER OG 1 1 13 2003 1 1 4 CYS C C 15.968 16.844 17.435 1.00 . A A . 4 CYS C 1 1 13 2004 1 1 4 CYS CA C 16.057 18.144 16.712 1.00 . A A . 4 CYS CA 1 1 13 2005 1 1 4 CYS CB C 15.956 19.300 17.721 1.00 . A A . 4 CYS CB 1 1 13 2006 1 1 4 CYS H H 14.270 18.878 15.880 1.00 . A A . 4 CYS H 1 1 13 2007 1 1 4 CYS HA H 17.026 18.165 16.235 1.00 . A A . 4 CYS HA 1 1 13 2008 1 1 4 CYS HB2 H 15.688 20.200 17.126 1.00 . A A . 4 CYS HB2 1 1 13 2009 1 1 4 CYS HB3 H 15.134 19.152 18.452 1.00 . A A . 4 CYS HB3 1 1 13 2010 1 1 4 CYS N N 15.049 18.281 15.706 1.00 . A A . 4 CYS N 1 1 13 2011 1 1 4 CYS O O 16.976 16.311 17.895 1.00 . A A . 4 CYS O 1 1 13 2012 1 1 4 CYS SG S 17.500 19.574 18.637 1.00 . A A . 4 CYS SG 1 1 13 2013 1 1 5 LYS C C 15.332 13.885 17.241 1.00 . A A . 5 LYS C 1 1 13 2014 1 1 5 LYS CA C 14.603 14.910 18.040 1.00 . A A . 5 LYS CA 1 1 13 2015 1 1 5 LYS CB C 13.124 14.487 18.066 1.00 . A A . 5 LYS CB 1 1 13 2016 1 1 5 LYS CD C 12.268 16.295 19.702 1.00 . A A . 5 LYS CD 1 1 13 2017 1 1 5 LYS CE C 11.494 16.524 21.001 1.00 . A A . 5 LYS CE 1 1 13 2018 1 1 5 LYS CG C 12.362 14.808 19.353 1.00 . A A . 5 LYS CG 1 1 13 2019 1 1 5 LYS H H 13.948 16.699 17.214 1.00 . A A . 5 LYS H 1 1 13 2020 1 1 5 LYS HA H 15.044 14.876 19.026 1.00 . A A . 5 LYS HA 1 1 13 2021 1 1 5 LYS HB2 H 12.576 14.912 17.198 1.00 . A A . 5 LYS HB2 1 1 13 2022 1 1 5 LYS HB3 H 13.043 13.383 17.974 1.00 . A A . 5 LYS HB3 1 1 13 2023 1 1 5 LYS HD2 H 13.290 16.718 19.812 1.00 . A A . 5 LYS HD2 1 1 13 2024 1 1 5 LYS HD3 H 11.760 16.823 18.867 1.00 . A A . 5 LYS HD3 1 1 13 2025 1 1 5 LYS HE2 H 10.470 16.098 20.930 1.00 . A A . 5 LYS HE2 1 1 13 2026 1 1 5 LYS HE3 H 12.023 16.054 21.857 1.00 . A A . 5 LYS HE3 1 1 13 2027 1 1 5 LYS HG2 H 11.332 14.411 19.225 1.00 . A A . 5 LYS HG2 1 1 13 2028 1 1 5 LYS HG3 H 12.822 14.256 20.199 1.00 . A A . 5 LYS HG3 1 1 13 2029 1 1 5 LYS HZ1 H 10.869 18.117 22.167 1.00 . A A . 5 LYS HZ1 1 1 13 2030 1 1 5 LYS HZ2 H 10.836 18.418 20.490 1.00 . A A . 5 LYS HZ2 1 1 13 2031 1 1 5 LYS HZ3 H 12.305 18.424 21.302 1.00 . A A . 5 LYS HZ3 1 1 13 2032 1 1 5 LYS N N 14.772 16.235 17.529 1.00 . A A . 5 LYS N 1 1 13 2033 1 1 5 LYS NZ N 11.368 17.975 21.265 1.00 . A A . 5 LYS NZ 1 1 13 2034 1 1 5 LYS O O 15.872 12.923 17.784 1.00 . A A . 5 LYS O 1 1 13 2035 1 1 6 ARG C C 17.609 13.658 14.995 1.00 . A A . 6 ARG C 1 1 13 2036 1 1 6 ARG CA C 16.185 13.223 15.048 1.00 . A A . 6 ARG CA 1 1 13 2037 1 1 6 ARG CB C 15.527 13.283 13.658 1.00 . A A . 6 ARG CB 1 1 13 2038 1 1 6 ARG CD C 13.260 13.031 12.592 1.00 . A A . 6 ARG CD 1 1 13 2039 1 1 6 ARG CG C 14.252 12.441 13.596 1.00 . A A . 6 ARG CG 1 1 13 2040 1 1 6 ARG CZ C 11.024 12.097 11.830 1.00 . A A . 6 ARG CZ 1 1 13 2041 1 1 6 ARG H H 14.921 14.803 15.457 1.00 . A A . 6 ARG H 1 1 13 2042 1 1 6 ARG HA H 16.181 12.201 15.398 1.00 . A A . 6 ARG HA 1 1 13 2043 1 1 6 ARG HB2 H 15.226 14.327 13.426 1.00 . A A . 6 ARG HB2 1 1 13 2044 1 1 6 ARG HB3 H 16.143 12.875 12.828 1.00 . A A . 6 ARG HB3 1 1 13 2045 1 1 6 ARG HD2 H 12.832 14.012 12.894 1.00 . A A . 6 ARG HD2 1 1 13 2046 1 1 6 ARG HD3 H 13.688 13.207 11.582 1.00 . A A . 6 ARG HD3 1 1 13 2047 1 1 6 ARG HE H 12.219 11.266 13.220 1.00 . A A . 6 ARG HE 1 1 13 2048 1 1 6 ARG HG2 H 14.625 11.419 13.368 1.00 . A A . 6 ARG HG2 1 1 13 2049 1 1 6 ARG HG3 H 13.892 12.361 14.644 1.00 . A A . 6 ARG HG3 1 1 13 2050 1 1 6 ARG HH11 H 11.548 13.685 10.628 1.00 . A A . 6 ARG HH11 1 1 13 2051 1 1 6 ARG HH12 H 9.918 13.084 10.444 1.00 . A A . 6 ARG HH12 1 1 13 2052 1 1 6 ARG HH21 H 10.185 10.417 12.686 1.00 . A A . 6 ARG HH21 1 1 13 2053 1 1 6 ARG HH22 H 9.179 11.237 11.549 1.00 . A A . 6 ARG HH22 1 1 13 2054 1 1 6 ARG N N 15.404 14.056 15.908 1.00 . A A . 6 ARG N 1 1 13 2055 1 1 6 ARG NE N 12.185 12.000 12.543 1.00 . A A . 6 ARG NE 1 1 13 2056 1 1 6 ARG NH1 N 10.804 13.074 10.904 1.00 . A A . 6 ARG NH1 1 1 13 2057 1 1 6 ARG NH2 N 10.048 11.165 12.038 1.00 . A A . 6 ARG NH2 1 1 13 2058 1 1 6 ARG O O 18.476 13.144 15.701 1.00 . A A . 6 ARG O 1 1 13 2059 1 1 7 ASN C C 19.692 16.090 14.835 1.00 . A A . 7 ASN C 1 1 13 2060 1 1 7 ASN CA C 19.233 15.084 13.834 1.00 . A A . 7 ASN CA 1 1 13 2061 1 1 7 ASN CB C 19.387 15.636 12.407 1.00 . A A . 7 ASN CB 1 1 13 2062 1 1 7 ASN CG C 18.510 14.849 11.442 1.00 . A A . 7 ASN CG 1 1 13 2063 1 1 7 ASN H H 17.147 15.071 13.645 1.00 . A A . 7 ASN H 1 1 13 2064 1 1 7 ASN HA H 19.882 14.225 13.918 1.00 . A A . 7 ASN HA 1 1 13 2065 1 1 7 ASN HB2 H 19.091 16.703 12.314 1.00 . A A . 7 ASN HB2 1 1 13 2066 1 1 7 ASN HB3 H 20.440 15.570 12.060 1.00 . A A . 7 ASN HB3 1 1 13 2067 1 1 7 ASN HD21 H 19.903 13.345 11.287 1.00 . A A . 7 ASN HD21 1 1 13 2068 1 1 7 ASN HD22 H 18.428 13.123 10.378 1.00 . A A . 7 ASN HD22 1 1 13 2069 1 1 7 ASN N N 17.906 14.643 14.130 1.00 . A A . 7 ASN N 1 1 13 2070 1 1 7 ASN ND2 N 18.998 13.658 11.002 1.00 . A A . 7 ASN ND2 1 1 13 2071 1 1 7 ASN O O 19.443 17.289 14.728 1.00 . A A . 7 ASN O 1 1 13 2072 1 1 7 ASN OD1 O 17.403 15.272 11.114 1.00 . A A . 7 ASN OD1 1 1 13 2073 1 1 8 PHE C C 21.805 17.482 16.745 1.00 . A A . 8 PHE C 1 1 13 2074 1 1 8 PHE CA C 20.761 16.452 17.008 1.00 . A A . 8 PHE CA 1 1 13 2075 1 1 8 PHE CB C 21.147 15.583 18.218 1.00 . A A . 8 PHE CB 1 1 13 2076 1 1 8 PHE CD1 C 23.433 14.648 17.775 1.00 . A A . 8 PHE CD1 1 1 13 2077 1 1 8 PHE CD2 C 21.590 13.176 17.875 1.00 . A A . 8 PHE CD2 1 1 13 2078 1 1 8 PHE CE1 C 24.276 13.578 17.579 1.00 . A A . 8 PHE CE1 1 1 13 2079 1 1 8 PHE CE2 C 22.420 12.098 17.675 1.00 . A A . 8 PHE CE2 1 1 13 2080 1 1 8 PHE CG C 22.080 14.459 17.926 1.00 . A A . 8 PHE CG 1 1 13 2081 1 1 8 PHE CZ C 23.772 12.300 17.530 1.00 . A A . 8 PHE CZ 1 1 13 2082 1 1 8 PHE H H 20.622 14.674 15.953 1.00 . A A . 8 PHE H 1 1 13 2083 1 1 8 PHE HA H 19.888 17.027 17.280 1.00 . A A . 8 PHE HA 1 1 13 2084 1 1 8 PHE HB2 H 21.572 16.190 19.045 1.00 . A A . 8 PHE HB2 1 1 13 2085 1 1 8 PHE HB3 H 20.220 15.116 18.613 1.00 . A A . 8 PHE HB3 1 1 13 2086 1 1 8 PHE HD1 H 23.872 15.633 17.834 1.00 . A A . 8 PHE HD1 1 1 13 2087 1 1 8 PHE HD2 H 20.539 12.972 18.015 1.00 . A A . 8 PHE HD2 1 1 13 2088 1 1 8 PHE HE1 H 25.336 13.747 17.465 1.00 . A A . 8 PHE HE1 1 1 13 2089 1 1 8 PHE HE2 H 21.984 11.111 17.638 1.00 . A A . 8 PHE HE2 1 1 13 2090 1 1 8 PHE HZ H 24.430 11.453 17.396 1.00 . A A . 8 PHE HZ 1 1 13 2091 1 1 8 PHE N N 20.405 15.644 15.884 1.00 . A A . 8 PHE N 1 1 13 2092 1 1 8 PHE O O 21.966 18.432 17.511 1.00 . A A . 8 PHE O 1 1 13 2093 1 1 9 LEU C C 22.786 19.508 14.451 1.00 . A A . 9 LEU C 1 1 13 2094 1 1 9 LEU CA C 23.454 18.409 15.203 1.00 . A A . 9 LEU CA 1 1 13 2095 1 1 9 LEU CB C 24.673 17.940 14.388 1.00 . A A . 9 LEU CB 1 1 13 2096 1 1 9 LEU CD1 C 26.361 16.225 13.654 1.00 . A A . 9 LEU CD1 1 1 13 2097 1 1 9 LEU CD2 C 26.180 16.618 16.074 1.00 . A A . 9 LEU CD2 1 1 13 2098 1 1 9 LEU CG C 25.375 16.625 14.765 1.00 . A A . 9 LEU CG 1 1 13 2099 1 1 9 LEU H H 22.414 16.591 15.043 1.00 . A A . 9 LEU H 1 1 13 2100 1 1 9 LEU HA H 23.848 18.893 16.084 1.00 . A A . 9 LEU HA 1 1 13 2101 1 1 9 LEU HB2 H 24.469 17.913 13.297 1.00 . A A . 9 LEU HB2 1 1 13 2102 1 1 9 LEU HB3 H 25.436 18.734 14.536 1.00 . A A . 9 LEU HB3 1 1 13 2103 1 1 9 LEU HD11 H 27.148 17.001 13.544 1.00 . A A . 9 LEU HD11 1 1 13 2104 1 1 9 LEU HD12 H 25.832 16.095 12.686 1.00 . A A . 9 LEU HD12 1 1 13 2105 1 1 9 LEU HD13 H 26.835 15.260 13.937 1.00 . A A . 9 LEU HD13 1 1 13 2106 1 1 9 LEU HD21 H 25.554 16.851 16.963 1.00 . A A . 9 LEU HD21 1 1 13 2107 1 1 9 LEU HD22 H 27.047 17.310 16.010 1.00 . A A . 9 LEU HD22 1 1 13 2108 1 1 9 LEU HD23 H 26.556 15.580 16.201 1.00 . A A . 9 LEU HD23 1 1 13 2109 1 1 9 LEU HG H 24.671 15.769 14.850 1.00 . A A . 9 LEU HG 1 1 13 2110 1 1 9 LEU N N 22.528 17.400 15.614 1.00 . A A . 9 LEU N 1 1 13 2111 1 1 9 LEU O O 23.404 20.523 14.137 1.00 . A A . 9 LEU O 1 1 13 2112 1 1 10 CYS C C 20.439 21.605 13.977 1.00 . A A . 10 CYS C 1 1 13 2113 1 1 10 CYS CA C 20.780 20.317 13.310 1.00 . A A . 10 CYS CA 1 1 13 2114 1 1 10 CYS CB C 19.498 19.706 12.718 1.00 . A A . 10 CYS CB 1 1 13 2115 1 1 10 CYS H H 20.994 18.615 14.534 1.00 . A A . 10 CYS H 1 1 13 2116 1 1 10 CYS HA H 21.419 20.571 12.477 1.00 . A A . 10 CYS HA 1 1 13 2117 1 1 10 CYS HB2 H 19.711 18.667 12.388 1.00 . A A . 10 CYS HB2 1 1 13 2118 1 1 10 CYS HB3 H 18.691 19.611 13.475 1.00 . A A . 10 CYS HB3 1 1 13 2119 1 1 10 CYS N N 21.478 19.400 14.157 1.00 . A A . 10 CYS N 1 1 13 2120 1 1 10 CYS O O 20.172 22.613 13.326 1.00 . A A . 10 CYS O 1 1 13 2121 1 1 10 CYS SG S 18.834 20.597 11.281 1.00 . A A . 10 CYS SG 1 1 13 2122 1 1 11 CYS C C 20.101 23.856 16.353 1.00 . A A . 11 CYS C 1 1 13 2123 1 1 11 CYS CA C 19.496 22.497 16.029 1.00 . A A . 11 CYS CA 1 1 13 2124 1 1 11 CYS CB C 19.086 21.826 17.350 1.00 . A A . 11 CYS CB 1 1 13 2125 1 1 11 CYS H H 20.748 20.881 15.874 1.00 . A A . 11 CYS H 1 1 13 2126 1 1 11 CYS HA H 18.654 22.667 15.374 1.00 . A A . 11 CYS HA 1 1 13 2127 1 1 11 CYS HB2 H 19.935 21.916 18.060 1.00 . A A . 11 CYS HB2 1 1 13 2128 1 1 11 CYS HB3 H 18.218 22.303 17.853 1.00 . A A . 11 CYS HB3 1 1 13 2129 1 1 11 CYS N N 20.380 21.625 15.321 1.00 . A A . 11 CYS N 1 1 13 2130 1 1 11 CYS O O 19.371 24.882 16.289 1.00 . A A . 11 CYS O 1 1 13 2131 1 1 11 CYS OXT O 21.297 23.924 16.743 1.00 . A A . 11 CYS OXT 1 1 13 2132 1 1 11 CYS SG S 18.820 20.038 17.168 1.00 . A A . 11 CYS SG 1 1 14 2133 1 1 1 SER C C 13.663 23.565 13.058 1.00 . A A . 1 SER C 1 1 14 2134 1 1 1 SER CA C 14.008 24.991 13.324 1.00 . A A . 1 SER CA 1 1 14 2135 1 1 1 SER CB C 14.152 25.172 14.844 1.00 . A A . 1 SER CB 1 1 14 2136 1 1 1 SER H1 H 12.097 25.859 13.116 1.00 . A A . 1 SER H1 1 1 14 2137 1 1 1 SER H2 H 13.001 25.818 11.697 1.00 . A A . 1 SER H2 1 1 14 2138 1 1 1 SER H3 H 13.394 26.925 12.880 1.00 . A A . 1 SER H3 1 1 14 2139 1 1 1 SER HA H 14.964 25.177 12.859 1.00 . A A . 1 SER HA 1 1 14 2140 1 1 1 SER HB2 H 13.195 24.935 15.356 1.00 . A A . 1 SER HB2 1 1 14 2141 1 1 1 SER HB3 H 14.929 24.488 15.246 1.00 . A A . 1 SER HB3 1 1 14 2142 1 1 1 SER HG H 14.376 26.609 16.095 1.00 . A A . 1 SER HG 1 1 14 2143 1 1 1 SER N N 13.057 25.955 12.726 1.00 . A A . 1 SER N 1 1 14 2144 1 1 1 SER O O 12.507 23.153 13.142 1.00 . A A . 1 SER O 1 1 14 2145 1 1 1 SER OG O 14.535 26.504 15.154 1.00 . A A . 1 SER OG 1 1 14 2146 1 1 2 CYS C C 14.435 20.445 13.385 1.00 . A A . 2 CYS C 1 1 14 2147 1 1 2 CYS CA C 14.534 21.408 12.252 1.00 . A A . 2 CYS CA 1 1 14 2148 1 1 2 CYS CB C 15.707 21.056 11.323 1.00 . A A . 2 CYS CB 1 1 14 2149 1 1 2 CYS H H 15.618 23.091 12.735 1.00 . A A . 2 CYS H 1 1 14 2150 1 1 2 CYS HA H 13.592 21.314 11.731 1.00 . A A . 2 CYS HA 1 1 14 2151 1 1 2 CYS HB2 H 15.863 19.959 11.249 1.00 . A A . 2 CYS HB2 1 1 14 2152 1 1 2 CYS HB3 H 15.472 21.397 10.292 1.00 . A A . 2 CYS HB3 1 1 14 2153 1 1 2 CYS N N 14.679 22.758 12.703 1.00 . A A . 2 CYS N 1 1 14 2154 1 1 2 CYS O O 14.471 20.812 14.558 1.00 . A A . 2 CYS O 1 1 14 2155 1 1 2 CYS SG S 17.264 21.884 11.761 1.00 . A A . 2 CYS SG 1 1 14 2156 1 1 3 SER C C 15.413 17.763 14.748 1.00 . A A . 3 SER C 1 1 14 2157 1 1 3 SER CA C 14.142 18.094 14.044 1.00 . A A . 3 SER CA 1 1 14 2158 1 1 3 SER CB C 13.604 16.814 13.381 1.00 . A A . 3 SER CB 1 1 14 2159 1 1 3 SER H H 14.164 18.847 12.139 1.00 . A A . 3 SER H 1 1 14 2160 1 1 3 SER HA H 13.466 18.452 14.806 1.00 . A A . 3 SER HA 1 1 14 2161 1 1 3 SER HB2 H 13.697 15.911 14.021 1.00 . A A . 3 SER HB2 1 1 14 2162 1 1 3 SER HB3 H 12.522 16.943 13.167 1.00 . A A . 3 SER HB3 1 1 14 2163 1 1 3 SER HG H 13.643 16.042 11.588 1.00 . A A . 3 SER HG 1 1 14 2164 1 1 3 SER N N 14.273 19.145 13.084 1.00 . A A . 3 SER N 1 1 14 2165 1 1 3 SER O O 16.237 16.983 14.272 1.00 . A A . 3 SER O 1 1 14 2166 1 1 3 SER OG O 14.243 16.547 12.142 1.00 . A A . 3 SER OG 1 1 14 2167 1 1 4 CYS C C 16.655 16.826 17.553 1.00 . A A . 4 CYS C 1 1 14 2168 1 1 4 CYS CA C 16.779 18.072 16.748 1.00 . A A . 4 CYS CA 1 1 14 2169 1 1 4 CYS CB C 17.100 19.261 17.670 1.00 . A A . 4 CYS CB 1 1 14 2170 1 1 4 CYS H H 14.895 18.887 16.350 1.00 . A A . 4 CYS H 1 1 14 2171 1 1 4 CYS HA H 17.634 17.940 16.101 1.00 . A A . 4 CYS HA 1 1 14 2172 1 1 4 CYS HB2 H 16.810 20.171 17.103 1.00 . A A . 4 CYS HB2 1 1 14 2173 1 1 4 CYS HB3 H 16.476 19.231 18.589 1.00 . A A . 4 CYS HB3 1 1 14 2174 1 1 4 CYS N N 15.607 18.307 15.963 1.00 . A A . 4 CYS N 1 1 14 2175 1 1 4 CYS O O 17.637 16.239 18.005 1.00 . A A . 4 CYS O 1 1 14 2176 1 1 4 CYS SG S 18.862 19.336 18.102 1.00 . A A . 4 CYS SG 1 1 14 2177 1 1 5 LYS C C 15.687 13.985 17.303 1.00 . A A . 5 LYS C 1 1 14 2178 1 1 5 LYS CA C 15.097 15.028 18.188 1.00 . A A . 5 LYS CA 1 1 14 2179 1 1 5 LYS CB C 13.576 14.807 18.245 1.00 . A A . 5 LYS CB 1 1 14 2180 1 1 5 LYS CD C 13.023 16.725 19.886 1.00 . A A . 5 LYS CD 1 1 14 2181 1 1 5 LYS CE C 12.429 17.083 21.249 1.00 . A A . 5 LYS CE 1 1 14 2182 1 1 5 LYS CG C 12.888 15.240 19.541 1.00 . A A . 5 LYS CG 1 1 14 2183 1 1 5 LYS H H 14.648 16.966 17.557 1.00 . A A . 5 LYS H 1 1 14 2184 1 1 5 LYS HA H 15.553 14.880 19.155 1.00 . A A . 5 LYS HA 1 1 14 2185 1 1 5 LYS HB2 H 13.065 15.316 17.399 1.00 . A A . 5 LYS HB2 1 1 14 2186 1 1 5 LYS HB3 H 13.347 13.723 18.153 1.00 . A A . 5 LYS HB3 1 1 14 2187 1 1 5 LYS HD2 H 14.104 16.982 19.910 1.00 . A A . 5 LYS HD2 1 1 14 2188 1 1 5 LYS HD3 H 12.532 17.324 19.090 1.00 . A A . 5 LYS HD3 1 1 14 2189 1 1 5 LYS HE2 H 11.327 16.938 21.248 1.00 . A A . 5 LYS HE2 1 1 14 2190 1 1 5 LYS HE3 H 12.880 16.467 22.056 1.00 . A A . 5 LYS HE3 1 1 14 2191 1 1 5 LYS HG2 H 11.811 14.986 19.449 1.00 . A A . 5 LYS HG2 1 1 14 2192 1 1 5 LYS HG3 H 13.293 14.628 20.376 1.00 . A A . 5 LYS HG3 1 1 14 2193 1 1 5 LYS HZ1 H 13.721 18.708 21.412 1.00 . A A . 5 LYS HZ1 1 1 14 2194 1 1 5 LYS HZ2 H 12.428 18.775 22.504 1.00 . A A . 5 LYS HZ2 1 1 14 2195 1 1 5 LYS HZ3 H 12.153 19.102 20.892 1.00 . A A . 5 LYS HZ3 1 1 14 2196 1 1 5 LYS N N 15.411 16.349 17.739 1.00 . A A . 5 LYS N 1 1 14 2197 1 1 5 LYS NZ N 12.708 18.507 21.539 1.00 . A A . 5 LYS NZ 1 1 14 2198 1 1 5 LYS O O 16.340 13.051 17.767 1.00 . A A . 5 LYS O 1 1 14 2199 1 1 6 ARG C C 17.505 13.588 14.695 1.00 . A A . 6 ARG C 1 1 14 2200 1 1 6 ARG CA C 16.090 13.239 15.005 1.00 . A A . 6 ARG CA 1 1 14 2201 1 1 6 ARG CB C 15.209 13.306 13.747 1.00 . A A . 6 ARG CB 1 1 14 2202 1 1 6 ARG CD C 12.807 13.262 13.062 1.00 . A A . 6 ARG CD 1 1 14 2203 1 1 6 ARG CG C 13.884 12.551 13.882 1.00 . A A . 6 ARG CG 1 1 14 2204 1 1 6 ARG CZ C 10.623 12.161 13.714 1.00 . A A . 6 ARG CZ 1 1 14 2205 1 1 6 ARG H H 14.974 14.870 15.606 1.00 . A A . 6 ARG H 1 1 14 2206 1 1 6 ARG HA H 16.092 12.228 15.385 1.00 . A A . 6 ARG HA 1 1 14 2207 1 1 6 ARG HB2 H 14.948 14.364 13.533 1.00 . A A . 6 ARG HB2 1 1 14 2208 1 1 6 ARG HB3 H 15.665 12.851 12.841 1.00 . A A . 6 ARG HB3 1 1 14 2209 1 1 6 ARG HD2 H 12.417 14.217 13.476 1.00 . A A . 6 ARG HD2 1 1 14 2210 1 1 6 ARG HD3 H 13.157 13.561 12.050 1.00 . A A . 6 ARG HD3 1 1 14 2211 1 1 6 ARG HE H 11.882 11.492 12.285 1.00 . A A . 6 ARG HE 1 1 14 2212 1 1 6 ARG HG2 H 14.123 11.514 13.565 1.00 . A A . 6 ARG HG2 1 1 14 2213 1 1 6 ARG HG3 H 13.701 12.468 14.975 1.00 . A A . 6 ARG HG3 1 1 14 2214 1 1 6 ARG HH11 H 10.768 13.981 14.681 1.00 . A A . 6 ARG HH11 1 1 14 2215 1 1 6 ARG HH12 H 9.489 12.904 15.203 1.00 . A A . 6 ARG HH12 1 1 14 2216 1 1 6 ARG HH21 H 10.105 10.254 13.129 1.00 . A A . 6 ARG HH21 1 1 14 2217 1 1 6 ARG HH22 H 9.119 11.014 14.354 1.00 . A A . 6 ARG HH22 1 1 14 2218 1 1 6 ARG N N 15.519 14.121 15.976 1.00 . A A . 6 ARG N 1 1 14 2219 1 1 6 ARG NE N 11.713 12.263 12.899 1.00 . A A . 6 ARG NE 1 1 14 2220 1 1 6 ARG NH1 N 10.305 13.096 14.657 1.00 . A A . 6 ARG NH1 1 1 14 2221 1 1 6 ARG NH2 N 9.815 11.064 13.637 1.00 . A A . 6 ARG NH2 1 1 14 2222 1 1 6 ARG O O 18.437 12.982 15.222 1.00 . A A . 6 ARG O 1 1 14 2223 1 1 7 ASN C C 19.639 15.878 14.547 1.00 . A A . 7 ASN C 1 1 14 2224 1 1 7 ASN CA C 19.058 15.026 13.472 1.00 . A A . 7 ASN CA 1 1 14 2225 1 1 7 ASN CB C 19.164 15.775 12.134 1.00 . A A . 7 ASN CB 1 1 14 2226 1 1 7 ASN CG C 18.378 15.079 11.032 1.00 . A A . 7 ASN CG 1 1 14 2227 1 1 7 ASN H H 16.956 15.035 13.414 1.00 . A A . 7 ASN H 1 1 14 2228 1 1 7 ASN HA H 19.690 14.155 13.392 1.00 . A A . 7 ASN HA 1 1 14 2229 1 1 7 ASN HB2 H 18.804 16.825 12.183 1.00 . A A . 7 ASN HB2 1 1 14 2230 1 1 7 ASN HB3 H 20.224 15.827 11.803 1.00 . A A . 7 ASN HB3 1 1 14 2231 1 1 7 ASN HD21 H 19.822 13.620 10.788 1.00 . A A . 7 ASN HD21 1 1 14 2232 1 1 7 ASN HD22 H 18.494 13.581 9.672 1.00 . A A . 7 ASN HD22 1 1 14 2233 1 1 7 ASN N N 17.745 14.568 13.805 1.00 . A A . 7 ASN N 1 1 14 2234 1 1 7 ASN ND2 N 18.940 13.972 10.476 1.00 . A A . 7 ASN ND2 1 1 14 2235 1 1 7 ASN O O 19.356 17.070 14.662 1.00 . A A . 7 ASN O 1 1 14 2236 1 1 7 ASN OD1 O 17.292 15.507 10.647 1.00 . A A . 7 ASN OD1 1 1 14 2237 1 1 8 PHE C C 21.829 17.080 16.522 1.00 . A A . 8 PHE C 1 1 14 2238 1 1 8 PHE CA C 20.952 15.880 16.635 1.00 . A A . 8 PHE CA 1 1 14 2239 1 1 8 PHE CB C 21.584 14.789 17.517 1.00 . A A . 8 PHE CB 1 1 14 2240 1 1 8 PHE CD1 C 23.913 14.372 16.704 1.00 . A A . 8 PHE CD1 1 1 14 2241 1 1 8 PHE CD2 C 22.286 12.681 16.422 1.00 . A A . 8 PHE CD2 1 1 14 2242 1 1 8 PHE CE1 C 24.866 13.559 16.138 1.00 . A A . 8 PHE CE1 1 1 14 2243 1 1 8 PHE CE2 C 23.227 11.855 15.854 1.00 . A A . 8 PHE CE2 1 1 14 2244 1 1 8 PHE CG C 22.613 13.947 16.846 1.00 . A A . 8 PHE CG 1 1 14 2245 1 1 8 PHE CZ C 24.522 12.298 15.710 1.00 . A A . 8 PHE CZ 1 1 14 2246 1 1 8 PHE H H 20.780 14.362 15.248 1.00 . A A . 8 PHE H 1 1 14 2247 1 1 8 PHE HA H 20.071 16.249 17.139 1.00 . A A . 8 PHE HA 1 1 14 2248 1 1 8 PHE HB2 H 22.025 15.219 18.442 1.00 . A A . 8 PHE HB2 1 1 14 2249 1 1 8 PHE HB3 H 20.785 14.088 17.839 1.00 . A A . 8 PHE HB3 1 1 14 2250 1 1 8 PHE HD1 H 24.228 15.342 17.058 1.00 . A A . 8 PHE HD1 1 1 14 2251 1 1 8 PHE HD2 H 21.296 12.270 16.556 1.00 . A A . 8 PHE HD2 1 1 14 2252 1 1 8 PHE HE1 H 25.884 13.906 16.048 1.00 . A A . 8 PHE HE1 1 1 14 2253 1 1 8 PHE HE2 H 22.934 10.865 15.539 1.00 . A A . 8 PHE HE2 1 1 14 2254 1 1 8 PHE HZ H 25.266 11.653 15.268 1.00 . A A . 8 PHE HZ 1 1 14 2255 1 1 8 PHE N N 20.504 15.307 15.404 1.00 . A A . 8 PHE N 1 1 14 2256 1 1 8 PHE O O 22.030 17.809 17.493 1.00 . A A . 8 PHE O 1 1 14 2257 1 1 9 LEU C C 22.295 19.675 14.571 1.00 . A A . 9 LEU C 1 1 14 2258 1 1 9 LEU CA C 23.130 18.516 14.995 1.00 . A A . 9 LEU CA 1 1 14 2259 1 1 9 LEU CB C 24.217 18.300 13.929 1.00 . A A . 9 LEU CB 1 1 14 2260 1 1 9 LEU CD1 C 25.813 16.829 12.623 1.00 . A A . 9 LEU CD1 1 1 14 2261 1 1 9 LEU CD2 C 26.075 16.879 15.074 1.00 . A A . 9 LEU CD2 1 1 14 2262 1 1 9 LEU CG C 25.041 17.001 13.941 1.00 . A A . 9 LEU CG 1 1 14 2263 1 1 9 LEU H H 22.188 16.670 14.615 1.00 . A A . 9 LEU H 1 1 14 2264 1 1 9 LEU HA H 23.623 18.850 15.896 1.00 . A A . 9 LEU HA 1 1 14 2265 1 1 9 LEU HB2 H 23.849 18.462 12.893 1.00 . A A . 9 LEU HB2 1 1 14 2266 1 1 9 LEU HB3 H 24.955 19.108 14.118 1.00 . A A . 9 LEU HB3 1 1 14 2267 1 1 9 LEU HD11 H 25.108 16.807 11.763 1.00 . A A . 9 LEU HD11 1 1 14 2268 1 1 9 LEU HD12 H 26.369 15.868 12.656 1.00 . A A . 9 LEU HD12 1 1 14 2269 1 1 9 LEU HD13 H 26.541 17.659 12.495 1.00 . A A . 9 LEU HD13 1 1 14 2270 1 1 9 LEU HD21 H 26.822 17.699 15.022 1.00 . A A . 9 LEU HD21 1 1 14 2271 1 1 9 LEU HD22 H 26.601 15.913 14.919 1.00 . A A . 9 LEU HD22 1 1 14 2272 1 1 9 LEU HD23 H 25.591 16.839 16.074 1.00 . A A . 9 LEU HD23 1 1 14 2273 1 1 9 LEU HG H 24.420 16.084 14.033 1.00 . A A . 9 LEU HG 1 1 14 2274 1 1 9 LEU N N 22.348 17.363 15.314 1.00 . A A . 9 LEU N 1 1 14 2275 1 1 9 LEU O O 22.787 20.783 14.365 1.00 . A A . 9 LEU O 1 1 14 2276 1 1 10 CYS C C 19.301 21.201 14.802 1.00 . A A . 10 CYS C 1 1 14 2277 1 1 10 CYS CA C 20.061 20.388 13.812 1.00 . A A . 10 CYS CA 1 1 14 2278 1 1 10 CYS CB C 19.121 19.663 12.834 1.00 . A A . 10 CYS CB 1 1 14 2279 1 1 10 CYS H H 20.656 18.550 14.641 1.00 . A A . 10 CYS H 1 1 14 2280 1 1 10 CYS HA H 20.626 21.078 13.203 1.00 . A A . 10 CYS HA 1 1 14 2281 1 1 10 CYS HB2 H 19.650 18.768 12.443 1.00 . A A . 10 CYS HB2 1 1 14 2282 1 1 10 CYS HB3 H 18.209 19.292 13.348 1.00 . A A . 10 CYS HB3 1 1 14 2283 1 1 10 CYS N N 20.974 19.468 14.415 1.00 . A A . 10 CYS N 1 1 14 2284 1 1 10 CYS O O 18.126 21.515 14.618 1.00 . A A . 10 CYS O 1 1 14 2285 1 1 10 CYS SG S 18.727 20.556 11.302 1.00 . A A . 10 CYS SG 1 1 14 2286 1 1 11 CYS C C 19.552 23.942 16.472 1.00 . A A . 11 CYS C 1 1 14 2287 1 1 11 CYS CA C 19.307 22.491 16.863 1.00 . A A . 11 CYS CA 1 1 14 2288 1 1 11 CYS CB C 19.814 22.300 18.303 1.00 . A A . 11 CYS CB 1 1 14 2289 1 1 11 CYS H H 20.863 21.322 16.096 1.00 . A A . 11 CYS H 1 1 14 2290 1 1 11 CYS HA H 18.238 22.334 16.857 1.00 . A A . 11 CYS HA 1 1 14 2291 1 1 11 CYS HB2 H 20.915 22.152 18.297 1.00 . A A . 11 CYS HB2 1 1 14 2292 1 1 11 CYS HB3 H 19.654 23.225 18.897 1.00 . A A . 11 CYS HB3 1 1 14 2293 1 1 11 CYS N N 19.927 21.616 15.917 1.00 . A A . 11 CYS N 1 1 14 2294 1 1 11 CYS O O 20.729 24.371 16.353 1.00 . A A . 11 CYS O 1 1 14 2295 1 1 11 CYS OXT O 18.558 24.692 16.282 1.00 . A A . 11 CYS OXT 1 1 14 2296 1 1 11 CYS SG S 19.015 20.988 19.272 1.00 . A A . 11 CYS SG 1 1 15 2297 1 1 1 SER C C 13.327 23.172 13.128 1.00 . A A . 1 SER C 1 1 15 2298 1 1 1 SER CA C 13.357 24.392 13.982 1.00 . A A . 1 SER CA 1 1 15 2299 1 1 1 SER CB C 14.120 24.073 15.279 1.00 . A A . 1 SER CB 1 1 15 2300 1 1 1 SER H1 H 12.022 25.847 14.696 1.00 . A A . 1 SER H1 1 1 15 2301 1 1 1 SER H2 H 11.547 24.265 14.975 1.00 . A A . 1 SER H2 1 1 15 2302 1 1 1 SER H3 H 11.384 24.914 13.440 1.00 . A A . 1 SER H3 1 1 15 2303 1 1 1 SER HA H 13.892 25.161 13.444 1.00 . A A . 1 SER HA 1 1 15 2304 1 1 1 SER HB2 H 13.571 23.323 15.886 1.00 . A A . 1 SER HB2 1 1 15 2305 1 1 1 SER HB3 H 15.129 23.654 15.073 1.00 . A A . 1 SER HB3 1 1 15 2306 1 1 1 SER HG H 14.849 25.012 16.811 1.00 . A A . 1 SER HG 1 1 15 2307 1 1 1 SER N N 11.997 24.894 14.280 1.00 . A A . 1 SER N 1 1 15 2308 1 1 1 SER O O 12.273 22.584 12.895 1.00 . A A . 1 SER O 1 1 15 2309 1 1 1 SER OG O 14.310 25.249 16.053 1.00 . A A . 1 SER OG 1 1 15 2310 1 1 2 CYS C C 14.420 20.335 13.065 1.00 . A A . 2 CYS C 1 1 15 2311 1 1 2 CYS CA C 14.603 21.403 12.043 1.00 . A A . 2 CYS CA 1 1 15 2312 1 1 2 CYS CB C 15.950 21.194 11.329 1.00 . A A . 2 CYS CB 1 1 15 2313 1 1 2 CYS H H 15.338 23.202 12.763 1.00 . A A . 2 CYS H 1 1 15 2314 1 1 2 CYS HA H 13.793 21.281 11.339 1.00 . A A . 2 CYS HA 1 1 15 2315 1 1 2 CYS HB2 H 16.141 20.116 11.138 1.00 . A A . 2 CYS HB2 1 1 15 2316 1 1 2 CYS HB3 H 15.936 21.671 10.325 1.00 . A A . 2 CYS HB3 1 1 15 2317 1 1 2 CYS N N 14.487 22.700 12.635 1.00 . A A . 2 CYS N 1 1 15 2318 1 1 2 CYS O O 14.429 20.617 14.263 1.00 . A A . 2 CYS O 1 1 15 2319 1 1 2 CYS SG S 17.357 21.913 12.225 1.00 . A A . 2 CYS SG 1 1 15 2320 1 1 3 SER C C 15.168 17.599 14.317 1.00 . A A . 3 SER C 1 1 15 2321 1 1 3 SER CA C 13.967 17.962 13.513 1.00 . A A . 3 SER CA 1 1 15 2322 1 1 3 SER CB C 13.492 16.714 12.750 1.00 . A A . 3 SER CB 1 1 15 2323 1 1 3 SER H H 14.129 18.861 11.676 1.00 . A A . 3 SER H 1 1 15 2324 1 1 3 SER HA H 13.222 18.281 14.227 1.00 . A A . 3 SER HA 1 1 15 2325 1 1 3 SER HB2 H 13.563 15.786 13.357 1.00 . A A . 3 SER HB2 1 1 15 2326 1 1 3 SER HB3 H 12.430 16.851 12.453 1.00 . A A . 3 SER HB3 1 1 15 2327 1 1 3 SER HG H 13.684 16.053 10.936 1.00 . A A . 3 SER HG 1 1 15 2328 1 1 3 SER N N 14.197 19.076 12.647 1.00 . A A . 3 SER N 1 1 15 2329 1 1 3 SER O O 15.969 16.740 13.952 1.00 . A A . 3 SER O 1 1 15 2330 1 1 3 SER OG O 14.242 16.524 11.560 1.00 . A A . 3 SER OG 1 1 15 2331 1 1 4 CYS C C 16.340 17.005 17.267 1.00 . A A . 4 CYS C 1 1 15 2332 1 1 4 CYS CA C 16.459 18.164 16.337 1.00 . A A . 4 CYS CA 1 1 15 2333 1 1 4 CYS CB C 16.598 19.466 17.143 1.00 . A A . 4 CYS CB 1 1 15 2334 1 1 4 CYS H H 14.590 18.890 15.732 1.00 . A A . 4 CYS H 1 1 15 2335 1 1 4 CYS HA H 17.358 18.025 15.753 1.00 . A A . 4 CYS HA 1 1 15 2336 1 1 4 CYS HB2 H 16.400 20.282 16.415 1.00 . A A . 4 CYS HB2 1 1 15 2337 1 1 4 CYS HB3 H 15.824 19.539 17.936 1.00 . A A . 4 CYS HB3 1 1 15 2338 1 1 4 CYS N N 15.311 18.245 15.488 1.00 . A A . 4 CYS N 1 1 15 2339 1 1 4 CYS O O 17.323 16.479 17.785 1.00 . A A . 4 CYS O 1 1 15 2340 1 1 4 CYS SG S 18.249 19.642 17.881 1.00 . A A . 4 CYS SG 1 1 15 2341 1 1 5 LYS C C 15.403 14.135 17.350 1.00 . A A . 5 LYS C 1 1 15 2342 1 1 5 LYS CA C 14.832 15.279 18.114 1.00 . A A . 5 LYS CA 1 1 15 2343 1 1 5 LYS CB C 13.316 15.101 18.304 1.00 . A A . 5 LYS CB 1 1 15 2344 1 1 5 LYS CD C 12.861 17.121 19.886 1.00 . A A . 5 LYS CD 1 1 15 2345 1 1 5 LYS CE C 12.483 17.467 21.327 1.00 . A A . 5 LYS CE 1 1 15 2346 1 1 5 LYS CG C 12.743 15.617 19.625 1.00 . A A . 5 LYS CG 1 1 15 2347 1 1 5 LYS H H 14.323 17.049 17.123 1.00 . A A . 5 LYS H 1 1 15 2348 1 1 5 LYS HA H 15.356 15.268 19.059 1.00 . A A . 5 LYS HA 1 1 15 2349 1 1 5 LYS HB2 H 12.764 15.583 17.470 1.00 . A A . 5 LYS HB2 1 1 15 2350 1 1 5 LYS HB3 H 13.059 14.020 18.282 1.00 . A A . 5 LYS HB3 1 1 15 2351 1 1 5 LYS HD2 H 13.908 17.448 19.714 1.00 . A A . 5 LYS HD2 1 1 15 2352 1 1 5 LYS HD3 H 12.210 17.668 19.170 1.00 . A A . 5 LYS HD3 1 1 15 2353 1 1 5 LYS HE2 H 11.441 17.158 21.557 1.00 . A A . 5 LYS HE2 1 1 15 2354 1 1 5 LYS HE3 H 13.177 16.955 22.027 1.00 . A A . 5 LYS HE3 1 1 15 2355 1 1 5 LYS HG2 H 11.665 15.349 19.644 1.00 . A A . 5 LYS HG2 1 1 15 2356 1 1 5 LYS HG3 H 13.224 15.065 20.460 1.00 . A A . 5 LYS HG3 1 1 15 2357 1 1 5 LYS HZ1 H 13.408 19.324 21.055 1.00 . A A . 5 LYS HZ1 1 1 15 2358 1 1 5 LYS HZ2 H 12.751 19.110 22.581 1.00 . A A . 5 LYS HZ2 1 1 15 2359 1 1 5 LYS HZ3 H 11.728 19.418 21.289 1.00 . A A . 5 LYS HZ3 1 1 15 2360 1 1 5 LYS N N 15.098 16.530 17.474 1.00 . A A . 5 LYS N 1 1 15 2361 1 1 5 LYS NZ N 12.599 18.922 21.570 1.00 . A A . 5 LYS NZ 1 1 15 2362 1 1 5 LYS O O 15.928 13.187 17.931 1.00 . A A . 5 LYS O 1 1 15 2363 1 1 6 ARG C C 17.507 13.651 14.982 1.00 . A A . 6 ARG C 1 1 15 2364 1 1 6 ARG CA C 16.087 13.249 15.187 1.00 . A A . 6 ARG CA 1 1 15 2365 1 1 6 ARG CB C 15.357 13.189 13.834 1.00 . A A . 6 ARG CB 1 1 15 2366 1 1 6 ARG CD C 13.081 12.910 12.844 1.00 . A A . 6 ARG CD 1 1 15 2367 1 1 6 ARG CG C 14.063 12.375 13.888 1.00 . A A . 6 ARG CG 1 1 15 2368 1 1 6 ARG CZ C 11.904 10.745 12.321 1.00 . A A . 6 ARG CZ 1 1 15 2369 1 1 6 ARG H H 14.849 14.873 15.518 1.00 . A A . 6 ARG H 1 1 15 2370 1 1 6 ARG HA H 16.102 12.267 15.636 1.00 . A A . 6 ARG HA 1 1 15 2371 1 1 6 ARG HB2 H 15.059 14.213 13.520 1.00 . A A . 6 ARG HB2 1 1 15 2372 1 1 6 ARG HB3 H 15.934 12.689 13.028 1.00 . A A . 6 ARG HB3 1 1 15 2373 1 1 6 ARG HD2 H 12.729 13.944 13.053 1.00 . A A . 6 ARG HD2 1 1 15 2374 1 1 6 ARG HD3 H 13.472 13.003 11.808 1.00 . A A . 6 ARG HD3 1 1 15 2375 1 1 6 ARG HE H 11.059 12.291 13.313 1.00 . A A . 6 ARG HE 1 1 15 2376 1 1 6 ARG HG2 H 14.396 11.324 13.754 1.00 . A A . 6 ARG HG2 1 1 15 2377 1 1 6 ARG HG3 H 13.717 12.417 14.942 1.00 . A A . 6 ARG HG3 1 1 15 2378 1 1 6 ARG HH11 H 13.818 10.801 11.563 1.00 . A A . 6 ARG HH11 1 1 15 2379 1 1 6 ARG HH12 H 12.909 9.368 11.188 1.00 . A A . 6 ARG HH12 1 1 15 2380 1 1 6 ARG HH21 H 10.117 10.176 13.134 1.00 . A A . 6 ARG HH21 1 1 15 2381 1 1 6 ARG HH22 H 10.873 8.994 12.153 1.00 . A A . 6 ARG HH22 1 1 15 2382 1 1 6 ARG N N 15.364 14.172 16.006 1.00 . A A . 6 ARG N 1 1 15 2383 1 1 6 ARG NE N 11.908 11.992 12.875 1.00 . A A . 6 ARG NE 1 1 15 2384 1 1 6 ARG NH1 N 12.984 10.256 11.642 1.00 . A A . 6 ARG NH1 1 1 15 2385 1 1 6 ARG NH2 N 10.801 9.948 12.442 1.00 . A A . 6 ARG NH2 1 1 15 2386 1 1 6 ARG O O 18.426 13.177 15.648 1.00 . A A . 6 ARG O 1 1 15 2387 1 1 7 ASN C C 19.497 16.112 14.612 1.00 . A A . 7 ASN C 1 1 15 2388 1 1 7 ASN CA C 19.037 15.060 13.661 1.00 . A A . 7 ASN CA 1 1 15 2389 1 1 7 ASN CB C 19.129 15.559 12.209 1.00 . A A . 7 ASN CB 1 1 15 2390 1 1 7 ASN CG C 18.405 14.591 11.286 1.00 . A A . 7 ASN CG 1 1 15 2391 1 1 7 ASN H H 16.952 14.842 13.484 1.00 . A A . 7 ASN H 1 1 15 2392 1 1 7 ASN HA H 19.743 14.249 13.754 1.00 . A A . 7 ASN HA 1 1 15 2393 1 1 7 ASN HB2 H 18.715 16.581 12.073 1.00 . A A . 7 ASN HB2 1 1 15 2394 1 1 7 ASN HB3 H 20.188 15.614 11.875 1.00 . A A . 7 ASN HB3 1 1 15 2395 1 1 7 ASN HD21 H 19.827 13.128 11.580 1.00 . A A . 7 ASN HD21 1 1 15 2396 1 1 7 ASN HD22 H 18.501 12.699 10.543 1.00 . A A . 7 ASN HD22 1 1 15 2397 1 1 7 ASN N N 17.749 14.537 13.999 1.00 . A A . 7 ASN N 1 1 15 2398 1 1 7 ASN ND2 N 18.960 13.358 11.138 1.00 . A A . 7 ASN ND2 1 1 15 2399 1 1 7 ASN O O 19.337 17.316 14.415 1.00 . A A . 7 ASN O 1 1 15 2400 1 1 7 ASN OD1 O 17.347 14.892 10.734 1.00 . A A . 7 ASN OD1 1 1 15 2401 1 1 8 PHE C C 21.538 17.486 16.662 1.00 . A A . 8 PHE C 1 1 15 2402 1 1 8 PHE CA C 20.455 16.483 16.860 1.00 . A A . 8 PHE CA 1 1 15 2403 1 1 8 PHE CB C 20.743 15.593 18.082 1.00 . A A . 8 PHE CB 1 1 15 2404 1 1 8 PHE CD1 C 23.024 14.592 17.824 1.00 . A A . 8 PHE CD1 1 1 15 2405 1 1 8 PHE CD2 C 21.135 13.177 17.701 1.00 . A A . 8 PHE CD2 1 1 15 2406 1 1 8 PHE CE1 C 23.850 13.501 17.701 1.00 . A A . 8 PHE CE1 1 1 15 2407 1 1 8 PHE CE2 C 21.949 12.076 17.580 1.00 . A A . 8 PHE CE2 1 1 15 2408 1 1 8 PHE CG C 21.657 14.442 17.835 1.00 . A A . 8 PHE CG 1 1 15 2409 1 1 8 PHE CZ C 23.315 12.240 17.580 1.00 . A A . 8 PHE CZ 1 1 15 2410 1 1 8 PHE H H 20.239 14.701 15.862 1.00 . A A . 8 PHE H 1 1 15 2411 1 1 8 PHE HA H 19.590 17.088 17.086 1.00 . A A . 8 PHE HA 1 1 15 2412 1 1 8 PHE HB2 H 21.149 16.181 18.932 1.00 . A A . 8 PHE HB2 1 1 15 2413 1 1 8 PHE HB3 H 19.787 15.138 18.418 1.00 . A A . 8 PHE HB3 1 1 15 2414 1 1 8 PHE HD1 H 23.491 15.560 17.936 1.00 . A A . 8 PHE HD1 1 1 15 2415 1 1 8 PHE HD2 H 20.071 12.993 17.742 1.00 . A A . 8 PHE HD2 1 1 15 2416 1 1 8 PHE HE1 H 24.922 13.633 17.692 1.00 . A A . 8 PHE HE1 1 1 15 2417 1 1 8 PHE HE2 H 21.502 11.097 17.500 1.00 . A A . 8 PHE HE2 1 1 15 2418 1 1 8 PHE HZ H 23.964 11.384 17.483 1.00 . A A . 8 PHE HZ 1 1 15 2419 1 1 8 PHE N N 20.120 15.682 15.723 1.00 . A A . 8 PHE N 1 1 15 2420 1 1 8 PHE O O 21.645 18.457 17.410 1.00 . A A . 8 PHE O 1 1 15 2421 1 1 9 LEU C C 22.809 19.468 14.515 1.00 . A A . 9 LEU C 1 1 15 2422 1 1 9 LEU CA C 23.364 18.286 15.232 1.00 . A A . 9 LEU CA 1 1 15 2423 1 1 9 LEU CB C 24.545 17.714 14.430 1.00 . A A . 9 LEU CB 1 1 15 2424 1 1 9 LEU CD1 C 26.016 15.809 13.688 1.00 . A A . 9 LEU CD1 1 1 15 2425 1 1 9 LEU CD2 C 25.919 16.257 16.114 1.00 . A A . 9 LEU CD2 1 1 15 2426 1 1 9 LEU CG C 25.105 16.334 14.811 1.00 . A A . 9 LEU CG 1 1 15 2427 1 1 9 LEU H H 22.153 16.587 14.982 1.00 . A A . 9 LEU H 1 1 15 2428 1 1 9 LEU HA H 23.780 18.693 16.141 1.00 . A A . 9 LEU HA 1 1 15 2429 1 1 9 LEU HB2 H 24.370 17.732 13.332 1.00 . A A . 9 LEU HB2 1 1 15 2430 1 1 9 LEU HB3 H 25.380 18.423 14.615 1.00 . A A . 9 LEU HB3 1 1 15 2431 1 1 9 LEU HD11 H 26.899 16.475 13.577 1.00 . A A . 9 LEU HD11 1 1 15 2432 1 1 9 LEU HD12 H 25.458 15.757 12.729 1.00 . A A . 9 LEU HD12 1 1 15 2433 1 1 9 LEU HD13 H 26.362 14.792 13.972 1.00 . A A . 9 LEU HD13 1 1 15 2434 1 1 9 LEU HD21 H 26.268 15.207 16.211 1.00 . A A . 9 LEU HD21 1 1 15 2435 1 1 9 LEU HD22 H 25.290 16.481 17.002 1.00 . A A . 9 LEU HD22 1 1 15 2436 1 1 9 LEU HD23 H 26.802 16.929 16.072 1.00 . A A . 9 LEU HD23 1 1 15 2437 1 1 9 LEU HG H 24.318 15.559 14.931 1.00 . A A . 9 LEU HG 1 1 15 2438 1 1 9 LEU N N 22.343 17.351 15.593 1.00 . A A . 9 LEU N 1 1 15 2439 1 1 9 LEU O O 23.525 20.409 14.175 1.00 . A A . 9 LEU O 1 1 15 2440 1 1 10 CYS C C 20.383 21.672 14.414 1.00 . A A . 10 CYS C 1 1 15 2441 1 1 10 CYS CA C 20.795 20.519 13.567 1.00 . A A . 10 CYS CA 1 1 15 2442 1 1 10 CYS CB C 19.581 19.968 12.801 1.00 . A A . 10 CYS CB 1 1 15 2443 1 1 10 CYS H H 20.966 18.701 14.602 1.00 . A A . 10 CYS H 1 1 15 2444 1 1 10 CYS HA H 21.465 20.931 12.827 1.00 . A A . 10 CYS HA 1 1 15 2445 1 1 10 CYS HB2 H 19.860 18.994 12.344 1.00 . A A . 10 CYS HB2 1 1 15 2446 1 1 10 CYS HB3 H 18.733 19.757 13.489 1.00 . A A . 10 CYS HB3 1 1 15 2447 1 1 10 CYS N N 21.486 19.486 14.273 1.00 . A A . 10 CYS N 1 1 15 2448 1 1 10 CYS O O 19.982 22.717 13.903 1.00 . A A . 10 CYS O 1 1 15 2449 1 1 10 CYS SG S 19.000 21.018 11.439 1.00 . A A . 10 CYS SG 1 1 15 2450 1 1 11 CYS C C 21.110 23.735 16.704 1.00 . A A . 11 CYS C 1 1 15 2451 1 1 11 CYS CA C 20.082 22.614 16.659 1.00 . A A . 11 CYS CA 1 1 15 2452 1 1 11 CYS CB C 19.913 22.158 18.119 1.00 . A A . 11 CYS CB 1 1 15 2453 1 1 11 CYS H H 20.931 20.788 16.155 1.00 . A A . 11 CYS H 1 1 15 2454 1 1 11 CYS HA H 19.159 23.036 16.289 1.00 . A A . 11 CYS HA 1 1 15 2455 1 1 11 CYS HB2 H 20.670 21.391 18.390 1.00 . A A . 11 CYS HB2 1 1 15 2456 1 1 11 CYS HB3 H 20.093 23.002 18.819 1.00 . A A . 11 CYS HB3 1 1 15 2457 1 1 11 CYS N N 20.483 21.583 15.753 1.00 . A A . 11 CYS N 1 1 15 2458 1 1 11 CYS O O 22.284 23.500 17.098 1.00 . A A . 11 CYS O 1 1 15 2459 1 1 11 CYS OXT O 20.729 24.902 16.419 1.00 . A A . 11 CYS OXT 1 1 15 2460 1 1 11 CYS SG S 18.241 21.571 18.513 1.00 . A A . 11 CYS SG 1 1 16 2461 1 1 1 SER C C 13.483 23.237 12.915 1.00 . A A . 1 SER C 1 1 16 2462 1 1 1 SER CA C 13.656 24.673 13.274 1.00 . A A . 1 SER CA 1 1 16 2463 1 1 1 SER CB C 14.792 24.812 14.302 1.00 . A A . 1 SER CB 1 1 16 2464 1 1 1 SER H1 H 12.186 24.916 14.751 1.00 . A A . 1 SER H1 1 1 16 2465 1 1 1 SER H2 H 11.630 25.159 13.154 1.00 . A A . 1 SER H2 1 1 16 2466 1 1 1 SER H3 H 12.561 26.317 13.936 1.00 . A A . 1 SER H3 1 1 16 2467 1 1 1 SER HA H 13.918 25.198 12.367 1.00 . A A . 1 SER HA 1 1 16 2468 1 1 1 SER HB2 H 14.501 24.337 15.263 1.00 . A A . 1 SER HB2 1 1 16 2469 1 1 1 SER HB3 H 15.729 24.318 13.964 1.00 . A A . 1 SER HB3 1 1 16 2470 1 1 1 SER HG H 15.542 26.217 15.381 1.00 . A A . 1 SER HG 1 1 16 2471 1 1 1 SER N N 12.425 25.294 13.811 1.00 . A A . 1 SER N 1 1 16 2472 1 1 1 SER O O 12.455 22.630 13.207 1.00 . A A . 1 SER O 1 1 16 2473 1 1 1 SER OG O 15.102 26.179 14.529 1.00 . A A . 1 SER OG 1 1 16 2474 1 1 2 CYS C C 14.470 20.341 13.146 1.00 . A A . 2 CYS C 1 1 16 2475 1 1 2 CYS CA C 14.589 21.234 11.960 1.00 . A A . 2 CYS CA 1 1 16 2476 1 1 2 CYS CB C 15.906 20.883 11.248 1.00 . A A . 2 CYS CB 1 1 16 2477 1 1 2 CYS H H 15.263 23.182 11.965 1.00 . A A . 2 CYS H 1 1 16 2478 1 1 2 CYS HA H 13.738 20.991 11.341 1.00 . A A . 2 CYS HA 1 1 16 2479 1 1 2 CYS HB2 H 16.146 19.803 11.341 1.00 . A A . 2 CYS HB2 1 1 16 2480 1 1 2 CYS HB3 H 15.837 21.047 10.151 1.00 . A A . 2 CYS HB3 1 1 16 2481 1 1 2 CYS N N 14.495 22.626 12.275 1.00 . A A . 2 CYS N 1 1 16 2482 1 1 2 CYS O O 14.655 20.767 14.285 1.00 . A A . 2 CYS O 1 1 16 2483 1 1 2 CYS SG S 17.289 21.870 11.890 1.00 . A A . 2 CYS SG 1 1 16 2484 1 1 3 SER C C 15.248 17.770 14.688 1.00 . A A . 3 SER C 1 1 16 2485 1 1 3 SER CA C 13.970 18.106 13.999 1.00 . A A . 3 SER CA 1 1 16 2486 1 1 3 SER CB C 13.303 16.799 13.538 1.00 . A A . 3 SER CB 1 1 16 2487 1 1 3 SER H H 14.041 18.676 12.023 1.00 . A A . 3 SER H 1 1 16 2488 1 1 3 SER HA H 13.349 18.599 14.733 1.00 . A A . 3 SER HA 1 1 16 2489 1 1 3 SER HB2 H 13.484 15.944 14.224 1.00 . A A . 3 SER HB2 1 1 16 2490 1 1 3 SER HB3 H 12.203 16.940 13.472 1.00 . A A . 3 SER HB3 1 1 16 2491 1 1 3 SER HG H 13.087 16.775 11.637 1.00 . A A . 3 SER HG 1 1 16 2492 1 1 3 SER N N 14.154 19.050 12.941 1.00 . A A . 3 SER N 1 1 16 2493 1 1 3 SER O O 16.074 17.013 14.179 1.00 . A A . 3 SER O 1 1 16 2494 1 1 3 SER OG O 13.731 16.403 12.244 1.00 . A A . 3 SER OG 1 1 16 2495 1 1 4 CYS C C 16.554 16.913 17.495 1.00 . A A . 4 CYS C 1 1 16 2496 1 1 4 CYS CA C 16.625 18.167 16.693 1.00 . A A . 4 CYS CA 1 1 16 2497 1 1 4 CYS CB C 16.792 19.383 17.619 1.00 . A A . 4 CYS CB 1 1 16 2498 1 1 4 CYS H H 14.712 18.866 16.297 1.00 . A A . 4 CYS H 1 1 16 2499 1 1 4 CYS HA H 17.505 18.116 16.067 1.00 . A A . 4 CYS HA 1 1 16 2500 1 1 4 CYS HB2 H 16.449 20.263 17.033 1.00 . A A . 4 CYS HB2 1 1 16 2501 1 1 4 CYS HB3 H 16.148 19.298 18.521 1.00 . A A . 4 CYS HB3 1 1 16 2502 1 1 4 CYS N N 15.445 18.319 15.900 1.00 . A A . 4 CYS N 1 1 16 2503 1 1 4 CYS O O 17.561 16.352 17.923 1.00 . A A . 4 CYS O 1 1 16 2504 1 1 4 CYS SG S 18.515 19.641 18.131 1.00 . A A . 4 CYS SG 1 1 16 2505 1 1 5 LYS C C 15.709 14.019 17.296 1.00 . A A . 5 LYS C 1 1 16 2506 1 1 5 LYS CA C 15.101 15.057 18.175 1.00 . A A . 5 LYS CA 1 1 16 2507 1 1 5 LYS CB C 13.592 14.779 18.281 1.00 . A A . 5 LYS CB 1 1 16 2508 1 1 5 LYS CD C 12.977 16.621 20.024 1.00 . A A . 5 LYS CD 1 1 16 2509 1 1 5 LYS CE C 12.355 16.819 21.407 1.00 . A A . 5 LYS CE 1 1 16 2510 1 1 5 LYS CG C 12.945 15.146 19.618 1.00 . A A . 5 LYS CG 1 1 16 2511 1 1 5 LYS H H 14.532 16.931 17.470 1.00 . A A . 5 LYS H 1 1 16 2512 1 1 5 LYS HA H 15.604 14.948 19.126 1.00 . A A . 5 LYS HA 1 1 16 2513 1 1 5 LYS HB2 H 13.024 15.279 17.468 1.00 . A A . 5 LYS HB2 1 1 16 2514 1 1 5 LYS HB3 H 13.404 13.688 18.178 1.00 . A A . 5 LYS HB3 1 1 16 2515 1 1 5 LYS HD2 H 14.030 16.974 20.054 1.00 . A A . 5 LYS HD2 1 1 16 2516 1 1 5 LYS HD3 H 12.419 17.218 19.272 1.00 . A A . 5 LYS HD3 1 1 16 2517 1 1 5 LYS HE2 H 11.293 16.492 21.409 1.00 . A A . 5 LYS HE2 1 1 16 2518 1 1 5 LYS HE3 H 12.908 16.226 22.167 1.00 . A A . 5 LYS HE3 1 1 16 2519 1 1 5 LYS HG2 H 11.884 14.821 19.565 1.00 . A A . 5 LYS HG2 1 1 16 2520 1 1 5 LYS HG3 H 13.422 14.542 20.419 1.00 . A A . 5 LYS HG3 1 1 16 2521 1 1 5 LYS HZ1 H 13.328 18.654 21.645 1.00 . A A . 5 LYS HZ1 1 1 16 2522 1 1 5 LYS HZ2 H 12.163 18.296 22.837 1.00 . A A . 5 LYS HZ2 1 1 16 2523 1 1 5 LYS HZ3 H 11.665 18.774 21.308 1.00 . A A . 5 LYS HZ3 1 1 16 2524 1 1 5 LYS N N 15.334 16.384 17.696 1.00 . A A . 5 LYS N 1 1 16 2525 1 1 5 LYS NZ N 12.391 18.239 21.825 1.00 . A A . 5 LYS NZ 1 1 16 2526 1 1 5 LYS O O 16.339 13.071 17.758 1.00 . A A . 5 LYS O 1 1 16 2527 1 1 6 ARG C C 17.452 13.582 14.595 1.00 . A A . 6 ARG C 1 1 16 2528 1 1 6 ARG CA C 16.059 13.241 15.000 1.00 . A A . 6 ARG CA 1 1 16 2529 1 1 6 ARG CB C 15.086 13.301 13.811 1.00 . A A . 6 ARG CB 1 1 16 2530 1 1 6 ARG CD C 12.623 13.184 13.297 1.00 . A A . 6 ARG CD 1 1 16 2531 1 1 6 ARG CG C 13.773 12.570 14.098 1.00 . A A . 6 ARG CG 1 1 16 2532 1 1 6 ARG CZ C 11.537 10.960 12.893 1.00 . A A . 6 ARG CZ 1 1 16 2533 1 1 6 ARG H H 15.024 14.920 15.585 1.00 . A A . 6 ARG H 1 1 16 2534 1 1 6 ARG HA H 16.067 12.237 15.394 1.00 . A A . 6 ARG HA 1 1 16 2535 1 1 6 ARG HB2 H 14.816 14.355 13.585 1.00 . A A . 6 ARG HB2 1 1 16 2536 1 1 6 ARG HB3 H 15.456 12.807 12.887 1.00 . A A . 6 ARG HB3 1 1 16 2537 1 1 6 ARG HD2 H 12.296 14.183 13.657 1.00 . A A . 6 ARG HD2 1 1 16 2538 1 1 6 ARG HD3 H 12.852 13.376 12.227 1.00 . A A . 6 ARG HD3 1 1 16 2539 1 1 6 ARG HE H 10.733 12.407 14.038 1.00 . A A . 6 ARG HE 1 1 16 2540 1 1 6 ARG HG2 H 14.023 11.516 13.854 1.00 . A A . 6 ARG HG2 1 1 16 2541 1 1 6 ARG HG3 H 13.653 12.559 15.203 1.00 . A A . 6 ARG HG3 1 1 16 2542 1 1 6 ARG HH11 H 13.013 11.302 11.500 1.00 . A A . 6 ARG HH11 1 1 16 2543 1 1 6 ARG HH12 H 12.416 9.675 11.556 1.00 . A A . 6 ARG HH12 1 1 16 2544 1 1 6 ARG HH21 H 10.288 10.181 14.290 1.00 . A A . 6 ARG HH21 1 1 16 2545 1 1 6 ARG HH22 H 10.890 9.034 13.167 1.00 . A A . 6 ARG HH22 1 1 16 2546 1 1 6 ARG N N 15.542 14.159 15.968 1.00 . A A . 6 ARG N 1 1 16 2547 1 1 6 ARG NE N 11.494 12.220 13.416 1.00 . A A . 6 ARG NE 1 1 16 2548 1 1 6 ARG NH1 N 12.400 10.616 11.893 1.00 . A A . 6 ARG NH1 1 1 16 2549 1 1 6 ARG NH2 N 10.728 9.991 13.412 1.00 . A A . 6 ARG NH2 1 1 16 2550 1 1 6 ARG O O 18.414 12.902 14.948 1.00 . A A . 6 ARG O 1 1 16 2551 1 1 7 ASN C C 19.422 16.091 14.537 1.00 . A A . 7 ASN C 1 1 16 2552 1 1 7 ASN CA C 18.835 15.281 13.433 1.00 . A A . 7 ASN CA 1 1 16 2553 1 1 7 ASN CB C 18.723 16.151 12.168 1.00 . A A . 7 ASN CB 1 1 16 2554 1 1 7 ASN CG C 17.889 15.418 11.127 1.00 . A A . 7 ASN CG 1 1 16 2555 1 1 7 ASN H H 16.752 15.121 13.552 1.00 . A A . 7 ASN H 1 1 16 2556 1 1 7 ASN HA H 19.530 14.483 13.224 1.00 . A A . 7 ASN HA 1 1 16 2557 1 1 7 ASN HB2 H 18.309 17.168 12.339 1.00 . A A . 7 ASN HB2 1 1 16 2558 1 1 7 ASN HB3 H 19.731 16.307 11.728 1.00 . A A . 7 ASN HB3 1 1 16 2559 1 1 7 ASN HD21 H 16.153 16.421 11.641 1.00 . A A . 7 ASN HD21 1 1 16 2560 1 1 7 ASN HD22 H 16.029 15.231 10.372 1.00 . A A . 7 ASN HD22 1 1 16 2561 1 1 7 ASN N N 17.601 14.680 13.832 1.00 . A A . 7 ASN N 1 1 16 2562 1 1 7 ASN ND2 N 16.570 15.740 11.041 1.00 . A A . 7 ASN ND2 1 1 16 2563 1 1 7 ASN O O 19.225 17.300 14.649 1.00 . A A . 7 ASN O 1 1 16 2564 1 1 7 ASN OD1 O 18.392 14.533 10.436 1.00 . A A . 7 ASN OD1 1 1 16 2565 1 1 8 PHE C C 21.630 17.096 16.605 1.00 . A A . 8 PHE C 1 1 16 2566 1 1 8 PHE CA C 20.624 15.999 16.680 1.00 . A A . 8 PHE CA 1 1 16 2567 1 1 8 PHE CB C 21.067 14.893 17.652 1.00 . A A . 8 PHE CB 1 1 16 2568 1 1 8 PHE CD1 C 23.450 14.264 17.249 1.00 . A A . 8 PHE CD1 1 1 16 2569 1 1 8 PHE CD2 C 21.748 12.723 16.672 1.00 . A A . 8 PHE CD2 1 1 16 2570 1 1 8 PHE CE1 C 24.407 13.345 16.890 1.00 . A A . 8 PHE CE1 1 1 16 2571 1 1 8 PHE CE2 C 22.700 11.807 16.290 1.00 . A A . 8 PHE CE2 1 1 16 2572 1 1 8 PHE CG C 22.113 13.960 17.145 1.00 . A A . 8 PHE CG 1 1 16 2573 1 1 8 PHE CZ C 24.036 12.110 16.414 1.00 . A A . 8 PHE CZ 1 1 16 2574 1 1 8 PHE H H 20.406 14.486 15.284 1.00 . A A . 8 PHE H 1 1 16 2575 1 1 8 PHE HA H 19.761 16.485 17.111 1.00 . A A . 8 PHE HA 1 1 16 2576 1 1 8 PHE HB2 H 21.423 15.324 18.612 1.00 . A A . 8 PHE HB2 1 1 16 2577 1 1 8 PHE HB3 H 20.194 14.251 17.891 1.00 . A A . 8 PHE HB3 1 1 16 2578 1 1 8 PHE HD1 H 23.789 15.212 17.643 1.00 . A A . 8 PHE HD1 1 1 16 2579 1 1 8 PHE HD2 H 20.714 12.413 16.625 1.00 . A A . 8 PHE HD2 1 1 16 2580 1 1 8 PHE HE1 H 25.453 13.592 17.006 1.00 . A A . 8 PHE HE1 1 1 16 2581 1 1 8 PHE HE2 H 22.378 10.845 15.920 1.00 . A A . 8 PHE HE2 1 1 16 2582 1 1 8 PHE HZ H 24.789 11.386 16.138 1.00 . A A . 8 PHE HZ 1 1 16 2583 1 1 8 PHE N N 20.193 15.449 15.432 1.00 . A A . 8 PHE N 1 1 16 2584 1 1 8 PHE O O 21.770 17.883 17.538 1.00 . A A . 8 PHE O 1 1 16 2585 1 1 9 LEU C C 22.569 19.526 14.675 1.00 . A A . 9 LEU C 1 1 16 2586 1 1 9 LEU CA C 23.244 18.322 15.234 1.00 . A A . 9 LEU CA 1 1 16 2587 1 1 9 LEU CB C 24.457 17.979 14.353 1.00 . A A . 9 LEU CB 1 1 16 2588 1 1 9 LEU CD1 C 26.099 16.338 13.368 1.00 . A A . 9 LEU CD1 1 1 16 2589 1 1 9 LEU CD2 C 26.017 16.489 15.828 1.00 . A A . 9 LEU CD2 1 1 16 2590 1 1 9 LEU CG C 25.166 16.630 14.555 1.00 . A A . 9 LEU CG 1 1 16 2591 1 1 9 LEU H H 22.202 16.554 14.761 1.00 . A A . 9 LEU H 1 1 16 2592 1 1 9 LEU HA H 23.647 18.637 16.186 1.00 . A A . 9 LEU HA 1 1 16 2593 1 1 9 LEU HB2 H 24.257 18.109 13.267 1.00 . A A . 9 LEU HB2 1 1 16 2594 1 1 9 LEU HB3 H 25.225 18.739 14.613 1.00 . A A . 9 LEU HB3 1 1 16 2595 1 1 9 LEU HD11 H 25.522 16.327 12.418 1.00 . A A . 9 LEU HD11 1 1 16 2596 1 1 9 LEU HD12 H 26.570 15.343 13.517 1.00 . A A . 9 LEU HD12 1 1 16 2597 1 1 9 LEU HD13 H 26.888 17.119 13.315 1.00 . A A . 9 LEU HD13 1 1 16 2598 1 1 9 LEU HD21 H 26.805 17.271 15.877 1.00 . A A . 9 LEU HD21 1 1 16 2599 1 1 9 LEU HD22 H 26.502 15.491 15.772 1.00 . A A . 9 LEU HD22 1 1 16 2600 1 1 9 LEU HD23 H 25.388 16.492 16.744 1.00 . A A . 9 LEU HD23 1 1 16 2601 1 1 9 LEU HG H 24.467 15.767 14.608 1.00 . A A . 9 LEU HG 1 1 16 2602 1 1 9 LEU N N 22.328 17.249 15.466 1.00 . A A . 9 LEU N 1 1 16 2603 1 1 9 LEU O O 23.220 20.529 14.386 1.00 . A A . 9 LEU O 1 1 16 2604 1 1 10 CYS C C 19.936 21.586 14.671 1.00 . A A . 10 CYS C 1 1 16 2605 1 1 10 CYS CA C 20.513 20.524 13.801 1.00 . A A . 10 CYS CA 1 1 16 2606 1 1 10 CYS CB C 19.419 19.900 12.919 1.00 . A A . 10 CYS CB 1 1 16 2607 1 1 10 CYS H H 20.749 18.698 14.817 1.00 . A A . 10 CYS H 1 1 16 2608 1 1 10 CYS HA H 21.194 21.026 13.129 1.00 . A A . 10 CYS HA 1 1 16 2609 1 1 10 CYS HB2 H 19.817 18.942 12.522 1.00 . A A . 10 CYS HB2 1 1 16 2610 1 1 10 CYS HB3 H 18.516 19.654 13.518 1.00 . A A . 10 CYS HB3 1 1 16 2611 1 1 10 CYS N N 21.234 19.514 14.512 1.00 . A A . 10 CYS N 1 1 16 2612 1 1 10 CYS O O 19.104 22.378 14.229 1.00 . A A . 10 CYS O 1 1 16 2613 1 1 10 CYS SG S 18.983 20.850 11.434 1.00 . A A . 10 CYS SG 1 1 16 2614 1 1 11 CYS C C 20.568 24.068 16.587 1.00 . A A . 11 CYS C 1 1 16 2615 1 1 11 CYS CA C 19.830 22.754 16.802 1.00 . A A . 11 CYS CA 1 1 16 2616 1 1 11 CYS CB C 19.895 22.404 18.299 1.00 . A A . 11 CYS CB 1 1 16 2617 1 1 11 CYS H H 21.048 21.127 16.310 1.00 . A A . 11 CYS H 1 1 16 2618 1 1 11 CYS HA H 18.799 22.945 16.543 1.00 . A A . 11 CYS HA 1 1 16 2619 1 1 11 CYS HB2 H 20.823 21.839 18.537 1.00 . A A . 11 CYS HB2 1 1 16 2620 1 1 11 CYS HB3 H 19.949 23.325 18.916 1.00 . A A . 11 CYS HB3 1 1 16 2621 1 1 11 CYS N N 20.336 21.724 15.948 1.00 . A A . 11 CYS N 1 1 16 2622 1 1 11 CYS O O 19.924 25.065 16.167 1.00 . A A . 11 CYS O 1 1 16 2623 1 1 11 CYS OXT O 21.801 24.158 16.827 1.00 . A A . 11 CYS OXT 1 1 16 2624 1 1 11 CYS SG S 18.453 21.503 18.935 1.00 . A A . 11 CYS SG 1 1 17 2625 1 1 1 SER C C 13.342 23.385 12.814 1.00 . A A . 1 SER C 1 1 17 2626 1 1 1 SER CA C 13.469 24.690 13.522 1.00 . A A . 1 SER CA 1 1 17 2627 1 1 1 SER CB C 14.110 24.397 14.889 1.00 . A A . 1 SER CB 1 1 17 2628 1 1 1 SER H1 H 11.731 25.591 12.767 1.00 . A A . 1 SER H1 1 1 17 2629 1 1 1 SER H2 H 12.362 26.346 14.154 1.00 . A A . 1 SER H2 1 1 17 2630 1 1 1 SER H3 H 11.522 24.895 14.260 1.00 . A A . 1 SER H3 1 1 17 2631 1 1 1 SER HA H 14.125 25.310 12.930 1.00 . A A . 1 SER HA 1 1 17 2632 1 1 1 SER HB2 H 13.450 23.733 15.488 1.00 . A A . 1 SER HB2 1 1 17 2633 1 1 1 SER HB3 H 15.081 23.872 14.775 1.00 . A A . 1 SER HB3 1 1 17 2634 1 1 1 SER HG H 14.909 25.305 16.374 1.00 . A A . 1 SER HG 1 1 17 2635 1 1 1 SER N N 12.199 25.433 13.681 1.00 . A A . 1 SER N 1 1 17 2636 1 1 1 SER O O 12.249 22.872 12.583 1.00 . A A . 1 SER O 1 1 17 2637 1 1 1 SER OG O 14.373 25.581 15.627 1.00 . A A . 1 SER OG 1 1 17 2638 1 1 2 CYS C C 14.314 20.468 13.221 1.00 . A A . 2 CYS C 1 1 17 2639 1 1 2 CYS CA C 14.562 21.388 12.076 1.00 . A A . 2 CYS CA 1 1 17 2640 1 1 2 CYS CB C 15.910 21.039 11.424 1.00 . A A . 2 CYS CB 1 1 17 2641 1 1 2 CYS H H 15.357 23.234 12.549 1.00 . A A . 2 CYS H 1 1 17 2642 1 1 2 CYS HA H 13.763 21.199 11.373 1.00 . A A . 2 CYS HA 1 1 17 2643 1 1 2 CYS HB2 H 16.051 19.939 11.352 1.00 . A A . 2 CYS HB2 1 1 17 2644 1 1 2 CYS HB3 H 15.940 21.407 10.377 1.00 . A A . 2 CYS HB3 1 1 17 2645 1 1 2 CYS N N 14.484 22.760 12.473 1.00 . A A . 2 CYS N 1 1 17 2646 1 1 2 CYS O O 14.267 20.865 14.384 1.00 . A A . 2 CYS O 1 1 17 2647 1 1 2 CYS SG S 17.326 21.784 12.283 1.00 . A A . 2 CYS SG 1 1 17 2648 1 1 3 SER C C 15.060 17.823 14.710 1.00 . A A . 3 SER C 1 1 17 2649 1 1 3 SER CA C 13.856 18.138 13.889 1.00 . A A . 3 SER CA 1 1 17 2650 1 1 3 SER CB C 13.369 16.853 13.197 1.00 . A A . 3 SER CB 1 1 17 2651 1 1 3 SER H H 14.086 18.842 11.991 1.00 . A A . 3 SER H 1 1 17 2652 1 1 3 SER HA H 13.106 18.506 14.572 1.00 . A A . 3 SER HA 1 1 17 2653 1 1 3 SER HB2 H 13.438 15.952 13.843 1.00 . A A . 3 SER HB2 1 1 17 2654 1 1 3 SER HB3 H 12.305 16.965 12.897 1.00 . A A . 3 SER HB3 1 1 17 2655 1 1 3 SER HG H 13.632 15.994 11.461 1.00 . A A . 3 SER HG 1 1 17 2656 1 1 3 SER N N 14.104 19.171 12.933 1.00 . A A . 3 SER N 1 1 17 2657 1 1 3 SER O O 16.053 17.282 14.228 1.00 . A A . 3 SER O 1 1 17 2658 1 1 3 SER OG O 14.112 16.619 12.009 1.00 . A A . 3 SER OG 1 1 17 2659 1 1 4 CYS C C 16.235 16.798 17.539 1.00 . A A . 4 CYS C 1 1 17 2660 1 1 4 CYS CA C 16.109 18.143 16.912 1.00 . A A . 4 CYS CA 1 1 17 2661 1 1 4 CYS CB C 15.939 19.215 18.001 1.00 . A A . 4 CYS CB 1 1 17 2662 1 1 4 CYS H H 14.128 18.476 16.380 1.00 . A A . 4 CYS H 1 1 17 2663 1 1 4 CYS HA H 17.025 18.325 16.370 1.00 . A A . 4 CYS HA 1 1 17 2664 1 1 4 CYS HB2 H 15.282 20.015 17.596 1.00 . A A . 4 CYS HB2 1 1 17 2665 1 1 4 CYS HB3 H 15.468 18.820 18.927 1.00 . A A . 4 CYS HB3 1 1 17 2666 1 1 4 CYS N N 14.999 18.163 16.009 1.00 . A A . 4 CYS N 1 1 17 2667 1 1 4 CYS O O 17.333 16.331 17.837 1.00 . A A . 4 CYS O 1 1 17 2668 1 1 4 CYS SG S 17.513 20.011 18.435 1.00 . A A . 4 CYS SG 1 1 17 2669 1 1 5 LYS C C 15.687 13.795 17.287 1.00 . A A . 5 LYS C 1 1 17 2670 1 1 5 LYS CA C 15.062 14.753 18.242 1.00 . A A . 5 LYS CA 1 1 17 2671 1 1 5 LYS CB C 13.611 14.318 18.511 1.00 . A A . 5 LYS CB 1 1 17 2672 1 1 5 LYS CD C 13.123 16.081 20.343 1.00 . A A . 5 LYS CD 1 1 17 2673 1 1 5 LYS CE C 12.555 16.323 21.743 1.00 . A A . 5 LYS CE 1 1 17 2674 1 1 5 LYS CG C 13.085 14.612 19.916 1.00 . A A . 5 LYS CG 1 1 17 2675 1 1 5 LYS H H 14.217 16.483 17.527 1.00 . A A . 5 LYS H 1 1 17 2676 1 1 5 LYS HA H 15.658 14.696 19.141 1.00 . A A . 5 LYS HA 1 1 17 2677 1 1 5 LYS HB2 H 12.922 14.774 17.767 1.00 . A A . 5 LYS HB2 1 1 17 2678 1 1 5 LYS HB3 H 13.524 13.216 18.401 1.00 . A A . 5 LYS HB3 1 1 17 2679 1 1 5 LYS HD2 H 14.176 16.434 20.315 1.00 . A A . 5 LYS HD2 1 1 17 2680 1 1 5 LYS HD3 H 12.541 16.682 19.612 1.00 . A A . 5 LYS HD3 1 1 17 2681 1 1 5 LYS HE2 H 11.465 16.107 21.768 1.00 . A A . 5 LYS HE2 1 1 17 2682 1 1 5 LYS HE3 H 13.062 15.669 22.485 1.00 . A A . 5 LYS HE3 1 1 17 2683 1 1 5 LYS HG2 H 12.029 14.267 19.949 1.00 . A A . 5 LYS HG2 1 1 17 2684 1 1 5 LYS HG3 H 13.658 14.005 20.650 1.00 . A A . 5 LYS HG3 1 1 17 2685 1 1 5 LYS HZ1 H 12.324 18.392 21.489 1.00 . A A . 5 LYS HZ1 1 1 17 2686 1 1 5 LYS HZ2 H 13.777 17.928 22.213 1.00 . A A . 5 LYS HZ2 1 1 17 2687 1 1 5 LYS HZ3 H 12.349 17.872 23.106 1.00 . A A . 5 LYS HZ3 1 1 17 2688 1 1 5 LYS N N 15.108 16.090 17.737 1.00 . A A . 5 LYS N 1 1 17 2689 1 1 5 LYS NZ N 12.758 17.728 22.161 1.00 . A A . 5 LYS NZ 1 1 17 2690 1 1 5 LYS O O 16.359 12.843 17.680 1.00 . A A . 5 LYS O 1 1 17 2691 1 1 6 ARG C C 17.451 13.659 14.599 1.00 . A A . 6 ARG C 1 1 17 2692 1 1 6 ARG CA C 16.057 13.246 14.923 1.00 . A A . 6 ARG CA 1 1 17 2693 1 1 6 ARG CB C 15.107 13.345 13.718 1.00 . A A . 6 ARG CB 1 1 17 2694 1 1 6 ARG CD C 12.642 13.226 13.279 1.00 . A A . 6 ARG CD 1 1 17 2695 1 1 6 ARG CG C 13.838 12.514 13.916 1.00 . A A . 6 ARG CG 1 1 17 2696 1 1 6 ARG CZ C 10.549 11.967 12.616 1.00 . A A . 6 ARG CZ 1 1 17 2697 1 1 6 ARG H H 14.951 14.816 15.691 1.00 . A A . 6 ARG H 1 1 17 2698 1 1 6 ARG HA H 16.108 12.211 15.228 1.00 . A A . 6 ARG HA 1 1 17 2699 1 1 6 ARG HB2 H 14.784 14.400 13.591 1.00 . A A . 6 ARG HB2 1 1 17 2700 1 1 6 ARG HB3 H 15.503 12.967 12.751 1.00 . A A . 6 ARG HB3 1 1 17 2701 1 1 6 ARG HD2 H 12.416 14.219 13.723 1.00 . A A . 6 ARG HD2 1 1 17 2702 1 1 6 ARG HD3 H 12.770 13.458 12.200 1.00 . A A . 6 ARG HD3 1 1 17 2703 1 1 6 ARG HE H 11.318 11.982 14.469 1.00 . A A . 6 ARG HE 1 1 17 2704 1 1 6 ARG HG2 H 14.087 11.510 13.512 1.00 . A A . 6 ARG HG2 1 1 17 2705 1 1 6 ARG HG3 H 13.770 12.360 15.015 1.00 . A A . 6 ARG HG3 1 1 17 2706 1 1 6 ARG HH11 H 11.691 12.300 10.960 1.00 . A A . 6 ARG HH11 1 1 17 2707 1 1 6 ARG HH12 H 10.090 11.788 10.624 1.00 . A A . 6 ARG HH12 1 1 17 2708 1 1 6 ARG HH21 H 9.185 11.305 14.008 1.00 . A A . 6 ARG HH21 1 1 17 2709 1 1 6 ARG HH22 H 8.725 11.097 12.342 1.00 . A A . 6 ARG HH22 1 1 17 2710 1 1 6 ARG N N 15.500 14.034 15.978 1.00 . A A . 6 ARG N 1 1 17 2711 1 1 6 ARG NE N 11.473 12.341 13.549 1.00 . A A . 6 ARG NE 1 1 17 2712 1 1 6 ARG NH1 N 10.756 12.143 11.279 1.00 . A A . 6 ARG NH1 1 1 17 2713 1 1 6 ARG NH2 N 9.399 11.360 13.032 1.00 . A A . 6 ARG NH2 1 1 17 2714 1 1 6 ARG O O 18.408 12.994 14.991 1.00 . A A . 6 ARG O 1 1 17 2715 1 1 7 ASN C C 19.541 16.038 14.630 1.00 . A A . 7 ASN C 1 1 17 2716 1 1 7 ASN CA C 18.917 15.276 13.512 1.00 . A A . 7 ASN CA 1 1 17 2717 1 1 7 ASN CB C 18.928 16.138 12.238 1.00 . A A . 7 ASN CB 1 1 17 2718 1 1 7 ASN CG C 17.990 15.555 11.191 1.00 . A A . 7 ASN CG 1 1 17 2719 1 1 7 ASN H H 16.827 15.335 13.653 1.00 . A A . 7 ASN H 1 1 17 2720 1 1 7 ASN HA H 19.547 14.419 13.326 1.00 . A A . 7 ASN HA 1 1 17 2721 1 1 7 ASN HB2 H 18.642 17.194 12.432 1.00 . A A . 7 ASN HB2 1 1 17 2722 1 1 7 ASN HB3 H 19.950 16.158 11.803 1.00 . A A . 7 ASN HB3 1 1 17 2723 1 1 7 ASN HD21 H 16.555 16.964 11.612 1.00 . A A . 7 ASN HD21 1 1 17 2724 1 1 7 ASN HD22 H 16.227 15.942 10.248 1.00 . A A . 7 ASN HD22 1 1 17 2725 1 1 7 ASN N N 17.627 14.789 13.891 1.00 . A A . 7 ASN N 1 1 17 2726 1 1 7 ASN ND2 N 16.845 16.255 10.970 1.00 . A A . 7 ASN ND2 1 1 17 2727 1 1 7 ASN O O 19.267 17.215 14.862 1.00 . A A . 7 ASN O 1 1 17 2728 1 1 7 ASN OD1 O 18.219 14.507 10.587 1.00 . A A . 7 ASN OD1 1 1 17 2729 1 1 8 PHE C C 21.766 17.011 16.681 1.00 . A A . 8 PHE C 1 1 17 2730 1 1 8 PHE CA C 20.849 15.836 16.690 1.00 . A A . 8 PHE CA 1 1 17 2731 1 1 8 PHE CB C 21.380 14.674 17.546 1.00 . A A . 8 PHE CB 1 1 17 2732 1 1 8 PHE CD1 C 23.829 14.313 17.209 1.00 . A A . 8 PHE CD1 1 1 17 2733 1 1 8 PHE CD2 C 22.312 12.716 16.345 1.00 . A A . 8 PHE CD2 1 1 17 2734 1 1 8 PHE CE1 C 24.883 13.584 16.713 1.00 . A A . 8 PHE CE1 1 1 17 2735 1 1 8 PHE CE2 C 23.361 11.970 15.862 1.00 . A A . 8 PHE CE2 1 1 17 2736 1 1 8 PHE CG C 22.533 13.907 16.995 1.00 . A A . 8 PHE CG 1 1 17 2737 1 1 8 PHE CZ C 24.652 12.417 16.025 1.00 . A A . 8 PHE CZ 1 1 17 2738 1 1 8 PHE H H 20.708 14.464 15.126 1.00 . A A . 8 PHE H 1 1 17 2739 1 1 8 PHE HA H 19.965 16.210 17.187 1.00 . A A . 8 PHE HA 1 1 17 2740 1 1 8 PHE HB2 H 21.653 15.017 18.567 1.00 . A A . 8 PHE HB2 1 1 17 2741 1 1 8 PHE HB3 H 20.565 13.927 17.656 1.00 . A A . 8 PHE HB3 1 1 17 2742 1 1 8 PHE HD1 H 24.046 15.204 17.781 1.00 . A A . 8 PHE HD1 1 1 17 2743 1 1 8 PHE HD2 H 21.317 12.321 16.201 1.00 . A A . 8 PHE HD2 1 1 17 2744 1 1 8 PHE HE1 H 25.894 13.929 16.880 1.00 . A A . 8 PHE HE1 1 1 17 2745 1 1 8 PHE HE2 H 23.145 11.044 15.351 1.00 . A A . 8 PHE HE2 1 1 17 2746 1 1 8 PHE HZ H 25.477 11.838 15.636 1.00 . A A . 8 PHE HZ 1 1 17 2747 1 1 8 PHE N N 20.413 15.373 15.409 1.00 . A A . 8 PHE N 1 1 17 2748 1 1 8 PHE O O 21.773 17.790 17.634 1.00 . A A . 8 PHE O 1 1 17 2749 1 1 9 LEU C C 22.740 19.568 14.887 1.00 . A A . 9 LEU C 1 1 17 2750 1 1 9 LEU CA C 23.406 18.377 15.483 1.00 . A A . 9 LEU CA 1 1 17 2751 1 1 9 LEU CB C 24.710 18.166 14.695 1.00 . A A . 9 LEU CB 1 1 17 2752 1 1 9 LEU CD1 C 26.597 16.737 13.805 1.00 . A A . 9 LEU CD1 1 1 17 2753 1 1 9 LEU CD2 C 26.276 16.797 16.250 1.00 . A A . 9 LEU CD2 1 1 17 2754 1 1 9 LEU CG C 25.534 16.883 14.907 1.00 . A A . 9 LEU CG 1 1 17 2755 1 1 9 LEU H H 22.549 16.549 14.893 1.00 . A A . 9 LEU H 1 1 17 2756 1 1 9 LEU HA H 23.670 18.707 16.478 1.00 . A A . 9 LEU HA 1 1 17 2757 1 1 9 LEU HB2 H 24.583 18.314 13.603 1.00 . A A . 9 LEU HB2 1 1 17 2758 1 1 9 LEU HB3 H 25.378 18.985 15.038 1.00 . A A . 9 LEU HB3 1 1 17 2759 1 1 9 LEU HD11 H 26.110 16.656 12.810 1.00 . A A . 9 LEU HD11 1 1 17 2760 1 1 9 LEU HD12 H 27.179 15.809 13.990 1.00 . A A . 9 LEU HD12 1 1 17 2761 1 1 9 LEU HD13 H 27.287 17.607 13.819 1.00 . A A . 9 LEU HD13 1 1 17 2762 1 1 9 LEU HD21 H 26.924 15.895 16.206 1.00 . A A . 9 LEU HD21 1 1 17 2763 1 1 9 LEU HD22 H 25.561 16.660 17.090 1.00 . A A . 9 LEU HD22 1 1 17 2764 1 1 9 LEU HD23 H 26.919 17.689 16.408 1.00 . A A . 9 LEU HD23 1 1 17 2765 1 1 9 LEU HG H 24.914 15.963 14.856 1.00 . A A . 9 LEU HG 1 1 17 2766 1 1 9 LEU N N 22.553 17.236 15.614 1.00 . A A . 9 LEU N 1 1 17 2767 1 1 9 LEU O O 23.347 20.633 14.784 1.00 . A A . 9 LEU O 1 1 17 2768 1 1 10 CYS C C 20.548 21.761 14.231 1.00 . A A . 10 CYS C 1 1 17 2769 1 1 10 CYS CA C 20.839 20.431 13.624 1.00 . A A . 10 CYS CA 1 1 17 2770 1 1 10 CYS CB C 19.557 19.878 12.980 1.00 . A A . 10 CYS CB 1 1 17 2771 1 1 10 CYS H H 20.981 18.640 14.749 1.00 . A A . 10 CYS H 1 1 17 2772 1 1 10 CYS HA H 21.521 20.647 12.815 1.00 . A A . 10 CYS HA 1 1 17 2773 1 1 10 CYS HB2 H 19.764 18.854 12.602 1.00 . A A . 10 CYS HB2 1 1 17 2774 1 1 10 CYS HB3 H 18.732 19.772 13.717 1.00 . A A . 10 CYS HB3 1 1 17 2775 1 1 10 CYS N N 21.460 19.473 14.485 1.00 . A A . 10 CYS N 1 1 17 2776 1 1 10 CYS O O 20.365 22.750 13.522 1.00 . A A . 10 CYS O 1 1 17 2777 1 1 10 CYS SG S 18.945 20.809 11.545 1.00 . A A . 10 CYS SG 1 1 17 2778 1 1 11 CYS C C 20.693 24.105 16.596 1.00 . A A . 11 CYS C 1 1 17 2779 1 1 11 CYS CA C 19.776 22.957 16.199 1.00 . A A . 11 CYS CA 1 1 17 2780 1 1 11 CYS CB C 19.005 22.462 17.434 1.00 . A A . 11 CYS CB 1 1 17 2781 1 1 11 CYS H H 20.736 21.110 16.154 1.00 . A A . 11 CYS H 1 1 17 2782 1 1 11 CYS HA H 19.091 23.376 15.476 1.00 . A A . 11 CYS HA 1 1 17 2783 1 1 11 CYS HB2 H 19.709 21.952 18.126 1.00 . A A . 11 CYS HB2 1 1 17 2784 1 1 11 CYS HB3 H 18.548 23.286 18.023 1.00 . A A . 11 CYS HB3 1 1 17 2785 1 1 11 CYS N N 20.449 21.864 15.568 1.00 . A A . 11 CYS N 1 1 17 2786 1 1 11 CYS O O 21.905 23.910 16.881 1.00 . A A . 11 CYS O 1 1 17 2787 1 1 11 CYS OXT O 20.194 25.261 16.615 1.00 . A A . 11 CYS OXT 1 1 17 2788 1 1 11 CYS SG S 17.740 21.285 16.872 1.00 . A A . 11 CYS SG 1 1 18 2789 1 1 1 SER C C 13.354 23.421 13.156 1.00 . A A . 1 SER C 1 1 18 2790 1 1 1 SER CA C 13.367 24.839 13.615 1.00 . A A . 1 SER CA 1 1 18 2791 1 1 1 SER CB C 14.009 24.894 15.011 1.00 . A A . 1 SER CB 1 1 18 2792 1 1 1 SER H1 H 11.325 24.838 14.109 1.00 . A A . 1 SER H1 1 1 18 2793 1 1 1 SER H2 H 11.657 25.500 12.615 1.00 . A A . 1 SER H2 1 1 18 2794 1 1 1 SER H3 H 12.001 26.393 13.974 1.00 . A A . 1 SER H3 1 1 18 2795 1 1 1 SER HA H 13.970 25.401 12.916 1.00 . A A . 1 SER HA 1 1 18 2796 1 1 1 SER HB2 H 13.393 24.325 15.740 1.00 . A A . 1 SER HB2 1 1 18 2797 1 1 1 SER HB3 H 15.024 24.445 14.994 1.00 . A A . 1 SER HB3 1 1 18 2798 1 1 1 SER HG H 14.483 26.209 16.349 1.00 . A A . 1 SER HG 1 1 18 2799 1 1 1 SER N N 12.009 25.426 13.591 1.00 . A A . 1 SER N 1 1 18 2800 1 1 1 SER O O 12.324 22.753 13.228 1.00 . A A . 1 SER O 1 1 18 2801 1 1 1 SER OG O 14.125 26.238 15.458 1.00 . A A . 1 SER OG 1 1 18 2802 1 1 2 CYS C C 14.479 20.536 13.301 1.00 . A A . 2 CYS C 1 1 18 2803 1 1 2 CYS CA C 14.574 21.544 12.206 1.00 . A A . 2 CYS CA 1 1 18 2804 1 1 2 CYS CB C 15.833 21.262 11.369 1.00 . A A . 2 CYS CB 1 1 18 2805 1 1 2 CYS H H 15.318 23.451 12.636 1.00 . A A . 2 CYS H 1 1 18 2806 1 1 2 CYS HA H 13.707 21.362 11.588 1.00 . A A . 2 CYS HA 1 1 18 2807 1 1 2 CYS HB2 H 15.943 20.174 11.170 1.00 . A A . 2 CYS HB2 1 1 18 2808 1 1 2 CYS HB3 H 15.750 21.725 10.363 1.00 . A A . 2 CYS HB3 1 1 18 2809 1 1 2 CYS N N 14.494 22.891 12.676 1.00 . A A . 2 CYS N 1 1 18 2810 1 1 2 CYS O O 14.545 20.852 14.487 1.00 . A A . 2 CYS O 1 1 18 2811 1 1 2 CYS SG S 17.349 21.907 12.132 1.00 . A A . 2 CYS SG 1 1 18 2812 1 1 3 SER C C 15.224 17.807 14.663 1.00 . A A . 3 SER C 1 1 18 2813 1 1 3 SER CA C 14.048 18.168 13.822 1.00 . A A . 3 SER CA 1 1 18 2814 1 1 3 SER CB C 13.637 16.898 13.059 1.00 . A A . 3 SER CB 1 1 18 2815 1 1 3 SER H H 14.160 19.028 11.964 1.00 . A A . 3 SER H 1 1 18 2816 1 1 3 SER HA H 13.265 18.485 14.494 1.00 . A A . 3 SER HA 1 1 18 2817 1 1 3 SER HB2 H 13.667 15.980 13.684 1.00 . A A . 3 SER HB2 1 1 18 2818 1 1 3 SER HB3 H 12.594 17.015 12.695 1.00 . A A . 3 SER HB3 1 1 18 2819 1 1 3 SER HG H 15.361 16.700 12.224 1.00 . A A . 3 SER HG 1 1 18 2820 1 1 3 SER N N 14.274 19.261 12.927 1.00 . A A . 3 SER N 1 1 18 2821 1 1 3 SER O O 16.118 17.081 14.230 1.00 . A A . 3 SER O 1 1 18 2822 1 1 3 SER OG O 14.452 16.683 11.916 1.00 . A A . 3 SER OG 1 1 18 2823 1 1 4 CYS C C 16.198 16.704 17.472 1.00 . A A . 4 CYS C 1 1 18 2824 1 1 4 CYS CA C 16.274 18.064 16.867 1.00 . A A . 4 CYS CA 1 1 18 2825 1 1 4 CYS CB C 16.214 19.140 17.964 1.00 . A A . 4 CYS CB 1 1 18 2826 1 1 4 CYS H H 14.433 18.810 16.216 1.00 . A A . 4 CYS H 1 1 18 2827 1 1 4 CYS HA H 17.230 18.124 16.367 1.00 . A A . 4 CYS HA 1 1 18 2828 1 1 4 CYS HB2 H 15.927 20.084 17.453 1.00 . A A . 4 CYS HB2 1 1 18 2829 1 1 4 CYS HB3 H 15.428 18.921 18.719 1.00 . A A . 4 CYS HB3 1 1 18 2830 1 1 4 CYS N N 15.218 18.267 15.926 1.00 . A A . 4 CYS N 1 1 18 2831 1 1 4 CYS O O 17.209 16.125 17.863 1.00 . A A . 4 CYS O 1 1 18 2832 1 1 4 CYS SG S 17.785 19.378 18.844 1.00 . A A . 4 CYS SG 1 1 18 2833 1 1 5 LYS C C 15.404 13.757 17.088 1.00 . A A . 5 LYS C 1 1 18 2834 1 1 5 LYS CA C 14.788 14.772 17.988 1.00 . A A . 5 LYS CA 1 1 18 2835 1 1 5 LYS CB C 13.292 14.454 18.152 1.00 . A A . 5 LYS CB 1 1 18 2836 1 1 5 LYS CD C 12.885 16.087 20.127 1.00 . A A . 5 LYS CD 1 1 18 2837 1 1 5 LYS CE C 12.563 16.115 21.622 1.00 . A A . 5 LYS CE 1 1 18 2838 1 1 5 LYS CG C 12.742 14.673 19.562 1.00 . A A . 5 LYS CG 1 1 18 2839 1 1 5 LYS H H 14.169 16.622 17.292 1.00 . A A . 5 LYS H 1 1 18 2840 1 1 5 LYS HA H 15.310 14.657 18.926 1.00 . A A . 5 LYS HA 1 1 18 2841 1 1 5 LYS HB2 H 12.673 15.033 17.433 1.00 . A A . 5 LYS HB2 1 1 18 2842 1 1 5 LYS HB3 H 13.103 13.380 17.939 1.00 . A A . 5 LYS HB3 1 1 18 2843 1 1 5 LYS HD2 H 13.926 16.450 19.996 1.00 . A A . 5 LYS HD2 1 1 18 2844 1 1 5 LYS HD3 H 12.209 16.773 19.572 1.00 . A A . 5 LYS HD3 1 1 18 2845 1 1 5 LYS HE2 H 11.537 15.738 21.823 1.00 . A A . 5 LYS HE2 1 1 18 2846 1 1 5 LYS HE3 H 13.288 15.478 22.173 1.00 . A A . 5 LYS HE3 1 1 18 2847 1 1 5 LYS HG2 H 11.662 14.412 19.548 1.00 . A A . 5 LYS HG2 1 1 18 2848 1 1 5 LYS HG3 H 13.238 13.959 20.253 1.00 . A A . 5 LYS HG3 1 1 18 2849 1 1 5 LYS HZ1 H 13.501 17.975 21.748 1.00 . A A . 5 LYS HZ1 1 1 18 2850 1 1 5 LYS HZ2 H 12.784 17.451 23.186 1.00 . A A . 5 LYS HZ2 1 1 18 2851 1 1 5 LYS HZ3 H 11.825 18.049 21.926 1.00 . A A . 5 LYS HZ3 1 1 18 2852 1 1 5 LYS N N 14.991 16.115 17.540 1.00 . A A . 5 LYS N 1 1 18 2853 1 1 5 LYS NZ N 12.675 17.492 22.152 1.00 . A A . 5 LYS NZ 1 1 18 2854 1 1 5 LYS O O 15.904 12.735 17.558 1.00 . A A . 5 LYS O 1 1 18 2855 1 1 6 ARG C C 17.592 13.584 14.809 1.00 . A A . 6 ARG C 1 1 18 2856 1 1 6 ARG CA C 16.163 13.164 14.855 1.00 . A A . 6 ARG CA 1 1 18 2857 1 1 6 ARG CB C 15.511 13.298 13.468 1.00 . A A . 6 ARG CB 1 1 18 2858 1 1 6 ARG CD C 13.304 13.328 12.304 1.00 . A A . 6 ARG CD 1 1 18 2859 1 1 6 ARG CG C 14.159 12.593 13.337 1.00 . A A . 6 ARG CG 1 1 18 2860 1 1 6 ARG CZ C 10.797 13.334 12.612 1.00 . A A . 6 ARG CZ 1 1 18 2861 1 1 6 ARG H H 14.991 14.792 15.366 1.00 . A A . 6 ARG H 1 1 18 2862 1 1 6 ARG HA H 16.132 12.131 15.170 1.00 . A A . 6 ARG HA 1 1 18 2863 1 1 6 ARG HB2 H 15.314 14.369 13.250 1.00 . A A . 6 ARG HB2 1 1 18 2864 1 1 6 ARG HB3 H 16.109 12.852 12.644 1.00 . A A . 6 ARG HB3 1 1 18 2865 1 1 6 ARG HD2 H 13.207 14.407 12.548 1.00 . A A . 6 ARG HD2 1 1 18 2866 1 1 6 ARG HD3 H 13.679 13.349 11.259 1.00 . A A . 6 ARG HD3 1 1 18 2867 1 1 6 ARG HE H 11.880 11.680 12.315 1.00 . A A . 6 ARG HE 1 1 18 2868 1 1 6 ARG HG2 H 14.402 11.529 13.131 1.00 . A A . 6 ARG HG2 1 1 18 2869 1 1 6 ARG HG3 H 13.733 12.568 14.364 1.00 . A A . 6 ARG HG3 1 1 18 2870 1 1 6 ARG HH11 H 11.272 15.138 11.792 1.00 . A A . 6 ARG HH11 1 1 18 2871 1 1 6 ARG HH12 H 9.728 15.036 12.563 1.00 . A A . 6 ARG HH12 1 1 18 2872 1 1 6 ARG HH21 H 9.903 11.716 13.423 1.00 . A A . 6 ARG HH21 1 1 18 2873 1 1 6 ARG HH22 H 8.912 13.156 13.312 1.00 . A A . 6 ARG HH22 1 1 18 2874 1 1 6 ARG N N 15.434 13.993 15.765 1.00 . A A . 6 ARG N 1 1 18 2875 1 1 6 ARG NE N 11.965 12.676 12.353 1.00 . A A . 6 ARG NE 1 1 18 2876 1 1 6 ARG NH1 N 10.652 14.678 12.428 1.00 . A A . 6 ARG NH1 1 1 18 2877 1 1 6 ARG NH2 N 9.716 12.625 13.047 1.00 . A A . 6 ARG NH2 1 1 18 2878 1 1 6 ARG O O 18.479 12.942 15.369 1.00 . A A . 6 ARG O 1 1 18 2879 1 1 7 ASN C C 19.583 16.164 14.924 1.00 . A A . 7 ASN C 1 1 18 2880 1 1 7 ASN CA C 19.219 15.159 13.887 1.00 . A A . 7 ASN CA 1 1 18 2881 1 1 7 ASN CB C 19.458 15.726 12.477 1.00 . A A . 7 ASN CB 1 1 18 2882 1 1 7 ASN CG C 18.591 15.002 11.457 1.00 . A A . 7 ASN CG 1 1 18 2883 1 1 7 ASN H H 17.140 15.161 13.636 1.00 . A A . 7 ASN H 1 1 18 2884 1 1 7 ASN HA H 19.884 14.315 14.000 1.00 . A A . 7 ASN HA 1 1 18 2885 1 1 7 ASN HB2 H 19.185 16.800 12.407 1.00 . A A . 7 ASN HB2 1 1 18 2886 1 1 7 ASN HB3 H 20.523 15.633 12.172 1.00 . A A . 7 ASN HB3 1 1 18 2887 1 1 7 ASN HD21 H 19.679 13.274 11.582 1.00 . A A . 7 ASN HD21 1 1 18 2888 1 1 7 ASN HD22 H 18.344 13.227 10.474 1.00 . A A . 7 ASN HD22 1 1 18 2889 1 1 7 ASN N N 17.887 14.682 14.090 1.00 . A A . 7 ASN N 1 1 18 2890 1 1 7 ASN ND2 N 18.935 13.736 11.100 1.00 . A A . 7 ASN ND2 1 1 18 2891 1 1 7 ASN O O 19.380 17.369 14.778 1.00 . A A . 7 ASN O 1 1 18 2892 1 1 7 ASN OD1 O 17.592 15.561 11.006 1.00 . A A . 7 ASN OD1 1 1 18 2893 1 1 8 PHE C C 21.777 17.477 16.759 1.00 . A A . 8 PHE C 1 1 18 2894 1 1 8 PHE CA C 20.682 16.529 17.106 1.00 . A A . 8 PHE CA 1 1 18 2895 1 1 8 PHE CB C 21.091 15.656 18.304 1.00 . A A . 8 PHE CB 1 1 18 2896 1 1 8 PHE CD1 C 23.280 14.561 17.762 1.00 . A A . 8 PHE CD1 1 1 18 2897 1 1 8 PHE CD2 C 21.332 13.228 17.880 1.00 . A A . 8 PHE CD2 1 1 18 2898 1 1 8 PHE CE1 C 24.029 13.448 17.463 1.00 . A A . 8 PHE CE1 1 1 18 2899 1 1 8 PHE CE2 C 22.071 12.108 17.582 1.00 . A A . 8 PHE CE2 1 1 18 2900 1 1 8 PHE CG C 21.922 14.468 17.957 1.00 . A A . 8 PHE CG 1 1 18 2901 1 1 8 PHE CZ C 23.425 12.216 17.369 1.00 . A A . 8 PHE CZ 1 1 18 2902 1 1 8 PHE H H 20.302 14.732 16.151 1.00 . A A . 8 PHE H 1 1 18 2903 1 1 8 PHE HA H 19.858 17.157 17.410 1.00 . A A . 8 PHE HA 1 1 18 2904 1 1 8 PHE HB2 H 21.623 16.239 19.086 1.00 . A A . 8 PHE HB2 1 1 18 2905 1 1 8 PHE HB3 H 20.175 15.241 18.777 1.00 . A A . 8 PHE HB3 1 1 18 2906 1 1 8 PHE HD1 H 23.799 15.503 17.850 1.00 . A A . 8 PHE HD1 1 1 18 2907 1 1 8 PHE HD2 H 20.281 13.081 18.084 1.00 . A A . 8 PHE HD2 1 1 18 2908 1 1 8 PHE HE1 H 25.095 13.537 17.312 1.00 . A A . 8 PHE HE1 1 1 18 2909 1 1 8 PHE HE2 H 21.569 11.152 17.547 1.00 . A A . 8 PHE HE2 1 1 18 2910 1 1 8 PHE HZ H 24.003 11.339 17.117 1.00 . A A . 8 PHE HZ 1 1 18 2911 1 1 8 PHE N N 20.215 15.718 16.024 1.00 . A A . 8 PHE N 1 1 18 2912 1 1 8 PHE O O 22.102 18.394 17.512 1.00 . A A . 8 PHE O 1 1 18 2913 1 1 9 LEU C C 22.777 19.316 14.237 1.00 . A A . 9 LEU C 1 1 18 2914 1 1 9 LEU CA C 23.372 18.181 14.998 1.00 . A A . 9 LEU CA 1 1 18 2915 1 1 9 LEU CB C 24.375 17.469 14.074 1.00 . A A . 9 LEU CB 1 1 18 2916 1 1 9 LEU CD1 C 25.519 15.383 13.204 1.00 . A A . 9 LEU CD1 1 1 18 2917 1 1 9 LEU CD2 C 25.880 15.976 15.579 1.00 . A A . 9 LEU CD2 1 1 18 2918 1 1 9 LEU CG C 24.868 16.056 14.423 1.00 . A A . 9 LEU CG 1 1 18 2919 1 1 9 LEU H H 22.047 16.548 15.034 1.00 . A A . 9 LEU H 1 1 18 2920 1 1 9 LEU HA H 23.925 18.622 15.813 1.00 . A A . 9 LEU HA 1 1 18 2921 1 1 9 LEU HB2 H 24.053 17.460 13.010 1.00 . A A . 9 LEU HB2 1 1 18 2922 1 1 9 LEU HB3 H 25.280 18.113 14.110 1.00 . A A . 9 LEU HB3 1 1 18 2923 1 1 9 LEU HD11 H 24.820 15.365 12.341 1.00 . A A . 9 LEU HD11 1 1 18 2924 1 1 9 LEU HD12 H 25.787 14.343 13.490 1.00 . A A . 9 LEU HD12 1 1 18 2925 1 1 9 LEU HD13 H 26.459 15.911 12.933 1.00 . A A . 9 LEU HD13 1 1 18 2926 1 1 9 LEU HD21 H 26.156 14.907 15.702 1.00 . A A . 9 LEU HD21 1 1 18 2927 1 1 9 LEU HD22 H 25.434 16.324 16.534 1.00 . A A . 9 LEU HD22 1 1 18 2928 1 1 9 LEU HD23 H 26.800 16.549 15.335 1.00 . A A . 9 LEU HD23 1 1 18 2929 1 1 9 LEU HG H 24.060 15.357 14.729 1.00 . A A . 9 LEU HG 1 1 18 2930 1 1 9 LEU N N 22.371 17.330 15.562 1.00 . A A . 9 LEU N 1 1 18 2931 1 1 9 LEU O O 23.487 20.140 13.663 1.00 . A A . 9 LEU O 1 1 18 2932 1 1 10 CYS C C 20.441 21.637 14.129 1.00 . A A . 10 CYS C 1 1 18 2933 1 1 10 CYS CA C 20.756 20.390 13.377 1.00 . A A . 10 CYS CA 1 1 18 2934 1 1 10 CYS CB C 19.451 19.824 12.794 1.00 . A A . 10 CYS CB 1 1 18 2935 1 1 10 CYS H H 20.907 18.725 14.656 1.00 . A A . 10 CYS H 1 1 18 2936 1 1 10 CYS HA H 21.384 20.680 12.547 1.00 . A A . 10 CYS HA 1 1 18 2937 1 1 10 CYS HB2 H 19.654 18.788 12.447 1.00 . A A . 10 CYS HB2 1 1 18 2938 1 1 10 CYS HB3 H 18.654 19.742 13.563 1.00 . A A . 10 CYS HB3 1 1 18 2939 1 1 10 CYS N N 21.438 19.409 14.163 1.00 . A A . 10 CYS N 1 1 18 2940 1 1 10 CYS O O 20.080 22.658 13.544 1.00 . A A . 10 CYS O 1 1 18 2941 1 1 10 CYS SG S 18.810 20.730 11.356 1.00 . A A . 10 CYS SG 1 1 18 2942 1 1 11 CYS C C 20.503 23.715 16.690 1.00 . A A . 11 CYS C 1 1 18 2943 1 1 11 CYS CA C 19.761 22.428 16.359 1.00 . A A . 11 CYS CA 1 1 18 2944 1 1 11 CYS CB C 19.488 21.667 17.666 1.00 . A A . 11 CYS CB 1 1 18 2945 1 1 11 CYS H H 20.959 20.818 15.911 1.00 . A A . 11 CYS H 1 1 18 2946 1 1 11 CYS HA H 18.850 22.694 15.843 1.00 . A A . 11 CYS HA 1 1 18 2947 1 1 11 CYS HB2 H 20.432 21.645 18.252 1.00 . A A . 11 CYS HB2 1 1 18 2948 1 1 11 CYS HB3 H 18.742 22.156 18.328 1.00 . A A . 11 CYS HB3 1 1 18 2949 1 1 11 CYS N N 20.507 21.591 15.472 1.00 . A A . 11 CYS N 1 1 18 2950 1 1 11 CYS O O 21.680 23.659 17.138 1.00 . A A . 11 CYS O 1 1 18 2951 1 1 11 CYS OXT O 19.912 24.817 16.538 1.00 . A A . 11 CYS OXT 1 1 18 2952 1 1 11 CYS SG S 19.056 19.929 17.361 1.00 . A A . 11 CYS SG 1 1 19 2953 1 1 1 SER C C 13.513 23.513 12.872 1.00 . A A . 1 SER C 1 1 19 2954 1 1 1 SER CA C 13.662 24.815 13.579 1.00 . A A . 1 SER CA 1 1 19 2955 1 1 1 SER CB C 13.922 24.489 15.060 1.00 . A A . 1 SER CB 1 1 19 2956 1 1 1 SER H1 H 11.762 25.475 14.134 1.00 . A A . 1 SER H1 1 1 19 2957 1 1 1 SER H2 H 12.083 25.667 12.482 1.00 . A A . 1 SER H2 1 1 19 2958 1 1 1 SER H3 H 12.771 26.694 13.642 1.00 . A A . 1 SER H3 1 1 19 2959 1 1 1 SER HA H 14.519 25.320 13.159 1.00 . A A . 1 SER HA 1 1 19 2960 1 1 1 SER HB2 H 13.026 24.022 15.524 1.00 . A A . 1 SER HB2 1 1 19 2961 1 1 1 SER HB3 H 14.760 23.769 15.169 1.00 . A A . 1 SER HB3 1 1 19 2962 1 1 1 SER HG H 15.138 25.529 16.125 1.00 . A A . 1 SER HG 1 1 19 2963 1 1 1 SER N N 12.495 25.713 13.436 1.00 . A A . 1 SER N 1 1 19 2964 1 1 1 SER O O 12.402 23.027 12.670 1.00 . A A . 1 SER O 1 1 19 2965 1 1 1 SER OG O 14.250 25.665 15.784 1.00 . A A . 1 SER OG 1 1 19 2966 1 1 2 CYS C C 14.655 20.584 13.199 1.00 . A A . 2 CYS C 1 1 19 2967 1 1 2 CYS CA C 14.652 21.521 12.041 1.00 . A A . 2 CYS CA 1 1 19 2968 1 1 2 CYS CB C 15.827 21.226 11.094 1.00 . A A . 2 CYS CB 1 1 19 2969 1 1 2 CYS H H 15.535 23.304 12.584 1.00 . A A . 2 CYS H 1 1 19 2970 1 1 2 CYS HA H 13.733 21.331 11.507 1.00 . A A . 2 CYS HA 1 1 19 2971 1 1 2 CYS HB2 H 15.976 20.134 10.963 1.00 . A A . 2 CYS HB2 1 1 19 2972 1 1 2 CYS HB3 H 15.598 21.615 10.078 1.00 . A A . 2 CYS HB3 1 1 19 2973 1 1 2 CYS N N 14.638 22.879 12.492 1.00 . A A . 2 CYS N 1 1 19 2974 1 1 2 CYS O O 14.748 20.969 14.362 1.00 . A A . 2 CYS O 1 1 19 2975 1 1 2 CYS SG S 17.386 22.023 11.578 1.00 . A A . 2 CYS SG 1 1 19 2976 1 1 3 SER C C 15.506 17.820 14.613 1.00 . A A . 3 SER C 1 1 19 2977 1 1 3 SER CA C 14.277 18.255 13.892 1.00 . A A . 3 SER CA 1 1 19 2978 1 1 3 SER CB C 13.606 17.047 13.216 1.00 . A A . 3 SER CB 1 1 19 2979 1 1 3 SER H H 14.403 18.967 11.974 1.00 . A A . 3 SER H 1 1 19 2980 1 1 3 SER HA H 13.629 18.684 14.643 1.00 . A A . 3 SER HA 1 1 19 2981 1 1 3 SER HB2 H 13.554 16.146 13.862 1.00 . A A . 3 SER HB2 1 1 19 2982 1 1 3 SER HB3 H 12.564 17.335 12.960 1.00 . A A . 3 SER HB3 1 1 19 2983 1 1 3 SER HG H 13.549 16.355 11.406 1.00 . A A . 3 SER HG 1 1 19 2984 1 1 3 SER N N 14.496 19.279 12.917 1.00 . A A . 3 SER N 1 1 19 2985 1 1 3 SER O O 16.331 17.073 14.091 1.00 . A A . 3 SER O 1 1 19 2986 1 1 3 SER OG O 14.229 16.703 11.987 1.00 . A A . 3 SER OG 1 1 19 2987 1 1 4 CYS C C 16.587 16.695 17.480 1.00 . A A . 4 CYS C 1 1 19 2988 1 1 4 CYS CA C 16.773 17.961 16.716 1.00 . A A . 4 CYS CA 1 1 19 2989 1 1 4 CYS CB C 17.064 19.143 17.656 1.00 . A A . 4 CYS CB 1 1 19 2990 1 1 4 CYS H H 14.948 18.851 16.251 1.00 . A A . 4 CYS H 1 1 19 2991 1 1 4 CYS HA H 17.654 17.804 16.111 1.00 . A A . 4 CYS HA 1 1 19 2992 1 1 4 CYS HB2 H 16.769 20.058 17.100 1.00 . A A . 4 CYS HB2 1 1 19 2993 1 1 4 CYS HB3 H 16.440 19.087 18.575 1.00 . A A . 4 CYS HB3 1 1 19 2994 1 1 4 CYS N N 15.661 18.266 15.872 1.00 . A A . 4 CYS N 1 1 19 2995 1 1 4 CYS O O 17.557 16.023 17.826 1.00 . A A . 4 CYS O 1 1 19 2996 1 1 4 CYS SG S 18.816 19.249 18.121 1.00 . A A . 4 CYS SG 1 1 19 2997 1 1 5 LYS C C 15.411 13.890 17.283 1.00 . A A . 5 LYS C 1 1 19 2998 1 1 5 LYS CA C 14.997 14.975 18.216 1.00 . A A . 5 LYS CA 1 1 19 2999 1 1 5 LYS CB C 13.487 14.830 18.471 1.00 . A A . 5 LYS CB 1 1 19 3000 1 1 5 LYS CD C 13.084 16.672 20.234 1.00 . A A . 5 LYS CD 1 1 19 3001 1 1 5 LYS CE C 12.643 16.957 21.671 1.00 . A A . 5 LYS CE 1 1 19 3002 1 1 5 LYS CG C 12.984 15.190 19.870 1.00 . A A . 5 LYS CG 1 1 19 3003 1 1 5 LYS H H 14.575 16.899 17.549 1.00 . A A . 5 LYS H 1 1 19 3004 1 1 5 LYS HA H 15.564 14.805 19.120 1.00 . A A . 5 LYS HA 1 1 19 3005 1 1 5 LYS HB2 H 12.902 15.424 17.737 1.00 . A A . 5 LYS HB2 1 1 19 3006 1 1 5 LYS HB3 H 13.183 13.769 18.339 1.00 . A A . 5 LYS HB3 1 1 19 3007 1 1 5 LYS HD2 H 14.130 17.026 20.104 1.00 . A A . 5 LYS HD2 1 1 19 3008 1 1 5 LYS HD3 H 12.443 17.241 19.525 1.00 . A A . 5 LYS HD3 1 1 19 3009 1 1 5 LYS HE2 H 11.645 16.515 21.879 1.00 . A A . 5 LYS HE2 1 1 19 3010 1 1 5 LYS HE3 H 13.382 16.544 22.391 1.00 . A A . 5 LYS HE3 1 1 19 3011 1 1 5 LYS HG2 H 11.910 14.911 19.896 1.00 . A A . 5 LYS HG2 1 1 19 3012 1 1 5 LYS HG3 H 13.503 14.569 20.632 1.00 . A A . 5 LYS HG3 1 1 19 3013 1 1 5 LYS HZ1 H 13.355 18.890 21.416 1.00 . A A . 5 LYS HZ1 1 1 19 3014 1 1 5 LYS HZ2 H 12.620 18.640 22.899 1.00 . A A . 5 LYS HZ2 1 1 19 3015 1 1 5 LYS HZ3 H 11.672 18.798 21.481 1.00 . A A . 5 LYS HZ3 1 1 19 3016 1 1 5 LYS N N 15.333 16.276 17.727 1.00 . A A . 5 LYS N 1 1 19 3017 1 1 5 LYS NZ N 12.554 18.419 21.884 1.00 . A A . 5 LYS NZ 1 1 19 3018 1 1 5 LYS O O 15.825 12.810 17.704 1.00 . A A . 5 LYS O 1 1 19 3019 1 1 6 ARG C C 17.407 13.621 14.831 1.00 . A A . 6 ARG C 1 1 19 3020 1 1 6 ARG CA C 15.949 13.341 14.956 1.00 . A A . 6 ARG CA 1 1 19 3021 1 1 6 ARG CB C 15.188 13.568 13.640 1.00 . A A . 6 ARG CB 1 1 19 3022 1 1 6 ARG CD C 12.828 13.590 12.776 1.00 . A A . 6 ARG CD 1 1 19 3023 1 1 6 ARG CG C 13.867 12.799 13.574 1.00 . A A . 6 ARG CG 1 1 19 3024 1 1 6 ARG CZ C 10.944 12.800 11.292 1.00 . A A . 6 ARG CZ 1 1 19 3025 1 1 6 ARG H H 14.818 14.933 15.635 1.00 . A A . 6 ARG H 1 1 19 3026 1 1 6 ARG HA H 15.860 12.296 15.216 1.00 . A A . 6 ARG HA 1 1 19 3027 1 1 6 ARG HB2 H 14.934 14.646 13.549 1.00 . A A . 6 ARG HB2 1 1 19 3028 1 1 6 ARG HB3 H 15.719 13.236 12.723 1.00 . A A . 6 ARG HB3 1 1 19 3029 1 1 6 ARG HD2 H 12.285 14.393 13.320 1.00 . A A . 6 ARG HD2 1 1 19 3030 1 1 6 ARG HD3 H 13.291 14.127 11.920 1.00 . A A . 6 ARG HD3 1 1 19 3031 1 1 6 ARG HE H 12.165 11.604 12.295 1.00 . A A . 6 ARG HE 1 1 19 3032 1 1 6 ARG HG2 H 14.158 11.818 13.142 1.00 . A A . 6 ARG HG2 1 1 19 3033 1 1 6 ARG HG3 H 13.621 12.567 14.632 1.00 . A A . 6 ARG HG3 1 1 19 3034 1 1 6 ARG HH11 H 10.593 14.772 11.704 1.00 . A A . 6 ARG HH11 1 1 19 3035 1 1 6 ARG HH12 H 9.625 14.115 10.443 1.00 . A A . 6 ARG HH12 1 1 19 3036 1 1 6 ARG HH21 H 11.100 10.913 10.604 1.00 . A A . 6 ARG HH21 1 1 19 3037 1 1 6 ARG HH22 H 10.160 12.006 9.621 1.00 . A A . 6 ARG HH22 1 1 19 3038 1 1 6 ARG N N 15.323 14.139 15.964 1.00 . A A . 6 ARG N 1 1 19 3039 1 1 6 ARG NE N 11.883 12.563 12.253 1.00 . A A . 6 ARG NE 1 1 19 3040 1 1 6 ARG NH1 N 10.415 14.036 11.052 1.00 . A A . 6 ARG NH1 1 1 19 3041 1 1 6 ARG NH2 N 10.569 11.755 10.498 1.00 . A A . 6 ARG NH2 1 1 19 3042 1 1 6 ARG O O 18.224 13.021 15.530 1.00 . A A . 6 ARG O 1 1 19 3043 1 1 7 ASN C C 19.707 15.833 14.706 1.00 . A A . 7 ASN C 1 1 19 3044 1 1 7 ASN CA C 19.201 14.836 13.721 1.00 . A A . 7 ASN CA 1 1 19 3045 1 1 7 ASN CB C 19.574 15.255 12.289 1.00 . A A . 7 ASN CB 1 1 19 3046 1 1 7 ASN CG C 19.030 14.214 11.321 1.00 . A A . 7 ASN CG 1 1 19 3047 1 1 7 ASN H H 17.116 14.977 13.382 1.00 . A A . 7 ASN H 1 1 19 3048 1 1 7 ASN HA H 19.752 13.926 13.904 1.00 . A A . 7 ASN HA 1 1 19 3049 1 1 7 ASN HB2 H 19.244 16.281 12.016 1.00 . A A . 7 ASN HB2 1 1 19 3050 1 1 7 ASN HB3 H 20.675 15.242 12.142 1.00 . A A . 7 ASN HB3 1 1 19 3051 1 1 7 ASN HD21 H 17.816 15.584 10.387 1.00 . A A . 7 ASN HD21 1 1 19 3052 1 1 7 ASN HD22 H 17.859 13.977 9.686 1.00 . A A . 7 ASN HD22 1 1 19 3053 1 1 7 ASN N N 17.821 14.519 13.919 1.00 . A A . 7 ASN N 1 1 19 3054 1 1 7 ASN ND2 N 18.130 14.634 10.389 1.00 . A A . 7 ASN ND2 1 1 19 3055 1 1 7 ASN O O 19.432 17.026 14.595 1.00 . A A . 7 ASN O 1 1 19 3056 1 1 7 ASN OD1 O 19.386 13.039 11.392 1.00 . A A . 7 ASN OD1 1 1 19 3057 1 1 8 PHE C C 21.777 17.357 16.570 1.00 . A A . 8 PHE C 1 1 19 3058 1 1 8 PHE CA C 20.899 16.185 16.848 1.00 . A A . 8 PHE CA 1 1 19 3059 1 1 8 PHE CB C 21.523 15.299 17.940 1.00 . A A . 8 PHE CB 1 1 19 3060 1 1 8 PHE CD1 C 23.845 14.811 17.113 1.00 . A A . 8 PHE CD1 1 1 19 3061 1 1 8 PHE CD2 C 22.387 13.014 17.577 1.00 . A A . 8 PHE CD2 1 1 19 3062 1 1 8 PHE CE1 C 24.826 13.922 16.738 1.00 . A A . 8 PHE CE1 1 1 19 3063 1 1 8 PHE CE2 C 23.358 12.116 17.201 1.00 . A A . 8 PHE CE2 1 1 19 3064 1 1 8 PHE CG C 22.606 14.370 17.513 1.00 . A A . 8 PHE CG 1 1 19 3065 1 1 8 PHE CZ C 24.584 12.568 16.773 1.00 . A A . 8 PHE CZ 1 1 19 3066 1 1 8 PHE H H 20.744 14.450 15.761 1.00 . A A . 8 PHE H 1 1 19 3067 1 1 8 PHE HA H 20.002 16.627 17.254 1.00 . A A . 8 PHE HA 1 1 19 3068 1 1 8 PHE HB2 H 21.918 15.917 18.774 1.00 . A A . 8 PHE HB2 1 1 19 3069 1 1 8 PHE HB3 H 20.716 14.664 18.363 1.00 . A A . 8 PHE HB3 1 1 19 3070 1 1 8 PHE HD1 H 24.096 15.861 17.070 1.00 . A A . 8 PHE HD1 1 1 19 3071 1 1 8 PHE HD2 H 21.439 12.607 17.894 1.00 . A A . 8 PHE HD2 1 1 19 3072 1 1 8 PHE HE1 H 25.782 14.293 16.403 1.00 . A A . 8 PHE HE1 1 1 19 3073 1 1 8 PHE HE2 H 23.129 11.060 17.229 1.00 . A A . 8 PHE HE2 1 1 19 3074 1 1 8 PHE HZ H 25.346 11.872 16.456 1.00 . A A . 8 PHE HZ 1 1 19 3075 1 1 8 PHE N N 20.485 15.412 15.719 1.00 . A A . 8 PHE N 1 1 19 3076 1 1 8 PHE O O 21.918 18.273 17.380 1.00 . A A . 8 PHE O 1 1 19 3077 1 1 9 LEU C C 22.297 19.639 14.449 1.00 . A A . 9 LEU C 1 1 19 3078 1 1 9 LEU CA C 23.151 18.499 14.883 1.00 . A A . 9 LEU CA 1 1 19 3079 1 1 9 LEU CB C 24.136 18.175 13.748 1.00 . A A . 9 LEU CB 1 1 19 3080 1 1 9 LEU CD1 C 25.644 16.611 12.460 1.00 . A A . 9 LEU CD1 1 1 19 3081 1 1 9 LEU CD2 C 26.107 16.872 14.862 1.00 . A A . 9 LEU CD2 1 1 19 3082 1 1 9 LEU CG C 24.978 16.889 13.818 1.00 . A A . 9 LEU CG 1 1 19 3083 1 1 9 LEU H H 22.206 16.606 14.787 1.00 . A A . 9 LEU H 1 1 19 3084 1 1 9 LEU HA H 23.716 18.880 15.721 1.00 . A A . 9 LEU HA 1 1 19 3085 1 1 9 LEU HB2 H 23.672 18.230 12.740 1.00 . A A . 9 LEU HB2 1 1 19 3086 1 1 9 LEU HB3 H 24.884 18.997 13.784 1.00 . A A . 9 LEU HB3 1 1 19 3087 1 1 9 LEU HD11 H 26.195 15.648 12.528 1.00 . A A . 9 LEU HD11 1 1 19 3088 1 1 9 LEU HD12 H 26.362 17.424 12.221 1.00 . A A . 9 LEU HD12 1 1 19 3089 1 1 9 LEU HD13 H 24.871 16.535 11.665 1.00 . A A . 9 LEU HD13 1 1 19 3090 1 1 9 LEU HD21 H 26.678 15.934 14.694 1.00 . A A . 9 LEU HD21 1 1 19 3091 1 1 9 LEU HD22 H 25.704 16.829 15.896 1.00 . A A . 9 LEU HD22 1 1 19 3092 1 1 9 LEU HD23 H 26.796 17.734 14.726 1.00 . A A . 9 LEU HD23 1 1 19 3093 1 1 9 LEU HG H 24.381 15.976 14.021 1.00 . A A . 9 LEU HG 1 1 19 3094 1 1 9 LEU N N 22.375 17.400 15.367 1.00 . A A . 9 LEU N 1 1 19 3095 1 1 9 LEU O O 22.782 20.757 14.274 1.00 . A A . 9 LEU O 1 1 19 3096 1 1 10 CYS C C 19.406 21.261 14.675 1.00 . A A . 10 CYS C 1 1 19 3097 1 1 10 CYS CA C 20.099 20.395 13.681 1.00 . A A . 10 CYS CA 1 1 19 3098 1 1 10 CYS CB C 19.093 19.735 12.723 1.00 . A A . 10 CYS CB 1 1 19 3099 1 1 10 CYS H H 20.633 18.527 14.495 1.00 . A A . 10 CYS H 1 1 19 3100 1 1 10 CYS HA H 20.684 21.056 13.059 1.00 . A A . 10 CYS HA 1 1 19 3101 1 1 10 CYS HB2 H 19.501 18.764 12.368 1.00 . A A . 10 CYS HB2 1 1 19 3102 1 1 10 CYS HB3 H 18.135 19.502 13.237 1.00 . A A . 10 CYS HB3 1 1 19 3103 1 1 10 CYS N N 20.980 19.433 14.269 1.00 . A A . 10 CYS N 1 1 19 3104 1 1 10 CYS O O 18.326 21.798 14.430 1.00 . A A . 10 CYS O 1 1 19 3105 1 1 10 CYS SG S 18.817 20.643 11.174 1.00 . A A . 10 CYS SG 1 1 19 3106 1 1 11 CYS C C 20.114 23.796 16.476 1.00 . A A . 11 CYS C 1 1 19 3107 1 1 11 CYS CA C 19.522 22.435 16.817 1.00 . A A . 11 CYS CA 1 1 19 3108 1 1 11 CYS CB C 19.962 22.148 18.264 1.00 . A A . 11 CYS CB 1 1 19 3109 1 1 11 CYS H H 20.862 21.032 16.073 1.00 . A A . 11 CYS H 1 1 19 3110 1 1 11 CYS HA H 18.445 22.488 16.763 1.00 . A A . 11 CYS HA 1 1 19 3111 1 1 11 CYS HB2 H 21.020 21.809 18.272 1.00 . A A . 11 CYS HB2 1 1 19 3112 1 1 11 CYS HB3 H 19.952 23.079 18.869 1.00 . A A . 11 CYS HB3 1 1 19 3113 1 1 11 CYS N N 20.006 21.494 15.856 1.00 . A A . 11 CYS N 1 1 19 3114 1 1 11 CYS O O 19.378 24.817 16.431 1.00 . A A . 11 CYS O 1 1 19 3115 1 1 11 CYS OXT O 21.352 23.875 16.253 1.00 . A A . 11 CYS OXT 1 1 19 3116 1 1 11 CYS SG S 18.937 20.969 19.191 1.00 . A A . 11 CYS SG 1 1 20 3117 1 1 1 SER C C 13.505 23.360 13.147 1.00 . A A . 1 SER C 1 1 20 3118 1 1 1 SER CA C 13.648 24.718 13.744 1.00 . A A . 1 SER CA 1 1 20 3119 1 1 1 SER CB C 13.835 24.595 15.265 1.00 . A A . 1 SER CB 1 1 20 3120 1 1 1 SER H1 H 12.590 26.529 13.748 1.00 . A A . 1 SER H1 1 1 20 3121 1 1 1 SER H2 H 11.600 25.158 13.809 1.00 . A A . 1 SER H2 1 1 20 3122 1 1 1 SER H3 H 12.368 25.600 12.373 1.00 . A A . 1 SER H3 1 1 20 3123 1 1 1 SER HA H 14.522 25.175 13.305 1.00 . A A . 1 SER HA 1 1 20 3124 1 1 1 SER HB2 H 12.945 24.120 15.731 1.00 . A A . 1 SER HB2 1 1 20 3125 1 1 1 SER HB3 H 14.719 23.960 15.488 1.00 . A A . 1 SER HB3 1 1 20 3126 1 1 1 SER HG H 14.203 25.730 16.787 1.00 . A A . 1 SER HG 1 1 20 3127 1 1 1 SER N N 12.474 25.554 13.406 1.00 . A A . 1 SER N 1 1 20 3128 1 1 1 SER O O 12.390 22.856 13.021 1.00 . A A . 1 SER O 1 1 20 3129 1 1 1 SER OG O 14.036 25.873 15.851 1.00 . A A . 1 SER OG 1 1 20 3130 1 1 2 CYS C C 14.401 20.348 13.245 1.00 . A A . 2 CYS C 1 1 20 3131 1 1 2 CYS CA C 14.591 21.388 12.194 1.00 . A A . 2 CYS CA 1 1 20 3132 1 1 2 CYS CB C 15.837 21.112 11.337 1.00 . A A . 2 CYS CB 1 1 20 3133 1 1 2 CYS H H 15.520 23.082 12.909 1.00 . A A . 2 CYS H 1 1 20 3134 1 1 2 CYS HA H 13.709 21.297 11.578 1.00 . A A . 2 CYS HA 1 1 20 3135 1 1 2 CYS HB2 H 15.995 20.025 11.172 1.00 . A A . 2 CYS HB2 1 1 20 3136 1 1 2 CYS HB3 H 15.696 21.551 10.325 1.00 . A A . 2 CYS HB3 1 1 20 3137 1 1 2 CYS N N 14.612 22.700 12.762 1.00 . A A . 2 CYS N 1 1 20 3138 1 1 2 CYS O O 14.236 20.657 14.424 1.00 . A A . 2 CYS O 1 1 20 3139 1 1 2 CYS SG S 17.360 21.875 11.967 1.00 . A A . 2 CYS SG 1 1 20 3140 1 1 3 SER C C 15.147 17.648 14.669 1.00 . A A . 3 SER C 1 1 20 3141 1 1 3 SER CA C 14.037 17.956 13.724 1.00 . A A . 3 SER CA 1 1 20 3142 1 1 3 SER CB C 13.695 16.697 12.911 1.00 . A A . 3 SER CB 1 1 20 3143 1 1 3 SER H H 14.442 18.795 11.908 1.00 . A A . 3 SER H 1 1 20 3144 1 1 3 SER HA H 13.202 18.258 14.338 1.00 . A A . 3 SER HA 1 1 20 3145 1 1 3 SER HB2 H 13.682 15.768 13.520 1.00 . A A . 3 SER HB2 1 1 20 3146 1 1 3 SER HB3 H 12.685 16.818 12.464 1.00 . A A . 3 SER HB3 1 1 20 3147 1 1 3 SER HG H 14.214 15.857 11.247 1.00 . A A . 3 SER HG 1 1 20 3148 1 1 3 SER N N 14.327 19.061 12.862 1.00 . A A . 3 SER N 1 1 20 3149 1 1 3 SER O O 16.049 16.859 14.390 1.00 . A A . 3 SER O 1 1 20 3150 1 1 3 SER OG O 14.611 16.497 11.843 1.00 . A A . 3 SER OG 1 1 20 3151 1 1 4 CYS C C 16.121 16.926 17.622 1.00 . A A . 4 CYS C 1 1 20 3152 1 1 4 CYS CA C 16.163 18.190 16.835 1.00 . A A . 4 CYS CA 1 1 20 3153 1 1 4 CYS CB C 16.041 19.396 17.782 1.00 . A A . 4 CYS CB 1 1 20 3154 1 1 4 CYS H H 14.295 18.772 16.114 1.00 . A A . 4 CYS H 1 1 20 3155 1 1 4 CYS HA H 17.117 18.206 16.331 1.00 . A A . 4 CYS HA 1 1 20 3156 1 1 4 CYS HB2 H 15.890 20.276 17.121 1.00 . A A . 4 CYS HB2 1 1 20 3157 1 1 4 CYS HB3 H 15.140 19.319 18.429 1.00 . A A . 4 CYS HB3 1 1 20 3158 1 1 4 CYS N N 15.103 18.241 15.876 1.00 . A A . 4 CYS N 1 1 20 3159 1 1 4 CYS O O 17.120 16.455 18.163 1.00 . A A . 4 CYS O 1 1 20 3160 1 1 4 CYS SG S 17.454 19.655 18.894 1.00 . A A . 4 CYS SG 1 1 20 3161 1 1 5 LYS C C 15.624 13.994 17.302 1.00 . A A . 5 LYS C 1 1 20 3162 1 1 5 LYS CA C 14.801 14.927 18.122 1.00 . A A . 5 LYS CA 1 1 20 3163 1 1 5 LYS CB C 13.332 14.473 18.072 1.00 . A A . 5 LYS CB 1 1 20 3164 1 1 5 LYS CD C 12.279 16.139 19.768 1.00 . A A . 5 LYS CD 1 1 20 3165 1 1 5 LYS CE C 11.632 16.213 21.152 1.00 . A A . 5 LYS CE 1 1 20 3166 1 1 5 LYS CG C 12.516 14.686 19.348 1.00 . A A . 5 LYS CG 1 1 20 3167 1 1 5 LYS H H 14.130 16.742 17.332 1.00 . A A . 5 LYS H 1 1 20 3168 1 1 5 LYS HA H 15.207 14.859 19.120 1.00 . A A . 5 LYS HA 1 1 20 3169 1 1 5 LYS HB2 H 12.789 14.949 17.227 1.00 . A A . 5 LYS HB2 1 1 20 3170 1 1 5 LYS HB3 H 13.289 13.376 17.903 1.00 . A A . 5 LYS HB3 1 1 20 3171 1 1 5 LYS HD2 H 13.252 16.674 19.798 1.00 . A A . 5 LYS HD2 1 1 20 3172 1 1 5 LYS HD3 H 11.634 16.631 19.008 1.00 . A A . 5 LYS HD3 1 1 20 3173 1 1 5 LYS HE2 H 10.652 15.690 21.149 1.00 . A A . 5 LYS HE2 1 1 20 3174 1 1 5 LYS HE3 H 12.293 15.750 21.915 1.00 . A A . 5 LYS HE3 1 1 20 3175 1 1 5 LYS HG2 H 11.526 14.211 19.179 1.00 . A A . 5 LYS HG2 1 1 20 3176 1 1 5 LYS HG3 H 12.997 14.134 20.183 1.00 . A A . 5 LYS HG3 1 1 20 3177 1 1 5 LYS HZ1 H 10.506 17.935 21.092 1.00 . A A . 5 LYS HZ1 1 1 20 3178 1 1 5 LYS HZ2 H 12.164 18.240 21.254 1.00 . A A . 5 LYS HZ2 1 1 20 3179 1 1 5 LYS HZ3 H 11.279 17.671 22.582 1.00 . A A . 5 LYS HZ3 1 1 20 3180 1 1 5 LYS N N 14.943 16.277 17.674 1.00 . A A . 5 LYS N 1 1 20 3181 1 1 5 LYS NZ N 11.385 17.618 21.548 1.00 . A A . 5 LYS NZ 1 1 20 3182 1 1 5 LYS O O 16.400 13.199 17.831 1.00 . A A . 5 LYS O 1 1 20 3183 1 1 6 ARG C C 17.564 13.608 14.753 1.00 . A A . 6 ARG C 1 1 20 3184 1 1 6 ARG CA C 16.164 13.188 15.048 1.00 . A A . 6 ARG CA 1 1 20 3185 1 1 6 ARG CB C 15.320 13.161 13.762 1.00 . A A . 6 ARG CB 1 1 20 3186 1 1 6 ARG CD C 12.936 12.935 13.017 1.00 . A A . 6 ARG CD 1 1 20 3187 1 1 6 ARG CG C 14.044 12.326 13.878 1.00 . A A . 6 ARG CG 1 1 20 3188 1 1 6 ARG CZ C 10.498 12.271 13.348 1.00 . A A . 6 ARG CZ 1 1 20 3189 1 1 6 ARG H H 14.912 14.752 15.551 1.00 . A A . 6 ARG H 1 1 20 3190 1 1 6 ARG HA H 16.217 12.190 15.456 1.00 . A A . 6 ARG HA 1 1 20 3191 1 1 6 ARG HB2 H 14.996 14.195 13.514 1.00 . A A . 6 ARG HB2 1 1 20 3192 1 1 6 ARG HB3 H 15.822 12.722 12.873 1.00 . A A . 6 ARG HB3 1 1 20 3193 1 1 6 ARG HD2 H 12.621 13.952 13.332 1.00 . A A . 6 ARG HD2 1 1 20 3194 1 1 6 ARG HD3 H 13.202 13.073 11.947 1.00 . A A . 6 ARG HD3 1 1 20 3195 1 1 6 ARG HE H 12.004 10.985 13.193 1.00 . A A . 6 ARG HE 1 1 20 3196 1 1 6 ARG HG2 H 14.368 11.299 13.605 1.00 . A A . 6 ARG HG2 1 1 20 3197 1 1 6 ARG HG3 H 13.828 12.266 14.967 1.00 . A A . 6 ARG HG3 1 1 20 3198 1 1 6 ARG HH11 H 10.681 14.279 13.646 1.00 . A A . 6 ARG HH11 1 1 20 3199 1 1 6 ARG HH12 H 9.092 13.660 13.796 1.00 . A A . 6 ARG HH12 1 1 20 3200 1 1 6 ARG HH21 H 10.014 10.301 13.502 1.00 . A A . 6 ARG HH21 1 1 20 3201 1 1 6 ARG HH22 H 8.668 11.376 13.721 1.00 . A A . 6 ARG HH22 1 1 20 3202 1 1 6 ARG N N 15.489 14.052 15.965 1.00 . A A . 6 ARG N 1 1 20 3203 1 1 6 ARG NE N 11.810 11.965 13.130 1.00 . A A . 6 ARG NE 1 1 20 3204 1 1 6 ARG NH1 N 10.026 13.547 13.460 1.00 . A A . 6 ARG NH1 1 1 20 3205 1 1 6 ARG NH2 N 9.636 11.226 13.517 1.00 . A A . 6 ARG NH2 1 1 20 3206 1 1 6 ARG O O 18.520 12.982 15.205 1.00 . A A . 6 ARG O 1 1 20 3207 1 1 7 ASN C C 19.534 16.145 14.630 1.00 . A A . 7 ASN C 1 1 20 3208 1 1 7 ASN CA C 19.016 15.204 13.596 1.00 . A A . 7 ASN CA 1 1 20 3209 1 1 7 ASN CB C 19.099 15.819 12.189 1.00 . A A . 7 ASN CB 1 1 20 3210 1 1 7 ASN CG C 18.469 14.847 11.202 1.00 . A A . 7 ASN CG 1 1 20 3211 1 1 7 ASN H H 16.913 15.152 13.652 1.00 . A A . 7 ASN H 1 1 20 3212 1 1 7 ASN HA H 19.699 14.367 13.569 1.00 . A A . 7 ASN HA 1 1 20 3213 1 1 7 ASN HB2 H 18.605 16.809 12.092 1.00 . A A . 7 ASN HB2 1 1 20 3214 1 1 7 ASN HB3 H 20.160 15.965 11.895 1.00 . A A . 7 ASN HB3 1 1 20 3215 1 1 7 ASN HD21 H 19.995 13.501 11.467 1.00 . A A . 7 ASN HD21 1 1 20 3216 1 1 7 ASN HD22 H 18.686 12.968 10.456 1.00 . A A . 7 ASN HD22 1 1 20 3217 1 1 7 ASN N N 17.736 14.687 13.969 1.00 . A A . 7 ASN N 1 1 20 3218 1 1 7 ASN ND2 N 19.146 13.690 10.973 1.00 . A A . 7 ASN ND2 1 1 20 3219 1 1 7 ASN O O 19.274 17.347 14.653 1.00 . A A . 7 ASN O 1 1 20 3220 1 1 7 ASN OD1 O 17.390 15.079 10.658 1.00 . A A . 7 ASN OD1 1 1 20 3221 1 1 8 PHE C C 21.774 17.310 16.587 1.00 . A A . 8 PHE C 1 1 20 3222 1 1 8 PHE CA C 20.778 16.216 16.763 1.00 . A A . 8 PHE CA 1 1 20 3223 1 1 8 PHE CB C 21.264 15.147 17.757 1.00 . A A . 8 PHE CB 1 1 20 3224 1 1 8 PHE CD1 C 23.592 14.493 17.145 1.00 . A A . 8 PHE CD1 1 1 20 3225 1 1 8 PHE CD2 C 21.835 12.946 16.767 1.00 . A A . 8 PHE CD2 1 1 20 3226 1 1 8 PHE CE1 C 24.486 13.620 16.572 1.00 . A A . 8 PHE CE1 1 1 20 3227 1 1 8 PHE CE2 C 22.728 12.067 16.201 1.00 . A A . 8 PHE CE2 1 1 20 3228 1 1 8 PHE CG C 22.253 14.181 17.202 1.00 . A A . 8 PHE CG 1 1 20 3229 1 1 8 PHE CZ C 24.057 12.403 16.096 1.00 . A A . 8 PHE CZ 1 1 20 3230 1 1 8 PHE H H 20.581 14.631 15.457 1.00 . A A . 8 PHE H 1 1 20 3231 1 1 8 PHE HA H 19.914 16.709 17.187 1.00 . A A . 8 PHE HA 1 1 20 3232 1 1 8 PHE HB2 H 21.689 15.609 18.673 1.00 . A A . 8 PHE HB2 1 1 20 3233 1 1 8 PHE HB3 H 20.396 14.527 18.067 1.00 . A A . 8 PHE HB3 1 1 20 3234 1 1 8 PHE HD1 H 23.963 15.424 17.548 1.00 . A A . 8 PHE HD1 1 1 20 3235 1 1 8 PHE HD2 H 20.809 12.621 16.865 1.00 . A A . 8 PHE HD2 1 1 20 3236 1 1 8 PHE HE1 H 25.531 13.883 16.510 1.00 . A A . 8 PHE HE1 1 1 20 3237 1 1 8 PHE HE2 H 22.354 11.114 15.858 1.00 . A A . 8 PHE HE2 1 1 20 3238 1 1 8 PHE HZ H 24.761 11.714 15.653 1.00 . A A . 8 PHE HZ 1 1 20 3239 1 1 8 PHE N N 20.345 15.594 15.551 1.00 . A A . 8 PHE N 1 1 20 3240 1 1 8 PHE O O 21.877 18.194 17.436 1.00 . A A . 8 PHE O 1 1 20 3241 1 1 9 LEU C C 22.706 19.584 14.499 1.00 . A A . 9 LEU C 1 1 20 3242 1 1 9 LEU CA C 23.395 18.455 15.182 1.00 . A A . 9 LEU CA 1 1 20 3243 1 1 9 LEU CB C 24.669 18.138 14.380 1.00 . A A . 9 LEU CB 1 1 20 3244 1 1 9 LEU CD1 C 26.523 16.641 13.549 1.00 . A A . 9 LEU CD1 1 1 20 3245 1 1 9 LEU CD2 C 26.235 16.786 15.984 1.00 . A A . 9 LEU CD2 1 1 20 3246 1 1 9 LEU CG C 25.470 16.853 14.650 1.00 . A A . 9 LEU CG 1 1 20 3247 1 1 9 LEU H H 22.459 16.607 14.819 1.00 . A A . 9 LEU H 1 1 20 3248 1 1 9 LEU HA H 23.753 18.862 16.117 1.00 . A A . 9 LEU HA 1 1 20 3249 1 1 9 LEU HB2 H 24.506 18.196 13.283 1.00 . A A . 9 LEU HB2 1 1 20 3250 1 1 9 LEU HB3 H 25.371 18.963 14.630 1.00 . A A . 9 LEU HB3 1 1 20 3251 1 1 9 LEU HD11 H 26.029 16.595 12.554 1.00 . A A . 9 LEU HD11 1 1 20 3252 1 1 9 LEU HD12 H 27.057 15.688 13.748 1.00 . A A . 9 LEU HD12 1 1 20 3253 1 1 9 LEU HD13 H 27.259 17.473 13.572 1.00 . A A . 9 LEU HD13 1 1 20 3254 1 1 9 LEU HD21 H 25.545 16.788 16.854 1.00 . A A . 9 LEU HD21 1 1 20 3255 1 1 9 LEU HD22 H 26.976 17.609 16.065 1.00 . A A . 9 LEU HD22 1 1 20 3256 1 1 9 LEU HD23 H 26.779 15.818 15.993 1.00 . A A . 9 LEU HD23 1 1 20 3257 1 1 9 LEU HG H 24.826 15.949 14.637 1.00 . A A . 9 LEU HG 1 1 20 3258 1 1 9 LEU N N 22.531 17.355 15.476 1.00 . A A . 9 LEU N 1 1 20 3259 1 1 9 LEU O O 23.330 20.595 14.179 1.00 . A A . 9 LEU O 1 1 20 3260 1 1 10 CYS C C 20.241 21.672 14.237 1.00 . A A . 10 CYS C 1 1 20 3261 1 1 10 CYS CA C 20.677 20.474 13.466 1.00 . A A . 10 CYS CA 1 1 20 3262 1 1 10 CYS CB C 19.451 19.849 12.780 1.00 . A A . 10 CYS CB 1 1 20 3263 1 1 10 CYS H H 20.888 18.737 14.634 1.00 . A A . 10 CYS H 1 1 20 3264 1 1 10 CYS HA H 21.331 20.833 12.686 1.00 . A A . 10 CYS HA 1 1 20 3265 1 1 10 CYS HB2 H 19.699 18.815 12.456 1.00 . A A . 10 CYS HB2 1 1 20 3266 1 1 10 CYS HB3 H 18.608 19.739 13.496 1.00 . A A . 10 CYS HB3 1 1 20 3267 1 1 10 CYS N N 21.385 19.514 14.256 1.00 . A A . 10 CYS N 1 1 20 3268 1 1 10 CYS O O 19.812 22.686 13.690 1.00 . A A . 10 CYS O 1 1 20 3269 1 1 10 CYS SG S 18.887 20.721 11.291 1.00 . A A . 10 CYS SG 1 1 20 3270 1 1 11 CYS C C 20.383 23.705 16.789 1.00 . A A . 11 CYS C 1 1 20 3271 1 1 11 CYS CA C 19.636 22.406 16.518 1.00 . A A . 11 CYS CA 1 1 20 3272 1 1 11 CYS CB C 19.518 21.650 17.852 1.00 . A A . 11 CYS CB 1 1 20 3273 1 1 11 CYS H H 20.812 20.819 15.998 1.00 . A A . 11 CYS H 1 1 20 3274 1 1 11 CYS HA H 18.679 22.652 16.082 1.00 . A A . 11 CYS HA 1 1 20 3275 1 1 11 CYS HB2 H 20.526 21.625 18.318 1.00 . A A . 11 CYS HB2 1 1 20 3276 1 1 11 CYS HB3 H 18.861 22.163 18.587 1.00 . A A . 11 CYS HB3 1 1 20 3277 1 1 11 CYS N N 20.325 21.581 15.576 1.00 . A A . 11 CYS N 1 1 20 3278 1 1 11 CYS O O 19.782 24.799 16.622 1.00 . A A . 11 CYS O 1 1 20 3279 1 1 11 CYS OXT O 21.582 23.661 17.176 1.00 . A A . 11 CYS OXT 1 1 20 3280 1 1 11 CYS SG S 19.030 19.914 17.643 1.00 . A A . 11 CYS SG 1 1 stop_ save_
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