NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
392263 | 1pvz | 5865 | cing | 4-filtered-FRED | STAR | entry | full | 129 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1pvz # This FRED archive file contains, for PDB entry <1pvz>: # # - 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, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend, # JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with # curated sets of experimental NMR restraints for over 4,000 protein and nucleic # acid PDB entries. (in preparation) save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_1pvz _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1pvz _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 3186.37 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 $K__toxin_like_peptide A . 1 1 stop_ save_ save_K__toxin_like_peptide _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "K toxin like peptide" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code TPFAIKCATDADCSRKCPGNPPCRNGFCACT _Entity.Number_of_monomers 31 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 THR . 1 1 2 PRO . 1 1 3 PHE . 1 1 4 ALA . 1 1 5 ILE . 1 1 6 LYS . 1 1 7 CYS . 1 1 8 ALA . 1 1 9 THR . 1 1 10 ASP . 1 1 11 ALA . 1 1 12 ASP . 1 1 13 CYS . 1 1 14 SER . 1 1 15 ARG . 1 1 16 LYS . 1 1 17 CYS . 1 1 18 PRO . 1 1 19 GLY . 1 1 20 ASN . 1 1 21 PRO . 1 1 22 PRO . 1 1 23 CYS . 1 1 24 ARG . 1 1 25 ASN . 1 1 26 GLY . 1 1 27 PHE . 1 1 28 CYS . 1 1 29 ALA . 1 1 30 CYS . 1 1 31 THR . 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 THR 1 1 1 1 PRO 2 2 1 1 PHE 3 3 1 1 ALA 4 4 1 1 ILE 5 5 1 1 LYS 6 6 1 1 CYS 7 7 1 1 ALA 8 8 1 1 THR 9 9 1 1 ASP 10 10 1 1 ALA 11 11 1 1 ASP 12 12 1 1 CYS 13 13 1 1 SER 14 14 1 1 ARG 15 15 1 1 LYS 16 16 1 1 CYS 17 17 1 1 PRO 18 18 1 1 GLY 19 19 1 1 ASN 20 20 1 1 PRO 21 21 1 1 PRO 22 22 1 1 CYS 23 23 1 1 ARG 24 24 1 1 ASN 25 25 1 1 GLY 26 26 1 1 PHE 27 27 1 1 CYS 28 28 1 1 ALA 29 29 1 1 CYS 30 30 1 1 THR 31 31 1 1 stop_ save_ save_DYANA/DIANA_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 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 THR HA . 1 THR HA 1 1 1 1 2 1 1 2 PRO HD3 . 2 PRO HD3 1 1 2 1 1 1 1 2 PRO HA . 2 PRO HA 1 1 2 1 2 1 1 3 PHE H . 3 PHE HN 1 1 3 1 1 1 1 3 PHE HA . 3 PHE HA 1 1 3 1 2 1 1 4 ALA H . 4 ALA HN 1 1 4 1 1 1 1 3 PHE HB3 . 3 PHE HB3 1 1 4 1 2 1 1 4 ALA H . 4 ALA HN 1 1 5 1 1 1 1 4 ALA H . 4 ALA HN 1 1 5 1 2 1 1 4 ALA MB . 4 ALA QB 1 1 6 1 1 1 1 4 ALA H . 4 ALA HN 1 1 6 1 2 1 1 5 ILE H . 5 ILE HN 1 1 7 1 1 1 1 4 ALA HA . 4 ALA HA 1 1 7 1 2 1 1 5 ILE H . 5 ILE HN 1 1 8 1 1 1 1 4 ALA MB . 4 ALA QB 1 1 8 1 2 1 1 5 ILE H . 5 ILE HN 1 1 9 1 1 1 1 4 ALA MB . 4 ALA QB 1 1 9 1 2 1 1 27 PHE HB3 . 27 PHE HB3 1 1 10 1 1 1 1 4 ALA MB . 4 ALA QB 1 1 10 1 2 1 1 27 PHE QD . 27 PHE QD 1 1 11 1 1 1 1 5 ILE H . 5 ILE HN 1 1 11 1 2 1 1 5 ILE HB . 5 ILE HB 1 1 12 1 1 1 1 5 ILE H . 5 ILE HN 1 1 12 1 2 1 1 5 ILE HG13 . 5 ILE HG13 1 1 13 1 1 1 1 5 ILE H . 5 ILE HN 1 1 13 1 2 1 1 27 PHE QD . 27 PHE QD 1 1 14 1 1 1 1 5 ILE H . 5 ILE HN 1 1 14 1 2 1 1 28 CYS H . 28 CYSS HN 1 1 15 1 1 1 1 5 ILE HA . 5 ILE HA 1 1 15 1 2 1 1 5 ILE MD . 5 ILE QD1 1 1 16 1 1 1 1 5 ILE HA . 5 ILE HA 1 1 16 1 2 1 1 5 ILE HG13 . 5 ILE HG13 1 1 17 1 1 1 1 5 ILE HA . 5 ILE HA 1 1 17 1 2 1 1 5 ILE MG . 5 ILE QG2 1 1 18 1 1 1 1 5 ILE HA . 5 ILE HA 1 1 18 1 2 1 1 6 LYS H . 6 LYS HN 1 1 19 1 1 1 1 5 ILE HB . 5 ILE HB 1 1 19 1 2 1 1 5 ILE MD . 5 ILE QD1 1 1 20 1 1 1 1 5 ILE HB . 5 ILE HB 1 1 20 1 2 1 1 6 LYS H . 6 LYS HN 1 1 21 1 1 1 1 5 ILE HB . 5 ILE HB 1 1 21 1 2 1 1 28 CYS H . 28 CYSS HN 1 1 22 1 1 1 1 5 ILE HB . 5 ILE HB 1 1 22 1 2 1 1 28 CYS HB3 . 28 CYSS HB3 1 1 23 1 1 1 1 5 ILE MD . 5 ILE QD1 1 1 23 1 2 1 1 28 CYS HB3 . 28 CYSS HB3 1 1 24 1 1 1 1 5 ILE HG13 . 5 ILE HG13 1 1 24 1 2 1 1 5 ILE MG . 5 ILE QG2 1 1 25 1 1 1 1 5 ILE HG13 . 5 ILE HG13 1 1 25 1 2 1 1 6 LYS H . 6 LYS HN 1 1 26 1 1 1 1 5 ILE MG . 5 ILE QG2 1 1 26 1 2 1 1 6 LYS H . 6 LYS HN 1 1 27 1 1 1 1 5 ILE MG . 5 ILE QG2 1 1 27 1 2 1 1 28 CYS H . 28 CYSS HN 1 1 28 1 1 1 1 5 ILE MG . 5 ILE QG2 1 1 28 1 2 1 1 28 CYS HB3 . 28 CYSS HB3 1 1 29 1 1 1 1 6 LYS H . 6 LYS HN 1 1 29 1 2 1 1 6 LYS HB3 . 6 LYS HB3 1 1 30 1 1 1 1 6 LYS HA . 6 LYS HA 1 1 30 1 2 1 1 6 LYS HB3 . 6 LYS HB3 1 1 31 1 1 1 1 6 LYS HA . 6 LYS HA 1 1 31 1 2 1 1 7 CYS H . 7 CYSS HN 1 1 32 1 1 1 1 6 LYS HA . 6 LYS HA 1 1 32 1 2 1 1 27 PHE HA . 27 PHE HA 1 1 33 1 1 1 1 6 LYS HA . 6 LYS HA 1 1 33 1 2 1 1 27 PHE QD . 27 PHE QD 1 1 34 1 1 1 1 6 LYS HA . 6 LYS HA 1 1 34 1 2 1 1 28 CYS H . 28 CYSS HN 1 1 35 1 1 1 1 6 LYS HB3 . 6 LYS HB3 1 1 35 1 2 1 1 7 CYS H . 7 CYSS HN 1 1 36 1 1 1 1 7 CYS H . 7 CYSS HN 1 1 36 1 2 1 1 7 CYS HB3 . 7 CYSS HB3 1 1 37 1 1 1 1 7 CYS H . 7 CYSS HN 1 1 37 1 2 1 1 27 PHE HA . 27 PHE HA 1 1 38 1 1 1 1 7 CYS HB3 . 7 CYSS HB3 1 1 38 1 2 1 1 8 ALA H . 8 ALA HN 1 1 39 1 1 1 1 8 ALA H . 8 ALA HN 1 1 39 1 2 1 1 8 ALA MB . 8 ALA QB 1 1 40 1 1 1 1 8 ALA MB . 8 ALA QB 1 1 40 1 2 1 1 9 THR H . 9 THR HN 1 1 41 1 1 1 1 8 ALA MB . 8 ALA QB 1 1 41 1 2 1 1 9 THR MG . 9 THR QG2 1 1 42 1 1 1 1 9 THR H . 9 THR HN 1 1 42 1 2 1 1 9 THR MG . 9 THR QG2 1 1 43 1 1 1 1 9 THR HB . 9 THR HB 1 1 43 1 2 1 1 10 ASP H . 10 ASP HN 1 1 44 1 1 1 1 9 THR HB . 9 THR HB 1 1 44 1 2 1 1 11 ALA H . 11 ALA HN 1 1 45 1 1 1 1 9 THR MG . 9 THR QG2 1 1 45 1 2 1 1 10 ASP H . 10 ASP HN 1 1 46 1 1 1 1 9 THR MG . 9 THR QG2 1 1 46 1 2 1 1 11 ALA H . 11 ALA HN 1 1 47 1 1 1 1 9 THR MG . 9 THR QG2 1 1 47 1 2 1 1 12 ASP H . 12 ASP HN 1 1 48 1 1 1 1 10 ASP H . 10 ASP HN 1 1 48 1 2 1 1 10 ASP HB3 . 10 ASP HB3 1 1 49 1 1 1 1 10 ASP H . 10 ASP HN 1 1 49 1 2 1 1 11 ALA H . 11 ALA HN 1 1 50 1 1 1 1 10 ASP HA . 10 ASP HA 1 1 50 1 2 1 1 10 ASP HB3 . 10 ASP HB3 1 1 51 1 1 1 1 10 ASP HA . 10 ASP HA 1 1 51 1 2 1 1 11 ALA H . 11 ALA HN 1 1 52 1 1 1 1 10 ASP HA . 10 ASP HA 1 1 52 1 2 1 1 13 CYS H . 13 CYSS HN 1 1 53 1 1 1 1 10 ASP HA . 10 ASP HA 1 1 53 1 2 1 1 13 CYS HB3 . 13 CYSS HB3 1 1 54 1 1 1 1 10 ASP HA . 10 ASP HA 1 1 54 1 2 1 1 14 SER H . 14 SER HN 1 1 55 1 1 1 1 10 ASP HA . 10 ASP HA 1 1 55 1 2 1 1 23 CYS H . 23 CYSS HN 1 1 56 1 1 1 1 10 ASP HB3 . 10 ASP HB3 1 1 56 1 2 1 1 11 ALA H . 11 ALA HN 1 1 57 1 1 1 1 11 ALA H . 11 ALA HN 1 1 57 1 2 1 1 11 ALA HA . 11 ALA HA 1 1 58 1 1 1 1 11 ALA H . 11 ALA HN 1 1 58 1 2 1 1 11 ALA MB . 11 ALA QB 1 1 59 1 1 1 1 11 ALA H . 11 ALA HN 1 1 59 1 2 1 1 12 ASP H . 12 ASP HN 1 1 60 1 1 1 1 11 ALA HA . 11 ALA HA 1 1 60 1 2 1 1 14 SER H . 14 SER HN 1 1 61 1 1 1 1 11 ALA HA . 11 ALA HA 1 1 61 1 2 1 1 14 SER HB3 . 14 SER HB3 1 1 62 1 1 1 1 11 ALA MB . 11 ALA QB 1 1 62 1 2 1 1 12 ASP H . 12 ASP HN 1 1 63 1 1 1 1 12 ASP H . 12 ASP HN 1 1 63 1 2 1 1 12 ASP HA . 12 ASP HA 1 1 64 1 1 1 1 12 ASP H . 12 ASP HN 1 1 64 1 2 1 1 12 ASP HB3 . 12 ASP HB3 1 1 65 1 1 1 1 12 ASP H . 12 ASP HN 1 1 65 1 2 1 1 13 CYS H . 13 CYSS HN 1 1 66 1 1 1 1 12 ASP HA . 12 ASP HA 1 1 66 1 2 1 1 13 CYS H . 13 CYSS HN 1 1 67 1 1 1 1 13 CYS H . 13 CYSS HN 1 1 67 1 2 1 1 13 CYS HB3 . 13 CYSS HB3 1 1 68 1 1 1 1 13 CYS H . 13 CYSS HN 1 1 68 1 2 1 1 14 SER H . 14 SER HN 1 1 69 1 1 1 1 14 SER H . 14 SER HN 1 1 69 1 2 1 1 14 SER HB3 . 14 SER HB3 1 1 70 1 1 1 1 14 SER H . 14 SER HN 1 1 70 1 2 1 1 15 ARG H . 15 ARG HN 1 1 71 1 1 1 1 14 SER HA . 14 SER HA 1 1 71 1 2 1 1 14 SER HB3 . 14 SER HB3 1 1 72 1 1 1 1 14 SER HA . 14 SER HA 1 1 72 1 2 1 1 15 ARG H . 15 ARG HN 1 1 73 1 1 1 1 15 ARG H . 15 ARG HN 1 1 73 1 2 1 1 15 ARG HA . 15 ARG HA 1 1 74 1 1 1 1 15 ARG H . 15 ARG HN 1 1 74 1 2 1 1 16 LYS H . 16 LYS HN 1 1 75 1 1 1 1 15 ARG HA . 15 ARG HA 1 1 75 1 2 1 1 15 ARG HB3 . 15 ARG HB3 1 1 76 1 1 1 1 15 ARG HA . 15 ARG HA 1 1 76 1 2 1 1 15 ARG HG3 . 15 ARG HG3 1 1 77 1 1 1 1 16 LYS H . 16 LYS HN 1 1 77 1 2 1 1 16 LYS HA . 16 LYS HA 1 1 78 1 1 1 1 16 LYS H . 16 LYS HN 1 1 78 1 2 1 1 16 LYS HB3 . 16 LYS HB3 1 1 79 1 1 1 1 16 LYS H . 16 LYS HN 1 1 79 1 2 1 1 17 CYS H . 17 CYSS HN 1 1 80 1 1 1 1 16 LYS HA . 16 LYS HA 1 1 80 1 2 1 1 16 LYS HB3 . 16 LYS HB3 1 1 81 1 1 1 1 16 LYS HA . 16 LYS HA 1 1 81 1 2 1 1 16 LYS HG3 . 16 LYS HG3 1 1 82 1 1 1 1 16 LYS HA . 16 LYS HA 1 1 82 1 2 1 1 17 CYS H . 17 CYSS HN 1 1 83 1 1 1 1 16 LYS HB3 . 16 LYS HB3 1 1 83 1 2 1 1 17 CYS H . 17 CYSS HN 1 1 84 1 1 1 1 17 CYS H . 17 CYSS HN 1 1 84 1 2 1 1 17 CYS HB3 . 17 CYSS HB3 1 1 85 1 1 1 1 17 CYS HA . 17 CYSS HA 1 1 85 1 2 1 1 17 CYS HB3 . 17 CYSS HB3 1 1 86 1 1 1 1 17 CYS HA . 17 CYSS HA 1 1 86 1 2 1 1 18 PRO HD3 . 18 PRO HD3 1 1 87 1 1 1 1 18 PRO HA . 18 PRO HA 1 1 87 1 2 1 1 18 PRO HB3 . 18 PRO HB3 1 1 88 1 1 1 1 18 PRO HA . 18 PRO HA 1 1 88 1 2 1 1 19 GLY H . 19 GLY HN 1 1 89 1 1 1 1 18 PRO HB3 . 18 PRO HB3 1 1 89 1 2 1 1 19 GLY H . 19 GLY HN 1 1 90 1 1 1 1 18 PRO HD3 . 18 PRO HD3 1 1 90 1 2 1 1 18 PRO HG3 . 18 PRO HG3 1 1 91 1 1 1 1 19 GLY H . 19 GLY HN 1 1 91 1 2 1 1 19 GLY HA2 . 19 GLY HA1 1 1 92 1 1 1 1 19 GLY H . 19 GLY HN 1 1 92 1 2 1 1 19 GLY HA3 . 19 GLY HA2 1 1 93 1 1 1 1 19 GLY H . 19 GLY HN 1 1 93 1 2 1 1 20 ASN H . 20 ASN HN 1 1 94 1 1 1 1 19 GLY HA2 . 19 GLY HA1 1 1 94 1 2 1 1 20 ASN H . 20 ASN HN 1 1 95 1 1 1 1 19 GLY HA3 . 19 GLY HA2 1 1 95 1 2 1 1 20 ASN H . 20 ASN HN 1 1 96 1 1 1 1 20 ASN H . 20 ASN HN 1 1 96 1 2 1 1 21 PRO HD3 . 21 PRO HD3 1 1 97 1 1 1 1 20 ASN HA . 20 ASN HA 1 1 97 1 2 1 1 21 PRO HD3 . 21 PRO HD3 1 1 98 1 1 1 1 21 PRO HD3 . 21 PRO HD3 1 1 98 1 2 1 1 21 PRO HG3 . 21 PRO HG3 1 1 99 1 1 1 1 22 PRO HA . 22 PRO HA 1 1 99 1 2 1 1 22 PRO HB3 . 22 PRO HB3 1 1 100 1 1 1 1 22 PRO HA . 22 PRO HA 1 1 100 1 2 1 1 23 CYS H . 23 CYSS HN 1 1 101 1 1 1 1 22 PRO HB3 . 22 PRO HB3 1 1 101 1 2 1 1 23 CYS H . 23 CYSS HN 1 1 102 1 1 1 1 23 CYS HA . 23 CYSS HA 1 1 102 1 2 1 1 24 ARG H . 24 ARG HN 1 1 103 1 1 1 1 23 CYS HA . 23 CYSS HA 1 1 103 1 2 1 1 28 CYS HA . 28 CYSS HA 1 1 104 1 1 1 1 24 ARG H . 24 ARG HN 1 1 104 1 2 1 1 24 ARG HB3 . 24 ARG HB3 1 1 105 1 1 1 1 24 ARG H . 24 ARG HN 1 1 105 1 2 1 1 27 PHE H . 27 PHE HN 1 1 106 1 1 1 1 24 ARG HB3 . 24 ARG HB3 1 1 106 1 2 1 1 24 ARG HG3 . 24 ARG HG3 1 1 107 1 1 1 1 25 ASN H . 25 ASN HN 1 1 107 1 2 1 1 25 ASN HA . 25 ASN HA 1 1 108 1 1 1 1 25 ASN H . 25 ASN HN 1 1 108 1 2 1 1 26 GLY H . 26 GLY HN 1 1 109 1 1 1 1 25 ASN HA . 25 ASN HA 1 1 109 1 2 1 1 25 ASN HB3 . 25 ASN HB3 1 1 110 1 1 1 1 25 ASN HA . 25 ASN HA 1 1 110 1 2 1 1 26 GLY H . 26 GLY HN 1 1 111 1 1 1 1 26 GLY H . 26 GLY HN 1 1 111 1 2 1 1 26 GLY HA2 . 26 GLY HA1 1 1 112 1 1 1 1 26 GLY H . 26 GLY HN 1 1 112 1 2 1 1 26 GLY HA3 . 26 GLY HA2 1 1 113 1 1 1 1 26 GLY H . 26 GLY HN 1 1 113 1 2 1 1 27 PHE H . 27 PHE HN 1 1 114 1 1 1 1 26 GLY HA2 . 26 GLY HA1 1 1 114 1 2 1 1 27 PHE H . 27 PHE HN 1 1 115 1 1 1 1 26 GLY HA3 . 26 GLY HA2 1 1 115 1 2 1 1 27 PHE H . 27 PHE HN 1 1 116 1 1 1 1 27 PHE H . 27 PHE HN 1 1 116 1 2 1 1 27 PHE HB3 . 27 PHE HB3 1 1 117 1 1 1 1 27 PHE H . 27 PHE HN 1 1 117 1 2 1 1 27 PHE QD . 27 PHE QD 1 1 118 1 1 1 1 27 PHE HA . 27 PHE HA 1 1 118 1 2 1 1 27 PHE HB3 . 27 PHE HB3 1 1 119 1 1 1 1 27 PHE HA . 27 PHE HA 1 1 119 1 2 1 1 27 PHE QD . 27 PHE QD 1 1 120 1 1 1 1 27 PHE HA . 27 PHE HA 1 1 120 1 2 1 1 28 CYS H . 28 CYSS HN 1 1 121 1 1 1 1 27 PHE HB3 . 27 PHE HB3 1 1 121 1 2 1 1 28 CYS H . 28 CYSS HN 1 1 122 1 1 1 1 27 PHE QD . 27 PHE QD 1 1 122 1 2 1 1 28 CYS H . 28 CYSS HN 1 1 123 1 1 1 1 28 CYS H . 28 CYSS HN 1 1 123 1 2 1 1 28 CYS HB3 . 28 CYSS HB3 1 1 124 1 1 1 1 29 ALA H . 29 ALA HN 1 1 124 1 2 1 1 29 ALA MB . 29 ALA QB 1 1 125 1 1 1 1 29 ALA MB . 29 ALA QB 1 1 125 1 2 1 1 30 CYS H . 30 CYSS HN 1 1 126 1 1 1 1 30 CYS H . 30 CYSS HN 1 1 126 1 2 1 1 30 CYS HB3 . 30 CYSS HB3 1 1 127 1 1 1 1 30 CYS HA . 30 CYSS HA 1 1 127 1 2 1 1 31 THR H . 31 THR HN 1 1 128 1 1 1 1 30 CYS HB3 . 30 CYSS HB3 1 1 128 1 2 1 1 31 THR H . 31 THR HN 1 1 129 1 1 1 1 31 THR H . 31 THR HN 1 1 129 1 2 1 1 31 THR MG . 31 THR QG2 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . . . 2.5 1 1 2 1 . . . . . . . 2.8 1 1 3 1 . . . . . . . 3.2 1 1 4 1 . . . . . . . 5.0 1 1 5 1 . . . . . . . 3.5 1 1 6 1 . . . . . . . 4.0 1 1 7 1 . . . . . . . 4.1 1 1 8 1 . . . . . . . 4.2 1 1 9 1 . . . . . . . 5.7 1 1 10 1 . . . . . . . 7.1 1 1 11 1 . . . . . . . 3.0 1 1 12 1 . . . . . . . 3.0 1 1 13 1 . . . . . . . 5.4 1 1 14 1 . . . . . . . 4.5 1 1 15 1 . . . . . . . 4.5 1 1 16 1 . . . . . . . 3.4 1 1 17 1 . . . . . . . 3.5 1 1 18 1 . . . . . . . 2.5 1 1 19 1 . . . . . . . 3.5 1 1 20 1 . . . . . . . 4.7 1 1 21 1 . . . . . . . 3.1 1 1 22 1 . . . . . . . 2.5 1 1 23 1 . . . . . . . 6.0 1 1 24 1 . . . . . . . 3.7 1 1 25 1 . . . . . . . 3.3 1 1 26 1 . . . . . . . 5.0 1 1 27 1 . . . . . . . 6.0 1 1 28 1 . . . . . . . 5.9 1 1 29 1 . . . . . . . 2.7 1 1 30 1 . . . . . . . 2.7 1 1 31 1 . . . . . . . 2.5 1 1 32 1 . . . . . . . 3.0 1 1 33 1 . . . . . . . 5.0 1 1 34 1 . . . . . . . 5.0 1 1 35 1 . . . . . . . 3.2 1 1 36 1 . . . . . . . 3.1 1 1 37 1 . . . . . . . 3.4 1 1 38 1 . . . . . . . 3.2 1 1 39 1 . . . . . . . 3.6 1 1 40 1 . . . . . . . 3.5 1 1 41 1 . . . . . . . 5.4 1 1 42 1 . . . . . . . 3.8 1 1 43 1 . . . . . . . 3.0 1 1 44 1 . . . . . . . 3.1 1 1 45 1 . . . . . . . 6.0 1 1 46 1 . . . . . . . 6.0 1 1 47 1 . . . . . . . 6.0 1 1 48 1 . . . . . . . 3.5 1 1 49 1 . . . . . . . 3.2 1 1 50 1 . . . . . . . 2.7 1 1 51 1 . . . . . . . 4.4 1 1 52 1 . . . . . . . 4.2 1 1 53 1 . . . . . . . 4.1 1 1 54 1 . . . . . . . 4.9 1 1 55 1 . . . . . . . 3.2 1 1 56 1 . . . . . . . 4.0 1 1 57 1 . . . . . . . 3.0 1 1 58 1 . . . . . . . 3.5 1 1 59 1 . . . . . . . 3.0 1 1 60 1 . . . . . . . 3.1 1 1 61 1 . . . . . . . 4.6 1 1 62 1 . . . . . . . 3.5 1 1 63 1 . . . . . . . 3.1 1 1 64 1 . . . . . . . 2.6 1 1 65 1 . . . . . . . 3.1 1 1 66 1 . . . . . . . 4.7 1 1 67 1 . . . . . . . 2.7 1 1 68 1 . . . . . . . 3.0 1 1 69 1 . . . . . . . 3.3 1 1 70 1 . . . . . . . 3.8 1 1 71 1 . . . . . . . 3.1 1 1 72 1 . . . . . . . 3.2 1 1 73 1 . . . . . . . 3.0 1 1 74 1 . . . . . . . 3.2 1 1 75 1 . . . . . . . 3.0 1 1 76 1 . . . . . . . 3.7 1 1 77 1 . . . . . . . 3.0 1 1 78 1 . . . . . . . 3.4 1 1 79 1 . . . . . . . 2.8 1 1 80 1 . . . . . . . 2.9 1 1 81 1 . . . . . . . 3.6 1 1 82 1 . . . . . . . 3.8 1 1 83 1 . . . . . . . 4.4 1 1 84 1 . . . . . . . 3.9 1 1 85 1 . . . . . . . 3.1 1 1 86 1 . . . . . . . 2.5 1 1 87 1 . . . . . . . 2.8 1 1 88 1 . . . . . . . 2.6 1 1 89 1 . . . . . . . 4.1 1 1 90 1 . . . . . . . 2.7 1 1 91 1 . . . . . . . 2.7 1 1 92 1 . . . . . . . 3.1 1 1 93 1 . . . . . . . 3.2 1 1 94 1 . . . . . . . 3.9 1 1 95 1 . . . . . . . 3.3 1 1 96 1 . . . . . . . 2.7 1 1 97 1 . . . . . . . 3.1 1 1 98 1 . . . . . . . 2.6 1 1 99 1 . . . . . . . 2.7 1 1 100 1 . . . . . . . 2.6 1 1 101 1 . . . . . . . 4.9 1 1 102 1 . . . . . . . 3.5 1 1 103 1 . . . . . . . 5.0 1 1 104 1 . . . . . . . 3.6 1 1 105 1 . . . . . . . 3.2 1 1 106 1 . . . . . . . 3.0 1 1 107 1 . . . . . . . 2.5 1 1 108 1 . . . . . . . 3.2 1 1 109 1 . . . . . . . 2.7 1 1 110 1 . . . . . . . 3.2 1 1 111 1 . . . . . . . 2.6 1 1 112 1 . . . . . . . 3.0 1 1 113 1 . . . . . . . 3.1 1 1 114 1 . . . . . . . 4.1 1 1 115 1 . . . . . . . 4.0 1 1 116 1 . . . . . . . 3.9 1 1 117 1 . . . . . . . 5.4 1 1 118 1 . . . . . . . 2.7 1 1 119 1 . . . . . . . 4.1 1 1 120 1 . . . . . . . 2.6 1 1 121 1 . . . . . . . 3.1 1 1 122 1 . . . . . . . 5.9 1 1 123 1 . . . . . . . 3.2 1 1 124 1 . . . . . . . 3.5 1 1 125 1 . . . . . . . 5.0 1 1 126 1 . . . . . . . 4.0 1 1 127 1 . . . . . . . 4.0 1 1 128 1 . . . . . . . 4.0 1 1 129 1 . . . . . . . 4.3 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 THR C C -4.290 -6.879 7.396 1.00 . A A . 1 THR C 1 1 1 2 1 1 1 THR CA C -5.510 -7.004 8.319 1.00 . A A . 1 THR CA 1 1 1 3 1 1 1 THR CB C -6.768 -6.326 7.731 1.00 . A A . 1 THR CB 1 1 1 4 1 1 1 THR CG2 C -6.798 -4.796 7.854 1.00 . A A . 1 THR CG2 1 1 1 5 1 1 1 THR H1 H -4.599 -5.618 9.624 1.00 . A A . 1 THR H1 1 1 1 6 1 1 1 THR HA H -5.762 -8.050 8.477 1.00 . A A . 1 THR HA 1 1 1 7 1 1 1 THR HB H -7.627 -6.709 8.283 1.00 . A A . 1 THR HB 1 1 1 8 1 1 1 THR HG1 H -6.620 -5.955 5.812 1.00 . A A . 1 THR HG1 1 1 1 9 1 1 1 THR HG21 H -7.725 -4.421 7.418 1.00 . A A . 1 THR HG21 1 1 1 10 1 1 1 THR HG22 H -6.771 -4.498 8.902 1.00 . A A . 1 THR HG22 1 1 1 11 1 1 1 THR HG23 H -5.959 -4.340 7.330 1.00 . A A . 1 THR HG23 1 1 1 12 1 1 1 THR N N -5.192 -6.437 9.617 1.00 . A A . 1 THR N 1 1 1 13 1 1 1 THR O O -3.934 -5.762 7.023 1.00 . A A . 1 THR O 1 1 1 14 1 1 1 THR OG1 O -6.940 -6.678 6.371 1.00 . A A . 1 THR OG1 1 1 1 15 1 1 2 PRO C C -3.108 -7.746 4.578 1.00 . A A . 2 PRO C 1 1 1 16 1 1 2 PRO CA C -2.552 -7.917 6.003 1.00 . A A . 2 PRO CA 1 1 1 17 1 1 2 PRO CB C -1.808 -9.243 6.196 1.00 . A A . 2 PRO CB 1 1 1 18 1 1 2 PRO CD C -3.898 -9.355 7.365 1.00 . A A . 2 PRO CD 1 1 1 19 1 1 2 PRO CG C -2.938 -10.213 6.537 1.00 . A A . 2 PRO CG 1 1 1 20 1 1 2 PRO HA H -1.875 -7.090 6.219 1.00 . A A . 2 PRO HA 1 1 1 21 1 1 2 PRO HB3 H -1.142 -9.158 7.057 1.00 . A A . 2 PRO HB3 1 1 1 22 1 1 2 PRO HD3 H -3.672 -9.469 8.428 1.00 . A A . 2 PRO HD3 1 1 1 23 1 1 2 PRO HG3 H -2.585 -11.088 7.082 1.00 . A A . 2 PRO HG3 1 1 1 24 1 1 2 PRO N N -3.646 -7.979 6.967 1.00 . A A . 2 PRO N 1 1 1 25 1 1 2 PRO O O -2.608 -8.355 3.636 1.00 . A A . 2 PRO O 1 1 1 26 1 1 3 PHE C C -5.440 -5.248 3.350 1.00 . A A . 3 PHE C 1 1 1 27 1 1 3 PHE CA C -4.912 -6.673 3.227 1.00 . A A . 3 PHE CA 1 1 1 28 1 1 3 PHE CB C -6.105 -7.642 3.134 1.00 . A A . 3 PHE CB 1 1 1 29 1 1 3 PHE CD1 C -5.045 -9.824 2.407 1.00 . A A . 3 PHE CD1 1 1 1 30 1 1 3 PHE CD2 C -6.283 -9.768 4.501 1.00 . A A . 3 PHE CD2 1 1 1 31 1 1 3 PHE CE1 C -4.781 -11.192 2.599 1.00 . A A . 3 PHE CE1 1 1 1 32 1 1 3 PHE CE2 C -6.042 -11.142 4.681 1.00 . A A . 3 PHE CE2 1 1 1 33 1 1 3 PHE CG C -5.791 -9.109 3.358 1.00 . A A . 3 PHE CG 1 1 1 34 1 1 3 PHE CZ C -5.288 -11.853 3.731 1.00 . A A . 3 PHE CZ 1 1 1 35 1 1 3 PHE H H -4.394 -6.322 5.220 1.00 . A A . 3 PHE H 1 1 1 36 1 1 3 PHE HA H -4.283 -6.781 2.347 1.00 . A A . 3 PHE HA 1 1 1 37 1 1 3 PHE HB3 H -6.552 -7.534 2.145 1.00 . A A . 3 PHE HB3 1 1 1 38 1 1 3 PHE HD1 H -4.639 -9.314 1.547 1.00 . A A . 3 PHE HD1 1 1 1 39 1 1 3 PHE HD2 H -6.855 -9.225 5.242 1.00 . A A . 3 PHE HD2 1 1 1 40 1 1 3 PHE HE1 H -4.187 -11.733 1.878 1.00 . A A . 3 PHE HE1 1 1 1 41 1 1 3 PHE HE2 H -6.433 -11.650 5.551 1.00 . A A . 3 PHE HE2 1 1 1 42 1 1 3 PHE HZ H -5.094 -12.906 3.873 1.00 . A A . 3 PHE HZ 1 1 1 43 1 1 3 PHE N N -4.139 -6.906 4.432 1.00 . A A . 3 PHE N 1 1 1 44 1 1 3 PHE O O -6.006 -4.915 4.393 1.00 . A A . 3 PHE O 1 1 1 45 1 1 4 ALA C C -5.582 -2.562 0.813 1.00 . A A . 4 ALA C 1 1 1 46 1 1 4 ALA CA C -5.718 -3.045 2.263 1.00 . A A . 4 ALA CA 1 1 1 47 1 1 4 ALA CB C -4.946 -2.169 3.267 1.00 . A A . 4 ALA CB 1 1 1 48 1 1 4 ALA H H -4.827 -4.791 1.476 1.00 . A A . 4 ALA H 1 1 1 49 1 1 4 ALA HA H -6.777 -3.024 2.528 1.00 . A A . 4 ALA HA 1 1 1 50 1 1 4 ALA HB1 H -3.897 -2.087 2.984 1.00 . A A . 4 ALA HB1 1 1 1 51 1 1 4 ALA HB2 H -5.385 -1.171 3.308 1.00 . A A . 4 ALA HB2 1 1 1 52 1 1 4 ALA HB3 H -5.004 -2.590 4.270 1.00 . A A . 4 ALA HB3 1 1 1 53 1 1 4 ALA N N -5.249 -4.422 2.319 1.00 . A A . 4 ALA N 1 1 1 54 1 1 4 ALA O O -5.806 -3.337 -0.115 1.00 . A A . 4 ALA O 1 1 1 55 1 1 5 ILE C C -3.771 -1.465 -1.391 1.00 . A A . 5 ILE C 1 1 1 56 1 1 5 ILE CA C -4.950 -0.739 -0.718 1.00 . A A . 5 ILE CA 1 1 1 57 1 1 5 ILE CB C -4.741 0.780 -0.538 1.00 . A A . 5 ILE CB 1 1 1 58 1 1 5 ILE CD1 C -5.984 2.917 0.141 1.00 . A A . 5 ILE CD1 1 1 1 59 1 1 5 ILE CG1 C -6.103 1.451 -0.288 1.00 . A A . 5 ILE CG1 1 1 1 60 1 1 5 ILE CG2 C -4.025 1.407 -1.736 1.00 . A A . 5 ILE CG2 1 1 1 61 1 1 5 ILE H H -4.964 -0.725 1.397 1.00 . A A . 5 ILE H 1 1 1 62 1 1 5 ILE HA H -5.843 -0.893 -1.326 1.00 . A A . 5 ILE HA 1 1 1 63 1 1 5 ILE HB H -4.112 0.944 0.337 1.00 . A A . 5 ILE HB 1 1 1 64 1 1 5 ILE HD11 H -5.309 3.002 0.992 1.00 . A A . 5 ILE HD11 1 1 1 65 1 1 5 ILE HD12 H -5.622 3.539 -0.676 1.00 . A A . 5 ILE HD12 1 1 1 66 1 1 5 ILE HD13 H -6.970 3.281 0.435 1.00 . A A . 5 ILE HD13 1 1 1 67 1 1 5 ILE HG13 H -6.619 0.921 0.513 1.00 . A A . 5 ILE HG13 1 1 1 68 1 1 5 ILE HG21 H -3.019 0.999 -1.784 1.00 . A A . 5 ILE HG21 1 1 1 69 1 1 5 ILE HG22 H -4.565 1.190 -2.658 1.00 . A A . 5 ILE HG22 1 1 1 70 1 1 5 ILE HG23 H -3.931 2.484 -1.610 1.00 . A A . 5 ILE HG23 1 1 1 71 1 1 5 ILE N N -5.180 -1.309 0.601 1.00 . A A . 5 ILE N 1 1 1 72 1 1 5 ILE O O -2.675 -1.504 -0.840 1.00 . A A . 5 ILE O 1 1 1 73 1 1 6 LYS C C -1.755 -2.102 -3.622 1.00 . A A . 6 LYS C 1 1 1 74 1 1 6 LYS CA C -3.012 -2.907 -3.260 1.00 . A A . 6 LYS CA 1 1 1 75 1 1 6 LYS CB C -3.658 -3.543 -4.507 1.00 . A A . 6 LYS CB 1 1 1 76 1 1 6 LYS CD C -1.748 -5.255 -4.942 1.00 . A A . 6 LYS CD 1 1 1 77 1 1 6 LYS CE C -1.201 -6.076 -3.762 1.00 . A A . 6 LYS CE 1 1 1 78 1 1 6 LYS CG C -3.259 -5.004 -4.778 1.00 . A A . 6 LYS CG 1 1 1 79 1 1 6 LYS H H -4.918 -2.004 -2.963 1.00 . A A . 6 LYS H 1 1 1 80 1 1 6 LYS HA H -2.739 -3.706 -2.578 1.00 . A A . 6 LYS HA 1 1 1 81 1 1 6 LYS HB3 H -3.438 -2.940 -5.390 1.00 . A A . 6 LYS HB3 1 1 1 82 1 1 6 LYS HD3 H -1.217 -4.310 -5.055 1.00 . A A . 6 LYS HD3 1 1 1 83 1 1 6 LYS HE3 H -1.591 -7.095 -3.828 1.00 . A A . 6 LYS HE3 1 1 1 84 1 1 6 LYS HG3 H -3.755 -5.300 -5.706 1.00 . A A . 6 LYS HG3 1 1 1 85 1 1 6 LYS HZ1 H 0.661 -5.198 -3.549 1.00 . A A . 6 LYS HZ1 1 1 1 86 1 1 6 LYS HZ2 H 0.571 -6.708 -2.968 1.00 . A A . 6 LYS HZ2 1 1 1 87 1 1 6 LYS HZ3 H 0.663 -6.473 -4.602 1.00 . A A . 6 LYS HZ3 1 1 1 88 1 1 6 LYS N N -3.992 -2.066 -2.568 1.00 . A A . 6 LYS N 1 1 1 89 1 1 6 LYS NZ N 0.276 -6.126 -3.739 1.00 . A A . 6 LYS NZ 1 1 1 90 1 1 6 LYS O O -1.835 -1.144 -4.397 1.00 . A A . 6 LYS O 1 1 1 91 1 1 7 CYS C C 1.742 -2.622 -3.904 1.00 . A A . 7 CYS C 1 1 1 92 1 1 7 CYS CA C 0.662 -1.764 -3.241 1.00 . A A . 7 CYS CA 1 1 1 93 1 1 7 CYS CB C 1.118 -1.305 -1.856 1.00 . A A . 7 CYS CB 1 1 1 94 1 1 7 CYS H H -0.562 -3.300 -2.472 1.00 . A A . 7 CYS H 1 1 1 95 1 1 7 CYS HA H 0.526 -0.871 -3.853 1.00 . A A . 7 CYS HA 1 1 1 96 1 1 7 CYS HB3 H 1.108 -2.137 -1.157 1.00 . A A . 7 CYS HB3 1 1 1 97 1 1 7 CYS N N -0.593 -2.492 -3.086 1.00 . A A . 7 CYS N 1 1 1 98 1 1 7 CYS O O 1.695 -3.851 -3.816 1.00 . A A . 7 CYS O 1 1 1 99 1 1 7 CYS SG S 2.778 -0.618 -1.815 1.00 . A A . 7 CYS SG 1 1 1 100 1 1 8 ALA C C 5.031 -2.123 -3.843 1.00 . A A . 8 ALA C 1 1 1 101 1 1 8 ALA CA C 4.003 -2.545 -4.901 1.00 . A A . 8 ALA CA 1 1 1 102 1 1 8 ALA CB C 4.414 -2.108 -6.310 1.00 . A A . 8 ALA CB 1 1 1 103 1 1 8 ALA H H 2.624 -0.970 -4.671 1.00 . A A . 8 ALA H 1 1 1 104 1 1 8 ALA HA H 3.943 -3.634 -4.900 1.00 . A A . 8 ALA HA 1 1 1 105 1 1 8 ALA HB1 H 3.678 -2.459 -7.032 1.00 . A A . 8 ALA HB1 1 1 1 106 1 1 8 ALA HB2 H 4.484 -1.023 -6.378 1.00 . A A . 8 ALA HB2 1 1 1 107 1 1 8 ALA HB3 H 5.385 -2.541 -6.556 1.00 . A A . 8 ALA HB3 1 1 1 108 1 1 8 ALA N N 2.708 -1.969 -4.563 1.00 . A A . 8 ALA N 1 1 1 109 1 1 8 ALA O O 5.525 -2.965 -3.099 1.00 . A A . 8 ALA O 1 1 1 110 1 1 9 THR C C 5.803 1.012 -2.186 1.00 . A A . 9 THR C 1 1 1 111 1 1 9 THR CA C 6.346 -0.247 -2.876 1.00 . A A . 9 THR CA 1 1 1 112 1 1 9 THR CB C 7.576 0.116 -3.722 1.00 . A A . 9 THR CB 1 1 1 113 1 1 9 THR CG2 C 8.283 -1.137 -4.248 1.00 . A A . 9 THR CG2 1 1 1 114 1 1 9 THR H H 4.908 -0.165 -4.397 1.00 . A A . 9 THR H 1 1 1 115 1 1 9 THR HA H 6.633 -0.958 -2.100 1.00 . A A . 9 THR HA 1 1 1 116 1 1 9 THR HB H 8.289 0.680 -3.116 1.00 . A A . 9 THR HB 1 1 1 117 1 1 9 THR HG1 H 7.950 1.224 -5.276 1.00 . A A . 9 THR HG1 1 1 1 118 1 1 9 THR HG21 H 9.196 -0.849 -4.771 1.00 . A A . 9 THR HG21 1 1 1 119 1 1 9 THR HG22 H 8.548 -1.788 -3.414 1.00 . A A . 9 THR HG22 1 1 1 120 1 1 9 THR HG23 H 7.641 -1.683 -4.939 1.00 . A A . 9 THR HG23 1 1 1 121 1 1 9 THR N N 5.337 -0.822 -3.764 1.00 . A A . 9 THR N 1 1 1 122 1 1 9 THR O O 4.767 1.540 -2.579 1.00 . A A . 9 THR O 1 1 1 123 1 1 9 THR OG1 O 7.164 0.907 -4.822 1.00 . A A . 9 THR OG1 1 1 1 124 1 1 10 ASP C C 6.013 3.911 -1.692 1.00 . A A . 10 ASP C 1 1 1 125 1 1 10 ASP CA C 6.453 2.873 -0.643 1.00 . A A . 10 ASP CA 1 1 1 126 1 1 10 ASP CB C 7.838 3.226 -0.073 1.00 . A A . 10 ASP CB 1 1 1 127 1 1 10 ASP CG C 8.938 2.735 -1.004 1.00 . A A . 10 ASP CG 1 1 1 128 1 1 10 ASP H H 7.410 1.037 -0.970 1.00 . A A . 10 ASP H 1 1 1 129 1 1 10 ASP HA H 5.731 2.884 0.172 1.00 . A A . 10 ASP HA 1 1 1 130 1 1 10 ASP HB3 H 7.965 2.733 0.890 1.00 . A A . 10 ASP HB3 1 1 1 131 1 1 10 ASP N N 6.535 1.514 -1.190 1.00 . A A . 10 ASP N 1 1 1 132 1 1 10 ASP O O 4.976 4.555 -1.540 1.00 . A A . 10 ASP O 1 1 1 133 1 1 10 ASP OD1 O 9.253 1.531 -0.879 1.00 . A A . 10 ASP OD1 1 1 1 134 1 1 10 ASP OD2 O 9.281 3.489 -1.940 1.00 . A A . 10 ASP OD2 1 1 1 135 1 1 11 ALA C C 5.014 4.705 -4.374 1.00 . A A . 11 ALA C 1 1 1 136 1 1 11 ALA CA C 6.449 4.937 -3.887 1.00 . A A . 11 ALA CA 1 1 1 137 1 1 11 ALA CB C 7.454 4.711 -5.021 1.00 . A A . 11 ALA CB 1 1 1 138 1 1 11 ALA H H 7.727 3.673 -2.728 1.00 . A A . 11 ALA H 1 1 1 139 1 1 11 ALA HA H 6.541 5.972 -3.554 1.00 . A A . 11 ALA HA 1 1 1 140 1 1 11 ALA HB1 H 7.396 3.681 -5.375 1.00 . A A . 11 ALA HB1 1 1 1 141 1 1 11 ALA HB2 H 7.230 5.387 -5.847 1.00 . A A . 11 ALA HB2 1 1 1 142 1 1 11 ALA HB3 H 8.465 4.910 -4.663 1.00 . A A . 11 ALA HB3 1 1 1 143 1 1 11 ALA N N 6.787 4.070 -2.766 1.00 . A A . 11 ALA N 1 1 1 144 1 1 11 ALA O O 4.270 5.659 -4.598 1.00 . A A . 11 ALA O 1 1 1 145 1 1 12 ASP C C 2.258 3.541 -3.885 1.00 . A A . 12 ASP C 1 1 1 146 1 1 12 ASP CA C 3.261 3.101 -4.951 1.00 . A A . 12 ASP CA 1 1 1 147 1 1 12 ASP CB C 3.136 1.609 -5.282 1.00 . A A . 12 ASP CB 1 1 1 148 1 1 12 ASP CG C 2.070 1.359 -6.337 1.00 . A A . 12 ASP CG 1 1 1 149 1 1 12 ASP H H 5.212 2.690 -4.205 1.00 . A A . 12 ASP H 1 1 1 150 1 1 12 ASP HA H 3.069 3.661 -5.868 1.00 . A A . 12 ASP HA 1 1 1 151 1 1 12 ASP HB3 H 2.906 1.048 -4.380 1.00 . A A . 12 ASP HB3 1 1 1 152 1 1 12 ASP N N 4.613 3.439 -4.531 1.00 . A A . 12 ASP N 1 1 1 153 1 1 12 ASP O O 1.275 4.192 -4.208 1.00 . A A . 12 ASP O 1 1 1 154 1 1 12 ASP OD1 O 1.010 2.025 -6.322 1.00 . A A . 12 ASP OD1 1 1 1 155 1 1 12 ASP OD2 O 2.342 0.555 -7.248 1.00 . A A . 12 ASP OD2 1 1 1 156 1 1 13 CYS C C 1.467 5.287 -1.745 1.00 . A A . 13 CYS C 1 1 1 157 1 1 13 CYS CA C 1.738 3.795 -1.486 1.00 . A A . 13 CYS CA 1 1 1 158 1 1 13 CYS CB C 2.512 3.622 -0.164 1.00 . A A . 13 CYS CB 1 1 1 159 1 1 13 CYS H H 3.361 2.720 -2.416 1.00 . A A . 13 CYS H 1 1 1 160 1 1 13 CYS HA H 0.795 3.252 -1.443 1.00 . A A . 13 CYS HA 1 1 1 161 1 1 13 CYS HB3 H 2.939 4.582 0.119 1.00 . A A . 13 CYS HB3 1 1 1 162 1 1 13 CYS N N 2.514 3.246 -2.606 1.00 . A A . 13 CYS N 1 1 1 163 1 1 13 CYS O O 0.316 5.717 -1.845 1.00 . A A . 13 CYS O 1 1 1 164 1 1 13 CYS SG S 1.699 3.018 1.345 1.00 . A A . 13 CYS SG 1 1 1 165 1 1 14 SER C C 1.626 7.756 -3.469 1.00 . A A . 14 SER C 1 1 1 166 1 1 14 SER CA C 2.539 7.461 -2.271 1.00 . A A . 14 SER CA 1 1 1 167 1 1 14 SER CB C 3.969 7.979 -2.501 1.00 . A A . 14 SER CB 1 1 1 168 1 1 14 SER H H 3.453 5.565 -1.880 1.00 . A A . 14 SER H 1 1 1 169 1 1 14 SER HA H 2.150 7.978 -1.402 1.00 . A A . 14 SER HA 1 1 1 170 1 1 14 SER HB3 H 4.162 8.108 -3.567 1.00 . A A . 14 SER HB3 1 1 1 171 1 1 14 SER HG H 5.120 9.399 -1.866 1.00 . A A . 14 SER HG 1 1 1 172 1 1 14 SER N N 2.556 6.039 -1.946 1.00 . A A . 14 SER N 1 1 1 173 1 1 14 SER O O 0.807 8.671 -3.416 1.00 . A A . 14 SER O 1 1 1 174 1 1 14 SER OG O 4.172 9.211 -1.828 1.00 . A A . 14 SER OG 1 1 1 175 1 1 15 ARG C C -0.537 7.174 -5.449 1.00 . A A . 15 ARG C 1 1 1 176 1 1 15 ARG CA C 0.964 7.088 -5.763 1.00 . A A . 15 ARG CA 1 1 1 177 1 1 15 ARG CB C 1.259 5.903 -6.698 1.00 . A A . 15 ARG CB 1 1 1 178 1 1 15 ARG CD C 0.246 4.743 -8.697 1.00 . A A . 15 ARG CD 1 1 1 179 1 1 15 ARG CG C 0.758 6.082 -8.136 1.00 . A A . 15 ARG CG 1 1 1 180 1 1 15 ARG CZ C 2.184 3.319 -9.407 1.00 . A A . 15 ARG CZ 1 1 1 181 1 1 15 ARG H H 2.475 6.247 -4.509 1.00 . A A . 15 ARG H 1 1 1 182 1 1 15 ARG HA H 1.267 8.008 -6.265 1.00 . A A . 15 ARG HA 1 1 1 183 1 1 15 ARG HB3 H 0.760 5.027 -6.298 1.00 . A A . 15 ARG HB3 1 1 1 184 1 1 15 ARG HD3 H -0.052 4.864 -9.741 1.00 . A A . 15 ARG HD3 1 1 1 185 1 1 15 ARG HE H 1.069 3.021 -7.725 1.00 . A A . 15 ARG HE 1 1 1 186 1 1 15 ARG HG3 H 1.565 6.485 -8.748 1.00 . A A . 15 ARG HG3 1 1 1 187 1 1 15 ARG HH11 H 1.985 5.052 -10.436 1.00 . A A . 15 ARG HH11 1 1 1 188 1 1 15 ARG HH12 H 3.199 3.979 -11.072 1.00 . A A . 15 ARG HH12 1 1 1 189 1 1 15 ARG HH21 H 2.618 1.488 -8.577 1.00 . A A . 15 ARG HH21 1 1 1 190 1 1 15 ARG HH22 H 3.608 1.928 -9.932 1.00 . A A . 15 ARG HH22 1 1 1 191 1 1 15 ARG N N 1.764 6.974 -4.544 1.00 . A A . 15 ARG N 1 1 1 192 1 1 15 ARG NE N 1.207 3.630 -8.539 1.00 . A A . 15 ARG NE 1 1 1 193 1 1 15 ARG NH1 N 2.478 4.173 -10.394 1.00 . A A . 15 ARG NH1 1 1 1 194 1 1 15 ARG NH2 N 2.858 2.169 -9.306 1.00 . A A . 15 ARG NH2 1 1 1 195 1 1 15 ARG O O -1.237 7.965 -6.074 1.00 . A A . 15 ARG O 1 1 1 196 1 1 16 LYS C C -2.671 7.584 -3.159 1.00 . A A . 16 LYS C 1 1 1 197 1 1 16 LYS CA C -2.454 6.429 -4.139 1.00 . A A . 16 LYS CA 1 1 1 198 1 1 16 LYS CB C -2.984 5.128 -3.510 1.00 . A A . 16 LYS CB 1 1 1 199 1 1 16 LYS CD C -1.415 3.327 -4.311 1.00 . A A . 16 LYS CD 1 1 1 200 1 1 16 LYS CE C -1.291 1.802 -4.278 1.00 . A A . 16 LYS CE 1 1 1 201 1 1 16 LYS CG C -2.846 3.866 -4.376 1.00 . A A . 16 LYS CG 1 1 1 202 1 1 16 LYS H H -0.408 5.761 -3.992 1.00 . A A . 16 LYS H 1 1 1 203 1 1 16 LYS HA H -3.059 6.621 -5.027 1.00 . A A . 16 LYS HA 1 1 1 204 1 1 16 LYS HB3 H -4.050 5.281 -3.334 1.00 . A A . 16 LYS HB3 1 1 1 205 1 1 16 LYS HD3 H -0.962 3.676 -3.382 1.00 . A A . 16 LYS HD3 1 1 1 206 1 1 16 LYS HE3 H -2.063 1.376 -3.646 1.00 . A A . 16 LYS HE3 1 1 1 207 1 1 16 LYS HG3 H -3.136 4.086 -5.404 1.00 . A A . 16 LYS HG3 1 1 1 208 1 1 16 LYS HZ1 H -2.179 1.500 -6.120 1.00 . A A . 16 LYS HZ1 1 1 1 209 1 1 16 LYS HZ2 H -0.515 1.422 -6.114 1.00 . A A . 16 LYS HZ2 1 1 1 210 1 1 16 LYS HZ3 H -1.422 0.176 -5.469 1.00 . A A . 16 LYS HZ3 1 1 1 211 1 1 16 LYS N N -1.045 6.350 -4.521 1.00 . A A . 16 LYS N 1 1 1 212 1 1 16 LYS NZ N -1.371 1.184 -5.610 1.00 . A A . 16 LYS NZ 1 1 1 213 1 1 16 LYS O O -3.593 8.380 -3.326 1.00 . A A . 16 LYS O 1 1 1 214 1 1 17 CYS C C -0.674 9.064 -0.575 1.00 . A A . 17 CYS C 1 1 1 215 1 1 17 CYS CA C -2.043 8.479 -0.936 1.00 . A A . 17 CYS CA 1 1 1 216 1 1 17 CYS CB C -2.654 7.659 0.207 1.00 . A A . 17 CYS CB 1 1 1 217 1 1 17 CYS H H -1.090 6.959 -2.058 1.00 . A A . 17 CYS H 1 1 1 218 1 1 17 CYS HA H -2.757 9.268 -1.165 1.00 . A A . 17 CYS HA 1 1 1 219 1 1 17 CYS HB3 H -3.670 7.389 -0.080 1.00 . A A . 17 CYS HB3 1 1 1 220 1 1 17 CYS N N -1.861 7.622 -2.101 1.00 . A A . 17 CYS N 1 1 1 221 1 1 17 CYS O O 0.191 8.330 -0.102 1.00 . A A . 17 CYS O 1 1 1 222 1 1 17 CYS SG S -1.788 6.115 0.568 1.00 . A A . 17 CYS SG 1 1 1 223 1 1 18 PRO C C 1.579 11.004 0.465 1.00 . A A . 18 PRO C 1 1 1 224 1 1 18 PRO CA C 0.909 10.918 -0.907 1.00 . A A . 18 PRO CA 1 1 1 225 1 1 18 PRO CB C 0.751 12.297 -1.558 1.00 . A A . 18 PRO CB 1 1 1 226 1 1 18 PRO CD C -1.413 11.351 -1.256 1.00 . A A . 18 PRO CD 1 1 1 227 1 1 18 PRO CG C -0.680 12.691 -1.197 1.00 . A A . 18 PRO CG 1 1 1 228 1 1 18 PRO HA H 1.537 10.301 -1.550 1.00 . A A . 18 PRO HA 1 1 1 229 1 1 18 PRO HB3 H 0.826 12.190 -2.641 1.00 . A A . 18 PRO HB3 1 1 1 230 1 1 18 PRO HD3 H -1.734 11.148 -2.279 1.00 . A A . 18 PRO HD3 1 1 1 231 1 1 18 PRO HG3 H -1.100 13.425 -1.886 1.00 . A A . 18 PRO HG3 1 1 1 232 1 1 18 PRO N N -0.432 10.357 -0.850 1.00 . A A . 18 PRO N 1 1 1 233 1 1 18 PRO O O 0.941 10.848 1.504 1.00 . A A . 18 PRO O 1 1 1 234 1 1 19 GLY C C 4.523 10.169 1.933 1.00 . A A . 19 GLY C 1 1 1 235 1 1 19 GLY CA C 3.715 11.431 1.635 1.00 . A A . 19 GLY CA 1 1 1 236 1 1 19 GLY H H 3.335 11.375 -0.454 1.00 . A A . 19 GLY H 1 1 1 237 1 1 19 GLY HA2 H 4.412 12.251 1.463 1.00 . A A . 19 GLY HA2 1 1 1 238 1 1 19 GLY HA3 H 3.106 11.680 2.506 1.00 . A A . 19 GLY HA3 1 1 1 239 1 1 19 GLY N N 2.886 11.281 0.446 1.00 . A A . 19 GLY N 1 1 1 240 1 1 19 GLY O O 5.045 10.021 3.034 1.00 . A A . 19 GLY O 1 1 1 241 1 1 20 ASN C C 5.097 7.207 2.304 1.00 . A A . 20 ASN C 1 1 1 242 1 1 20 ASN CA C 5.426 8.036 1.052 1.00 . A A . 20 ASN CA 1 1 1 243 1 1 20 ASN CB C 6.931 8.353 0.971 1.00 . A A . 20 ASN CB 1 1 1 244 1 1 20 ASN CG C 7.294 9.209 -0.239 1.00 . A A . 20 ASN CG 1 1 1 245 1 1 20 ASN H H 4.181 9.429 0.066 1.00 . A A . 20 ASN H 1 1 1 246 1 1 20 ASN HA H 5.175 7.413 0.194 1.00 . A A . 20 ASN HA 1 1 1 247 1 1 20 ASN HB3 H 7.490 7.418 0.902 1.00 . A A . 20 ASN HB3 1 1 1 248 1 1 20 ASN HD21 H 8.463 10.441 0.882 1.00 . A A . 20 ASN HD21 1 1 1 249 1 1 20 ASN HD22 H 8.351 10.825 -0.827 1.00 . A A . 20 ASN HD22 1 1 1 250 1 1 20 ASN N N 4.647 9.266 0.953 1.00 . A A . 20 ASN N 1 1 1 251 1 1 20 ASN ND2 N 8.102 10.246 -0.040 1.00 . A A . 20 ASN ND2 1 1 1 252 1 1 20 ASN O O 6.014 6.810 3.022 1.00 . A A . 20 ASN O 1 1 1 253 1 1 20 ASN OD1 O 6.830 8.967 -1.351 1.00 . A A . 20 ASN OD1 1 1 1 254 1 1 21 PRO C C 4.071 4.579 3.336 1.00 . A A . 21 PRO C 1 1 1 255 1 1 21 PRO CA C 3.472 5.965 3.637 1.00 . A A . 21 PRO CA 1 1 1 256 1 1 21 PRO CB C 1.941 5.956 3.712 1.00 . A A . 21 PRO CB 1 1 1 257 1 1 21 PRO CD C 2.628 7.389 1.894 1.00 . A A . 21 PRO CD 1 1 1 258 1 1 21 PRO CG C 1.470 6.518 2.368 1.00 . A A . 21 PRO CG 1 1 1 259 1 1 21 PRO HA H 3.877 6.347 4.575 1.00 . A A . 21 PRO HA 1 1 1 260 1 1 21 PRO HB3 H 1.626 6.639 4.502 1.00 . A A . 21 PRO HB3 1 1 1 261 1 1 21 PRO HD3 H 2.422 8.417 2.195 1.00 . A A . 21 PRO HD3 1 1 1 262 1 1 21 PRO HG3 H 0.548 7.093 2.462 1.00 . A A . 21 PRO HG3 1 1 1 263 1 1 21 PRO N N 3.815 6.904 2.580 1.00 . A A . 21 PRO N 1 1 1 264 1 1 21 PRO O O 4.386 4.276 2.186 1.00 . A A . 21 PRO O 1 1 1 265 1 1 22 PRO C C 3.834 1.402 3.662 1.00 . A A . 22 PRO C 1 1 1 266 1 1 22 PRO CA C 4.863 2.414 4.178 1.00 . A A . 22 PRO CA 1 1 1 267 1 1 22 PRO CB C 5.368 2.026 5.569 1.00 . A A . 22 PRO CB 1 1 1 268 1 1 22 PRO CD C 4.043 4.008 5.763 1.00 . A A . 22 PRO CD 1 1 1 269 1 1 22 PRO CG C 4.361 2.706 6.498 1.00 . A A . 22 PRO CG 1 1 1 270 1 1 22 PRO HA H 5.705 2.466 3.485 1.00 . A A . 22 PRO HA 1 1 1 271 1 1 22 PRO HB3 H 6.354 2.466 5.728 1.00 . A A . 22 PRO HB3 1 1 1 272 1 1 22 PRO HD3 H 4.741 4.782 6.091 1.00 . A A . 22 PRO HD3 1 1 1 273 1 1 22 PRO HG3 H 4.768 2.880 7.495 1.00 . A A . 22 PRO HG3 1 1 1 274 1 1 22 PRO N N 4.266 3.728 4.354 1.00 . A A . 22 PRO N 1 1 1 275 1 1 22 PRO O O 2.633 1.543 3.901 1.00 . A A . 22 PRO O 1 1 1 276 1 1 23 CYS C C 3.948 -2.014 3.460 1.00 . A A . 23 CYS C 1 1 1 277 1 1 23 CYS CA C 3.510 -0.814 2.631 1.00 . A A . 23 CYS CA 1 1 1 278 1 1 23 CYS CB C 3.607 -1.128 1.132 1.00 . A A . 23 CYS CB 1 1 1 279 1 1 23 CYS H H 5.313 0.282 2.846 1.00 . A A . 23 CYS H 1 1 1 280 1 1 23 CYS HA H 2.468 -0.613 2.861 1.00 . A A . 23 CYS HA 1 1 1 281 1 1 23 CYS HB3 H 3.011 -2.017 0.929 1.00 . A A . 23 CYS HB3 1 1 1 282 1 1 23 CYS N N 4.318 0.345 2.998 1.00 . A A . 23 CYS N 1 1 1 283 1 1 23 CYS O O 5.107 -2.100 3.878 1.00 . A A . 23 CYS O 1 1 1 284 1 1 23 CYS SG S 2.967 0.187 0.079 1.00 . A A . 23 CYS SG 1 1 1 285 1 1 24 ARG C C 2.453 -5.278 3.724 1.00 . A A . 24 ARG C 1 1 1 286 1 1 24 ARG CA C 3.289 -4.198 4.407 1.00 . A A . 24 ARG CA 1 1 1 287 1 1 24 ARG CB C 2.940 -4.045 5.899 1.00 . A A . 24 ARG CB 1 1 1 288 1 1 24 ARG CD C 5.110 -4.119 7.271 1.00 . A A . 24 ARG CD 1 1 1 289 1 1 24 ARG CG C 3.859 -4.883 6.802 1.00 . A A . 24 ARG CG 1 1 1 290 1 1 24 ARG CZ C 7.113 -3.239 5.996 1.00 . A A . 24 ARG CZ 1 1 1 291 1 1 24 ARG H H 2.089 -2.821 3.344 1.00 . A A . 24 ARG H 1 1 1 292 1 1 24 ARG HA H 4.339 -4.463 4.283 1.00 . A A . 24 ARG HA 1 1 1 293 1 1 24 ARG HB3 H 1.906 -4.366 6.047 1.00 . A A . 24 ARG HB3 1 1 1 294 1 1 24 ARG HD3 H 5.759 -4.842 7.768 1.00 . A A . 24 ARG HD3 1 1 1 295 1 1 24 ARG HE H 5.203 -2.994 5.458 1.00 . A A . 24 ARG HE 1 1 1 296 1 1 24 ARG HG3 H 4.147 -5.802 6.290 1.00 . A A . 24 ARG HG3 1 1 1 297 1 1 24 ARG HH11 H 7.671 -4.128 7.741 1.00 . A A . 24 ARG HH11 1 1 1 298 1 1 24 ARG HH12 H 8.989 -3.552 6.770 1.00 . A A . 24 ARG HH12 1 1 1 299 1 1 24 ARG HH21 H 6.801 -2.271 4.252 1.00 . A A . 24 ARG HH21 1 1 1 300 1 1 24 ARG HH22 H 8.495 -2.419 4.693 1.00 . A A . 24 ARG HH22 1 1 1 301 1 1 24 ARG N N 3.031 -2.949 3.709 1.00 . A A . 24 ARG N 1 1 1 302 1 1 24 ARG NE N 5.795 -3.426 6.165 1.00 . A A . 24 ARG NE 1 1 1 303 1 1 24 ARG NH1 N 7.997 -3.679 6.898 1.00 . A A . 24 ARG NH1 1 1 1 304 1 1 24 ARG NH2 N 7.524 -2.598 4.899 1.00 . A A . 24 ARG NH2 1 1 1 305 1 1 24 ARG O O 1.335 -5.005 3.298 1.00 . A A . 24 ARG O 1 1 1 306 1 1 25 ASN C C 1.980 -7.087 1.375 1.00 . A A . 25 ASN C 1 1 1 307 1 1 25 ASN CA C 2.393 -7.562 2.782 1.00 . A A . 25 ASN CA 1 1 1 308 1 1 25 ASN CB C 1.228 -8.151 3.599 1.00 . A A . 25 ASN CB 1 1 1 309 1 1 25 ASN CG C 0.901 -9.603 3.241 1.00 . A A . 25 ASN CG 1 1 1 310 1 1 25 ASN H H 3.942 -6.641 3.913 1.00 . A A . 25 ASN H 1 1 1 311 1 1 25 ASN HA H 3.148 -8.341 2.661 1.00 . A A . 25 ASN HA 1 1 1 312 1 1 25 ASN HB3 H 0.336 -7.536 3.494 1.00 . A A . 25 ASN HB3 1 1 1 313 1 1 25 ASN HD21 H 0.262 -9.103 1.384 1.00 . A A . 25 ASN HD21 1 1 1 314 1 1 25 ASN HD22 H 0.147 -10.812 1.812 1.00 . A A . 25 ASN HD22 1 1 1 315 1 1 25 ASN N N 3.020 -6.476 3.539 1.00 . A A . 25 ASN N 1 1 1 316 1 1 25 ASN ND2 N 0.390 -9.863 2.045 1.00 . A A . 25 ASN ND2 1 1 1 317 1 1 25 ASN O O 1.008 -7.563 0.795 1.00 . A A . 25 ASN O 1 1 1 318 1 1 25 ASN OD1 O 1.114 -10.498 4.051 1.00 . A A . 25 ASN OD1 1 1 1 319 1 1 26 GLY C C 1.033 -4.797 -0.455 1.00 . A A . 26 GLY C 1 1 1 320 1 1 26 GLY CA C 2.390 -5.509 -0.462 1.00 . A A . 26 GLY CA 1 1 1 321 1 1 26 GLY H H 3.527 -5.783 1.312 1.00 . A A . 26 GLY H 1 1 1 322 1 1 26 GLY HA2 H 3.160 -4.772 -0.701 1.00 . A A . 26 GLY HA2 1 1 1 323 1 1 26 GLY HA3 H 2.394 -6.273 -1.240 1.00 . A A . 26 GLY HA3 1 1 1 324 1 1 26 GLY N N 2.719 -6.124 0.815 1.00 . A A . 26 GLY N 1 1 1 325 1 1 26 GLY O O 0.393 -4.691 -1.503 1.00 . A A . 26 GLY O 1 1 1 326 1 1 27 PHE C C -0.170 -2.133 1.525 1.00 . A A . 27 PHE C 1 1 1 327 1 1 27 PHE CA C -0.573 -3.423 0.817 1.00 . A A . 27 PHE CA 1 1 1 328 1 1 27 PHE CB C -1.672 -4.161 1.582 1.00 . A A . 27 PHE CB 1 1 1 329 1 1 27 PHE CD1 C -3.181 -5.105 -0.213 1.00 . A A . 27 PHE CD1 1 1 1 330 1 1 27 PHE CD2 C -1.873 -6.649 1.126 1.00 . A A . 27 PHE CD2 1 1 1 331 1 1 27 PHE CE1 C -3.784 -6.186 -0.877 1.00 . A A . 27 PHE CE1 1 1 1 332 1 1 27 PHE CE2 C -2.436 -7.731 0.430 1.00 . A A . 27 PHE CE2 1 1 1 333 1 1 27 PHE CG C -2.252 -5.333 0.815 1.00 . A A . 27 PHE CG 1 1 1 334 1 1 27 PHE CZ C -3.402 -7.501 -0.564 1.00 . A A . 27 PHE CZ 1 1 1 335 1 1 27 PHE H H 1.127 -4.422 1.549 1.00 . A A . 27 PHE H 1 1 1 336 1 1 27 PHE HA H -0.957 -3.168 -0.169 1.00 . A A . 27 PHE HA 1 1 1 337 1 1 27 PHE HB3 H -2.477 -3.455 1.784 1.00 . A A . 27 PHE HB3 1 1 1 338 1 1 27 PHE HD1 H -3.472 -4.098 -0.455 1.00 . A A . 27 PHE HD1 1 1 1 339 1 1 27 PHE HD2 H -1.193 -6.838 1.941 1.00 . A A . 27 PHE HD2 1 1 1 340 1 1 27 PHE HE1 H -4.571 -6.004 -1.597 1.00 . A A . 27 PHE HE1 1 1 1 341 1 1 27 PHE HE2 H -2.180 -8.739 0.723 1.00 . A A . 27 PHE HE2 1 1 1 342 1 1 27 PHE HZ H -3.881 -8.337 -1.056 1.00 . A A . 27 PHE HZ 1 1 1 343 1 1 27 PHE N N 0.604 -4.268 0.693 1.00 . A A . 27 PHE N 1 1 1 344 1 1 27 PHE O O 0.634 -2.172 2.454 1.00 . A A . 27 PHE O 1 1 1 345 1 1 28 CYS C C -0.979 0.534 2.941 1.00 . A A . 28 CYS C 1 1 1 346 1 1 28 CYS CA C -0.335 0.317 1.574 1.00 . A A . 28 CYS CA 1 1 1 347 1 1 28 CYS CB C -0.763 1.401 0.582 1.00 . A A . 28 CYS CB 1 1 1 348 1 1 28 CYS H H -1.382 -1.050 0.324 1.00 . A A . 28 CYS H 1 1 1 349 1 1 28 CYS HA H 0.741 0.365 1.697 1.00 . A A . 28 CYS HA 1 1 1 350 1 1 28 CYS HB3 H -1.840 1.355 0.437 1.00 . A A . 28 CYS HB3 1 1 1 351 1 1 28 CYS N N -0.683 -0.996 1.056 1.00 . A A . 28 CYS N 1 1 1 352 1 1 28 CYS O O -2.154 0.220 3.116 1.00 . A A . 28 CYS O 1 1 1 353 1 1 28 CYS SG S -0.357 3.074 1.113 1.00 . A A . 28 CYS SG 1 1 1 354 1 1 29 ALA C C -1.790 2.277 5.382 1.00 . A A . 29 ALA C 1 1 1 355 1 1 29 ALA CA C -0.690 1.215 5.278 1.00 . A A . 29 ALA CA 1 1 1 356 1 1 29 ALA CB C 0.487 1.574 6.187 1.00 . A A . 29 ALA CB 1 1 1 357 1 1 29 ALA H H 0.769 1.247 3.728 1.00 . A A . 29 ALA H 1 1 1 358 1 1 29 ALA HA H -1.103 0.267 5.625 1.00 . A A . 29 ALA HA 1 1 1 359 1 1 29 ALA HB1 H 0.137 1.676 7.216 1.00 . A A . 29 ALA HB1 1 1 1 360 1 1 29 ALA HB2 H 1.239 0.788 6.147 1.00 . A A . 29 ALA HB2 1 1 1 361 1 1 29 ALA HB3 H 0.930 2.519 5.868 1.00 . A A . 29 ALA HB3 1 1 1 362 1 1 29 ALA N N -0.210 1.038 3.912 1.00 . A A . 29 ALA N 1 1 1 363 1 1 29 ALA O O -2.595 2.237 6.309 1.00 . A A . 29 ALA O 1 1 1 364 1 1 30 CYS C C -4.198 3.771 4.293 1.00 . A A . 30 CYS C 1 1 1 365 1 1 30 CYS CA C -2.788 4.331 4.504 1.00 . A A . 30 CYS CA 1 1 1 366 1 1 30 CYS CB C -2.452 5.399 3.458 1.00 . A A . 30 CYS CB 1 1 1 367 1 1 30 CYS H H -1.156 3.209 3.698 1.00 . A A . 30 CYS H 1 1 1 368 1 1 30 CYS HA H -2.726 4.797 5.490 1.00 . A A . 30 CYS HA 1 1 1 369 1 1 30 CYS HB3 H -1.370 5.517 3.409 1.00 . A A . 30 CYS HB3 1 1 1 370 1 1 30 CYS N N -1.802 3.256 4.472 1.00 . A A . 30 CYS N 1 1 1 371 1 1 30 CYS O O -4.392 2.804 3.558 1.00 . A A . 30 CYS O 1 1 1 372 1 1 30 CYS SG S -3.062 5.034 1.797 1.00 . A A . 30 CYS SG 1 1 1 373 1 1 31 THR C C -7.061 4.208 3.355 1.00 . A A . 31 THR C 1 1 1 374 1 1 31 THR CA C -6.579 3.960 4.786 1.00 . A A . 31 THR CA 1 1 1 375 1 1 31 THR CB C -7.474 4.645 5.832 1.00 . A A . 31 THR CB 1 1 1 376 1 1 31 THR CG2 C -7.497 6.173 5.706 1.00 . A A . 31 THR CG2 1 1 1 377 1 1 31 THR H H -4.985 5.171 5.528 1.00 . A A . 31 THR H 1 1 1 378 1 1 31 THR HA H -6.633 2.885 4.964 1.00 . A A . 31 THR HA 1 1 1 379 1 1 31 THR HB H -7.110 4.380 6.825 1.00 . A A . 31 THR HB 1 1 1 380 1 1 31 THR HG1 H -9.329 4.497 6.415 1.00 . A A . 31 THR HG1 1 1 1 381 1 1 31 THR HG21 H -7.893 6.473 4.735 1.00 . A A . 31 THR HG21 1 1 1 382 1 1 31 THR HG22 H -8.135 6.593 6.486 1.00 . A A . 31 THR HG22 1 1 1 383 1 1 31 THR HG23 H -6.497 6.587 5.824 1.00 . A A . 31 THR HG23 1 1 1 384 1 1 31 THR N N -5.192 4.377 4.945 1.00 . A A . 31 THR N 1 1 1 385 1 1 31 THR O O -6.574 5.110 2.673 1.00 . A A . 31 THR O 1 1 1 386 1 1 31 THR OG1 O -8.791 4.155 5.697 1.00 . A A . 31 THR OG1 1 1 2 387 1 1 1 THR C C -13.030 -3.566 -2.891 1.00 . A A . 1 THR C 1 1 2 388 1 1 1 THR CA C -13.692 -2.552 -3.837 1.00 . A A . 1 THR CA 1 1 2 389 1 1 1 THR CB C -14.816 -1.746 -3.167 1.00 . A A . 1 THR CB 1 1 2 390 1 1 1 THR CG2 C -14.267 -0.657 -2.240 1.00 . A A . 1 THR CG2 1 1 2 391 1 1 1 THR H1 H -15.091 -2.742 -5.348 1.00 . A A . 1 THR H1 1 1 2 392 1 1 1 THR HA H -12.940 -1.848 -4.191 1.00 . A A . 1 THR HA 1 1 2 393 1 1 1 THR HB H -15.462 -2.419 -2.599 1.00 . A A . 1 THR HB 1 1 2 394 1 1 1 THR HG1 H -16.336 -0.678 -3.769 1.00 . A A . 1 THR HG1 1 1 2 395 1 1 1 THR HG21 H -15.092 -0.114 -1.780 1.00 . A A . 1 THR HG21 1 1 2 396 1 1 1 THR HG22 H -13.661 -1.105 -1.451 1.00 . A A . 1 THR HG22 1 1 2 397 1 1 1 THR HG23 H -13.654 0.043 -2.809 1.00 . A A . 1 THR HG23 1 1 2 398 1 1 1 THR N N -14.264 -3.212 -4.996 1.00 . A A . 1 THR N 1 1 2 399 1 1 1 THR O O -13.476 -3.730 -1.755 1.00 . A A . 1 THR O 1 1 2 400 1 1 1 THR OG1 O -15.598 -1.135 -4.180 1.00 . A A . 1 THR OG1 1 1 2 401 1 1 2 PRO C C -10.545 -4.455 -1.356 1.00 . A A . 2 PRO C 1 1 2 402 1 1 2 PRO CA C -11.254 -5.201 -2.488 1.00 . A A . 2 PRO CA 1 1 2 403 1 1 2 PRO CB C -10.263 -5.910 -3.416 1.00 . A A . 2 PRO CB 1 1 2 404 1 1 2 PRO CD C -11.347 -4.162 -4.641 1.00 . A A . 2 PRO CD 1 1 2 405 1 1 2 PRO CG C -9.999 -4.869 -4.506 1.00 . A A . 2 PRO CG 1 1 2 406 1 1 2 PRO HA H -11.950 -5.934 -2.074 1.00 . A A . 2 PRO HA 1 1 2 407 1 1 2 PRO HB3 H -10.746 -6.778 -3.862 1.00 . A A . 2 PRO HB3 1 1 2 408 1 1 2 PRO HD3 H -11.967 -4.689 -5.368 1.00 . A A . 2 PRO HD3 1 1 2 409 1 1 2 PRO HG3 H -9.672 -5.323 -5.442 1.00 . A A . 2 PRO HG3 1 1 2 410 1 1 2 PRO N N -11.967 -4.258 -3.330 1.00 . A A . 2 PRO N 1 1 2 411 1 1 2 PRO O O -9.924 -3.416 -1.580 1.00 . A A . 2 PRO O 1 1 2 412 1 1 3 PHE C C -8.446 -4.411 0.800 1.00 . A A . 3 PHE C 1 1 2 413 1 1 3 PHE CA C -9.959 -4.408 1.017 1.00 . A A . 3 PHE CA 1 1 2 414 1 1 3 PHE CB C -10.311 -5.207 2.278 1.00 . A A . 3 PHE CB 1 1 2 415 1 1 3 PHE CD1 C -12.512 -4.165 2.972 1.00 . A A . 3 PHE CD1 1 1 2 416 1 1 3 PHE CD2 C -12.473 -6.533 2.401 1.00 . A A . 3 PHE CD2 1 1 2 417 1 1 3 PHE CE1 C -13.892 -4.248 3.221 1.00 . A A . 3 PHE CE1 1 1 2 418 1 1 3 PHE CE2 C -13.854 -6.613 2.650 1.00 . A A . 3 PHE CE2 1 1 2 419 1 1 3 PHE CG C -11.798 -5.307 2.561 1.00 . A A . 3 PHE CG 1 1 2 420 1 1 3 PHE CZ C -14.565 -5.472 3.063 1.00 . A A . 3 PHE CZ 1 1 2 421 1 1 3 PHE H H -11.192 -5.813 0.009 1.00 . A A . 3 PHE H 1 1 2 422 1 1 3 PHE HA H -10.315 -3.383 1.139 1.00 . A A . 3 PHE HA 1 1 2 423 1 1 3 PHE HB3 H -9.830 -4.731 3.134 1.00 . A A . 3 PHE HB3 1 1 2 424 1 1 3 PHE HD1 H -12.006 -3.219 3.093 1.00 . A A . 3 PHE HD1 1 1 2 425 1 1 3 PHE HD2 H -11.938 -7.419 2.094 1.00 . A A . 3 PHE HD2 1 1 2 426 1 1 3 PHE HE1 H -14.437 -3.369 3.535 1.00 . A A . 3 PHE HE1 1 1 2 427 1 1 3 PHE HE2 H -14.371 -7.554 2.531 1.00 . A A . 3 PHE HE2 1 1 2 428 1 1 3 PHE HZ H -15.626 -5.535 3.256 1.00 . A A . 3 PHE HZ 1 1 2 429 1 1 3 PHE N N -10.636 -4.983 -0.133 1.00 . A A . 3 PHE N 1 1 2 430 1 1 3 PHE O O -7.888 -5.434 0.404 1.00 . A A . 3 PHE O 1 1 2 431 1 1 4 ALA C C -5.775 -3.035 -0.307 1.00 . A A . 4 ALA C 1 1 2 432 1 1 4 ALA CA C -6.351 -3.107 1.116 1.00 . A A . 4 ALA CA 1 1 2 433 1 1 4 ALA CB C -5.667 -4.149 2.009 1.00 . A A . 4 ALA CB 1 1 2 434 1 1 4 ALA H H -8.358 -2.491 1.389 1.00 . A A . 4 ALA H 1 1 2 435 1 1 4 ALA HA H -6.169 -2.146 1.600 1.00 . A A . 4 ALA HA 1 1 2 436 1 1 4 ALA HB1 H -4.619 -3.887 2.131 1.00 . A A . 4 ALA HB1 1 1 2 437 1 1 4 ALA HB2 H -6.137 -4.157 2.992 1.00 . A A . 4 ALA HB2 1 1 2 438 1 1 4 ALA HB3 H -5.734 -5.146 1.579 1.00 . A A . 4 ALA HB3 1 1 2 439 1 1 4 ALA N N -7.798 -3.284 1.113 1.00 . A A . 4 ALA N 1 1 2 440 1 1 4 ALA O O -5.640 -4.038 -1.005 1.00 . A A . 4 ALA O 1 1 2 441 1 1 5 ILE C C -3.438 -2.164 -2.113 1.00 . A A . 5 ILE C 1 1 2 442 1 1 5 ILE CA C -4.841 -1.548 -2.047 1.00 . A A . 5 ILE CA 1 1 2 443 1 1 5 ILE CB C -4.796 -0.019 -2.245 1.00 . A A . 5 ILE CB 1 1 2 444 1 1 5 ILE CD1 C -6.149 2.055 -1.705 1.00 . A A . 5 ILE CD1 1 1 2 445 1 1 5 ILE CG1 C -6.205 0.605 -2.193 1.00 . A A . 5 ILE CG1 1 1 2 446 1 1 5 ILE CG2 C -4.127 0.350 -3.576 1.00 . A A . 5 ILE CG2 1 1 2 447 1 1 5 ILE H H -5.514 -1.045 -0.104 1.00 . A A . 5 ILE H 1 1 2 448 1 1 5 ILE HA H -5.480 -1.989 -2.815 1.00 . A A . 5 ILE HA 1 1 2 449 1 1 5 ILE HB H -4.199 0.405 -1.436 1.00 . A A . 5 ILE HB 1 1 2 450 1 1 5 ILE HD11 H -5.488 2.649 -2.333 1.00 . A A . 5 ILE HD11 1 1 2 451 1 1 5 ILE HD12 H -7.152 2.484 -1.731 1.00 . A A . 5 ILE HD12 1 1 2 452 1 1 5 ILE HD13 H -5.781 2.083 -0.679 1.00 . A A . 5 ILE HD13 1 1 2 453 1 1 5 ILE HG13 H -6.856 0.066 -1.505 1.00 . A A . 5 ILE HG13 1 1 2 454 1 1 5 ILE HG21 H -4.184 1.425 -3.745 1.00 . A A . 5 ILE HG21 1 1 2 455 1 1 5 ILE HG22 H -3.075 0.072 -3.560 1.00 . A A . 5 ILE HG22 1 1 2 456 1 1 5 ILE HG23 H -4.622 -0.163 -4.401 1.00 . A A . 5 ILE HG23 1 1 2 457 1 1 5 ILE N N -5.414 -1.824 -0.734 1.00 . A A . 5 ILE N 1 1 2 458 1 1 5 ILE O O -2.629 -1.911 -1.219 1.00 . A A . 5 ILE O 1 1 2 459 1 1 6 LYS C C -0.759 -2.500 -3.694 1.00 . A A . 6 LYS C 1 1 2 460 1 1 6 LYS CA C -1.811 -3.555 -3.311 1.00 . A A . 6 LYS CA 1 1 2 461 1 1 6 LYS CB C -1.838 -4.762 -4.269 1.00 . A A . 6 LYS CB 1 1 2 462 1 1 6 LYS CD C -1.373 -6.579 -2.535 1.00 . A A . 6 LYS CD 1 1 2 463 1 1 6 LYS CE C -1.670 -7.978 -1.984 1.00 . A A . 6 LYS CE 1 1 2 464 1 1 6 LYS CG C -2.338 -6.072 -3.623 1.00 . A A . 6 LYS CG 1 1 2 465 1 1 6 LYS H H -3.832 -3.130 -3.856 1.00 . A A . 6 LYS H 1 1 2 466 1 1 6 LYS HA H -1.512 -3.907 -2.336 1.00 . A A . 6 LYS HA 1 1 2 467 1 1 6 LYS HB3 H -0.827 -4.944 -4.640 1.00 . A A . 6 LYS HB3 1 1 2 468 1 1 6 LYS HD3 H -1.436 -5.893 -1.697 1.00 . A A . 6 LYS HD3 1 1 2 469 1 1 6 LYS HE3 H -1.189 -8.725 -2.619 1.00 . A A . 6 LYS HE3 1 1 2 470 1 1 6 LYS HG3 H -2.411 -6.827 -4.409 1.00 . A A . 6 LYS HG3 1 1 2 471 1 1 6 LYS HZ1 H -0.226 -7.895 -0.425 1.00 . A A . 6 LYS HZ1 1 1 2 472 1 1 6 LYS HZ2 H -1.730 -7.501 0.015 1.00 . A A . 6 LYS HZ2 1 1 2 473 1 1 6 LYS HZ3 H -1.360 -9.066 -0.249 1.00 . A A . 6 LYS HZ3 1 1 2 474 1 1 6 LYS N N -3.140 -2.970 -3.141 1.00 . A A . 6 LYS N 1 1 2 475 1 1 6 LYS NZ N -1.208 -8.126 -0.582 1.00 . A A . 6 LYS NZ 1 1 2 476 1 1 6 LYS O O -1.093 -1.419 -4.170 1.00 . A A . 6 LYS O 1 1 2 477 1 1 7 CYS C C 2.906 -2.696 -3.369 1.00 . A A . 7 CYS C 1 1 2 478 1 1 7 CYS CA C 1.619 -1.878 -3.295 1.00 . A A . 7 CYS CA 1 1 2 479 1 1 7 CYS CB C 1.490 -1.215 -1.919 1.00 . A A . 7 CYS CB 1 1 2 480 1 1 7 CYS H H 0.688 -3.728 -3.011 1.00 . A A . 7 CYS H 1 1 2 481 1 1 7 CYS HA H 1.586 -1.127 -4.085 1.00 . A A . 7 CYS HA 1 1 2 482 1 1 7 CYS HB3 H 1.482 -1.988 -1.154 1.00 . A A . 7 CYS HB3 1 1 2 483 1 1 7 CYS N N 0.509 -2.815 -3.415 1.00 . A A . 7 CYS N 1 1 2 484 1 1 7 CYS O O 3.089 -3.586 -2.541 1.00 . A A . 7 CYS O 1 1 2 485 1 1 7 CYS SG S 2.708 0.018 -1.397 1.00 . A A . 7 CYS SG 1 1 2 486 1 1 8 ALA C C 6.118 -2.256 -3.730 1.00 . A A . 8 ALA C 1 1 2 487 1 1 8 ALA CA C 5.071 -3.108 -4.440 1.00 . A A . 8 ALA CA 1 1 2 488 1 1 8 ALA CB C 5.445 -3.361 -5.906 1.00 . A A . 8 ALA CB 1 1 2 489 1 1 8 ALA H H 3.641 -1.658 -4.984 1.00 . A A . 8 ALA H 1 1 2 490 1 1 8 ALA HA H 5.032 -4.083 -3.952 1.00 . A A . 8 ALA HA 1 1 2 491 1 1 8 ALA HB1 H 5.583 -2.424 -6.443 1.00 . A A . 8 ALA HB1 1 1 2 492 1 1 8 ALA HB2 H 6.379 -3.925 -5.946 1.00 . A A . 8 ALA HB2 1 1 2 493 1 1 8 ALA HB3 H 4.661 -3.940 -6.393 1.00 . A A . 8 ALA HB3 1 1 2 494 1 1 8 ALA N N 3.776 -2.449 -4.350 1.00 . A A . 8 ALA N 1 1 2 495 1 1 8 ALA O O 6.875 -2.777 -2.912 1.00 . A A . 8 ALA O 1 1 2 496 1 1 9 THR C C 6.455 1.193 -2.819 1.00 . A A . 9 THR C 1 1 2 497 1 1 9 THR CA C 7.131 -0.024 -3.461 1.00 . A A . 9 THR CA 1 1 2 498 1 1 9 THR CB C 8.113 0.411 -4.559 1.00 . A A . 9 THR CB 1 1 2 499 1 1 9 THR CG2 C 8.926 -0.780 -5.080 1.00 . A A . 9 THR CG2 1 1 2 500 1 1 9 THR H H 5.512 -0.588 -4.734 1.00 . A A . 9 THR H 1 1 2 501 1 1 9 THR HA H 7.706 -0.514 -2.676 1.00 . A A . 9 THR HA 1 1 2 502 1 1 9 THR HB H 8.808 1.146 -4.155 1.00 . A A . 9 THR HB 1 1 2 503 1 1 9 THR HG1 H 8.045 1.289 -6.293 1.00 . A A . 9 THR HG1 1 1 2 504 1 1 9 THR HG21 H 8.275 -1.493 -5.585 1.00 . A A . 9 THR HG21 1 1 2 505 1 1 9 THR HG22 H 9.680 -0.429 -5.784 1.00 . A A . 9 THR HG22 1 1 2 506 1 1 9 THR HG23 H 9.425 -1.276 -4.247 1.00 . A A . 9 THR HG23 1 1 2 507 1 1 9 THR N N 6.158 -0.952 -4.026 1.00 . A A . 9 THR N 1 1 2 508 1 1 9 THR O O 5.312 1.532 -3.128 1.00 . A A . 9 THR O 1 1 2 509 1 1 9 THR OG1 O 7.410 0.989 -5.640 1.00 . A A . 9 THR OG1 1 1 2 510 1 1 10 ASP C C 6.297 4.084 -2.606 1.00 . A A . 10 ASP C 1 1 2 511 1 1 10 ASP CA C 7.071 3.274 -1.562 1.00 . A A . 10 ASP CA 1 1 2 512 1 1 10 ASP CB C 8.492 3.848 -1.379 1.00 . A A . 10 ASP CB 1 1 2 513 1 1 10 ASP CG C 9.455 3.262 -2.400 1.00 . A A . 10 ASP CG 1 1 2 514 1 1 10 ASP H H 8.145 1.494 -1.783 1.00 . A A . 10 ASP H 1 1 2 515 1 1 10 ASP HA H 6.534 3.337 -0.613 1.00 . A A . 10 ASP HA 1 1 2 516 1 1 10 ASP HB3 H 8.863 3.600 -0.383 1.00 . A A . 10 ASP HB3 1 1 2 517 1 1 10 ASP N N 7.208 1.867 -1.942 1.00 . A A . 10 ASP N 1 1 2 518 1 1 10 ASP O O 5.210 4.590 -2.329 1.00 . A A . 10 ASP O 1 1 2 519 1 1 10 ASP OD1 O 9.946 2.150 -2.106 1.00 . A A . 10 ASP OD1 1 1 2 520 1 1 10 ASP OD2 O 9.520 3.824 -3.514 1.00 . A A . 10 ASP OD2 1 1 2 521 1 1 11 ALA C C 4.773 4.591 -5.095 1.00 . A A . 11 ALA C 1 1 2 522 1 1 11 ALA CA C 6.267 4.891 -4.939 1.00 . A A . 11 ALA CA 1 1 2 523 1 1 11 ALA CB C 7.030 4.528 -6.215 1.00 . A A . 11 ALA CB 1 1 2 524 1 1 11 ALA H H 7.826 3.883 -3.905 1.00 . A A . 11 ALA H 1 1 2 525 1 1 11 ALA HA H 6.398 5.962 -4.779 1.00 . A A . 11 ALA HA 1 1 2 526 1 1 11 ALA HB1 H 6.654 5.121 -7.048 1.00 . A A . 11 ALA HB1 1 1 2 527 1 1 11 ALA HB2 H 8.092 4.738 -6.083 1.00 . A A . 11 ALA HB2 1 1 2 528 1 1 11 ALA HB3 H 6.900 3.470 -6.442 1.00 . A A . 11 ALA HB3 1 1 2 529 1 1 11 ALA N N 6.860 4.200 -3.811 1.00 . A A . 11 ALA N 1 1 2 530 1 1 11 ALA O O 3.991 5.504 -5.352 1.00 . A A . 11 ALA O 1 1 2 531 1 1 12 ASP C C 2.053 3.531 -4.276 1.00 . A A . 12 ASP C 1 1 2 532 1 1 12 ASP CA C 2.991 2.902 -5.294 1.00 . A A . 12 ASP CA 1 1 2 533 1 1 12 ASP CB C 2.859 1.378 -5.296 1.00 . A A . 12 ASP CB 1 1 2 534 1 1 12 ASP CG C 3.765 0.696 -6.307 1.00 . A A . 12 ASP CG 1 1 2 535 1 1 12 ASP H H 5.021 2.610 -4.705 1.00 . A A . 12 ASP H 1 1 2 536 1 1 12 ASP HA H 2.672 3.252 -6.273 1.00 . A A . 12 ASP HA 1 1 2 537 1 1 12 ASP HB3 H 1.829 1.115 -5.538 1.00 . A A . 12 ASP HB3 1 1 2 538 1 1 12 ASP N N 4.367 3.319 -5.030 1.00 . A A . 12 ASP N 1 1 2 539 1 1 12 ASP O O 1.053 4.140 -4.656 1.00 . A A . 12 ASP O 1 1 2 540 1 1 12 ASP OD1 O 3.939 1.249 -7.418 1.00 . A A . 12 ASP OD1 1 1 2 541 1 1 12 ASP OD2 O 4.269 -0.380 -5.934 1.00 . A A . 12 ASP OD2 1 1 2 542 1 1 13 CYS C C 1.696 5.661 -2.379 1.00 . A A . 13 CYS C 1 1 2 543 1 1 13 CYS CA C 1.714 4.197 -1.960 1.00 . A A . 13 CYS CA 1 1 2 544 1 1 13 CYS CB C 2.390 4.088 -0.587 1.00 . A A . 13 CYS CB 1 1 2 545 1 1 13 CYS H H 3.263 2.941 -2.764 1.00 . A A . 13 CYS H 1 1 2 546 1 1 13 CYS HA H 0.683 3.853 -1.898 1.00 . A A . 13 CYS HA 1 1 2 547 1 1 13 CYS HB3 H 2.213 5.023 -0.058 1.00 . A A . 13 CYS HB3 1 1 2 548 1 1 13 CYS N N 2.406 3.429 -2.989 1.00 . A A . 13 CYS N 1 1 2 549 1 1 13 CYS O O 0.627 6.252 -2.490 1.00 . A A . 13 CYS O 1 1 2 550 1 1 13 CYS SG S 1.822 2.818 0.563 1.00 . A A . 13 CYS SG 1 1 2 551 1 1 14 SER C C 2.070 8.171 -3.965 1.00 . A A . 14 SER C 1 1 2 552 1 1 14 SER CA C 3.084 7.633 -2.944 1.00 . A A . 14 SER CA 1 1 2 553 1 1 14 SER CB C 4.533 7.867 -3.397 1.00 . A A . 14 SER CB 1 1 2 554 1 1 14 SER H H 3.698 5.632 -2.524 1.00 . A A . 14 SER H 1 1 2 555 1 1 14 SER HA H 2.928 8.178 -2.011 1.00 . A A . 14 SER HA 1 1 2 556 1 1 14 SER HB3 H 4.581 8.040 -4.474 1.00 . A A . 14 SER HB3 1 1 2 557 1 1 14 SER HG H 5.925 8.655 -2.301 1.00 . A A . 14 SER HG 1 1 2 558 1 1 14 SER N N 2.880 6.224 -2.628 1.00 . A A . 14 SER N 1 1 2 559 1 1 14 SER O O 1.441 9.195 -3.709 1.00 . A A . 14 SER O 1 1 2 560 1 1 14 SER OG O 5.106 8.963 -2.712 1.00 . A A . 14 SER OG 1 1 2 561 1 1 15 ARG C C -0.496 8.062 -5.468 1.00 . A A . 15 ARG C 1 1 2 562 1 1 15 ARG CA C 0.899 7.944 -6.097 1.00 . A A . 15 ARG CA 1 1 2 563 1 1 15 ARG CB C 0.772 7.009 -7.314 1.00 . A A . 15 ARG CB 1 1 2 564 1 1 15 ARG CD C 3.081 6.211 -8.033 1.00 . A A . 15 ARG CD 1 1 2 565 1 1 15 ARG CG C 1.878 7.085 -8.382 1.00 . A A . 15 ARG CG 1 1 2 566 1 1 15 ARG CZ C 4.223 4.384 -9.290 1.00 . A A . 15 ARG CZ 1 1 2 567 1 1 15 ARG H H 2.434 6.652 -5.273 1.00 . A A . 15 ARG H 1 1 2 568 1 1 15 ARG HA H 1.186 8.936 -6.452 1.00 . A A . 15 ARG HA 1 1 2 569 1 1 15 ARG HB3 H -0.138 7.314 -7.834 1.00 . A A . 15 ARG HB3 1 1 2 570 1 1 15 ARG HD3 H 2.688 5.409 -7.410 1.00 . A A . 15 ARG HD3 1 1 2 571 1 1 15 ARG HE H 3.695 6.195 -10.072 1.00 . A A . 15 ARG HE 1 1 2 572 1 1 15 ARG HG3 H 2.184 8.120 -8.549 1.00 . A A . 15 ARG HG3 1 1 2 573 1 1 15 ARG HH11 H 4.186 4.152 -7.290 1.00 . A A . 15 ARG HH11 1 1 2 574 1 1 15 ARG HH12 H 4.420 2.665 -8.115 1.00 . A A . 15 ARG HH12 1 1 2 575 1 1 15 ARG HH21 H 4.455 4.329 -11.327 1.00 . A A . 15 ARG HH21 1 1 2 576 1 1 15 ARG HH22 H 4.927 2.887 -10.473 1.00 . A A . 15 ARG HH22 1 1 2 577 1 1 15 ARG N N 1.890 7.495 -5.112 1.00 . A A . 15 ARG N 1 1 2 578 1 1 15 ARG NE N 3.724 5.633 -9.232 1.00 . A A . 15 ARG NE 1 1 2 579 1 1 15 ARG NH1 N 4.374 3.692 -8.163 1.00 . A A . 15 ARG NH1 1 1 2 580 1 1 15 ARG NH2 N 4.562 3.829 -10.456 1.00 . A A . 15 ARG NH2 1 1 2 581 1 1 15 ARG O O -1.226 9.007 -5.752 1.00 . A A . 15 ARG O 1 1 2 582 1 1 16 LYS C C -2.551 7.771 -3.003 1.00 . A A . 16 LYS C 1 1 2 583 1 1 16 LYS CA C -2.281 6.914 -4.247 1.00 . A A . 16 LYS CA 1 1 2 584 1 1 16 LYS CB C -2.583 5.426 -3.983 1.00 . A A . 16 LYS CB 1 1 2 585 1 1 16 LYS CD C -5.107 5.820 -3.774 1.00 . A A . 16 LYS CD 1 1 2 586 1 1 16 LYS CE C -6.496 5.257 -4.090 1.00 . A A . 16 LYS CE 1 1 2 587 1 1 16 LYS CG C -3.991 4.991 -4.424 1.00 . A A . 16 LYS CG 1 1 2 588 1 1 16 LYS H H -0.225 6.358 -4.392 1.00 . A A . 16 LYS H 1 1 2 589 1 1 16 LYS HA H -2.928 7.257 -5.056 1.00 . A A . 16 LYS HA 1 1 2 590 1 1 16 LYS HB3 H -2.439 5.202 -2.924 1.00 . A A . 16 LYS HB3 1 1 2 591 1 1 16 LYS HD3 H -5.058 6.836 -4.167 1.00 . A A . 16 LYS HD3 1 1 2 592 1 1 16 LYS HE3 H -6.575 4.237 -3.711 1.00 . A A . 16 LYS HE3 1 1 2 593 1 1 16 LYS HG3 H -4.109 3.939 -4.154 1.00 . A A . 16 LYS HG3 1 1 2 594 1 1 16 LYS HZ1 H -7.514 7.027 -3.844 1.00 . A A . 16 LYS HZ1 1 1 2 595 1 1 16 LYS HZ2 H -8.470 5.695 -3.713 1.00 . A A . 16 LYS HZ2 1 1 2 596 1 1 16 LYS HZ3 H -7.460 6.106 -2.481 1.00 . A A . 16 LYS HZ3 1 1 2 597 1 1 16 LYS N N -0.902 7.054 -4.692 1.00 . A A . 16 LYS N 1 1 2 598 1 1 16 LYS NZ N -7.564 6.081 -3.487 1.00 . A A . 16 LYS NZ 1 1 2 599 1 1 16 LYS O O -3.660 8.268 -2.816 1.00 . A A . 16 LYS O 1 1 2 600 1 1 17 CYS C C -0.445 9.156 -0.379 1.00 . A A . 17 CYS C 1 1 2 601 1 1 17 CYS CA C -1.707 8.378 -0.760 1.00 . A A . 17 CYS CA 1 1 2 602 1 1 17 CYS CB C -1.938 7.182 0.164 1.00 . A A . 17 CYS CB 1 1 2 603 1 1 17 CYS H H -0.658 7.484 -2.353 1.00 . A A . 17 CYS H 1 1 2 604 1 1 17 CYS HA H -2.593 9.007 -0.698 1.00 . A A . 17 CYS HA 1 1 2 605 1 1 17 CYS HB3 H -1.142 6.446 0.040 1.00 . A A . 17 CYS HB3 1 1 2 606 1 1 17 CYS N N -1.561 7.882 -2.118 1.00 . A A . 17 CYS N 1 1 2 607 1 1 17 CYS O O 0.639 8.571 -0.362 1.00 . A A . 17 CYS O 1 1 2 608 1 1 17 CYS SG S -2.060 7.579 1.921 1.00 . A A . 17 CYS SG 1 1 2 609 1 1 18 PRO C C 1.300 11.009 1.404 1.00 . A A . 18 PRO C 1 1 2 610 1 1 18 PRO CA C 0.618 11.323 0.073 1.00 . A A . 18 PRO CA 1 1 2 611 1 1 18 PRO CB C 0.088 12.759 0.013 1.00 . A A . 18 PRO CB 1 1 2 612 1 1 18 PRO CD C -1.768 11.256 -0.039 1.00 . A A . 18 PRO CD 1 1 2 613 1 1 18 PRO CG C -1.346 12.616 0.517 1.00 . A A . 18 PRO CG 1 1 2 614 1 1 18 PRO HA H 1.334 11.167 -0.735 1.00 . A A . 18 PRO HA 1 1 2 615 1 1 18 PRO HB3 H 0.069 13.091 -1.026 1.00 . A A . 18 PRO HB3 1 1 2 616 1 1 18 PRO HD3 H -2.193 11.380 -1.037 1.00 . A A . 18 PRO HD3 1 1 2 617 1 1 18 PRO HG3 H -1.992 13.425 0.171 1.00 . A A . 18 PRO HG3 1 1 2 618 1 1 18 PRO N N -0.545 10.473 -0.128 1.00 . A A . 18 PRO N 1 1 2 619 1 1 18 PRO O O 0.786 10.250 2.223 1.00 . A A . 18 PRO O 1 1 2 620 1 1 19 GLY C C 4.170 10.039 2.590 1.00 . A A . 19 GLY C 1 1 2 621 1 1 19 GLY CA C 3.318 11.298 2.775 1.00 . A A . 19 GLY CA 1 1 2 622 1 1 19 GLY H H 2.866 12.194 0.902 1.00 . A A . 19 GLY H 1 1 2 623 1 1 19 GLY HA2 H 3.986 12.146 2.937 1.00 . A A . 19 GLY HA2 1 1 2 624 1 1 19 GLY HA3 H 2.696 11.178 3.664 1.00 . A A . 19 GLY HA3 1 1 2 625 1 1 19 GLY N N 2.490 11.579 1.609 1.00 . A A . 19 GLY N 1 1 2 626 1 1 19 GLY O O 5.036 9.766 3.416 1.00 . A A . 19 GLY O 1 1 2 627 1 1 20 ASN C C 4.711 7.071 2.329 1.00 . A A . 20 ASN C 1 1 2 628 1 1 20 ASN CA C 4.691 8.079 1.168 1.00 . A A . 20 ASN CA 1 1 2 629 1 1 20 ASN CB C 6.098 8.453 0.676 1.00 . A A . 20 ASN CB 1 1 2 630 1 1 20 ASN CG C 6.756 7.319 -0.111 1.00 . A A . 20 ASN CG 1 1 2 631 1 1 20 ASN H H 3.197 9.546 0.886 1.00 . A A . 20 ASN H 1 1 2 632 1 1 20 ASN HA H 4.178 7.609 0.327 1.00 . A A . 20 ASN HA 1 1 2 633 1 1 20 ASN HB3 H 6.738 8.738 1.511 1.00 . A A . 20 ASN HB3 1 1 2 634 1 1 20 ASN HD21 H 6.947 6.182 1.556 1.00 . A A . 20 ASN HD21 1 1 2 635 1 1 20 ASN HD22 H 7.547 5.458 0.069 1.00 . A A . 20 ASN HD22 1 1 2 636 1 1 20 ASN N N 3.947 9.285 1.507 1.00 . A A . 20 ASN N 1 1 2 637 1 1 20 ASN ND2 N 7.132 6.234 0.558 1.00 . A A . 20 ASN ND2 1 1 2 638 1 1 20 ASN O O 5.780 6.725 2.836 1.00 . A A . 20 ASN O 1 1 2 639 1 1 20 ASN OD1 O 6.921 7.424 -1.322 1.00 . A A . 20 ASN OD1 1 1 2 640 1 1 21 PRO C C 4.146 4.198 2.997 1.00 . A A . 21 PRO C 1 1 2 641 1 1 21 PRO CA C 3.502 5.426 3.662 1.00 . A A . 21 PRO CA 1 1 2 642 1 1 21 PRO CB C 2.022 5.215 3.992 1.00 . A A . 21 PRO CB 1 1 2 643 1 1 21 PRO CD C 2.214 6.981 2.355 1.00 . A A . 21 PRO CD 1 1 2 644 1 1 21 PRO CG C 1.268 5.887 2.843 1.00 . A A . 21 PRO CG 1 1 2 645 1 1 21 PRO HA H 4.043 5.686 4.572 1.00 . A A . 21 PRO HA 1 1 2 646 1 1 21 PRO HB3 H 1.782 5.733 4.923 1.00 . A A . 21 PRO HB3 1 1 2 647 1 1 21 PRO HD3 H 1.968 7.916 2.861 1.00 . A A . 21 PRO HD3 1 1 2 648 1 1 21 PRO HG3 H 0.317 6.305 3.167 1.00 . A A . 21 PRO HG3 1 1 2 649 1 1 21 PRO N N 3.545 6.561 2.755 1.00 . A A . 21 PRO N 1 1 2 650 1 1 21 PRO O O 4.321 4.176 1.779 1.00 . A A . 21 PRO O 1 1 2 651 1 1 22 PRO C C 4.176 0.953 2.765 1.00 . A A . 22 PRO C 1 1 2 652 1 1 22 PRO CA C 5.196 1.991 3.249 1.00 . A A . 22 PRO CA 1 1 2 653 1 1 22 PRO CB C 5.993 1.448 4.436 1.00 . A A . 22 PRO CB 1 1 2 654 1 1 22 PRO CD C 4.535 3.166 5.228 1.00 . A A . 22 PRO CD 1 1 2 655 1 1 22 PRO CG C 5.102 1.802 5.630 1.00 . A A . 22 PRO CG 1 1 2 656 1 1 22 PRO HA H 5.875 2.246 2.435 1.00 . A A . 22 PRO HA 1 1 2 657 1 1 22 PRO HB3 H 6.936 1.991 4.515 1.00 . A A . 22 PRO HB3 1 1 2 658 1 1 22 PRO HD3 H 5.201 3.949 5.597 1.00 . A A . 22 PRO HD3 1 1 2 659 1 1 22 PRO HG3 H 5.661 1.847 6.566 1.00 . A A . 22 PRO HG3 1 1 2 660 1 1 22 PRO N N 4.540 3.178 3.775 1.00 . A A . 22 PRO N 1 1 2 661 1 1 22 PRO O O 3.004 0.981 3.144 1.00 . A A . 22 PRO O 1 1 2 662 1 1 23 CYS C C 4.055 -2.188 2.904 1.00 . A A . 23 CYS C 1 1 2 663 1 1 23 CYS CA C 3.884 -1.235 1.712 1.00 . A A . 23 CYS CA 1 1 2 664 1 1 23 CYS CB C 4.346 -1.935 0.427 1.00 . A A . 23 CYS CB 1 1 2 665 1 1 23 CYS H H 5.603 0.014 1.663 1.00 . A A . 23 CYS H 1 1 2 666 1 1 23 CYS HA H 2.836 -0.970 1.585 1.00 . A A . 23 CYS HA 1 1 2 667 1 1 23 CYS HB3 H 3.632 -2.729 0.214 1.00 . A A . 23 CYS HB3 1 1 2 668 1 1 23 CYS N N 4.645 -0.021 1.978 1.00 . A A . 23 CYS N 1 1 2 669 1 1 23 CYS O O 5.112 -2.200 3.545 1.00 . A A . 23 CYS O 1 1 2 670 1 1 23 CYS SG S 4.516 -0.968 -1.096 1.00 . A A . 23 CYS SG 1 1 2 671 1 1 24 ARG C C 2.251 -5.215 3.763 1.00 . A A . 24 ARG C 1 1 2 672 1 1 24 ARG CA C 3.075 -4.024 4.259 1.00 . A A . 24 ARG CA 1 1 2 673 1 1 24 ARG CB C 2.501 -3.440 5.563 1.00 . A A . 24 ARG CB 1 1 2 674 1 1 24 ARG CD C 4.355 -3.158 7.307 1.00 . A A . 24 ARG CD 1 1 2 675 1 1 24 ARG CG C 3.184 -4.022 6.809 1.00 . A A . 24 ARG CG 1 1 2 676 1 1 24 ARG CZ C 6.537 -2.374 6.323 1.00 . A A . 24 ARG CZ 1 1 2 677 1 1 24 ARG H H 2.172 -2.897 2.712 1.00 . A A . 24 ARG H 1 1 2 678 1 1 24 ARG HA H 4.103 -4.355 4.406 1.00 . A A . 24 ARG HA 1 1 2 679 1 1 24 ARG HB3 H 1.432 -3.660 5.608 1.00 . A A . 24 ARG HB3 1 1 2 680 1 1 24 ARG HD3 H 4.889 -3.738 8.063 1.00 . A A . 24 ARG HD3 1 1 2 681 1 1 24 ARG HE H 4.852 -2.670 5.283 1.00 . A A . 24 ARG HE 1 1 2 682 1 1 24 ARG HG3 H 3.523 -5.039 6.607 1.00 . A A . 24 ARG HG3 1 1 2 683 1 1 24 ARG HH11 H 6.615 -2.552 8.345 1.00 . A A . 24 ARG HH11 1 1 2 684 1 1 24 ARG HH12 H 8.108 -2.057 7.608 1.00 . A A . 24 ARG HH12 1 1 2 685 1 1 24 ARG HH21 H 6.663 -2.059 4.334 1.00 . A A . 24 ARG HH21 1 1 2 686 1 1 24 ARG HH22 H 8.163 -1.763 5.200 1.00 . A A . 24 ARG HH22 1 1 2 687 1 1 24 ARG N N 3.046 -3.005 3.215 1.00 . A A . 24 ARG N 1 1 2 688 1 1 24 ARG NE N 5.254 -2.746 6.215 1.00 . A A . 24 ARG NE 1 1 2 689 1 1 24 ARG NH1 N 7.141 -2.330 7.514 1.00 . A A . 24 ARG NH1 1 1 2 690 1 1 24 ARG NH2 N 7.195 -2.041 5.208 1.00 . A A . 24 ARG NH2 1 1 2 691 1 1 24 ARG O O 1.110 -5.023 3.353 1.00 . A A . 24 ARG O 1 1 2 692 1 1 25 ASN C C 1.861 -7.132 1.549 1.00 . A A . 25 ASN C 1 1 2 693 1 1 25 ASN CA C 2.256 -7.560 2.973 1.00 . A A . 25 ASN CA 1 1 2 694 1 1 25 ASN CB C 1.104 -8.188 3.773 1.00 . A A . 25 ASN CB 1 1 2 695 1 1 25 ASN CG C 0.540 -9.451 3.121 1.00 . A A . 25 ASN CG 1 1 2 696 1 1 25 ASN H H 3.766 -6.530 4.072 1.00 . A A . 25 ASN H 1 1 2 697 1 1 25 ASN HA H 3.043 -8.312 2.878 1.00 . A A . 25 ASN HA 1 1 2 698 1 1 25 ASN HB3 H 0.304 -7.461 3.889 1.00 . A A . 25 ASN HB3 1 1 2 699 1 1 25 ASN HD21 H -1.084 -9.443 4.349 1.00 . A A . 25 ASN HD21 1 1 2 700 1 1 25 ASN HD22 H -0.988 -10.762 3.197 1.00 . A A . 25 ASN HD22 1 1 2 701 1 1 25 ASN N N 2.833 -6.422 3.702 1.00 . A A . 25 ASN N 1 1 2 702 1 1 25 ASN ND2 N -0.623 -9.903 3.579 1.00 . A A . 25 ASN ND2 1 1 2 703 1 1 25 ASN O O 0.807 -7.478 1.006 1.00 . A A . 25 ASN O 1 1 2 704 1 1 25 ASN OD1 O 1.139 -10.029 2.220 1.00 . A A . 25 ASN OD1 1 1 2 705 1 1 26 GLY C C 1.194 -4.916 -0.435 1.00 . A A . 26 GLY C 1 1 2 706 1 1 26 GLY CA C 2.515 -5.686 -0.336 1.00 . A A . 26 GLY CA 1 1 2 707 1 1 26 GLY H H 3.582 -6.085 1.440 1.00 . A A . 26 GLY H 1 1 2 708 1 1 26 GLY HA2 H 3.339 -4.998 -0.504 1.00 . A A . 26 GLY HA2 1 1 2 709 1 1 26 GLY HA3 H 2.542 -6.451 -1.113 1.00 . A A . 26 GLY HA3 1 1 2 710 1 1 26 GLY N N 2.728 -6.311 0.953 1.00 . A A . 26 GLY N 1 1 2 711 1 1 26 GLY O O 0.669 -4.787 -1.533 1.00 . A A . 26 GLY O 1 1 2 712 1 1 27 PHE C C -0.112 -2.174 1.182 1.00 . A A . 27 PHE C 1 1 2 713 1 1 27 PHE CA C -0.541 -3.559 0.708 1.00 . A A . 27 PHE CA 1 1 2 714 1 1 27 PHE CB C -1.595 -4.101 1.680 1.00 . A A . 27 PHE CB 1 1 2 715 1 1 27 PHE CD1 C -3.131 -5.476 0.226 1.00 . A A . 27 PHE CD1 1 1 2 716 1 1 27 PHE CD2 C -2.166 -6.513 2.200 1.00 . A A . 27 PHE CD2 1 1 2 717 1 1 27 PHE CE1 C -3.983 -6.581 0.059 1.00 . A A . 27 PHE CE1 1 1 2 718 1 1 27 PHE CE2 C -3.005 -7.626 2.026 1.00 . A A . 27 PHE CE2 1 1 2 719 1 1 27 PHE CG C -2.234 -5.426 1.308 1.00 . A A . 27 PHE CG 1 1 2 720 1 1 27 PHE CZ C -3.929 -7.654 0.965 1.00 . A A . 27 PHE CZ 1 1 2 721 1 1 27 PHE H H 1.072 -4.601 1.571 1.00 . A A . 27 PHE H 1 1 2 722 1 1 27 PHE HA H -0.981 -3.476 -0.278 1.00 . A A . 27 PHE HA 1 1 2 723 1 1 27 PHE HB3 H -2.390 -3.356 1.736 1.00 . A A . 27 PHE HB3 1 1 2 724 1 1 27 PHE HD1 H -3.247 -4.615 -0.417 1.00 . A A . 27 PHE HD1 1 1 2 725 1 1 27 PHE HD2 H -1.552 -6.440 3.085 1.00 . A A . 27 PHE HD2 1 1 2 726 1 1 27 PHE HE1 H -4.765 -6.544 -0.689 1.00 . A A . 27 PHE HE1 1 1 2 727 1 1 27 PHE HE2 H -3.014 -8.416 2.766 1.00 . A A . 27 PHE HE2 1 1 2 728 1 1 27 PHE HZ H -4.654 -8.454 0.897 1.00 . A A . 27 PHE HZ 1 1 2 729 1 1 27 PHE N N 0.634 -4.424 0.676 1.00 . A A . 27 PHE N 1 1 2 730 1 1 27 PHE O O 0.698 -2.084 2.100 1.00 . A A . 27 PHE O 1 1 2 731 1 1 28 CYS C C -0.737 0.577 2.376 1.00 . A A . 28 CYS C 1 1 2 732 1 1 28 CYS CA C -0.224 0.241 0.975 1.00 . A A . 28 CYS CA 1 1 2 733 1 1 28 CYS CB C -0.726 1.305 -0.008 1.00 . A A . 28 CYS CB 1 1 2 734 1 1 28 CYS H H -1.333 -1.221 -0.140 1.00 . A A . 28 CYS H 1 1 2 735 1 1 28 CYS HA H 0.865 0.269 0.982 1.00 . A A . 28 CYS HA 1 1 2 736 1 1 28 CYS HB3 H -1.812 1.261 -0.082 1.00 . A A . 28 CYS HB3 1 1 2 737 1 1 28 CYS N N -0.629 -1.101 0.584 1.00 . A A . 28 CYS N 1 1 2 738 1 1 28 CYS O O -1.951 0.627 2.583 1.00 . A A . 28 CYS O 1 1 2 739 1 1 28 CYS SG S -0.254 2.943 0.577 1.00 . A A . 28 CYS SG 1 1 2 740 1 1 29 ALA C C -0.698 2.660 4.790 1.00 . A A . 29 ALA C 1 1 2 741 1 1 29 ALA CA C -0.236 1.199 4.695 1.00 . A A . 29 ALA CA 1 1 2 742 1 1 29 ALA CB C 0.929 0.901 5.646 1.00 . A A . 29 ALA CB 1 1 2 743 1 1 29 ALA H H 1.149 0.830 3.118 1.00 . A A . 29 ALA H 1 1 2 744 1 1 29 ALA HA H -1.069 0.562 5.000 1.00 . A A . 29 ALA HA 1 1 2 745 1 1 29 ALA HB1 H 1.771 1.554 5.416 1.00 . A A . 29 ALA HB1 1 1 2 746 1 1 29 ALA HB2 H 0.618 1.074 6.676 1.00 . A A . 29 ALA HB2 1 1 2 747 1 1 29 ALA HB3 H 1.239 -0.137 5.537 1.00 . A A . 29 ALA HB3 1 1 2 748 1 1 29 ALA N N 0.155 0.852 3.333 1.00 . A A . 29 ALA N 1 1 2 749 1 1 29 ALA O O -0.215 3.416 5.634 1.00 . A A . 29 ALA O 1 1 2 750 1 1 30 CYS C C -3.173 4.556 5.159 1.00 . A A . 30 CYS C 1 1 2 751 1 1 30 CYS CA C -2.227 4.407 3.964 1.00 . A A . 30 CYS CA 1 1 2 752 1 1 30 CYS CB C -2.952 4.694 2.647 1.00 . A A . 30 CYS CB 1 1 2 753 1 1 30 CYS H H -2.039 2.375 3.309 1.00 . A A . 30 CYS H 1 1 2 754 1 1 30 CYS HA H -1.429 5.141 4.069 1.00 . A A . 30 CYS HA 1 1 2 755 1 1 30 CYS HB3 H -3.778 3.990 2.546 1.00 . A A . 30 CYS HB3 1 1 2 756 1 1 30 CYS N N -1.656 3.063 3.949 1.00 . A A . 30 CYS N 1 1 2 757 1 1 30 CYS O O -4.391 4.614 5.010 1.00 . A A . 30 CYS O 1 1 2 758 1 1 30 CYS SG S -3.644 6.363 2.526 1.00 . A A . 30 CYS SG 1 1 2 759 1 1 31 THR C C -3.938 6.176 7.651 1.00 . A A . 31 THR C 1 1 2 760 1 1 31 THR CA C -3.369 4.756 7.588 1.00 . A A . 31 THR CA 1 1 2 761 1 1 31 THR CB C -2.506 4.408 8.811 1.00 . A A . 31 THR CB 1 1 2 762 1 1 31 THR CG2 C -1.305 5.346 8.987 1.00 . A A . 31 THR CG2 1 1 2 763 1 1 31 THR H H -1.599 4.453 6.410 1.00 . A A . 31 THR H 1 1 2 764 1 1 31 THR HA H -4.215 4.066 7.572 1.00 . A A . 31 THR HA 1 1 2 765 1 1 31 THR HB H -2.126 3.390 8.696 1.00 . A A . 31 THR HB 1 1 2 766 1 1 31 THR HG1 H -3.870 3.689 10.007 1.00 . A A . 31 THR HG1 1 1 2 767 1 1 31 THR HG21 H -1.638 6.370 9.150 1.00 . A A . 31 THR HG21 1 1 2 768 1 1 31 THR HG22 H -0.728 5.027 9.855 1.00 . A A . 31 THR HG22 1 1 2 769 1 1 31 THR HG23 H -0.658 5.315 8.110 1.00 . A A . 31 THR HG23 1 1 2 770 1 1 31 THR N N -2.606 4.568 6.364 1.00 . A A . 31 THR N 1 1 2 771 1 1 31 THR O O -3.405 7.100 7.039 1.00 . A A . 31 THR O 1 1 2 772 1 1 31 THR OG1 O -3.293 4.458 9.980 1.00 . A A . 31 THR OG1 1 1 3 773 1 1 1 THR C C -9.730 -9.959 2.632 1.00 . A A . 1 THR C 1 1 3 774 1 1 1 THR CA C -10.270 -11.400 2.509 1.00 . A A . 1 THR CA 1 1 3 775 1 1 1 THR CB C -11.799 -11.564 2.408 1.00 . A A . 1 THR CB 1 1 3 776 1 1 1 THR CG2 C -12.599 -11.081 3.626 1.00 . A A . 1 THR CG2 1 1 3 777 1 1 1 THR H1 H -9.809 -11.786 4.545 1.00 . A A . 1 THR H1 1 1 3 778 1 1 1 THR HA H -9.876 -11.845 1.597 1.00 . A A . 1 THR HA 1 1 3 779 1 1 1 THR HB H -11.995 -12.633 2.317 1.00 . A A . 1 THR HB 1 1 3 780 1 1 1 THR HG1 H -11.930 -11.393 0.467 1.00 . A A . 1 THR HG1 1 1 3 781 1 1 1 THR HG21 H -12.212 -11.534 4.538 1.00 . A A . 1 THR HG21 1 1 3 782 1 1 1 THR HG22 H -12.564 -9.998 3.717 1.00 . A A . 1 THR HG22 1 1 3 783 1 1 1 THR HG23 H -13.641 -11.379 3.504 1.00 . A A . 1 THR HG23 1 1 3 784 1 1 1 THR N N -9.777 -12.195 3.621 1.00 . A A . 1 THR N 1 1 3 785 1 1 1 THR O O -10.404 -9.057 3.127 1.00 . A A . 1 THR O 1 1 3 786 1 1 1 THR OG1 O -12.302 -10.956 1.239 1.00 . A A . 1 THR OG1 1 1 3 787 1 1 2 PRO C C -8.134 -7.372 1.614 1.00 . A A . 2 PRO C 1 1 3 788 1 1 2 PRO CA C -7.748 -8.507 2.569 1.00 . A A . 2 PRO CA 1 1 3 789 1 1 2 PRO CB C -6.265 -8.882 2.498 1.00 . A A . 2 PRO CB 1 1 3 790 1 1 2 PRO CD C -7.552 -10.714 1.671 1.00 . A A . 2 PRO CD 1 1 3 791 1 1 2 PRO CG C -6.246 -9.964 1.418 1.00 . A A . 2 PRO CG 1 1 3 792 1 1 2 PRO HA H -7.967 -8.187 3.590 1.00 . A A . 2 PRO HA 1 1 3 793 1 1 2 PRO HB3 H -5.963 -9.327 3.447 1.00 . A A . 2 PRO HB3 1 1 3 794 1 1 2 PRO HD3 H -7.377 -11.520 2.386 1.00 . A A . 2 PRO HD3 1 1 3 795 1 1 2 PRO HG3 H -5.374 -10.617 1.496 1.00 . A A . 2 PRO HG3 1 1 3 796 1 1 2 PRO N N -8.459 -9.735 2.251 1.00 . A A . 2 PRO N 1 1 3 797 1 1 2 PRO O O -7.356 -6.978 0.744 1.00 . A A . 2 PRO O 1 1 3 798 1 1 3 PHE C C -8.980 -4.394 1.575 1.00 . A A . 3 PHE C 1 1 3 799 1 1 3 PHE CA C -9.794 -5.613 1.125 1.00 . A A . 3 PHE CA 1 1 3 800 1 1 3 PHE CB C -11.287 -5.388 1.406 1.00 . A A . 3 PHE CB 1 1 3 801 1 1 3 PHE CD1 C -12.545 -6.368 -0.556 1.00 . A A . 3 PHE CD1 1 1 3 802 1 1 3 PHE CD2 C -12.807 -7.405 1.631 1.00 . A A . 3 PHE CD2 1 1 3 803 1 1 3 PHE CE1 C -13.470 -7.277 -1.099 1.00 . A A . 3 PHE CE1 1 1 3 804 1 1 3 PHE CE2 C -13.745 -8.300 1.091 1.00 . A A . 3 PHE CE2 1 1 3 805 1 1 3 PHE CG C -12.213 -6.430 0.810 1.00 . A A . 3 PHE CG 1 1 3 806 1 1 3 PHE CZ C -14.072 -8.241 -0.276 1.00 . A A . 3 PHE CZ 1 1 3 807 1 1 3 PHE H H -9.956 -7.273 2.470 1.00 . A A . 3 PHE H 1 1 3 808 1 1 3 PHE HA H -9.663 -5.737 0.049 1.00 . A A . 3 PHE HA 1 1 3 809 1 1 3 PHE HB3 H -11.570 -4.419 0.991 1.00 . A A . 3 PHE HB3 1 1 3 810 1 1 3 PHE HD1 H -12.102 -5.615 -1.192 1.00 . A A . 3 PHE HD1 1 1 3 811 1 1 3 PHE HD2 H -12.542 -7.482 2.676 1.00 . A A . 3 PHE HD2 1 1 3 812 1 1 3 PHE HE1 H -13.725 -7.228 -2.148 1.00 . A A . 3 PHE HE1 1 1 3 813 1 1 3 PHE HE2 H -14.174 -9.072 1.715 1.00 . A A . 3 PHE HE2 1 1 3 814 1 1 3 PHE HZ H -14.775 -8.950 -0.690 1.00 . A A . 3 PHE HZ 1 1 3 815 1 1 3 PHE N N -9.335 -6.818 1.806 1.00 . A A . 3 PHE N 1 1 3 816 1 1 3 PHE O O -9.487 -3.550 2.311 1.00 . A A . 3 PHE O 1 1 3 817 1 1 4 ALA C C -6.110 -2.761 0.116 1.00 . A A . 4 ALA C 1 1 3 818 1 1 4 ALA CA C -6.848 -3.163 1.394 1.00 . A A . 4 ALA CA 1 1 3 819 1 1 4 ALA CB C -5.876 -3.526 2.521 1.00 . A A . 4 ALA CB 1 1 3 820 1 1 4 ALA H H -7.361 -5.061 0.570 1.00 . A A . 4 ALA H 1 1 3 821 1 1 4 ALA HA H -7.439 -2.304 1.718 1.00 . A A . 4 ALA HA 1 1 3 822 1 1 4 ALA HB1 H -6.438 -3.709 3.438 1.00 . A A . 4 ALA HB1 1 1 3 823 1 1 4 ALA HB2 H -5.321 -4.427 2.264 1.00 . A A . 4 ALA HB2 1 1 3 824 1 1 4 ALA HB3 H -5.179 -2.706 2.691 1.00 . A A . 4 ALA HB3 1 1 3 825 1 1 4 ALA N N -7.727 -4.293 1.126 1.00 . A A . 4 ALA N 1 1 3 826 1 1 4 ALA O O -5.918 -3.578 -0.784 1.00 . A A . 4 ALA O 1 1 3 827 1 1 5 ILE C C -3.684 -1.637 -1.302 1.00 . A A . 5 ILE C 1 1 3 828 1 1 5 ILE CA C -5.020 -0.916 -1.111 1.00 . A A . 5 ILE CA 1 1 3 829 1 1 5 ILE CB C -4.831 0.600 -0.898 1.00 . A A . 5 ILE CB 1 1 3 830 1 1 5 ILE CD1 C -6.095 2.794 -0.474 1.00 . A A . 5 ILE CD1 1 1 3 831 1 1 5 ILE CG1 C -6.201 1.298 -0.790 1.00 . A A . 5 ILE CG1 1 1 3 832 1 1 5 ILE CG2 C -4.009 1.217 -2.040 1.00 . A A . 5 ILE CG2 1 1 3 833 1 1 5 ILE H H -5.868 -0.888 0.833 1.00 . A A . 5 ILE H 1 1 3 834 1 1 5 ILE HA H -5.642 -1.066 -1.996 1.00 . A A . 5 ILE HA 1 1 3 835 1 1 5 ILE HB H -4.287 0.754 0.035 1.00 . A A . 5 ILE HB 1 1 3 836 1 1 5 ILE HD11 H -5.453 2.950 0.393 1.00 . A A . 5 ILE HD11 1 1 3 837 1 1 5 ILE HD12 H -5.698 3.343 -1.329 1.00 . A A . 5 ILE HD12 1 1 3 838 1 1 5 ILE HD13 H -7.090 3.183 -0.253 1.00 . A A . 5 ILE HD13 1 1 3 839 1 1 5 ILE HG13 H -6.780 0.847 0.016 1.00 . A A . 5 ILE HG13 1 1 3 840 1 1 5 ILE HG21 H -3.816 2.269 -1.835 1.00 . A A . 5 ILE HG21 1 1 3 841 1 1 5 ILE HG22 H -3.039 0.728 -2.137 1.00 . A A . 5 ILE HG22 1 1 3 842 1 1 5 ILE HG23 H -4.553 1.125 -2.980 1.00 . A A . 5 ILE HG23 1 1 3 843 1 1 5 ILE N N -5.704 -1.491 0.040 1.00 . A A . 5 ILE N 1 1 3 844 1 1 5 ILE O O -2.834 -1.601 -0.413 1.00 . A A . 5 ILE O 1 1 3 845 1 1 6 LYS C C -1.079 -2.180 -3.023 1.00 . A A . 6 LYS C 1 1 3 846 1 1 6 LYS CA C -2.287 -3.069 -2.712 1.00 . A A . 6 LYS CA 1 1 3 847 1 1 6 LYS CB C -2.545 -4.115 -3.802 1.00 . A A . 6 LYS CB 1 1 3 848 1 1 6 LYS CD C -3.571 -6.381 -4.229 1.00 . A A . 6 LYS CD 1 1 3 849 1 1 6 LYS CE C -4.182 -7.634 -3.588 1.00 . A A . 6 LYS CE 1 1 3 850 1 1 6 LYS CG C -3.355 -5.268 -3.196 1.00 . A A . 6 LYS CG 1 1 3 851 1 1 6 LYS H H -4.224 -2.295 -3.141 1.00 . A A . 6 LYS H 1 1 3 852 1 1 6 LYS HA H -2.062 -3.611 -1.800 1.00 . A A . 6 LYS HA 1 1 3 853 1 1 6 LYS HB3 H -1.587 -4.508 -4.147 1.00 . A A . 6 LYS HB3 1 1 3 854 1 1 6 LYS HD3 H -2.622 -6.635 -4.710 1.00 . A A . 6 LYS HD3 1 1 3 855 1 1 6 LYS HE3 H -4.412 -8.351 -4.377 1.00 . A A . 6 LYS HE3 1 1 3 856 1 1 6 LYS HG3 H -4.317 -4.897 -2.837 1.00 . A A . 6 LYS HG3 1 1 3 857 1 1 6 LYS HZ1 H -3.073 -7.649 -1.843 1.00 . A A . 6 LYS HZ1 1 1 3 858 1 1 6 LYS HZ2 H -3.686 -9.114 -2.252 1.00 . A A . 6 LYS HZ2 1 1 3 859 1 1 6 LYS HZ3 H -2.392 -8.512 -3.064 1.00 . A A . 6 LYS HZ3 1 1 3 860 1 1 6 LYS N N -3.493 -2.295 -2.450 1.00 . A A . 6 LYS N 1 1 3 861 1 1 6 LYS NZ N -3.265 -8.272 -2.618 1.00 . A A . 6 LYS NZ 1 1 3 862 1 1 6 LYS O O -1.217 -1.094 -3.590 1.00 . A A . 6 LYS O 1 1 3 863 1 1 7 CYS C C 2.520 -2.896 -2.714 1.00 . A A . 7 CYS C 1 1 3 864 1 1 7 CYS CA C 1.358 -1.911 -2.638 1.00 . A A . 7 CYS CA 1 1 3 865 1 1 7 CYS CB C 1.432 -1.118 -1.333 1.00 . A A . 7 CYS CB 1 1 3 866 1 1 7 CYS H H 0.137 -3.582 -2.219 1.00 . A A . 7 CYS H 1 1 3 867 1 1 7 CYS HA H 1.390 -1.222 -3.479 1.00 . A A . 7 CYS HA 1 1 3 868 1 1 7 CYS HB3 H 1.482 -1.816 -0.503 1.00 . A A . 7 CYS HB3 1 1 3 869 1 1 7 CYS N N 0.108 -2.658 -2.641 1.00 . A A . 7 CYS N 1 1 3 870 1 1 7 CYS O O 2.685 -3.706 -1.799 1.00 . A A . 7 CYS O 1 1 3 871 1 1 7 CYS SG S 2.791 0.047 -1.110 1.00 . A A . 7 CYS SG 1 1 3 872 1 1 8 ALA C C 5.734 -2.694 -3.713 1.00 . A A . 8 ALA C 1 1 3 873 1 1 8 ALA CA C 4.531 -3.609 -3.939 1.00 . A A . 8 ALA CA 1 1 3 874 1 1 8 ALA CB C 4.574 -4.232 -5.337 1.00 . A A . 8 ALA CB 1 1 3 875 1 1 8 ALA H H 3.129 -2.139 -4.514 1.00 . A A . 8 ALA H 1 1 3 876 1 1 8 ALA HA H 4.576 -4.422 -3.211 1.00 . A A . 8 ALA HA 1 1 3 877 1 1 8 ALA HB1 H 4.526 -3.453 -6.099 1.00 . A A . 8 ALA HB1 1 1 3 878 1 1 8 ALA HB2 H 5.500 -4.795 -5.458 1.00 . A A . 8 ALA HB2 1 1 3 879 1 1 8 ALA HB3 H 3.727 -4.906 -5.465 1.00 . A A . 8 ALA HB3 1 1 3 880 1 1 8 ALA N N 3.301 -2.842 -3.794 1.00 . A A . 8 ALA N 1 1 3 881 1 1 8 ALA O O 6.721 -3.100 -3.105 1.00 . A A . 8 ALA O 1 1 3 882 1 1 9 THR C C 6.425 0.711 -3.385 1.00 . A A . 9 THR C 1 1 3 883 1 1 9 THR CA C 6.729 -0.494 -4.277 1.00 . A A . 9 THR CA 1 1 3 884 1 1 9 THR CB C 6.900 -0.052 -5.737 1.00 . A A . 9 THR CB 1 1 3 885 1 1 9 THR CG2 C 7.349 -1.212 -6.629 1.00 . A A . 9 THR CG2 1 1 3 886 1 1 9 THR H H 4.780 -1.196 -4.679 1.00 . A A . 9 THR H 1 1 3 887 1 1 9 THR HA H 7.663 -0.944 -3.938 1.00 . A A . 9 THR HA 1 1 3 888 1 1 9 THR HB H 7.664 0.729 -5.785 1.00 . A A . 9 THR HB 1 1 3 889 1 1 9 THR HG1 H 4.974 -0.199 -6.164 1.00 . A A . 9 THR HG1 1 1 3 890 1 1 9 THR HG21 H 6.588 -1.991 -6.663 1.00 . A A . 9 THR HG21 1 1 3 891 1 1 9 THR HG22 H 7.520 -0.842 -7.640 1.00 . A A . 9 THR HG22 1 1 3 892 1 1 9 THR HG23 H 8.278 -1.634 -6.245 1.00 . A A . 9 THR HG23 1 1 3 893 1 1 9 THR N N 5.650 -1.464 -4.224 1.00 . A A . 9 THR N 1 1 3 894 1 1 9 THR O O 5.272 0.998 -3.070 1.00 . A A . 9 THR O 1 1 3 895 1 1 9 THR OG1 O 5.681 0.467 -6.242 1.00 . A A . 9 THR OG1 1 1 3 896 1 1 10 ASP C C 6.461 3.624 -3.532 1.00 . A A . 10 ASP C 1 1 3 897 1 1 10 ASP CA C 7.301 2.827 -2.530 1.00 . A A . 10 ASP CA 1 1 3 898 1 1 10 ASP CB C 8.690 3.457 -2.334 1.00 . A A . 10 ASP CB 1 1 3 899 1 1 10 ASP CG C 9.484 3.577 -3.633 1.00 . A A . 10 ASP CG 1 1 3 900 1 1 10 ASP H H 8.366 1.301 -3.462 1.00 . A A . 10 ASP H 1 1 3 901 1 1 10 ASP HA H 6.786 2.796 -1.570 1.00 . A A . 10 ASP HA 1 1 3 902 1 1 10 ASP HB3 H 9.269 2.856 -1.631 1.00 . A A . 10 ASP HB3 1 1 3 903 1 1 10 ASP N N 7.460 1.471 -3.033 1.00 . A A . 10 ASP N 1 1 3 904 1 1 10 ASP O O 5.522 4.322 -3.148 1.00 . A A . 10 ASP O 1 1 3 905 1 1 10 ASP OD1 O 9.328 2.656 -4.471 1.00 . A A . 10 ASP OD1 1 1 3 906 1 1 10 ASP OD2 O 10.187 4.596 -3.780 1.00 . A A . 10 ASP OD2 1 1 3 907 1 1 11 ALA C C 4.573 3.935 -5.830 1.00 . A A . 11 ALA C 1 1 3 908 1 1 11 ALA CA C 6.089 4.117 -5.929 1.00 . A A . 11 ALA CA 1 1 3 909 1 1 11 ALA CB C 6.646 3.618 -7.265 1.00 . A A . 11 ALA CB 1 1 3 910 1 1 11 ALA H H 7.656 2.983 -5.002 1.00 . A A . 11 ALA H 1 1 3 911 1 1 11 ALA HA H 6.305 5.185 -5.871 1.00 . A A . 11 ALA HA 1 1 3 912 1 1 11 ALA HB1 H 6.171 4.160 -8.081 1.00 . A A . 11 ALA HB1 1 1 3 913 1 1 11 ALA HB2 H 7.723 3.792 -7.302 1.00 . A A . 11 ALA HB2 1 1 3 914 1 1 11 ALA HB3 H 6.454 2.554 -7.389 1.00 . A A . 11 ALA HB3 1 1 3 915 1 1 11 ALA N N 6.784 3.484 -4.822 1.00 . A A . 11 ALA N 1 1 3 916 1 1 11 ALA O O 3.855 4.927 -5.929 1.00 . A A . 11 ALA O 1 1 3 917 1 1 12 ASP C C 2.052 3.427 -4.447 1.00 . A A . 12 ASP C 1 1 3 918 1 1 12 ASP CA C 2.653 2.432 -5.436 1.00 . A A . 12 ASP CA 1 1 3 919 1 1 12 ASP CB C 2.399 1.026 -4.859 1.00 . A A . 12 ASP CB 1 1 3 920 1 1 12 ASP CG C 2.500 -0.114 -5.849 1.00 . A A . 12 ASP CG 1 1 3 921 1 1 12 ASP H H 4.733 1.925 -5.586 1.00 . A A . 12 ASP H 1 1 3 922 1 1 12 ASP HA H 2.145 2.534 -6.397 1.00 . A A . 12 ASP HA 1 1 3 923 1 1 12 ASP HB3 H 1.386 0.999 -4.456 1.00 . A A . 12 ASP HB3 1 1 3 924 1 1 12 ASP N N 4.081 2.704 -5.617 1.00 . A A . 12 ASP N 1 1 3 925 1 1 12 ASP O O 1.093 4.143 -4.747 1.00 . A A . 12 ASP O 1 1 3 926 1 1 12 ASP OD1 O 1.544 -0.250 -6.643 1.00 . A A . 12 ASP OD1 1 1 3 927 1 1 12 ASP OD2 O 3.467 -0.898 -5.714 1.00 . A A . 12 ASP OD2 1 1 3 928 1 1 13 CYS C C 2.210 5.695 -2.426 1.00 . A A . 13 CYS C 1 1 3 929 1 1 13 CYS CA C 2.024 4.209 -2.152 1.00 . A A . 13 CYS CA 1 1 3 930 1 1 13 CYS CB C 2.521 3.751 -0.776 1.00 . A A . 13 CYS CB 1 1 3 931 1 1 13 CYS H H 3.407 2.838 -3.061 1.00 . A A . 13 CYS H 1 1 3 932 1 1 13 CYS HA H 0.949 4.040 -2.187 1.00 . A A . 13 CYS HA 1 1 3 933 1 1 13 CYS HB3 H 3.246 4.465 -0.390 1.00 . A A . 13 CYS HB3 1 1 3 934 1 1 13 CYS N N 2.593 3.420 -3.228 1.00 . A A . 13 CYS N 1 1 3 935 1 1 13 CYS O O 1.270 6.465 -2.251 1.00 . A A . 13 CYS O 1 1 3 936 1 1 13 CYS SG S 1.170 3.576 0.420 1.00 . A A . 13 CYS SG 1 1 3 937 1 1 14 SER C C 2.837 7.833 -4.736 1.00 . A A . 14 SER C 1 1 3 938 1 1 14 SER CA C 3.639 7.448 -3.473 1.00 . A A . 14 SER CA 1 1 3 939 1 1 14 SER CB C 5.155 7.571 -3.701 1.00 . A A . 14 SER CB 1 1 3 940 1 1 14 SER H H 4.049 5.373 -3.181 1.00 . A A . 14 SER H 1 1 3 941 1 1 14 SER HA H 3.356 8.133 -2.674 1.00 . A A . 14 SER HA 1 1 3 942 1 1 14 SER HB3 H 5.417 7.122 -4.662 1.00 . A A . 14 SER HB3 1 1 3 943 1 1 14 SER HG H 5.206 9.344 -2.891 1.00 . A A . 14 SER HG 1 1 3 944 1 1 14 SER N N 3.349 6.088 -3.007 1.00 . A A . 14 SER N 1 1 3 945 1 1 14 SER O O 3.319 8.572 -5.591 1.00 . A A . 14 SER O 1 1 3 946 1 1 14 SER OG O 5.581 8.923 -3.676 1.00 . A A . 14 SER OG 1 1 3 947 1 1 15 ARG C C -0.770 7.459 -5.106 1.00 . A A . 15 ARG C 1 1 3 948 1 1 15 ARG CA C 0.571 7.695 -5.807 1.00 . A A . 15 ARG CA 1 1 3 949 1 1 15 ARG CB C 0.653 6.817 -7.071 1.00 . A A . 15 ARG CB 1 1 3 950 1 1 15 ARG CD C 2.202 8.278 -8.512 1.00 . A A . 15 ARG CD 1 1 3 951 1 1 15 ARG CG C 1.959 6.909 -7.870 1.00 . A A . 15 ARG CG 1 1 3 952 1 1 15 ARG CZ C 4.123 9.415 -9.634 1.00 . A A . 15 ARG CZ 1 1 3 953 1 1 15 ARG H H 1.271 6.824 -4.043 1.00 . A A . 15 ARG H 1 1 3 954 1 1 15 ARG HA H 0.642 8.751 -6.070 1.00 . A A . 15 ARG HA 1 1 3 955 1 1 15 ARG HB3 H -0.176 7.079 -7.730 1.00 . A A . 15 ARG HB3 1 1 3 956 1 1 15 ARG HD3 H 2.124 9.049 -7.745 1.00 . A A . 15 ARG HD3 1 1 3 957 1 1 15 ARG HE H 4.098 7.481 -9.000 1.00 . A A . 15 ARG HE 1 1 3 958 1 1 15 ARG HG3 H 1.929 6.154 -8.658 1.00 . A A . 15 ARG HG3 1 1 3 959 1 1 15 ARG HH11 H 2.482 10.576 -9.371 1.00 . A A . 15 ARG HH11 1 1 3 960 1 1 15 ARG HH12 H 3.819 11.392 -10.124 1.00 . A A . 15 ARG HH12 1 1 3 961 1 1 15 ARG HH21 H 5.916 8.505 -9.995 1.00 . A A . 15 ARG HH21 1 1 3 962 1 1 15 ARG HH22 H 5.833 10.164 -10.488 1.00 . A A . 15 ARG HH22 1 1 3 963 1 1 15 ARG N N 1.595 7.353 -4.836 1.00 . A A . 15 ARG N 1 1 3 964 1 1 15 ARG NE N 3.552 8.327 -9.092 1.00 . A A . 15 ARG NE 1 1 3 965 1 1 15 ARG NH1 N 3.424 10.552 -9.728 1.00 . A A . 15 ARG NH1 1 1 3 966 1 1 15 ARG NH2 N 5.383 9.357 -10.080 1.00 . A A . 15 ARG NH2 1 1 3 967 1 1 15 ARG O O -1.637 8.330 -5.104 1.00 . A A . 15 ARG O 1 1 3 968 1 1 16 LYS C C -2.504 6.566 -2.594 1.00 . A A . 16 LYS C 1 1 3 969 1 1 16 LYS CA C -2.194 5.847 -3.916 1.00 . A A . 16 LYS CA 1 1 3 970 1 1 16 LYS CB C -2.183 4.325 -3.728 1.00 . A A . 16 LYS CB 1 1 3 971 1 1 16 LYS CD C -1.838 2.089 -4.869 1.00 . A A . 16 LYS CD 1 1 3 972 1 1 16 LYS CE C -1.171 1.487 -6.114 1.00 . A A . 16 LYS CE 1 1 3 973 1 1 16 LYS CG C -2.053 3.595 -5.074 1.00 . A A . 16 LYS CG 1 1 3 974 1 1 16 LYS H H -0.178 5.592 -4.558 1.00 . A A . 16 LYS H 1 1 3 975 1 1 16 LYS HA H -3.000 6.087 -4.612 1.00 . A A . 16 LYS HA 1 1 3 976 1 1 16 LYS HB3 H -3.116 4.022 -3.253 1.00 . A A . 16 LYS HB3 1 1 3 977 1 1 16 LYS HD3 H -2.798 1.611 -4.670 1.00 . A A . 16 LYS HD3 1 1 3 978 1 1 16 LYS HE3 H -0.196 1.960 -6.243 1.00 . A A . 16 LYS HE3 1 1 3 979 1 1 16 LYS HG3 H -1.206 3.998 -5.626 1.00 . A A . 16 LYS HG3 1 1 3 980 1 1 16 LYS HZ1 H -0.087 -0.208 -6.483 1.00 . A A . 16 LYS HZ1 1 1 3 981 1 1 16 LYS HZ2 H -0.809 -0.233 -5.014 1.00 . A A . 16 LYS HZ2 1 1 3 982 1 1 16 LYS HZ3 H -1.715 -0.498 -6.359 1.00 . A A . 16 LYS HZ3 1 1 3 983 1 1 16 LYS N N -0.935 6.273 -4.511 1.00 . A A . 16 LYS N 1 1 3 984 1 1 16 LYS NZ N -0.947 0.036 -5.986 1.00 . A A . 16 LYS NZ 1 1 3 985 1 1 16 LYS O O -3.672 6.822 -2.315 1.00 . A A . 16 LYS O 1 1 3 986 1 1 17 CYS C C -0.509 8.340 -0.062 1.00 . A A . 17 CYS C 1 1 3 987 1 1 17 CYS CA C -1.701 7.452 -0.441 1.00 . A A . 17 CYS CA 1 1 3 988 1 1 17 CYS CB C -1.928 6.348 0.593 1.00 . A A . 17 CYS CB 1 1 3 989 1 1 17 CYS H H -0.539 6.652 -2.033 1.00 . A A . 17 CYS H 1 1 3 990 1 1 17 CYS HA H -2.614 8.043 -0.458 1.00 . A A . 17 CYS HA 1 1 3 991 1 1 17 CYS HB3 H -1.133 5.607 0.540 1.00 . A A . 17 CYS HB3 1 1 3 992 1 1 17 CYS N N -1.496 6.859 -1.762 1.00 . A A . 17 CYS N 1 1 3 993 1 1 17 CYS O O 0.593 7.825 0.107 1.00 . A A . 17 CYS O 1 1 3 994 1 1 17 CYS SG S -2.026 6.949 2.294 1.00 . A A . 17 CYS SG 1 1 3 995 1 1 18 PRO C C 1.144 10.543 1.469 1.00 . A A . 18 PRO C 1 1 3 996 1 1 18 PRO CA C 0.428 10.607 0.116 1.00 . A A . 18 PRO CA 1 1 3 997 1 1 18 PRO CB C -0.182 11.988 -0.147 1.00 . A A . 18 PRO CB 1 1 3 998 1 1 18 PRO CD C -1.948 10.389 -0.028 1.00 . A A . 18 PRO CD 1 1 3 999 1 1 18 PRO CG C -1.617 11.831 0.350 1.00 . A A . 18 PRO CG 1 1 3 1000 1 1 18 PRO HA H 1.154 10.383 -0.667 1.00 . A A . 18 PRO HA 1 1 3 1001 1 1 18 PRO HB3 H -0.200 12.174 -1.222 1.00 . A A . 18 PRO HB3 1 1 3 1002 1 1 18 PRO HD3 H -2.340 10.355 -1.046 1.00 . A A . 18 PRO HD3 1 1 3 1003 1 1 18 PRO HG3 H -2.300 12.548 -0.107 1.00 . A A . 18 PRO HG3 1 1 3 1004 1 1 18 PRO N N -0.684 9.671 0.028 1.00 . A A . 18 PRO N 1 1 3 1005 1 1 18 PRO O O 0.693 9.886 2.406 1.00 . A A . 18 PRO O 1 1 3 1006 1 1 19 GLY C C 4.053 9.961 2.732 1.00 . A A . 19 GLY C 1 1 3 1007 1 1 19 GLY CA C 3.162 11.206 2.719 1.00 . A A . 19 GLY CA 1 1 3 1008 1 1 19 GLY H H 2.583 11.776 0.756 1.00 . A A . 19 GLY H 1 1 3 1009 1 1 19 GLY HA2 H 3.805 12.087 2.691 1.00 . A A . 19 GLY HA2 1 1 3 1010 1 1 19 GLY HA3 H 2.575 11.238 3.637 1.00 . A A . 19 GLY HA3 1 1 3 1011 1 1 19 GLY N N 2.282 11.237 1.556 1.00 . A A . 19 GLY N 1 1 3 1012 1 1 19 GLY O O 4.662 9.654 3.752 1.00 . A A . 19 GLY O 1 1 3 1013 1 1 20 ASN C C 5.031 7.115 2.579 1.00 . A A . 20 ASN C 1 1 3 1014 1 1 20 ASN CA C 4.918 8.048 1.364 1.00 . A A . 20 ASN CA 1 1 3 1015 1 1 20 ASN CB C 6.296 8.426 0.792 1.00 . A A . 20 ASN CB 1 1 3 1016 1 1 20 ASN CG C 6.193 8.954 -0.635 1.00 . A A . 20 ASN CG 1 1 3 1017 1 1 20 ASN H H 3.619 9.595 0.796 1.00 . A A . 20 ASN H 1 1 3 1018 1 1 20 ASN HA H 4.408 7.466 0.594 1.00 . A A . 20 ASN HA 1 1 3 1019 1 1 20 ASN HB3 H 6.923 7.532 0.759 1.00 . A A . 20 ASN HB3 1 1 3 1020 1 1 20 ASN HD21 H 8.060 8.278 -1.122 1.00 . A A . 20 ASN HD21 1 1 3 1021 1 1 20 ASN HD22 H 7.113 8.987 -2.427 1.00 . A A . 20 ASN HD22 1 1 3 1022 1 1 20 ASN N N 4.126 9.252 1.598 1.00 . A A . 20 ASN N 1 1 3 1023 1 1 20 ASN ND2 N 7.228 8.747 -1.445 1.00 . A A . 20 ASN ND2 1 1 3 1024 1 1 20 ASN O O 6.141 6.762 2.978 1.00 . A A . 20 ASN O 1 1 3 1025 1 1 20 ASN OD1 O 5.174 9.512 -1.038 1.00 . A A . 20 ASN OD1 1 1 3 1026 1 1 21 PRO C C 4.385 4.269 3.246 1.00 . A A . 21 PRO C 1 1 3 1027 1 1 21 PRO CA C 3.946 5.509 4.043 1.00 . A A . 21 PRO CA 1 1 3 1028 1 1 21 PRO CB C 2.524 5.371 4.581 1.00 . A A . 21 PRO CB 1 1 3 1029 1 1 21 PRO CD C 2.539 7.015 2.826 1.00 . A A . 21 PRO CD 1 1 3 1030 1 1 21 PRO CG C 1.655 5.944 3.462 1.00 . A A . 21 PRO CG 1 1 3 1031 1 1 21 PRO HA H 4.633 5.719 4.863 1.00 . A A . 21 PRO HA 1 1 3 1032 1 1 21 PRO HB3 H 2.411 5.985 5.475 1.00 . A A . 21 PRO HB3 1 1 3 1033 1 1 21 PRO HD3 H 2.305 7.973 3.290 1.00 . A A . 21 PRO HD3 1 1 3 1034 1 1 21 PRO HG3 H 0.726 6.373 3.836 1.00 . A A . 21 PRO HG3 1 1 3 1035 1 1 21 PRO N N 3.907 6.643 3.141 1.00 . A A . 21 PRO N 1 1 3 1036 1 1 21 PRO O O 4.120 4.189 2.046 1.00 . A A . 21 PRO O 1 1 3 1037 1 1 22 PRO C C 4.547 1.140 2.828 1.00 . A A . 22 PRO C 1 1 3 1038 1 1 22 PRO CA C 5.633 2.162 3.179 1.00 . A A . 22 PRO CA 1 1 3 1039 1 1 22 PRO CB C 6.653 1.570 4.158 1.00 . A A . 22 PRO CB 1 1 3 1040 1 1 22 PRO CD C 5.447 3.297 5.280 1.00 . A A . 22 PRO CD 1 1 3 1041 1 1 22 PRO CG C 6.056 1.915 5.523 1.00 . A A . 22 PRO CG 1 1 3 1042 1 1 22 PRO HA H 6.138 2.476 2.264 1.00 . A A . 22 PRO HA 1 1 3 1043 1 1 22 PRO HB3 H 7.604 2.094 4.042 1.00 . A A . 22 PRO HB3 1 1 3 1044 1 1 22 PRO HD3 H 6.206 4.061 5.461 1.00 . A A . 22 PRO HD3 1 1 3 1045 1 1 22 PRO HG3 H 6.805 1.924 6.314 1.00 . A A . 22 PRO HG3 1 1 3 1046 1 1 22 PRO N N 5.079 3.311 3.876 1.00 . A A . 22 PRO N 1 1 3 1047 1 1 22 PRO O O 3.413 1.206 3.310 1.00 . A A . 22 PRO O 1 1 3 1048 1 1 23 CYS C C 4.238 -1.902 3.112 1.00 . A A . 23 CYS C 1 1 3 1049 1 1 23 CYS CA C 4.089 -1.041 1.863 1.00 . A A . 23 CYS CA 1 1 3 1050 1 1 23 CYS CB C 4.487 -1.877 0.640 1.00 . A A . 23 CYS CB 1 1 3 1051 1 1 23 CYS H H 5.852 0.122 1.644 1.00 . A A . 23 CYS H 1 1 3 1052 1 1 23 CYS HA H 3.050 -0.739 1.734 1.00 . A A . 23 CYS HA 1 1 3 1053 1 1 23 CYS HB3 H 3.760 -2.683 0.553 1.00 . A A . 23 CYS HB3 1 1 3 1054 1 1 23 CYS N N 4.917 0.140 2.026 1.00 . A A . 23 CYS N 1 1 3 1055 1 1 23 CYS O O 5.327 -2.400 3.399 1.00 . A A . 23 CYS O 1 1 3 1056 1 1 23 CYS SG S 4.548 -1.060 -0.968 1.00 . A A . 23 CYS SG 1 1 3 1057 1 1 24 ARG C C 2.992 -4.557 3.599 1.00 . A A . 24 ARG C 1 1 3 1058 1 1 24 ARG CA C 3.007 -3.386 4.591 1.00 . A A . 24 ARG CA 1 1 3 1059 1 1 24 ARG CB C 1.740 -3.301 5.455 1.00 . A A . 24 ARG CB 1 1 3 1060 1 1 24 ARG CD C 0.408 -4.329 7.347 1.00 . A A . 24 ARG CD 1 1 3 1061 1 1 24 ARG CG C 1.636 -4.475 6.440 1.00 . A A . 24 ARG CG 1 1 3 1062 1 1 24 ARG CZ C -0.430 -2.736 9.079 1.00 . A A . 24 ARG CZ 1 1 3 1063 1 1 24 ARG H H 2.269 -1.765 3.476 1.00 . A A . 24 ARG H 1 1 3 1064 1 1 24 ARG HA H 3.868 -3.481 5.256 1.00 . A A . 24 ARG HA 1 1 3 1065 1 1 24 ARG HB3 H 0.856 -3.279 4.817 1.00 . A A . 24 ARG HB3 1 1 3 1066 1 1 24 ARG HD3 H 0.334 -5.233 7.958 1.00 . A A . 24 ARG HD3 1 1 3 1067 1 1 24 ARG HE H 1.386 -2.635 8.165 1.00 . A A . 24 ARG HE 1 1 3 1068 1 1 24 ARG HG3 H 2.538 -4.529 7.052 1.00 . A A . 24 ARG HG3 1 1 3 1069 1 1 24 ARG HH11 H -1.708 -4.248 8.626 1.00 . A A . 24 ARG HH11 1 1 3 1070 1 1 24 ARG HH12 H -2.308 -3.136 9.818 1.00 . A A . 24 ARG HH12 1 1 3 1071 1 1 24 ARG HH21 H 0.633 -1.117 9.747 1.00 . A A . 24 ARG HH21 1 1 3 1072 1 1 24 ARG HH22 H -0.928 -1.308 10.469 1.00 . A A . 24 ARG HH22 1 1 3 1073 1 1 24 ARG N N 3.137 -2.173 3.807 1.00 . A A . 24 ARG N 1 1 3 1074 1 1 24 ARG NE N 0.520 -3.152 8.224 1.00 . A A . 24 ARG NE 1 1 3 1075 1 1 24 ARG NH1 N -1.575 -3.419 9.187 1.00 . A A . 24 ARG NH1 1 1 3 1076 1 1 24 ARG NH2 N -0.227 -1.640 9.821 1.00 . A A . 24 ARG NH2 1 1 3 1077 1 1 24 ARG O O 1.929 -5.081 3.267 1.00 . A A . 24 ARG O 1 1 3 1078 1 1 25 ASN C C 3.321 -6.571 1.452 1.00 . A A . 25 ASN C 1 1 3 1079 1 1 25 ASN CA C 4.531 -5.987 2.182 1.00 . A A . 25 ASN CA 1 1 3 1080 1 1 25 ASN CB C 5.310 -7.085 2.921 1.00 . A A . 25 ASN CB 1 1 3 1081 1 1 25 ASN CG C 6.681 -6.605 3.381 1.00 . A A . 25 ASN CG 1 1 3 1082 1 1 25 ASN H H 4.955 -4.291 3.374 1.00 . A A . 25 ASN H 1 1 3 1083 1 1 25 ASN HA H 5.199 -5.576 1.422 1.00 . A A . 25 ASN HA 1 1 3 1084 1 1 25 ASN HB3 H 5.465 -7.924 2.240 1.00 . A A . 25 ASN HB3 1 1 3 1085 1 1 25 ASN HD21 H 5.942 -5.911 5.149 1.00 . A A . 25 ASN HD21 1 1 3 1086 1 1 25 ASN HD22 H 7.663 -5.684 4.877 1.00 . A A . 25 ASN HD22 1 1 3 1087 1 1 25 ASN N N 4.189 -4.901 3.104 1.00 . A A . 25 ASN N 1 1 3 1088 1 1 25 ASN ND2 N 6.760 -6.012 4.569 1.00 . A A . 25 ASN ND2 1 1 3 1089 1 1 25 ASN O O 2.826 -7.631 1.830 1.00 . A A . 25 ASN O 1 1 3 1090 1 1 25 ASN OD1 O 7.666 -6.757 2.670 1.00 . A A . 25 ASN OD1 1 1 3 1091 1 1 26 GLY C C 0.590 -5.232 -0.301 1.00 . A A . 26 GLY C 1 1 3 1092 1 1 26 GLY CA C 1.683 -6.293 -0.353 1.00 . A A . 26 GLY CA 1 1 3 1093 1 1 26 GLY H H 3.297 -5.021 0.119 1.00 . A A . 26 GLY H 1 1 3 1094 1 1 26 GLY HA2 H 1.983 -6.438 -1.391 1.00 . A A . 26 GLY HA2 1 1 3 1095 1 1 26 GLY HA3 H 1.260 -7.230 0.013 1.00 . A A . 26 GLY HA3 1 1 3 1096 1 1 26 GLY N N 2.850 -5.882 0.408 1.00 . A A . 26 GLY N 1 1 3 1097 1 1 26 GLY O O -0.165 -5.105 -1.265 1.00 . A A . 26 GLY O 1 1 3 1098 1 1 27 PHE C C -0.025 -2.199 1.585 1.00 . A A . 27 PHE C 1 1 3 1099 1 1 27 PHE CA C -0.576 -3.509 1.025 1.00 . A A . 27 PHE CA 1 1 3 1100 1 1 27 PHE CB C -1.622 -4.113 1.961 1.00 . A A . 27 PHE CB 1 1 3 1101 1 1 27 PHE CD1 C -3.343 -5.368 0.589 1.00 . A A . 27 PHE CD1 1 1 3 1102 1 1 27 PHE CD2 C -1.664 -6.645 1.805 1.00 . A A . 27 PHE CD2 1 1 3 1103 1 1 27 PHE CE1 C -3.983 -6.561 0.215 1.00 . A A . 27 PHE CE1 1 1 3 1104 1 1 27 PHE CE2 C -2.260 -7.840 1.367 1.00 . A A . 27 PHE CE2 1 1 3 1105 1 1 27 PHE CG C -2.226 -5.405 1.443 1.00 . A A . 27 PHE CG 1 1 3 1106 1 1 27 PHE CZ C -3.437 -7.800 0.602 1.00 . A A . 27 PHE CZ 1 1 3 1107 1 1 27 PHE H H 1.130 -4.646 1.578 1.00 . A A . 27 PHE H 1 1 3 1108 1 1 27 PHE HA H -1.056 -3.277 0.082 1.00 . A A . 27 PHE HA 1 1 3 1109 1 1 27 PHE HB3 H -2.418 -3.380 2.106 1.00 . A A . 27 PHE HB3 1 1 3 1110 1 1 27 PHE HD1 H -3.751 -4.419 0.282 1.00 . A A . 27 PHE HD1 1 1 3 1111 1 1 27 PHE HD2 H -0.780 -6.683 2.428 1.00 . A A . 27 PHE HD2 1 1 3 1112 1 1 27 PHE HE1 H -4.943 -6.513 -0.284 1.00 . A A . 27 PHE HE1 1 1 3 1113 1 1 27 PHE HE2 H -1.852 -8.788 1.691 1.00 . A A . 27 PHE HE2 1 1 3 1114 1 1 27 PHE HZ H -3.967 -8.717 0.399 1.00 . A A . 27 PHE HZ 1 1 3 1115 1 1 27 PHE N N 0.493 -4.479 0.805 1.00 . A A . 27 PHE N 1 1 3 1116 1 1 27 PHE O O 0.893 -2.216 2.395 1.00 . A A . 27 PHE O 1 1 3 1117 1 1 28 CYS C C -0.362 0.396 3.088 1.00 . A A . 28 CYS C 1 1 3 1118 1 1 28 CYS CA C -0.126 0.266 1.585 1.00 . A A . 28 CYS CA 1 1 3 1119 1 1 28 CYS CB C -0.949 1.348 0.865 1.00 . A A . 28 CYS CB 1 1 3 1120 1 1 28 CYS H H -1.347 -1.121 0.511 1.00 . A A . 28 CYS H 1 1 3 1121 1 1 28 CYS HA H 0.931 0.411 1.364 1.00 . A A . 28 CYS HA 1 1 3 1122 1 1 28 CYS HB3 H -1.239 2.117 1.577 1.00 . A A . 28 CYS HB3 1 1 3 1123 1 1 28 CYS N N -0.560 -1.060 1.146 1.00 . A A . 28 CYS N 1 1 3 1124 1 1 28 CYS O O -1.498 0.233 3.534 1.00 . A A . 28 CYS O 1 1 3 1125 1 1 28 CYS SG S -0.167 2.250 -0.490 1.00 . A A . 28 CYS SG 1 1 3 1126 1 1 29 ALA C C -0.145 2.547 5.361 1.00 . A A . 29 ALA C 1 1 3 1127 1 1 29 ALA CA C 0.442 1.131 5.276 1.00 . A A . 29 ALA CA 1 1 3 1128 1 1 29 ALA CB C 1.769 1.019 6.035 1.00 . A A . 29 ALA CB 1 1 3 1129 1 1 29 ALA H H 1.578 0.929 3.483 1.00 . A A . 29 ALA H 1 1 3 1130 1 1 29 ALA HA H -0.262 0.434 5.736 1.00 . A A . 29 ALA HA 1 1 3 1131 1 1 29 ALA HB1 H 1.599 1.193 7.098 1.00 . A A . 29 ALA HB1 1 1 3 1132 1 1 29 ALA HB2 H 2.193 0.024 5.903 1.00 . A A . 29 ALA HB2 1 1 3 1133 1 1 29 ALA HB3 H 2.477 1.759 5.667 1.00 . A A . 29 ALA HB3 1 1 3 1134 1 1 29 ALA N N 0.652 0.770 3.877 1.00 . A A . 29 ALA N 1 1 3 1135 1 1 29 ALA O O 0.392 3.405 6.057 1.00 . A A . 29 ALA O 1 1 3 1136 1 1 30 CYS C C -2.143 4.844 5.675 1.00 . A A . 30 CYS C 1 1 3 1137 1 1 30 CYS CA C -1.706 4.164 4.381 1.00 . A A . 30 CYS CA 1 1 3 1138 1 1 30 CYS CB C -2.858 4.169 3.377 1.00 . A A . 30 CYS CB 1 1 3 1139 1 1 30 CYS H H -1.681 2.034 4.152 1.00 . A A . 30 CYS H 1 1 3 1140 1 1 30 CYS HA H -0.883 4.725 3.942 1.00 . A A . 30 CYS HA 1 1 3 1141 1 1 30 CYS HB3 H -3.651 3.520 3.744 1.00 . A A . 30 CYS HB3 1 1 3 1142 1 1 30 CYS N N -1.226 2.809 4.620 1.00 . A A . 30 CYS N 1 1 3 1143 1 1 30 CYS O O -2.922 4.287 6.446 1.00 . A A . 30 CYS O 1 1 3 1144 1 1 30 CYS SG S -3.571 5.810 3.114 1.00 . A A . 30 CYS SG 1 1 3 1145 1 1 31 THR C C -3.581 7.195 6.895 1.00 . A A . 31 THR C 1 1 3 1146 1 1 31 THR CA C -2.082 6.921 6.992 1.00 . A A . 31 THR CA 1 1 3 1147 1 1 31 THR CB C -1.260 8.212 6.888 1.00 . A A . 31 THR CB 1 1 3 1148 1 1 31 THR CG2 C 0.136 7.999 7.481 1.00 . A A . 31 THR CG2 1 1 3 1149 1 1 31 THR H H -1.087 6.532 5.211 1.00 . A A . 31 THR H 1 1 3 1150 1 1 31 THR HA H -1.890 6.428 7.947 1.00 . A A . 31 THR HA 1 1 3 1151 1 1 31 THR HB H -1.757 9.023 7.425 1.00 . A A . 31 THR HB 1 1 3 1152 1 1 31 THR HG1 H -0.607 9.349 5.427 1.00 . A A . 31 THR HG1 1 1 3 1153 1 1 31 THR HG21 H 0.054 7.748 8.539 1.00 . A A . 31 THR HG21 1 1 3 1154 1 1 31 THR HG22 H 0.648 7.189 6.961 1.00 . A A . 31 THR HG22 1 1 3 1155 1 1 31 THR HG23 H 0.724 8.913 7.384 1.00 . A A . 31 THR HG23 1 1 3 1156 1 1 31 THR N N -1.669 6.068 5.897 1.00 . A A . 31 THR N 1 1 3 1157 1 1 31 THR O O -4.155 7.837 7.771 1.00 . A A . 31 THR O 1 1 3 1158 1 1 31 THR OG1 O -1.115 8.536 5.514 1.00 . A A . 31 THR OG1 1 1 4 1159 1 1 1 THR C C -12.710 -8.901 0.167 1.00 . A A . 1 THR C 1 1 4 1160 1 1 1 THR CA C -13.996 -9.632 0.585 1.00 . A A . 1 THR CA 1 1 4 1161 1 1 1 THR CB C -14.814 -8.802 1.587 1.00 . A A . 1 THR CB 1 1 4 1162 1 1 1 THR CG2 C -16.277 -9.255 1.583 1.00 . A A . 1 THR CG2 1 1 4 1163 1 1 1 THR H1 H -13.534 -10.816 2.209 1.00 . A A . 1 THR H1 1 1 4 1164 1 1 1 THR HA H -14.594 -9.845 -0.301 1.00 . A A . 1 THR HA 1 1 4 1165 1 1 1 THR HB H -14.771 -7.743 1.328 1.00 . A A . 1 THR HB 1 1 4 1166 1 1 1 THR HG1 H -14.890 -8.596 3.528 1.00 . A A . 1 THR HG1 1 1 4 1167 1 1 1 THR HG21 H -16.709 -9.111 0.592 1.00 . A A . 1 THR HG21 1 1 4 1168 1 1 1 THR HG22 H -16.344 -10.310 1.851 1.00 . A A . 1 THR HG22 1 1 4 1169 1 1 1 THR HG23 H -16.851 -8.666 2.301 1.00 . A A . 1 THR HG23 1 1 4 1170 1 1 1 THR N N -13.684 -10.903 1.210 1.00 . A A . 1 THR N 1 1 4 1171 1 1 1 THR O O -11.664 -9.073 0.796 1.00 . A A . 1 THR O 1 1 4 1172 1 1 1 THR OG1 O -14.296 -8.997 2.892 1.00 . A A . 1 THR OG1 1 1 4 1173 1 1 2 PRO C C -11.252 -6.285 -0.241 1.00 . A A . 2 PRO C 1 1 4 1174 1 1 2 PRO CA C -11.609 -7.304 -1.325 1.00 . A A . 2 PRO CA 1 1 4 1175 1 1 2 PRO CB C -12.033 -6.634 -2.635 1.00 . A A . 2 PRO CB 1 1 4 1176 1 1 2 PRO CD C -13.922 -7.777 -1.712 1.00 . A A . 2 PRO CD 1 1 4 1177 1 1 2 PRO CG C -13.551 -6.519 -2.497 1.00 . A A . 2 PRO CG 1 1 4 1178 1 1 2 PRO HA H -10.758 -7.964 -1.513 1.00 . A A . 2 PRO HA 1 1 4 1179 1 1 2 PRO HB3 H -11.801 -7.296 -3.470 1.00 . A A . 2 PRO HB3 1 1 4 1180 1 1 2 PRO HD3 H -14.101 -8.601 -2.403 1.00 . A A . 2 PRO HD3 1 1 4 1181 1 1 2 PRO HG3 H -14.055 -6.469 -3.465 1.00 . A A . 2 PRO HG3 1 1 4 1182 1 1 2 PRO N N -12.758 -8.081 -0.895 1.00 . A A . 2 PRO N 1 1 4 1183 1 1 2 PRO O O -12.130 -5.588 0.264 1.00 . A A . 2 PRO O 1 1 4 1184 1 1 3 PHE C C -7.991 -5.038 0.821 1.00 . A A . 3 PHE C 1 1 4 1185 1 1 3 PHE CA C -9.445 -5.345 1.161 1.00 . A A . 3 PHE CA 1 1 4 1186 1 1 3 PHE CB C -9.524 -6.055 2.524 1.00 . A A . 3 PHE CB 1 1 4 1187 1 1 3 PHE CD1 C -10.575 -4.525 4.244 1.00 . A A . 3 PHE CD1 1 1 4 1188 1 1 3 PHE CD2 C -11.896 -6.373 3.367 1.00 . A A . 3 PHE CD2 1 1 4 1189 1 1 3 PHE CE1 C -11.646 -4.154 5.077 1.00 . A A . 3 PHE CE1 1 1 4 1190 1 1 3 PHE CE2 C -12.969 -5.997 4.194 1.00 . A A . 3 PHE CE2 1 1 4 1191 1 1 3 PHE CG C -10.698 -5.635 3.387 1.00 . A A . 3 PHE CG 1 1 4 1192 1 1 3 PHE CZ C -12.843 -4.889 5.052 1.00 . A A . 3 PHE CZ 1 1 4 1193 1 1 3 PHE H H -9.277 -6.775 -0.358 1.00 . A A . 3 PHE H 1 1 4 1194 1 1 3 PHE HA H -10.004 -4.408 1.188 1.00 . A A . 3 PHE HA 1 1 4 1195 1 1 3 PHE HB3 H -8.618 -5.846 3.095 1.00 . A A . 3 PHE HB3 1 1 4 1196 1 1 3 PHE HD1 H -9.657 -3.959 4.281 1.00 . A A . 3 PHE HD1 1 1 4 1197 1 1 3 PHE HD2 H -12.001 -7.226 2.711 1.00 . A A . 3 PHE HD2 1 1 4 1198 1 1 3 PHE HE1 H -11.546 -3.307 5.740 1.00 . A A . 3 PHE HE1 1 1 4 1199 1 1 3 PHE HE2 H -13.887 -6.560 4.173 1.00 . A A . 3 PHE HE2 1 1 4 1200 1 1 3 PHE HZ H -13.665 -4.606 5.692 1.00 . A A . 3 PHE HZ 1 1 4 1201 1 1 3 PHE N N -9.969 -6.212 0.119 1.00 . A A . 3 PHE N 1 1 4 1202 1 1 3 PHE O O -7.364 -5.798 0.085 1.00 . A A . 3 PHE O 1 1 4 1203 1 1 4 ALA C C -5.498 -3.143 0.111 1.00 . A A . 4 ALA C 1 1 4 1204 1 1 4 ALA CA C -6.058 -3.609 1.465 1.00 . A A . 4 ALA CA 1 1 4 1205 1 1 4 ALA CB C -5.253 -4.745 2.101 1.00 . A A . 4 ALA CB 1 1 4 1206 1 1 4 ALA H H -8.099 -3.388 1.961 1.00 . A A . 4 ALA H 1 1 4 1207 1 1 4 ALA HA H -5.987 -2.774 2.164 1.00 . A A . 4 ALA HA 1 1 4 1208 1 1 4 ALA HB1 H -4.244 -4.397 2.313 1.00 . A A . 4 ALA HB1 1 1 4 1209 1 1 4 ALA HB2 H -5.716 -5.047 3.041 1.00 . A A . 4 ALA HB2 1 1 4 1210 1 1 4 ALA HB3 H -5.204 -5.609 1.439 1.00 . A A . 4 ALA HB3 1 1 4 1211 1 1 4 ALA N N -7.471 -3.955 1.412 1.00 . A A . 4 ALA N 1 1 4 1212 1 1 4 ALA O O -5.351 -3.914 -0.834 1.00 . A A . 4 ALA O 1 1 4 1213 1 1 5 ILE C C -3.236 -1.879 -1.459 1.00 . A A . 5 ILE C 1 1 4 1214 1 1 5 ILE CA C -4.586 -1.220 -1.150 1.00 . A A . 5 ILE CA 1 1 4 1215 1 1 5 ILE CB C -4.441 0.295 -0.883 1.00 . A A . 5 ILE CB 1 1 4 1216 1 1 5 ILE CD1 C -5.749 2.415 -0.268 1.00 . A A . 5 ILE CD1 1 1 4 1217 1 1 5 ILE CG1 C -5.826 0.937 -0.673 1.00 . A A . 5 ILE CG1 1 1 4 1218 1 1 5 ILE CG2 C -3.702 0.987 -2.035 1.00 . A A . 5 ILE CG2 1 1 4 1219 1 1 5 ILE H H -5.279 -1.275 0.849 1.00 . A A . 5 ILE H 1 1 4 1220 1 1 5 ILE HA H -5.263 -1.362 -1.995 1.00 . A A . 5 ILE HA 1 1 4 1221 1 1 5 ILE HB H -3.852 0.431 0.026 1.00 . A A . 5 ILE HB 1 1 4 1222 1 1 5 ILE HD11 H -6.742 2.757 0.020 1.00 . A A . 5 ILE HD11 1 1 4 1223 1 1 5 ILE HD12 H -5.073 2.537 0.579 1.00 . A A . 5 ILE HD12 1 1 4 1224 1 1 5 ILE HD13 H -5.407 3.029 -1.100 1.00 . A A . 5 ILE HD13 1 1 4 1225 1 1 5 ILE HG13 H -6.356 0.420 0.125 1.00 . A A . 5 ILE HG13 1 1 4 1226 1 1 5 ILE HG21 H -3.554 2.040 -1.812 1.00 . A A . 5 ILE HG21 1 1 4 1227 1 1 5 ILE HG22 H -2.714 0.548 -2.174 1.00 . A A . 5 ILE HG22 1 1 4 1228 1 1 5 ILE HG23 H -4.279 0.885 -2.955 1.00 . A A . 5 ILE HG23 1 1 4 1229 1 1 5 ILE N N -5.163 -1.852 0.030 1.00 . A A . 5 ILE N 1 1 4 1230 1 1 5 ILE O O -2.290 -1.706 -0.700 1.00 . A A . 5 ILE O 1 1 4 1231 1 1 6 LYS C C -0.775 -2.362 -3.251 1.00 . A A . 6 LYS C 1 1 4 1232 1 1 6 LYS CA C -1.920 -3.338 -2.950 1.00 . A A . 6 LYS CA 1 1 4 1233 1 1 6 LYS CB C -2.213 -4.241 -4.156 1.00 . A A . 6 LYS CB 1 1 4 1234 1 1 6 LYS CD C -3.500 -6.241 -4.992 1.00 . A A . 6 LYS CD 1 1 4 1235 1 1 6 LYS CE C -4.464 -7.368 -4.597 1.00 . A A . 6 LYS CE 1 1 4 1236 1 1 6 LYS CG C -3.173 -5.375 -3.769 1.00 . A A . 6 LYS CG 1 1 4 1237 1 1 6 LYS H H -3.961 -2.741 -3.135 1.00 . A A . 6 LYS H 1 1 4 1238 1 1 6 LYS HA H -1.614 -3.975 -2.120 1.00 . A A . 6 LYS HA 1 1 4 1239 1 1 6 LYS HB3 H -1.275 -4.679 -4.503 1.00 . A A . 6 LYS HB3 1 1 4 1240 1 1 6 LYS HD3 H -2.568 -6.656 -5.383 1.00 . A A . 6 LYS HD3 1 1 4 1241 1 1 6 LYS HE3 H -5.381 -6.933 -4.194 1.00 . A A . 6 LYS HE3 1 1 4 1242 1 1 6 LYS HG3 H -4.094 -4.962 -3.354 1.00 . A A . 6 LYS HG3 1 1 4 1243 1 1 6 LYS HZ1 H -5.444 -8.962 -5.444 1.00 . A A . 6 LYS HZ1 1 1 4 1244 1 1 6 LYS HZ2 H -5.259 -7.694 -6.471 1.00 . A A . 6 LYS HZ2 1 1 4 1245 1 1 6 LYS HZ3 H -3.978 -8.670 -6.121 1.00 . A A . 6 LYS HZ3 1 1 4 1246 1 1 6 LYS N N -3.139 -2.629 -2.562 1.00 . A A . 6 LYS N 1 1 4 1247 1 1 6 LYS NZ N -4.810 -8.235 -5.745 1.00 . A A . 6 LYS NZ 1 1 4 1248 1 1 6 LYS O O -1.003 -1.299 -3.836 1.00 . A A . 6 LYS O 1 1 4 1249 1 1 7 CYS C C 2.883 -2.668 -2.957 1.00 . A A . 7 CYS C 1 1 4 1250 1 1 7 CYS CA C 1.610 -1.841 -2.817 1.00 . A A . 7 CYS CA 1 1 4 1251 1 1 7 CYS CB C 1.604 -1.133 -1.463 1.00 . A A . 7 CYS CB 1 1 4 1252 1 1 7 CYS H H 0.564 -3.624 -2.390 1.00 . A A . 7 CYS H 1 1 4 1253 1 1 7 CYS HA H 1.552 -1.106 -3.614 1.00 . A A . 7 CYS HA 1 1 4 1254 1 1 7 CYS HB3 H 1.699 -1.877 -0.676 1.00 . A A . 7 CYS HB3 1 1 4 1255 1 1 7 CYS N N 0.448 -2.725 -2.850 1.00 . A A . 7 CYS N 1 1 4 1256 1 1 7 CYS O O 3.130 -3.527 -2.114 1.00 . A A . 7 CYS O 1 1 4 1257 1 1 7 CYS SG S 2.837 0.146 -1.130 1.00 . A A . 7 CYS SG 1 1 4 1258 1 1 8 ALA C C 6.079 -2.021 -3.752 1.00 . A A . 8 ALA C 1 1 4 1259 1 1 8 ALA CA C 4.998 -3.026 -4.156 1.00 . A A . 8 ALA CA 1 1 4 1260 1 1 8 ALA CB C 5.183 -3.471 -5.610 1.00 . A A . 8 ALA CB 1 1 4 1261 1 1 8 ALA H H 3.452 -1.689 -4.666 1.00 . A A . 8 ALA H 1 1 4 1262 1 1 8 ALA HA H 5.103 -3.911 -3.526 1.00 . A A . 8 ALA HA 1 1 4 1263 1 1 8 ALA HB1 H 5.088 -2.618 -6.282 1.00 . A A . 8 ALA HB1 1 1 4 1264 1 1 8 ALA HB2 H 6.170 -3.914 -5.733 1.00 . A A . 8 ALA HB2 1 1 4 1265 1 1 8 ALA HB3 H 4.425 -4.212 -5.865 1.00 . A A . 8 ALA HB3 1 1 4 1266 1 1 8 ALA N N 3.681 -2.425 -3.998 1.00 . A A . 8 ALA N 1 1 4 1267 1 1 8 ALA O O 7.094 -2.404 -3.174 1.00 . A A . 8 ALA O 1 1 4 1268 1 1 9 THR C C 6.408 1.459 -3.077 1.00 . A A . 9 THR C 1 1 4 1269 1 1 9 THR CA C 6.861 0.315 -3.989 1.00 . A A . 9 THR CA 1 1 4 1270 1 1 9 THR CB C 7.106 0.852 -5.406 1.00 . A A . 9 THR CB 1 1 4 1271 1 1 9 THR CG2 C 7.745 -0.206 -6.310 1.00 . A A . 9 THR CG2 1 1 4 1272 1 1 9 THR H H 4.998 -0.511 -4.552 1.00 . A A . 9 THR H 1 1 4 1273 1 1 9 THR HA H 7.803 -0.074 -3.598 1.00 . A A . 9 THR HA 1 1 4 1274 1 1 9 THR HB H 7.788 1.702 -5.350 1.00 . A A . 9 THR HB 1 1 4 1275 1 1 9 THR HG1 H 5.246 0.544 -6.013 1.00 . A A . 9 THR HG1 1 1 4 1276 1 1 9 THR HG21 H 7.964 0.236 -7.283 1.00 . A A . 9 THR HG21 1 1 4 1277 1 1 9 THR HG22 H 8.676 -0.557 -5.864 1.00 . A A . 9 THR HG22 1 1 4 1278 1 1 9 THR HG23 H 7.072 -1.051 -6.451 1.00 . A A . 9 THR HG23 1 1 4 1279 1 1 9 THR N N 5.867 -0.743 -4.078 1.00 . A A . 9 THR N 1 1 4 1280 1 1 9 THR O O 5.217 1.681 -2.868 1.00 . A A . 9 THR O 1 1 4 1281 1 1 9 THR OG1 O 5.886 1.277 -5.990 1.00 . A A . 9 THR OG1 1 1 4 1282 1 1 10 ASP C C 6.209 4.325 -3.202 1.00 . A A . 10 ASP C 1 1 4 1283 1 1 10 ASP CA C 7.178 3.643 -2.225 1.00 . A A . 10 ASP CA 1 1 4 1284 1 1 10 ASP CB C 8.555 4.333 -2.218 1.00 . A A . 10 ASP CB 1 1 4 1285 1 1 10 ASP CG C 9.359 3.942 -3.450 1.00 . A A . 10 ASP CG 1 1 4 1286 1 1 10 ASP H H 8.342 2.004 -2.826 1.00 . A A . 10 ASP H 1 1 4 1287 1 1 10 ASP HA H 6.750 3.689 -1.222 1.00 . A A . 10 ASP HA 1 1 4 1288 1 1 10 ASP HB3 H 9.108 4.018 -1.333 1.00 . A A . 10 ASP HB3 1 1 4 1289 1 1 10 ASP N N 7.374 2.247 -2.608 1.00 . A A . 10 ASP N 1 1 4 1290 1 1 10 ASP O O 5.139 4.777 -2.804 1.00 . A A . 10 ASP O 1 1 4 1291 1 1 10 ASP OD1 O 9.901 2.817 -3.420 1.00 . A A . 10 ASP OD1 1 1 4 1292 1 1 10 ASP OD2 O 9.243 4.670 -4.457 1.00 . A A . 10 ASP OD2 1 1 4 1293 1 1 11 ALA C C 4.280 4.500 -5.501 1.00 . A A . 11 ALA C 1 1 4 1294 1 1 11 ALA CA C 5.751 4.925 -5.562 1.00 . A A . 11 ALA CA 1 1 4 1295 1 1 11 ALA CB C 6.383 4.589 -6.916 1.00 . A A . 11 ALA CB 1 1 4 1296 1 1 11 ALA H H 7.538 4.179 -4.706 1.00 . A A . 11 ALA H 1 1 4 1297 1 1 11 ALA HA H 5.787 6.010 -5.453 1.00 . A A . 11 ALA HA 1 1 4 1298 1 1 11 ALA HB1 H 5.825 5.084 -7.710 1.00 . A A . 11 ALA HB1 1 1 4 1299 1 1 11 ALA HB2 H 7.416 4.939 -6.936 1.00 . A A . 11 ALA HB2 1 1 4 1300 1 1 11 ALA HB3 H 6.368 3.514 -7.089 1.00 . A A . 11 ALA HB3 1 1 4 1301 1 1 11 ALA N N 6.562 4.369 -4.490 1.00 . A A . 11 ALA N 1 1 4 1302 1 1 11 ALA O O 3.419 5.357 -5.670 1.00 . A A . 11 ALA O 1 1 4 1303 1 1 12 ASP C C 1.872 3.617 -4.082 1.00 . A A . 12 ASP C 1 1 4 1304 1 1 12 ASP CA C 2.582 2.769 -5.130 1.00 . A A . 12 ASP CA 1 1 4 1305 1 1 12 ASP CB C 2.478 1.305 -4.686 1.00 . A A . 12 ASP CB 1 1 4 1306 1 1 12 ASP CG C 2.716 0.308 -5.791 1.00 . A A . 12 ASP CG 1 1 4 1307 1 1 12 ASP H H 4.721 2.535 -5.193 1.00 . A A . 12 ASP H 1 1 4 1308 1 1 12 ASP HA H 2.064 2.889 -6.083 1.00 . A A . 12 ASP HA 1 1 4 1309 1 1 12 ASP HB3 H 1.472 1.132 -4.308 1.00 . A A . 12 ASP HB3 1 1 4 1310 1 1 12 ASP N N 3.969 3.215 -5.280 1.00 . A A . 12 ASP N 1 1 4 1311 1 1 12 ASP O O 0.844 4.238 -4.373 1.00 . A A . 12 ASP O 1 1 4 1312 1 1 12 ASP OD1 O 1.768 0.135 -6.587 1.00 . A A . 12 ASP OD1 1 1 4 1313 1 1 12 ASP OD2 O 3.788 -0.337 -5.750 1.00 . A A . 12 ASP OD2 1 1 4 1314 1 1 13 CYS C C 1.768 5.859 -2.260 1.00 . A A . 13 CYS C 1 1 4 1315 1 1 13 CYS CA C 1.846 4.417 -1.783 1.00 . A A . 13 CYS CA 1 1 4 1316 1 1 13 CYS CB C 2.644 4.331 -0.476 1.00 . A A . 13 CYS CB 1 1 4 1317 1 1 13 CYS H H 3.281 3.114 -2.712 1.00 . A A . 13 CYS H 1 1 4 1318 1 1 13 CYS HA H 0.828 4.078 -1.598 1.00 . A A . 13 CYS HA 1 1 4 1319 1 1 13 CYS HB3 H 2.482 5.263 0.065 1.00 . A A . 13 CYS HB3 1 1 4 1320 1 1 13 CYS N N 2.406 3.609 -2.857 1.00 . A A . 13 CYS N 1 1 4 1321 1 1 13 CYS O O 0.675 6.407 -2.307 1.00 . A A . 13 CYS O 1 1 4 1322 1 1 13 CYS SG S 2.196 3.040 0.711 1.00 . A A . 13 CYS SG 1 1 4 1323 1 1 14 SER C C 2.376 8.119 -4.500 1.00 . A A . 14 SER C 1 1 4 1324 1 1 14 SER CA C 3.017 7.839 -3.126 1.00 . A A . 14 SER CA 1 1 4 1325 1 1 14 SER CB C 4.502 8.224 -3.111 1.00 . A A . 14 SER CB 1 1 4 1326 1 1 14 SER H H 3.724 5.869 -2.697 1.00 . A A . 14 SER H 1 1 4 1327 1 1 14 SER HA H 2.502 8.454 -2.384 1.00 . A A . 14 SER HA 1 1 4 1328 1 1 14 SER HB3 H 4.961 7.957 -4.066 1.00 . A A . 14 SER HB3 1 1 4 1329 1 1 14 SER HG H 5.570 9.855 -3.029 1.00 . A A . 14 SER HG 1 1 4 1330 1 1 14 SER N N 2.889 6.444 -2.695 1.00 . A A . 14 SER N 1 1 4 1331 1 1 14 SER O O 2.897 8.892 -5.304 1.00 . A A . 14 SER O 1 1 4 1332 1 1 14 SER OG O 4.659 9.608 -2.856 1.00 . A A . 14 SER OG 1 1 4 1333 1 1 15 ARG C C -1.081 7.430 -5.336 1.00 . A A . 15 ARG C 1 1 4 1334 1 1 15 ARG CA C 0.323 7.695 -5.880 1.00 . A A . 15 ARG CA 1 1 4 1335 1 1 15 ARG CB C 0.638 6.700 -7.008 1.00 . A A . 15 ARG CB 1 1 4 1336 1 1 15 ARG CD C 2.238 5.946 -8.788 1.00 . A A . 15 ARG CD 1 1 4 1337 1 1 15 ARG CG C 1.888 7.078 -7.814 1.00 . A A . 15 ARG CG 1 1 4 1338 1 1 15 ARG CZ C 3.669 7.016 -10.540 1.00 . A A . 15 ARG CZ 1 1 4 1339 1 1 15 ARG H H 0.879 6.921 -4.014 1.00 . A A . 15 ARG H 1 1 4 1340 1 1 15 ARG HA H 0.377 8.720 -6.251 1.00 . A A . 15 ARG HA 1 1 4 1341 1 1 15 ARG HB3 H -0.209 6.669 -7.693 1.00 . A A . 15 ARG HB3 1 1 4 1342 1 1 15 ARG HD3 H 1.421 5.768 -9.490 1.00 . A A . 15 ARG HD3 1 1 4 1343 1 1 15 ARG HE H 4.307 5.702 -9.123 1.00 . A A . 15 ARG HE 1 1 4 1344 1 1 15 ARG HG3 H 2.730 7.223 -7.141 1.00 . A A . 15 ARG HG3 1 1 4 1345 1 1 15 ARG HH11 H 1.733 7.610 -10.551 1.00 . A A . 15 ARG HH11 1 1 4 1346 1 1 15 ARG HH12 H 2.701 8.319 -11.810 1.00 . A A . 15 ARG HH12 1 1 4 1347 1 1 15 ARG HH21 H 5.666 6.634 -10.747 1.00 . A A . 15 ARG HH21 1 1 4 1348 1 1 15 ARG HH22 H 5.017 7.753 -11.901 1.00 . A A . 15 ARG HH22 1 1 4 1349 1 1 15 ARG N N 1.223 7.507 -4.756 1.00 . A A . 15 ARG N 1 1 4 1350 1 1 15 ARG NE N 3.506 6.200 -9.487 1.00 . A A . 15 ARG NE 1 1 4 1351 1 1 15 ARG NH1 N 2.623 7.700 -11.019 1.00 . A A . 15 ARG NH1 1 1 4 1352 1 1 15 ARG NH2 N 4.874 7.143 -11.109 1.00 . A A . 15 ARG NH2 1 1 4 1353 1 1 15 ARG O O -1.994 8.227 -5.528 1.00 . A A . 15 ARG O 1 1 4 1354 1 1 16 LYS C C -2.894 6.683 -2.838 1.00 . A A . 16 LYS C 1 1 4 1355 1 1 16 LYS CA C -2.504 5.861 -4.079 1.00 . A A . 16 LYS CA 1 1 4 1356 1 1 16 LYS CB C -2.411 4.351 -3.797 1.00 . A A . 16 LYS CB 1 1 4 1357 1 1 16 LYS CD C -1.688 2.154 -4.883 1.00 . A A . 16 LYS CD 1 1 4 1358 1 1 16 LYS CE C -1.558 1.403 -6.217 1.00 . A A . 16 LYS CE 1 1 4 1359 1 1 16 LYS CG C -2.235 3.569 -5.114 1.00 . A A . 16 LYS CG 1 1 4 1360 1 1 16 LYS H H -0.443 5.674 -4.524 1.00 . A A . 16 LYS H 1 1 4 1361 1 1 16 LYS HA H -3.292 6.010 -4.821 1.00 . A A . 16 LYS HA 1 1 4 1362 1 1 16 LYS HB3 H -3.323 4.017 -3.301 1.00 . A A . 16 LYS HB3 1 1 4 1363 1 1 16 LYS HD3 H -2.361 1.609 -4.226 1.00 . A A . 16 LYS HD3 1 1 4 1364 1 1 16 LYS HE3 H -1.063 2.035 -6.956 1.00 . A A . 16 LYS HE3 1 1 4 1365 1 1 16 LYS HG3 H -1.531 4.086 -5.766 1.00 . A A . 16 LYS HG3 1 1 4 1366 1 1 16 LYS HZ1 H -1.001 -0.360 -5.245 1.00 . A A . 16 LYS HZ1 1 1 4 1367 1 1 16 LYS HZ2 H -0.891 -0.434 -6.894 1.00 . A A . 16 LYS HZ2 1 1 4 1368 1 1 16 LYS HZ3 H 0.228 0.365 -6.067 1.00 . A A . 16 LYS HZ3 1 1 4 1369 1 1 16 LYS N N -1.239 6.295 -4.648 1.00 . A A . 16 LYS N 1 1 4 1370 1 1 16 LYS NZ N -0.771 0.159 -6.088 1.00 . A A . 16 LYS NZ 1 1 4 1371 1 1 16 LYS O O -4.078 6.764 -2.517 1.00 . A A . 16 LYS O 1 1 4 1372 1 1 17 CYS C C -0.950 9.015 -0.675 1.00 . A A . 17 CYS C 1 1 4 1373 1 1 17 CYS CA C -2.157 8.095 -0.937 1.00 . A A . 17 CYS CA 1 1 4 1374 1 1 17 CYS CB C -2.429 7.170 0.255 1.00 . A A . 17 CYS CB 1 1 4 1375 1 1 17 CYS H H -0.960 7.152 -2.400 1.00 . A A . 17 CYS H 1 1 4 1376 1 1 17 CYS HA H -3.044 8.705 -1.109 1.00 . A A . 17 CYS HA 1 1 4 1377 1 1 17 CYS HB3 H -1.835 6.261 0.161 1.00 . A A . 17 CYS HB3 1 1 4 1378 1 1 17 CYS N N -1.929 7.288 -2.135 1.00 . A A . 17 CYS N 1 1 4 1379 1 1 17 CYS O O 0.188 8.596 -0.852 1.00 . A A . 17 CYS O 1 1 4 1380 1 1 17 CYS SG S -2.037 7.874 1.870 1.00 . A A . 17 CYS SG 1 1 4 1381 1 1 18 PRO C C 0.815 10.868 1.096 1.00 . A A . 18 PRO C 1 1 4 1382 1 1 18 PRO CA C -0.065 11.233 -0.107 1.00 . A A . 18 PRO CA 1 1 4 1383 1 1 18 PRO CB C -0.740 12.596 0.072 1.00 . A A . 18 PRO CB 1 1 4 1384 1 1 18 PRO CD C -2.437 10.919 -0.014 1.00 . A A . 18 PRO CD 1 1 4 1385 1 1 18 PRO CG C -2.092 12.233 0.687 1.00 . A A . 18 PRO CG 1 1 4 1386 1 1 18 PRO HA H 0.559 11.253 -1.004 1.00 . A A . 18 PRO HA 1 1 4 1387 1 1 18 PRO HB3 H -0.906 13.046 -0.907 1.00 . A A . 18 PRO HB3 1 1 4 1388 1 1 18 PRO HD3 H -2.943 11.131 -0.958 1.00 . A A . 18 PRO HD3 1 1 4 1389 1 1 18 PRO HG3 H -2.847 13.003 0.523 1.00 . A A . 18 PRO HG3 1 1 4 1390 1 1 18 PRO N N -1.156 10.285 -0.289 1.00 . A A . 18 PRO N 1 1 4 1391 1 1 18 PRO O O 0.471 10.006 1.902 1.00 . A A . 18 PRO O 1 1 4 1392 1 1 19 GLY C C 3.892 10.306 2.230 1.00 . A A . 19 GLY C 1 1 4 1393 1 1 19 GLY CA C 2.846 11.415 2.379 1.00 . A A . 19 GLY CA 1 1 4 1394 1 1 19 GLY H H 2.206 12.228 0.524 1.00 . A A . 19 GLY H 1 1 4 1395 1 1 19 GLY HA2 H 3.370 12.360 2.512 1.00 . A A . 19 GLY HA2 1 1 4 1396 1 1 19 GLY HA3 H 2.262 11.225 3.281 1.00 . A A . 19 GLY HA3 1 1 4 1397 1 1 19 GLY N N 1.962 11.542 1.224 1.00 . A A . 19 GLY N 1 1 4 1398 1 1 19 GLY O O 4.837 10.255 3.012 1.00 . A A . 19 GLY O 1 1 4 1399 1 1 20 ASN C C 4.893 7.429 2.214 1.00 . A A . 20 ASN C 1 1 4 1400 1 1 20 ASN CA C 4.638 8.304 0.974 1.00 . A A . 20 ASN CA 1 1 4 1401 1 1 20 ASN CB C 5.960 8.808 0.369 1.00 . A A . 20 ASN CB 1 1 4 1402 1 1 20 ASN CG C 6.841 7.656 -0.116 1.00 . A A . 20 ASN CG 1 1 4 1403 1 1 20 ASN H H 2.922 9.514 0.646 1.00 . A A . 20 ASN H 1 1 4 1404 1 1 20 ASN HA H 4.148 7.678 0.227 1.00 . A A . 20 ASN HA 1 1 4 1405 1 1 20 ASN HB3 H 6.503 9.386 1.118 1.00 . A A . 20 ASN HB3 1 1 4 1406 1 1 20 ASN HD21 H 8.555 8.711 0.202 1.00 . A A . 20 ASN HD21 1 1 4 1407 1 1 20 ASN HD22 H 8.742 7.090 -0.451 1.00 . A A . 20 ASN HD22 1 1 4 1408 1 1 20 ASN N N 3.739 9.427 1.235 1.00 . A A . 20 ASN N 1 1 4 1409 1 1 20 ASN ND2 N 8.156 7.849 -0.136 1.00 . A A . 20 ASN ND2 1 1 4 1410 1 1 20 ASN O O 6.045 7.233 2.601 1.00 . A A . 20 ASN O 1 1 4 1411 1 1 20 ASN OD1 O 6.345 6.602 -0.500 1.00 . A A . 20 ASN OD1 1 1 4 1412 1 1 21 PRO C C 4.607 4.553 3.095 1.00 . A A . 21 PRO C 1 1 4 1413 1 1 21 PRO CA C 4.030 5.792 3.805 1.00 . A A . 21 PRO CA 1 1 4 1414 1 1 21 PRO CB C 2.640 5.542 4.401 1.00 . A A . 21 PRO CB 1 1 4 1415 1 1 21 PRO CD C 2.439 7.139 2.606 1.00 . A A . 21 PRO CD 1 1 4 1416 1 1 21 PRO CG C 1.680 6.020 3.313 1.00 . A A . 21 PRO CG 1 1 4 1417 1 1 21 PRO HA H 4.713 6.120 4.592 1.00 . A A . 21 PRO HA 1 1 4 1418 1 1 21 PRO HB3 H 2.512 6.167 5.286 1.00 . A A . 21 PRO HB3 1 1 4 1419 1 1 21 PRO HD3 H 2.178 8.091 3.069 1.00 . A A . 21 PRO HD3 1 1 4 1420 1 1 21 PRO HG3 H 0.744 6.384 3.739 1.00 . A A . 21 PRO HG3 1 1 4 1421 1 1 21 PRO N N 3.849 6.866 2.840 1.00 . A A . 21 PRO N 1 1 4 1422 1 1 21 PRO O O 4.621 4.499 1.868 1.00 . A A . 21 PRO O 1 1 4 1423 1 1 22 PRO C C 4.670 1.343 2.843 1.00 . A A . 22 PRO C 1 1 4 1424 1 1 22 PRO CA C 5.726 2.374 3.255 1.00 . A A . 22 PRO CA 1 1 4 1425 1 1 22 PRO CB C 6.626 1.821 4.363 1.00 . A A . 22 PRO CB 1 1 4 1426 1 1 22 PRO CD C 5.281 3.568 5.285 1.00 . A A . 22 PRO CD 1 1 4 1427 1 1 22 PRO CG C 5.869 2.199 5.636 1.00 . A A . 22 PRO CG 1 1 4 1428 1 1 22 PRO HA H 6.334 2.638 2.387 1.00 . A A . 22 PRO HA 1 1 4 1429 1 1 22 PRO HB3 H 7.582 2.346 4.345 1.00 . A A . 22 PRO HB3 1 1 4 1430 1 1 22 PRO HD3 H 5.993 4.347 5.563 1.00 . A A . 22 PRO HD3 1 1 4 1431 1 1 22 PRO HG3 H 6.519 2.239 6.510 1.00 . A A . 22 PRO HG3 1 1 4 1432 1 1 22 PRO N N 5.117 3.561 3.840 1.00 . A A . 22 PRO N 1 1 4 1433 1 1 22 PRO O O 3.522 1.383 3.293 1.00 . A A . 22 PRO O 1 1 4 1434 1 1 23 CYS C C 4.580 -1.749 3.102 1.00 . A A . 23 CYS C 1 1 4 1435 1 1 23 CYS CA C 4.316 -0.871 1.879 1.00 . A A . 23 CYS CA 1 1 4 1436 1 1 23 CYS CB C 4.705 -1.649 0.614 1.00 . A A . 23 CYS CB 1 1 4 1437 1 1 23 CYS H H 6.028 0.369 1.690 1.00 . A A . 23 CYS H 1 1 4 1438 1 1 23 CYS HA H 3.256 -0.631 1.812 1.00 . A A . 23 CYS HA 1 1 4 1439 1 1 23 CYS HB3 H 4.016 -2.487 0.517 1.00 . A A . 23 CYS HB3 1 1 4 1440 1 1 23 CYS N N 5.078 0.361 2.031 1.00 . A A . 23 CYS N 1 1 4 1441 1 1 23 CYS O O 5.680 -1.737 3.651 1.00 . A A . 23 CYS O 1 1 4 1442 1 1 23 CYS SG S 4.694 -0.784 -0.975 1.00 . A A . 23 CYS SG 1 1 4 1443 1 1 24 ARG C C 2.919 -4.756 4.075 1.00 . A A . 24 ARG C 1 1 4 1444 1 1 24 ARG CA C 3.681 -3.528 4.568 1.00 . A A . 24 ARG CA 1 1 4 1445 1 1 24 ARG CB C 3.072 -2.954 5.853 1.00 . A A . 24 ARG CB 1 1 4 1446 1 1 24 ARG CD C 2.615 -3.294 8.303 1.00 . A A . 24 ARG CD 1 1 4 1447 1 1 24 ARG CG C 3.168 -3.938 7.025 1.00 . A A . 24 ARG CG 1 1 4 1448 1 1 24 ARG CZ C 1.808 -5.194 9.724 1.00 . A A . 24 ARG CZ 1 1 4 1449 1 1 24 ARG H H 2.695 -2.471 3.040 1.00 . A A . 24 ARG H 1 1 4 1450 1 1 24 ARG HA H 4.725 -3.789 4.750 1.00 . A A . 24 ARG HA 1 1 4 1451 1 1 24 ARG HB3 H 2.025 -2.699 5.674 1.00 . A A . 24 ARG HB3 1 1 4 1452 1 1 24 ARG HD3 H 1.594 -2.940 8.145 1.00 . A A . 24 ARG HD3 1 1 4 1453 1 1 24 ARG HE H 3.450 -4.050 10.094 1.00 . A A . 24 ARG HE 1 1 4 1454 1 1 24 ARG HG3 H 4.215 -4.206 7.182 1.00 . A A . 24 ARG HG3 1 1 4 1455 1 1 24 ARG HH11 H 0.706 -4.876 8.050 1.00 . A A . 24 ARG HH11 1 1 4 1456 1 1 24 ARG HH12 H 0.111 -6.158 9.059 1.00 . A A . 24 ARG HH12 1 1 4 1457 1 1 24 ARG HH21 H 2.718 -5.762 11.468 1.00 . A A . 24 ARG HH21 1 1 4 1458 1 1 24 ARG HH22 H 1.309 -6.679 11.048 1.00 . A A . 24 ARG HH22 1 1 4 1459 1 1 24 ARG N N 3.589 -2.537 3.513 1.00 . A A . 24 ARG N 1 1 4 1460 1 1 24 ARG NE N 2.683 -4.211 9.453 1.00 . A A . 24 ARG NE 1 1 4 1461 1 1 24 ARG NH1 N 0.793 -5.433 8.885 1.00 . A A . 24 ARG NH1 1 1 4 1462 1 1 24 ARG NH2 N 1.955 -5.936 10.828 1.00 . A A . 24 ARG NH2 1 1 4 1463 1 1 24 ARG O O 1.762 -4.636 3.678 1.00 . A A . 24 ARG O 1 1 4 1464 1 1 25 ASN C C 2.376 -7.017 2.166 1.00 . A A . 25 ASN C 1 1 4 1465 1 1 25 ASN CA C 2.981 -7.174 3.572 1.00 . A A . 25 ASN CA 1 1 4 1466 1 1 25 ASN CB C 1.971 -7.700 4.607 1.00 . A A . 25 ASN CB 1 1 4 1467 1 1 25 ASN CG C 1.376 -9.063 4.253 1.00 . A A . 25 ASN CG 1 1 4 1468 1 1 25 ASN H H 4.528 -5.946 4.370 1.00 . A A . 25 ASN H 1 1 4 1469 1 1 25 ASN HA H 3.794 -7.897 3.488 1.00 . A A . 25 ASN HA 1 1 4 1470 1 1 25 ASN HB3 H 1.151 -6.987 4.708 1.00 . A A . 25 ASN HB3 1 1 4 1471 1 1 25 ASN HD21 H 3.213 -9.953 4.108 1.00 . A A . 25 ASN HD21 1 1 4 1472 1 1 25 ASN HD22 H 1.820 -10.969 3.804 1.00 . A A . 25 ASN HD22 1 1 4 1473 1 1 25 ASN N N 3.570 -5.923 4.053 1.00 . A A . 25 ASN N 1 1 4 1474 1 1 25 ASN ND2 N 2.216 -10.073 4.042 1.00 . A A . 25 ASN ND2 1 1 4 1475 1 1 25 ASN O O 1.392 -7.660 1.825 1.00 . A A . 25 ASN O 1 1 4 1476 1 1 25 ASN OD1 O 0.160 -9.218 4.207 1.00 . A A . 25 ASN OD1 1 1 4 1477 1 1 26 GLY C C 1.287 -5.012 -0.101 1.00 . A A . 26 GLY C 1 1 4 1478 1 1 26 GLY CA C 2.524 -5.914 -0.022 1.00 . A A . 26 GLY CA 1 1 4 1479 1 1 26 GLY H H 3.800 -5.670 1.656 1.00 . A A . 26 GLY H 1 1 4 1480 1 1 26 GLY HA2 H 3.344 -5.445 -0.562 1.00 . A A . 26 GLY HA2 1 1 4 1481 1 1 26 GLY HA3 H 2.300 -6.862 -0.512 1.00 . A A . 26 GLY HA3 1 1 4 1482 1 1 26 GLY N N 2.981 -6.161 1.337 1.00 . A A . 26 GLY N 1 1 4 1483 1 1 26 GLY O O 0.635 -4.969 -1.146 1.00 . A A . 26 GLY O 1 1 4 1484 1 1 27 PHE C C 0.255 -2.005 1.577 1.00 . A A . 27 PHE C 1 1 4 1485 1 1 27 PHE CA C -0.178 -3.363 1.019 1.00 . A A . 27 PHE CA 1 1 4 1486 1 1 27 PHE CB C -1.284 -3.963 1.887 1.00 . A A . 27 PHE CB 1 1 4 1487 1 1 27 PHE CD1 C -2.607 -5.411 0.287 1.00 . A A . 27 PHE CD1 1 1 4 1488 1 1 27 PHE CD2 C -1.407 -6.485 2.108 1.00 . A A . 27 PHE CD2 1 1 4 1489 1 1 27 PHE CE1 C -3.131 -6.655 -0.104 1.00 . A A . 27 PHE CE1 1 1 4 1490 1 1 27 PHE CE2 C -1.883 -7.738 1.682 1.00 . A A . 27 PHE CE2 1 1 4 1491 1 1 27 PHE CG C -1.773 -5.318 1.414 1.00 . A A . 27 PHE CG 1 1 4 1492 1 1 27 PHE CZ C -2.760 -7.821 0.588 1.00 . A A . 27 PHE CZ 1 1 4 1493 1 1 27 PHE H H 1.489 -4.375 1.831 1.00 . A A . 27 PHE H 1 1 4 1494 1 1 27 PHE HA H -0.559 -3.216 0.012 1.00 . A A . 27 PHE HA 1 1 4 1495 1 1 27 PHE HB3 H -2.124 -3.268 1.892 1.00 . A A . 27 PHE HB3 1 1 4 1496 1 1 27 PHE HD1 H -2.904 -4.519 -0.240 1.00 . A A . 27 PHE HD1 1 1 4 1497 1 1 27 PHE HD2 H -0.722 -6.437 2.942 1.00 . A A . 27 PHE HD2 1 1 4 1498 1 1 27 PHE HE1 H -3.859 -6.705 -0.901 1.00 . A A . 27 PHE HE1 1 1 4 1499 1 1 27 PHE HE2 H -1.562 -8.633 2.198 1.00 . A A . 27 PHE HE2 1 1 4 1500 1 1 27 PHE HZ H -3.156 -8.781 0.287 1.00 . A A . 27 PHE HZ 1 1 4 1501 1 1 27 PHE N N 0.963 -4.274 0.971 1.00 . A A . 27 PHE N 1 1 4 1502 1 1 27 PHE O O 1.107 -1.951 2.457 1.00 . A A . 27 PHE O 1 1 4 1503 1 1 28 CYS C C -0.233 0.768 2.849 1.00 . A A . 28 CYS C 1 1 4 1504 1 1 28 CYS CA C 0.165 0.431 1.415 1.00 . A A . 28 CYS CA 1 1 4 1505 1 1 28 CYS CB C -0.405 1.493 0.466 1.00 . A A . 28 CYS CB 1 1 4 1506 1 1 28 CYS H H -1.022 -1.005 0.362 1.00 . A A . 28 CYS H 1 1 4 1507 1 1 28 CYS HA H 1.250 0.454 1.336 1.00 . A A . 28 CYS HA 1 1 4 1508 1 1 28 CYS HB3 H -1.493 1.465 0.493 1.00 . A A . 28 CYS HB3 1 1 4 1509 1 1 28 CYS N N -0.293 -0.905 1.058 1.00 . A A . 28 CYS N 1 1 4 1510 1 1 28 CYS O O -1.426 0.822 3.155 1.00 . A A . 28 CYS O 1 1 4 1511 1 1 28 CYS SG S 0.132 3.144 0.962 1.00 . A A . 28 CYS SG 1 1 4 1512 1 1 29 ALA C C -0.031 2.811 5.303 1.00 . A A . 29 ALA C 1 1 4 1513 1 1 29 ALA CA C 0.464 1.367 5.128 1.00 . A A . 29 ALA CA 1 1 4 1514 1 1 29 ALA CB C 1.721 1.090 5.959 1.00 . A A . 29 ALA CB 1 1 4 1515 1 1 29 ALA H H 1.706 1.056 3.426 1.00 . A A . 29 ALA H 1 1 4 1516 1 1 29 ALA HA H -0.318 0.700 5.494 1.00 . A A . 29 ALA HA 1 1 4 1517 1 1 29 ALA HB1 H 1.495 1.206 7.021 1.00 . A A . 29 ALA HB1 1 1 4 1518 1 1 29 ALA HB2 H 2.066 0.069 5.781 1.00 . A A . 29 ALA HB2 1 1 4 1519 1 1 29 ALA HB3 H 2.512 1.789 5.686 1.00 . A A . 29 ALA HB3 1 1 4 1520 1 1 29 ALA N N 0.734 1.050 3.729 1.00 . A A . 29 ALA N 1 1 4 1521 1 1 29 ALA O O 0.406 3.511 6.212 1.00 . A A . 29 ALA O 1 1 4 1522 1 1 30 CYS C C -2.952 4.351 5.326 1.00 . A A . 30 CYS C 1 1 4 1523 1 1 30 CYS CA C -1.645 4.527 4.560 1.00 . A A . 30 CYS CA 1 1 4 1524 1 1 30 CYS CB C -1.921 5.103 3.170 1.00 . A A . 30 CYS CB 1 1 4 1525 1 1 30 CYS H H -1.280 2.594 3.745 1.00 . A A . 30 CYS H 1 1 4 1526 1 1 30 CYS HA H -1.029 5.248 5.099 1.00 . A A . 30 CYS HA 1 1 4 1527 1 1 30 CYS HB3 H -2.425 4.369 2.541 1.00 . A A . 30 CYS HB3 1 1 4 1528 1 1 30 CYS N N -0.959 3.246 4.449 1.00 . A A . 30 CYS N 1 1 4 1529 1 1 30 CYS O O -3.270 5.142 6.211 1.00 . A A . 30 CYS O 1 1 4 1530 1 1 30 CYS SG S -2.953 6.585 3.220 1.00 . A A . 30 CYS SG 1 1 4 1531 1 1 31 THR C C -5.854 4.250 5.764 1.00 . A A . 31 THR C 1 1 4 1532 1 1 31 THR CA C -5.010 2.988 5.562 1.00 . A A . 31 THR CA 1 1 4 1533 1 1 31 THR CB C -4.866 2.131 6.834 1.00 . A A . 31 THR CB 1 1 4 1534 1 1 31 THR CG2 C -4.118 2.805 7.991 1.00 . A A . 31 THR CG2 1 1 4 1535 1 1 31 THR H H -3.364 2.688 4.260 1.00 . A A . 31 THR H 1 1 4 1536 1 1 31 THR HA H -5.535 2.378 4.827 1.00 . A A . 31 THR HA 1 1 4 1537 1 1 31 THR HB H -4.314 1.228 6.565 1.00 . A A . 31 THR HB 1 1 4 1538 1 1 31 THR HG1 H -6.475 2.339 7.933 1.00 . A A . 31 THR HG1 1 1 4 1539 1 1 31 THR HG21 H -4.576 3.761 8.249 1.00 . A A . 31 THR HG21 1 1 4 1540 1 1 31 THR HG22 H -4.141 2.154 8.865 1.00 . A A . 31 THR HG22 1 1 4 1541 1 1 31 THR HG23 H -3.075 2.969 7.721 1.00 . A A . 31 THR HG23 1 1 4 1542 1 1 31 THR N N -3.703 3.296 4.989 1.00 . A A . 31 THR N 1 1 4 1543 1 1 31 THR O O -6.452 4.750 4.811 1.00 . A A . 31 THR O 1 1 4 1544 1 1 31 THR OG1 O -6.138 1.714 7.287 1.00 . A A . 31 THR OG1 1 1 5 1545 1 1 1 THR C C -10.786 -7.904 -2.062 1.00 . A A . 1 THR C 1 1 5 1546 1 1 1 THR CA C -10.522 -9.349 -1.615 1.00 . A A . 1 THR CA 1 1 5 1547 1 1 1 THR CB C -10.030 -9.448 -0.158 1.00 . A A . 1 THR CB 1 1 5 1548 1 1 1 THR CG2 C -8.700 -8.724 0.088 1.00 . A A . 1 THR CG2 1 1 5 1549 1 1 1 THR H1 H -8.995 -9.234 -3.033 1.00 . A A . 1 THR H1 1 1 5 1550 1 1 1 THR HA H -11.423 -9.952 -1.723 1.00 . A A . 1 THR HA 1 1 5 1551 1 1 1 THR HB H -9.888 -10.506 0.071 1.00 . A A . 1 THR HB 1 1 5 1552 1 1 1 THR HG1 H -10.739 -9.148 1.632 1.00 . A A . 1 THR HG1 1 1 5 1553 1 1 1 THR HG21 H -8.810 -7.655 -0.085 1.00 . A A . 1 THR HG21 1 1 5 1554 1 1 1 THR HG22 H -8.383 -8.881 1.121 1.00 . A A . 1 THR HG22 1 1 5 1555 1 1 1 THR HG23 H -7.926 -9.114 -0.573 1.00 . A A . 1 THR HG23 1 1 5 1556 1 1 1 THR N N -9.522 -9.916 -2.500 1.00 . A A . 1 THR N 1 1 5 1557 1 1 1 THR O O -9.849 -7.248 -2.521 1.00 . A A . 1 THR O 1 1 5 1558 1 1 1 THR OG1 O -10.996 -8.930 0.733 1.00 . A A . 1 THR OG1 1 1 5 1559 1 1 2 PRO C C -11.868 -5.058 -1.240 1.00 . A A . 2 PRO C 1 1 5 1560 1 1 2 PRO CA C -12.337 -6.016 -2.343 1.00 . A A . 2 PRO CA 1 1 5 1561 1 1 2 PRO CB C -13.859 -6.010 -2.534 1.00 . A A . 2 PRO CB 1 1 5 1562 1 1 2 PRO CD C -13.227 -8.099 -1.563 1.00 . A A . 2 PRO CD 1 1 5 1563 1 1 2 PRO CG C -14.332 -7.043 -1.511 1.00 . A A . 2 PRO CG 1 1 5 1564 1 1 2 PRO HA H -11.856 -5.739 -3.283 1.00 . A A . 2 PRO HA 1 1 5 1565 1 1 2 PRO HB3 H -14.094 -6.374 -3.536 1.00 . A A . 2 PRO HB3 1 1 5 1566 1 1 2 PRO HD3 H -13.476 -8.845 -2.320 1.00 . A A . 2 PRO HD3 1 1 5 1567 1 1 2 PRO HG3 H -15.313 -7.455 -1.755 1.00 . A A . 2 PRO HG3 1 1 5 1568 1 1 2 PRO N N -12.022 -7.388 -1.970 1.00 . A A . 2 PRO N 1 1 5 1569 1 1 2 PRO O O -12.666 -4.334 -0.649 1.00 . A A . 2 PRO O 1 1 5 1570 1 1 3 PHE C C -8.441 -4.444 0.011 1.00 . A A . 3 PHE C 1 1 5 1571 1 1 3 PHE CA C -9.961 -4.333 0.161 1.00 . A A . 3 PHE CA 1 1 5 1572 1 1 3 PHE CB C -10.450 -4.917 1.499 1.00 . A A . 3 PHE CB 1 1 5 1573 1 1 3 PHE CD1 C -10.238 -2.879 2.980 1.00 . A A . 3 PHE CD1 1 1 5 1574 1 1 3 PHE CD2 C -8.974 -4.876 3.562 1.00 . A A . 3 PHE CD2 1 1 5 1575 1 1 3 PHE CE1 C -9.621 -2.182 4.034 1.00 . A A . 3 PHE CE1 1 1 5 1576 1 1 3 PHE CE2 C -8.355 -4.178 4.613 1.00 . A A . 3 PHE CE2 1 1 5 1577 1 1 3 PHE CG C -9.904 -4.222 2.731 1.00 . A A . 3 PHE CG 1 1 5 1578 1 1 3 PHE CZ C -8.674 -2.829 4.845 1.00 . A A . 3 PHE CZ 1 1 5 1579 1 1 3 PHE H H -9.931 -5.654 -1.479 1.00 . A A . 3 PHE H 1 1 5 1580 1 1 3 PHE HA H -10.251 -3.282 0.084 1.00 . A A . 3 PHE HA 1 1 5 1581 1 1 3 PHE HB3 H -10.189 -5.976 1.527 1.00 . A A . 3 PHE HB3 1 1 5 1582 1 1 3 PHE HD1 H -10.973 -2.379 2.365 1.00 . A A . 3 PHE HD1 1 1 5 1583 1 1 3 PHE HD2 H -8.713 -5.910 3.387 1.00 . A A . 3 PHE HD2 1 1 5 1584 1 1 3 PHE HE1 H -9.890 -1.154 4.232 1.00 . A A . 3 PHE HE1 1 1 5 1585 1 1 3 PHE HE2 H -7.641 -4.682 5.249 1.00 . A A . 3 PHE HE2 1 1 5 1586 1 1 3 PHE HZ H -8.212 -2.298 5.665 1.00 . A A . 3 PHE HZ 1 1 5 1587 1 1 3 PHE N N -10.567 -5.067 -0.938 1.00 . A A . 3 PHE N 1 1 5 1588 1 1 3 PHE O O -7.971 -5.229 -0.807 1.00 . A A . 3 PHE O 1 1 5 1589 1 1 4 ALA C C -5.534 -3.462 -0.410 1.00 . A A . 4 ALA C 1 1 5 1590 1 1 4 ALA CA C -6.238 -3.772 0.921 1.00 . A A . 4 ALA CA 1 1 5 1591 1 1 4 ALA CB C -5.839 -5.123 1.524 1.00 . A A . 4 ALA CB 1 1 5 1592 1 1 4 ALA H H -8.165 -3.094 1.479 1.00 . A A . 4 ALA H 1 1 5 1593 1 1 4 ALA HA H -5.929 -3.016 1.644 1.00 . A A . 4 ALA HA 1 1 5 1594 1 1 4 ALA HB1 H -4.781 -5.105 1.777 1.00 . A A . 4 ALA HB1 1 1 5 1595 1 1 4 ALA HB2 H -6.401 -5.298 2.441 1.00 . A A . 4 ALA HB2 1 1 5 1596 1 1 4 ALA HB3 H -6.038 -5.935 0.826 1.00 . A A . 4 ALA HB3 1 1 5 1597 1 1 4 ALA N N -7.687 -3.679 0.808 1.00 . A A . 4 ALA N 1 1 5 1598 1 1 4 ALA O O -5.181 -4.351 -1.182 1.00 . A A . 4 ALA O 1 1 5 1599 1 1 5 ILE C C -3.215 -2.287 -1.930 1.00 . A A . 5 ILE C 1 1 5 1600 1 1 5 ILE CA C -4.609 -1.652 -1.831 1.00 . A A . 5 ILE CA 1 1 5 1601 1 1 5 ILE CB C -4.517 -0.116 -1.697 1.00 . A A . 5 ILE CB 1 1 5 1602 1 1 5 ILE CD1 C -5.934 1.827 -0.883 1.00 . A A . 5 ILE CD1 1 1 5 1603 1 1 5 ILE CG1 C -5.917 0.531 -1.697 1.00 . A A . 5 ILE CG1 1 1 5 1604 1 1 5 ILE CG2 C -3.666 0.503 -2.815 1.00 . A A . 5 ILE CG2 1 1 5 1605 1 1 5 ILE H H -5.601 -1.503 0.037 1.00 . A A . 5 ILE H 1 1 5 1606 1 1 5 ILE HA H -5.188 -1.893 -2.724 1.00 . A A . 5 ILE HA 1 1 5 1607 1 1 5 ILE HB H -4.031 0.107 -0.744 1.00 . A A . 5 ILE HB 1 1 5 1608 1 1 5 ILE HD11 H -6.928 2.272 -0.935 1.00 . A A . 5 ILE HD11 1 1 5 1609 1 1 5 ILE HD12 H -5.703 1.607 0.160 1.00 . A A . 5 ILE HD12 1 1 5 1610 1 1 5 ILE HD13 H -5.201 2.536 -1.264 1.00 . A A . 5 ILE HD13 1 1 5 1611 1 1 5 ILE HG13 H -6.658 -0.132 -1.253 1.00 . A A . 5 ILE HG13 1 1 5 1612 1 1 5 ILE HG21 H -3.676 1.589 -2.738 1.00 . A A . 5 ILE HG21 1 1 5 1613 1 1 5 ILE HG22 H -2.630 0.177 -2.735 1.00 . A A . 5 ILE HG22 1 1 5 1614 1 1 5 ILE HG23 H -4.058 0.212 -3.791 1.00 . A A . 5 ILE HG23 1 1 5 1615 1 1 5 ILE N N -5.305 -2.171 -0.658 1.00 . A A . 5 ILE N 1 1 5 1616 1 1 5 ILE O O -2.374 -2.034 -1.068 1.00 . A A . 5 ILE O 1 1 5 1617 1 1 6 LYS C C -0.611 -2.609 -3.565 1.00 . A A . 6 LYS C 1 1 5 1618 1 1 6 LYS CA C -1.641 -3.683 -3.190 1.00 . A A . 6 LYS CA 1 1 5 1619 1 1 6 LYS CB C -1.686 -4.851 -4.197 1.00 . A A . 6 LYS CB 1 1 5 1620 1 1 6 LYS CD C -0.988 -6.697 -2.581 1.00 . A A . 6 LYS CD 1 1 5 1621 1 1 6 LYS CE C -1.153 -8.122 -2.037 1.00 . A A . 6 LYS CE 1 1 5 1622 1 1 6 LYS CG C -2.059 -6.216 -3.579 1.00 . A A . 6 LYS CG 1 1 5 1623 1 1 6 LYS H H -3.694 -3.292 -3.631 1.00 . A A . 6 LYS H 1 1 5 1624 1 1 6 LYS HA H -1.310 -4.064 -2.235 1.00 . A A . 6 LYS HA 1 1 5 1625 1 1 6 LYS HB3 H -0.703 -4.961 -4.656 1.00 . A A . 6 LYS HB3 1 1 5 1626 1 1 6 LYS HD3 H -1.039 -6.042 -1.721 1.00 . A A . 6 LYS HD3 1 1 5 1627 1 1 6 LYS HE3 H -0.637 -8.822 -2.697 1.00 . A A . 6 LYS HE3 1 1 5 1628 1 1 6 LYS HG3 H -2.143 -6.942 -4.388 1.00 . A A . 6 LYS HG3 1 1 5 1629 1 1 6 LYS HZ1 H -1.161 -7.645 -0.032 1.00 . A A . 6 LYS HZ1 1 1 5 1630 1 1 6 LYS HZ2 H -0.712 -9.186 -0.313 1.00 . A A . 6 LYS HZ2 1 1 5 1631 1 1 6 LYS HZ3 H 0.340 -7.951 -0.530 1.00 . A A . 6 LYS HZ3 1 1 5 1632 1 1 6 LYS N N -2.963 -3.108 -2.960 1.00 . A A . 6 LYS N 1 1 5 1633 1 1 6 LYS NZ N -0.628 -8.240 -0.652 1.00 . A A . 6 LYS NZ 1 1 5 1634 1 1 6 LYS O O -0.968 -1.512 -3.993 1.00 . A A . 6 LYS O 1 1 5 1635 1 1 7 CYS C C 3.062 -2.801 -3.409 1.00 . A A . 7 CYS C 1 1 5 1636 1 1 7 CYS CA C 1.779 -1.992 -3.270 1.00 . A A . 7 CYS CA 1 1 5 1637 1 1 7 CYS CB C 1.730 -1.319 -1.897 1.00 . A A . 7 CYS CB 1 1 5 1638 1 1 7 CYS H H 0.862 -3.845 -2.948 1.00 . A A . 7 CYS H 1 1 5 1639 1 1 7 CYS HA H 1.703 -1.242 -4.059 1.00 . A A . 7 CYS HA 1 1 5 1640 1 1 7 CYS HB3 H 1.761 -2.083 -1.122 1.00 . A A . 7 CYS HB3 1 1 5 1641 1 1 7 CYS N N 0.665 -2.926 -3.331 1.00 . A A . 7 CYS N 1 1 5 1642 1 1 7 CYS O O 3.313 -3.673 -2.579 1.00 . A A . 7 CYS O 1 1 5 1643 1 1 7 CYS SG S 2.982 -0.087 -1.466 1.00 . A A . 7 CYS SG 1 1 5 1644 1 1 8 ALA C C 6.247 -2.221 -4.108 1.00 . A A . 8 ALA C 1 1 5 1645 1 1 8 ALA CA C 5.164 -3.175 -4.610 1.00 . A A . 8 ALA CA 1 1 5 1646 1 1 8 ALA CB C 5.383 -3.529 -6.084 1.00 . A A . 8 ALA CB 1 1 5 1647 1 1 8 ALA H H 3.639 -1.795 -5.097 1.00 . A A . 8 ALA H 1 1 5 1648 1 1 8 ALA HA H 5.232 -4.103 -4.038 1.00 . A A . 8 ALA HA 1 1 5 1649 1 1 8 ALA HB1 H 4.620 -4.238 -6.407 1.00 . A A . 8 ALA HB1 1 1 5 1650 1 1 8 ALA HB2 H 5.321 -2.635 -6.703 1.00 . A A . 8 ALA HB2 1 1 5 1651 1 1 8 ALA HB3 H 6.366 -3.982 -6.210 1.00 . A A . 8 ALA HB3 1 1 5 1652 1 1 8 ALA N N 3.857 -2.556 -4.450 1.00 . A A . 8 ALA N 1 1 5 1653 1 1 8 ALA O O 7.254 -2.662 -3.559 1.00 . A A . 8 ALA O 1 1 5 1654 1 1 9 THR C C 6.537 1.255 -3.258 1.00 . A A . 9 THR C 1 1 5 1655 1 1 9 THR CA C 7.043 0.119 -4.149 1.00 . A A . 9 THR CA 1 1 5 1656 1 1 9 THR CB C 7.381 0.680 -5.537 1.00 . A A . 9 THR CB 1 1 5 1657 1 1 9 THR CG2 C 8.038 -0.372 -6.435 1.00 . A A . 9 THR CG2 1 1 5 1658 1 1 9 THR H H 5.180 -0.640 -4.782 1.00 . A A . 9 THR H 1 1 5 1659 1 1 9 THR HA H 7.950 -0.288 -3.702 1.00 . A A . 9 THR HA 1 1 5 1660 1 1 9 THR HB H 8.083 1.510 -5.422 1.00 . A A . 9 THR HB 1 1 5 1661 1 1 9 THR HG1 H 5.548 0.438 -6.235 1.00 . A A . 9 THR HG1 1 1 5 1662 1 1 9 THR HG21 H 8.331 0.094 -7.376 1.00 . A A . 9 THR HG21 1 1 5 1663 1 1 9 THR HG22 H 8.927 -0.772 -5.945 1.00 . A A . 9 THR HG22 1 1 5 1664 1 1 9 THR HG23 H 7.347 -1.187 -6.646 1.00 . A A . 9 THR HG23 1 1 5 1665 1 1 9 THR N N 6.043 -0.918 -4.318 1.00 . A A . 9 THR N 1 1 5 1666 1 1 9 THR O O 5.334 1.494 -3.133 1.00 . A A . 9 THR O 1 1 5 1667 1 1 9 THR OG1 O 6.203 1.155 -6.163 1.00 . A A . 9 THR OG1 1 1 5 1668 1 1 10 ASP C C 6.428 4.138 -3.357 1.00 . A A . 10 ASP C 1 1 5 1669 1 1 10 ASP CA C 7.320 3.412 -2.337 1.00 . A A . 10 ASP CA 1 1 5 1670 1 1 10 ASP CB C 8.714 4.054 -2.256 1.00 . A A . 10 ASP CB 1 1 5 1671 1 1 10 ASP CG C 9.561 3.645 -3.455 1.00 . A A . 10 ASP CG 1 1 5 1672 1 1 10 ASP H H 8.459 1.742 -2.873 1.00 . A A . 10 ASP H 1 1 5 1673 1 1 10 ASP HA H 6.844 3.467 -1.358 1.00 . A A . 10 ASP HA 1 1 5 1674 1 1 10 ASP HB3 H 9.218 3.710 -1.352 1.00 . A A . 10 ASP HB3 1 1 5 1675 1 1 10 ASP N N 7.488 2.014 -2.712 1.00 . A A . 10 ASP N 1 1 5 1676 1 1 10 ASP O O 5.384 4.670 -2.985 1.00 . A A . 10 ASP O 1 1 5 1677 1 1 10 ASP OD1 O 10.068 2.505 -3.404 1.00 . A A . 10 ASP OD1 1 1 5 1678 1 1 10 ASP OD2 O 9.511 4.380 -4.462 1.00 . A A . 10 ASP OD2 1 1 5 1679 1 1 11 ALA C C 4.588 4.425 -5.688 1.00 . A A . 11 ALA C 1 1 5 1680 1 1 11 ALA CA C 6.086 4.748 -5.735 1.00 . A A . 11 ALA CA 1 1 5 1681 1 1 11 ALA CB C 6.714 4.368 -7.079 1.00 . A A . 11 ALA CB 1 1 5 1682 1 1 11 ALA H H 7.800 3.907 -4.815 1.00 . A A . 11 ALA H 1 1 5 1683 1 1 11 ALA HA H 6.203 5.828 -5.647 1.00 . A A . 11 ALA HA 1 1 5 1684 1 1 11 ALA HB1 H 7.773 4.634 -7.078 1.00 . A A . 11 ALA HB1 1 1 5 1685 1 1 11 ALA HB2 H 6.616 3.301 -7.269 1.00 . A A . 11 ALA HB2 1 1 5 1686 1 1 11 ALA HB3 H 6.213 4.913 -7.879 1.00 . A A . 11 ALA HB3 1 1 5 1687 1 1 11 ALA N N 6.828 4.153 -4.634 1.00 . A A . 11 ALA N 1 1 5 1688 1 1 11 ALA O O 3.785 5.349 -5.785 1.00 . A A . 11 ALA O 1 1 5 1689 1 1 12 ASP C C 2.026 3.565 -4.445 1.00 . A A . 12 ASP C 1 1 5 1690 1 1 12 ASP CA C 2.790 2.763 -5.499 1.00 . A A . 12 ASP CA 1 1 5 1691 1 1 12 ASP CB C 2.616 1.265 -5.213 1.00 . A A . 12 ASP CB 1 1 5 1692 1 1 12 ASP CG C 3.124 0.383 -6.336 1.00 . A A . 12 ASP CG 1 1 5 1693 1 1 12 ASP H H 4.916 2.427 -5.488 1.00 . A A . 12 ASP H 1 1 5 1694 1 1 12 ASP HA H 2.347 2.978 -6.473 1.00 . A A . 12 ASP HA 1 1 5 1695 1 1 12 ASP HB3 H 1.552 1.056 -5.098 1.00 . A A . 12 ASP HB3 1 1 5 1696 1 1 12 ASP N N 4.202 3.151 -5.539 1.00 . A A . 12 ASP N 1 1 5 1697 1 1 12 ASP O O 1.012 4.196 -4.748 1.00 . A A . 12 ASP O 1 1 5 1698 1 1 12 ASP OD1 O 2.577 0.490 -7.451 1.00 . A A . 12 ASP OD1 1 1 5 1699 1 1 12 ASP OD2 O 4.058 -0.397 -6.043 1.00 . A A . 12 ASP OD2 1 1 5 1700 1 1 13 CYS C C 1.944 5.825 -2.575 1.00 . A A . 13 CYS C 1 1 5 1701 1 1 13 CYS CA C 1.923 4.362 -2.144 1.00 . A A . 13 CYS CA 1 1 5 1702 1 1 13 CYS CB C 2.659 4.214 -0.806 1.00 . A A . 13 CYS CB 1 1 5 1703 1 1 13 CYS H H 3.368 3.026 -3.025 1.00 . A A . 13 CYS H 1 1 5 1704 1 1 13 CYS HA H 0.882 4.067 -2.010 1.00 . A A . 13 CYS HA 1 1 5 1705 1 1 13 CYS HB3 H 2.443 5.104 -0.215 1.00 . A A . 13 CYS HB3 1 1 5 1706 1 1 13 CYS N N 2.513 3.544 -3.199 1.00 . A A . 13 CYS N 1 1 5 1707 1 1 13 CYS O O 0.904 6.481 -2.590 1.00 . A A . 13 CYS O 1 1 5 1708 1 1 13 CYS SG S 2.215 2.827 0.270 1.00 . A A . 13 CYS SG 1 1 5 1709 1 1 14 SER C C 2.792 8.118 -4.697 1.00 . A A . 14 SER C 1 1 5 1710 1 1 14 SER CA C 3.411 7.699 -3.352 1.00 . A A . 14 SER CA 1 1 5 1711 1 1 14 SER CB C 4.938 7.856 -3.380 1.00 . A A . 14 SER CB 1 1 5 1712 1 1 14 SER H H 3.885 5.657 -3.013 1.00 . A A . 14 SER H 1 1 5 1713 1 1 14 SER HA H 3.013 8.354 -2.576 1.00 . A A . 14 SER HA 1 1 5 1714 1 1 14 SER HB3 H 5.337 7.259 -4.198 1.00 . A A . 14 SER HB3 1 1 5 1715 1 1 14 SER HG H 4.878 9.516 -4.375 1.00 . A A . 14 SER HG 1 1 5 1716 1 1 14 SER N N 3.116 6.316 -2.980 1.00 . A A . 14 SER N 1 1 5 1717 1 1 14 SER O O 3.393 8.897 -5.440 1.00 . A A . 14 SER O 1 1 5 1718 1 1 14 SER OG O 5.329 9.205 -3.576 1.00 . A A . 14 SER OG 1 1 5 1719 1 1 15 ARG C C -0.663 8.251 -5.519 1.00 . A A . 15 ARG C 1 1 5 1720 1 1 15 ARG CA C 0.732 8.039 -6.095 1.00 . A A . 15 ARG CA 1 1 5 1721 1 1 15 ARG CB C 0.714 6.937 -7.167 1.00 . A A . 15 ARG CB 1 1 5 1722 1 1 15 ARG CD C 2.083 7.863 -9.105 1.00 . A A . 15 ARG CD 1 1 5 1723 1 1 15 ARG CG C 2.024 6.846 -7.958 1.00 . A A . 15 ARG CG 1 1 5 1724 1 1 15 ARG CZ C 3.682 6.810 -10.720 1.00 . A A . 15 ARG CZ 1 1 5 1725 1 1 15 ARG H H 1.174 7.023 -4.307 1.00 . A A . 15 ARG H 1 1 5 1726 1 1 15 ARG HA H 1.073 8.980 -6.529 1.00 . A A . 15 ARG HA 1 1 5 1727 1 1 15 ARG HB3 H -0.112 7.112 -7.857 1.00 . A A . 15 ARG HB3 1 1 5 1728 1 1 15 ARG HD3 H 2.019 8.865 -8.678 1.00 . A A . 15 ARG HD3 1 1 5 1729 1 1 15 ARG HE H 4.033 8.493 -9.629 1.00 . A A . 15 ARG HE 1 1 5 1730 1 1 15 ARG HG3 H 2.107 5.831 -8.347 1.00 . A A . 15 ARG HG3 1 1 5 1731 1 1 15 ARG HH11 H 1.936 5.808 -10.490 1.00 . A A . 15 ARG HH11 1 1 5 1732 1 1 15 ARG HH12 H 3.027 5.078 -11.626 1.00 . A A . 15 ARG HH12 1 1 5 1733 1 1 15 ARG HH21 H 5.535 7.571 -11.132 1.00 . A A . 15 ARG HH21 1 1 5 1734 1 1 15 ARG HH22 H 5.137 6.121 -11.992 1.00 . A A . 15 ARG HH22 1 1 5 1735 1 1 15 ARG N N 1.586 7.639 -4.989 1.00 . A A . 15 ARG N 1 1 5 1736 1 1 15 ARG NE N 3.358 7.771 -9.839 1.00 . A A . 15 ARG NE 1 1 5 1737 1 1 15 ARG NH1 N 2.814 5.828 -10.986 1.00 . A A . 15 ARG NH1 1 1 5 1738 1 1 15 ARG NH2 N 4.872 6.838 -11.331 1.00 . A A . 15 ARG NH2 1 1 5 1739 1 1 15 ARG O O -1.259 9.309 -5.697 1.00 . A A . 15 ARG O 1 1 5 1740 1 1 16 LYS C C -2.575 7.929 -2.892 1.00 . A A . 16 LYS C 1 1 5 1741 1 1 16 LYS CA C -2.529 7.260 -4.271 1.00 . A A . 16 LYS CA 1 1 5 1742 1 1 16 LYS CB C -3.072 5.826 -4.220 1.00 . A A . 16 LYS CB 1 1 5 1743 1 1 16 LYS CD C -5.102 4.374 -3.907 1.00 . A A . 16 LYS CD 1 1 5 1744 1 1 16 LYS CE C -6.627 4.303 -3.733 1.00 . A A . 16 LYS CE 1 1 5 1745 1 1 16 LYS CG C -4.582 5.816 -3.946 1.00 . A A . 16 LYS CG 1 1 5 1746 1 1 16 LYS H H -0.634 6.392 -4.700 1.00 . A A . 16 LYS H 1 1 5 1747 1 1 16 LYS HA H -3.168 7.831 -4.948 1.00 . A A . 16 LYS HA 1 1 5 1748 1 1 16 LYS HB3 H -2.546 5.266 -3.443 1.00 . A A . 16 LYS HB3 1 1 5 1749 1 1 16 LYS HD3 H -4.597 3.837 -3.103 1.00 . A A . 16 LYS HD3 1 1 5 1750 1 1 16 LYS HE3 H -6.923 3.253 -3.706 1.00 . A A . 16 LYS HE3 1 1 5 1751 1 1 16 LYS HG3 H -5.085 6.370 -4.740 1.00 . A A . 16 LYS HG3 1 1 5 1752 1 1 16 LYS HZ1 H -8.094 4.862 -2.410 1.00 . A A . 16 LYS HZ1 1 1 5 1753 1 1 16 LYS HZ2 H -6.647 4.563 -1.688 1.00 . A A . 16 LYS HZ2 1 1 5 1754 1 1 16 LYS HZ3 H -6.879 5.956 -2.533 1.00 . A A . 16 LYS HZ3 1 1 5 1755 1 1 16 LYS N N -1.183 7.235 -4.821 1.00 . A A . 16 LYS N 1 1 5 1756 1 1 16 LYS NZ N -7.092 4.971 -2.499 1.00 . A A . 16 LYS NZ 1 1 5 1757 1 1 16 LYS O O -3.587 8.543 -2.553 1.00 . A A . 16 LYS O 1 1 5 1758 1 1 17 CYS C C -0.252 8.907 -0.316 1.00 . A A . 17 CYS C 1 1 5 1759 1 1 17 CYS CA C -1.528 8.133 -0.662 1.00 . A A . 17 CYS CA 1 1 5 1760 1 1 17 CYS CB C -1.646 6.874 0.198 1.00 . A A . 17 CYS CB 1 1 5 1761 1 1 17 CYS H H -0.711 7.270 -2.413 1.00 . A A . 17 CYS H 1 1 5 1762 1 1 17 CYS HA H -2.410 8.726 -0.433 1.00 . A A . 17 CYS HA 1 1 5 1763 1 1 17 CYS HB3 H -0.813 6.197 0.004 1.00 . A A . 17 CYS HB3 1 1 5 1764 1 1 17 CYS N N -1.534 7.754 -2.071 1.00 . A A . 17 CYS N 1 1 5 1765 1 1 17 CYS O O 0.826 8.310 -0.291 1.00 . A A . 17 CYS O 1 1 5 1766 1 1 17 CYS SG S -1.700 7.228 1.969 1.00 . A A . 17 CYS SG 1 1 5 1767 1 1 18 PRO C C 1.392 10.775 1.593 1.00 . A A . 18 PRO C 1 1 5 1768 1 1 18 PRO CA C 0.840 11.049 0.191 1.00 . A A . 18 PRO CA 1 1 5 1769 1 1 18 PRO CB C 0.362 12.494 0.019 1.00 . A A . 18 PRO CB 1 1 5 1770 1 1 18 PRO CD C -1.539 11.040 -0.054 1.00 . A A . 18 PRO CD 1 1 5 1771 1 1 18 PRO CG C -1.103 12.420 0.443 1.00 . A A . 18 PRO CG 1 1 5 1772 1 1 18 PRO HA H 1.624 10.838 -0.541 1.00 . A A . 18 PRO HA 1 1 5 1773 1 1 18 PRO HB3 H 0.411 12.763 -1.036 1.00 . A A . 18 PRO HB3 1 1 5 1774 1 1 18 PRO HD3 H -1.943 11.118 -1.065 1.00 . A A . 18 PRO HD3 1 1 5 1775 1 1 18 PRO HG3 H -1.702 13.224 0.014 1.00 . A A . 18 PRO HG3 1 1 5 1776 1 1 18 PRO N N -0.331 10.228 -0.077 1.00 . A A . 18 PRO N 1 1 5 1777 1 1 18 PRO O O 0.862 9.955 2.341 1.00 . A A . 18 PRO O 1 1 5 1778 1 1 19 GLY C C 3.953 9.844 3.107 1.00 . A A . 19 GLY C 1 1 5 1779 1 1 19 GLY CA C 3.221 11.188 3.178 1.00 . A A . 19 GLY CA 1 1 5 1780 1 1 19 GLY H H 2.878 12.123 1.298 1.00 . A A . 19 GLY H 1 1 5 1781 1 1 19 GLY HA2 H 3.958 11.977 3.326 1.00 . A A . 19 GLY HA2 1 1 5 1782 1 1 19 GLY HA3 H 2.536 11.185 4.028 1.00 . A A . 19 GLY HA3 1 1 5 1783 1 1 19 GLY N N 2.487 11.456 1.947 1.00 . A A . 19 GLY N 1 1 5 1784 1 1 19 GLY O O 4.261 9.254 4.138 1.00 . A A . 19 GLY O 1 1 5 1785 1 1 20 ASN C C 5.070 7.106 2.547 1.00 . A A . 20 ASN C 1 1 5 1786 1 1 20 ASN CA C 4.974 8.200 1.481 1.00 . A A . 20 ASN CA 1 1 5 1787 1 1 20 ASN CB C 6.346 8.630 0.937 1.00 . A A . 20 ASN CB 1 1 5 1788 1 1 20 ASN CG C 6.184 9.436 -0.352 1.00 . A A . 20 ASN CG 1 1 5 1789 1 1 20 ASN H H 3.988 9.995 1.104 1.00 . A A . 20 ASN H 1 1 5 1790 1 1 20 ASN HA H 4.447 7.756 0.636 1.00 . A A . 20 ASN HA 1 1 5 1791 1 1 20 ASN HB3 H 6.935 7.736 0.719 1.00 . A A . 20 ASN HB3 1 1 5 1792 1 1 20 ASN HD21 H 7.713 8.453 -1.287 1.00 . A A . 20 ASN HD21 1 1 5 1793 1 1 20 ASN HD22 H 6.697 9.495 -2.283 1.00 . A A . 20 ASN HD22 1 1 5 1794 1 1 20 ASN N N 4.230 9.390 1.879 1.00 . A A . 20 ASN N 1 1 5 1795 1 1 20 ASN ND2 N 6.985 9.145 -1.369 1.00 . A A . 20 ASN ND2 1 1 5 1796 1 1 20 ASN O O 6.171 6.787 3.001 1.00 . A A . 20 ASN O 1 1 5 1797 1 1 20 ASN OD1 O 5.298 10.283 -0.452 1.00 . A A . 20 ASN OD1 1 1 5 1798 1 1 21 PRO C C 4.596 4.123 2.972 1.00 . A A . 21 PRO C 1 1 5 1799 1 1 21 PRO CA C 3.968 5.288 3.753 1.00 . A A . 21 PRO CA 1 1 5 1800 1 1 21 PRO CB C 2.504 5.015 4.111 1.00 . A A . 21 PRO CB 1 1 5 1801 1 1 21 PRO CD C 2.583 6.822 2.531 1.00 . A A . 21 PRO CD 1 1 5 1802 1 1 21 PRO CG C 1.727 5.630 2.947 1.00 . A A . 21 PRO CG 1 1 5 1803 1 1 21 PRO HA H 4.536 5.497 4.658 1.00 . A A . 21 PRO HA 1 1 5 1804 1 1 21 PRO HB3 H 2.249 5.546 5.029 1.00 . A A . 21 PRO HB3 1 1 5 1805 1 1 21 PRO HD3 H 2.252 7.696 3.090 1.00 . A A . 21 PRO HD3 1 1 5 1806 1 1 21 PRO HG3 H 0.723 5.937 3.233 1.00 . A A . 21 PRO HG3 1 1 5 1807 1 1 21 PRO N N 3.944 6.480 2.924 1.00 . A A . 21 PRO N 1 1 5 1808 1 1 21 PRO O O 4.660 4.167 1.745 1.00 . A A . 21 PRO O 1 1 5 1809 1 1 22 PRO C C 4.608 0.915 2.573 1.00 . A A . 22 PRO C 1 1 5 1810 1 1 22 PRO CA C 5.676 1.914 3.040 1.00 . A A . 22 PRO CA 1 1 5 1811 1 1 22 PRO CB C 6.545 1.297 4.139 1.00 . A A . 22 PRO CB 1 1 5 1812 1 1 22 PRO CD C 5.184 2.998 5.115 1.00 . A A . 22 PRO CD 1 1 5 1813 1 1 22 PRO CG C 5.746 1.607 5.407 1.00 . A A . 22 PRO CG 1 1 5 1814 1 1 22 PRO HA H 6.300 2.201 2.192 1.00 . A A . 22 PRO HA 1 1 5 1815 1 1 22 PRO HB3 H 7.501 1.824 4.180 1.00 . A A . 22 PRO HB3 1 1 5 1816 1 1 22 PRO HD3 H 5.893 3.751 5.464 1.00 . A A . 22 PRO HD3 1 1 5 1817 1 1 22 PRO HG3 H 6.369 1.591 6.304 1.00 . A A . 22 PRO HG3 1 1 5 1818 1 1 22 PRO N N 5.075 3.079 3.667 1.00 . A A . 22 PRO N 1 1 5 1819 1 1 22 PRO O O 3.431 1.021 2.922 1.00 . A A . 22 PRO O 1 1 5 1820 1 1 23 CYS C C 4.461 -2.249 2.796 1.00 . A A . 23 CYS C 1 1 5 1821 1 1 23 CYS CA C 4.251 -1.307 1.603 1.00 . A A . 23 CYS CA 1 1 5 1822 1 1 23 CYS CB C 4.667 -2.027 0.312 1.00 . A A . 23 CYS CB 1 1 5 1823 1 1 23 CYS H H 6.022 -0.147 1.583 1.00 . A A . 23 CYS H 1 1 5 1824 1 1 23 CYS HA H 3.203 -1.032 1.512 1.00 . A A . 23 CYS HA 1 1 5 1825 1 1 23 CYS HB3 H 3.935 -2.812 0.134 1.00 . A A . 23 CYS HB3 1 1 5 1826 1 1 23 CYS N N 5.045 -0.108 1.831 1.00 . A A . 23 CYS N 1 1 5 1827 1 1 23 CYS O O 5.571 -2.343 3.314 1.00 . A A . 23 CYS O 1 1 5 1828 1 1 23 CYS SG S 4.798 -1.079 -1.228 1.00 . A A . 23 CYS SG 1 1 5 1829 1 1 24 ARG C C 2.646 -5.159 3.817 1.00 . A A . 24 ARG C 1 1 5 1830 1 1 24 ARG CA C 3.447 -3.949 4.297 1.00 . A A . 24 ARG CA 1 1 5 1831 1 1 24 ARG CB C 2.845 -3.316 5.557 1.00 . A A . 24 ARG CB 1 1 5 1832 1 1 24 ARG CD C 2.409 -3.511 8.023 1.00 . A A . 24 ARG CD 1 1 5 1833 1 1 24 ARG CG C 2.952 -4.232 6.781 1.00 . A A . 24 ARG CG 1 1 5 1834 1 1 24 ARG CZ C 2.167 -3.970 10.464 1.00 . A A . 24 ARG CZ 1 1 5 1835 1 1 24 ARG H H 2.519 -2.802 2.783 1.00 . A A . 24 ARG H 1 1 5 1836 1 1 24 ARG HA H 4.477 -4.247 4.503 1.00 . A A . 24 ARG HA 1 1 5 1837 1 1 24 ARG HB3 H 1.798 -3.069 5.372 1.00 . A A . 24 ARG HB3 1 1 5 1838 1 1 24 ARG HD3 H 1.360 -3.264 7.848 1.00 . A A . 24 ARG HD3 1 1 5 1839 1 1 24 ARG HE H 2.927 -5.269 9.092 1.00 . A A . 24 ARG HE 1 1 5 1840 1 1 24 ARG HG3 H 4.000 -4.492 6.942 1.00 . A A . 24 ARG HG3 1 1 5 1841 1 1 24 ARG HH11 H 1.519 -2.138 9.871 1.00 . A A . 24 ARG HH11 1 1 5 1842 1 1 24 ARG HH12 H 1.355 -2.437 11.575 1.00 . A A . 24 ARG HH12 1 1 5 1843 1 1 24 ARG HH21 H 2.734 -5.721 11.359 1.00 . A A . 24 ARG HH21 1 1 5 1844 1 1 24 ARG HH22 H 2.067 -4.539 12.434 1.00 . A A . 24 ARG HH22 1 1 5 1845 1 1 24 ARG N N 3.417 -2.964 3.222 1.00 . A A . 24 ARG N 1 1 5 1846 1 1 24 ARG NE N 2.531 -4.349 9.227 1.00 . A A . 24 ARG NE 1 1 5 1847 1 1 24 ARG NH1 N 1.639 -2.757 10.661 1.00 . A A . 24 ARG NH1 1 1 5 1848 1 1 24 ARG NH2 N 2.333 -4.805 11.497 1.00 . A A . 24 ARG NH2 1 1 5 1849 1 1 24 ARG O O 1.495 -5.000 3.417 1.00 . A A . 24 ARG O 1 1 5 1850 1 1 25 ASN C C 2.290 -7.132 1.636 1.00 . A A . 25 ASN C 1 1 5 1851 1 1 25 ASN CA C 2.703 -7.517 3.069 1.00 . A A . 25 ASN CA 1 1 5 1852 1 1 25 ASN CB C 1.572 -8.152 3.892 1.00 . A A . 25 ASN CB 1 1 5 1853 1 1 25 ASN CG C 1.039 -9.449 3.280 1.00 . A A . 25 ASN CG 1 1 5 1854 1 1 25 ASN H H 4.202 -6.420 4.118 1.00 . A A . 25 ASN H 1 1 5 1855 1 1 25 ASN HA H 3.505 -8.252 2.986 1.00 . A A . 25 ASN HA 1 1 5 1856 1 1 25 ASN HB3 H 0.753 -7.444 3.996 1.00 . A A . 25 ASN HB3 1 1 5 1857 1 1 25 ASN HD21 H -0.580 -9.447 4.518 1.00 . A A . 25 ASN HD21 1 1 5 1858 1 1 25 ASN HD22 H -0.452 -10.797 3.405 1.00 . A A . 25 ASN HD22 1 1 5 1859 1 1 25 ASN N N 3.257 -6.350 3.767 1.00 . A A . 25 ASN N 1 1 5 1860 1 1 25 ASN ND2 N -0.110 -9.919 3.761 1.00 . A A . 25 ASN ND2 1 1 5 1861 1 1 25 ASN O O 1.253 -7.532 1.099 1.00 . A A . 25 ASN O 1 1 5 1862 1 1 25 ASN OD1 O 1.649 -10.039 2.396 1.00 . A A . 25 ASN OD1 1 1 5 1863 1 1 26 GLY C C 1.546 -4.975 -0.385 1.00 . A A . 26 GLY C 1 1 5 1864 1 1 26 GLY CA C 2.883 -5.718 -0.286 1.00 . A A . 26 GLY CA 1 1 5 1865 1 1 26 GLY H H 3.967 -6.015 1.501 1.00 . A A . 26 GLY H 1 1 5 1866 1 1 26 GLY HA2 H 3.695 -5.027 -0.499 1.00 . A A . 26 GLY HA2 1 1 5 1867 1 1 26 GLY HA3 H 2.905 -6.512 -1.035 1.00 . A A . 26 GLY HA3 1 1 5 1868 1 1 26 GLY N N 3.124 -6.294 1.020 1.00 . A A . 26 GLY N 1 1 5 1869 1 1 26 GLY O O 0.989 -4.909 -1.472 1.00 . A A . 26 GLY O 1 1 5 1870 1 1 27 PHE C C 0.220 -2.206 1.214 1.00 . A A . 27 PHE C 1 1 5 1871 1 1 27 PHE CA C -0.184 -3.598 0.738 1.00 . A A . 27 PHE CA 1 1 5 1872 1 1 27 PHE CB C -1.244 -4.176 1.684 1.00 . A A . 27 PHE CB 1 1 5 1873 1 1 27 PHE CD1 C -2.676 -5.634 0.203 1.00 . A A . 27 PHE CD1 1 1 5 1874 1 1 27 PHE CD2 C -1.681 -6.622 2.183 1.00 . A A . 27 PHE CD2 1 1 5 1875 1 1 27 PHE CE1 C -3.440 -6.797 0.000 1.00 . A A . 27 PHE CE1 1 1 5 1876 1 1 27 PHE CE2 C -2.440 -7.791 1.983 1.00 . A A . 27 PHE CE2 1 1 5 1877 1 1 27 PHE CG C -1.810 -5.532 1.303 1.00 . A A . 27 PHE CG 1 1 5 1878 1 1 27 PHE CZ C -3.337 -7.870 0.901 1.00 . A A . 27 PHE CZ 1 1 5 1879 1 1 27 PHE H H 1.469 -4.570 1.612 1.00 . A A . 27 PHE H 1 1 5 1880 1 1 27 PHE HA H -0.602 -3.516 -0.257 1.00 . A A . 27 PHE HA 1 1 5 1881 1 1 27 PHE HB3 H -2.079 -3.471 1.711 1.00 . A A . 27 PHE HB3 1 1 5 1882 1 1 27 PHE HD1 H -2.833 -4.777 -0.437 1.00 . A A . 27 PHE HD1 1 1 5 1883 1 1 27 PHE HD2 H -1.079 -6.523 3.073 1.00 . A A . 27 PHE HD2 1 1 5 1884 1 1 27 PHE HE1 H -4.189 -6.814 -0.782 1.00 . A A . 27 PHE HE1 1 1 5 1885 1 1 27 PHE HE2 H -2.400 -8.590 2.709 1.00 . A A . 27 PHE HE2 1 1 5 1886 1 1 27 PHE HZ H -3.992 -8.724 0.801 1.00 . A A . 27 PHE HZ 1 1 5 1887 1 1 27 PHE N N 1.010 -4.440 0.720 1.00 . A A . 27 PHE N 1 1 5 1888 1 1 27 PHE O O 1.008 -2.102 2.149 1.00 . A A . 27 PHE O 1 1 5 1889 1 1 28 CYS C C -0.317 0.539 2.371 1.00 . A A . 28 CYS C 1 1 5 1890 1 1 28 CYS CA C 0.145 0.209 0.953 1.00 . A A . 28 CYS CA 1 1 5 1891 1 1 28 CYS CB C -0.389 1.270 -0.014 1.00 . A A . 28 CYS CB 1 1 5 1892 1 1 28 CYS H H -0.981 -1.268 -0.135 1.00 . A A . 28 CYS H 1 1 5 1893 1 1 28 CYS HA H 1.235 0.238 0.922 1.00 . A A . 28 CYS HA 1 1 5 1894 1 1 28 CYS HB3 H -1.478 1.246 -0.019 1.00 . A A . 28 CYS HB3 1 1 5 1895 1 1 28 CYS N N -0.281 -1.139 0.589 1.00 . A A . 28 CYS N 1 1 5 1896 1 1 28 CYS O O -1.520 0.534 2.632 1.00 . A A . 28 CYS O 1 1 5 1897 1 1 28 CYS SG S 0.145 2.915 0.504 1.00 . A A . 28 CYS SG 1 1 5 1898 1 1 29 ALA C C -0.275 2.554 4.835 1.00 . A A . 29 ALA C 1 1 5 1899 1 1 29 ALA CA C 0.273 1.128 4.680 1.00 . A A . 29 ALA CA 1 1 5 1900 1 1 29 ALA CB C 1.510 0.889 5.555 1.00 . A A . 29 ALA CB 1 1 5 1901 1 1 29 ALA H H 1.589 0.857 3.026 1.00 . A A . 29 ALA H 1 1 5 1902 1 1 29 ALA HA H -0.499 0.432 5.012 1.00 . A A . 29 ALA HA 1 1 5 1903 1 1 29 ALA HB1 H 1.251 1.027 6.605 1.00 . A A . 29 ALA HB1 1 1 5 1904 1 1 29 ALA HB2 H 1.871 -0.130 5.408 1.00 . A A . 29 ALA HB2 1 1 5 1905 1 1 29 ALA HB3 H 2.300 1.590 5.286 1.00 . A A . 29 ALA HB3 1 1 5 1906 1 1 29 ALA N N 0.609 0.840 3.288 1.00 . A A . 29 ALA N 1 1 5 1907 1 1 29 ALA O O 0.205 3.328 5.663 1.00 . A A . 29 ALA O 1 1 5 1908 1 1 30 CYS C C -2.817 4.377 5.304 1.00 . A A . 30 CYS C 1 1 5 1909 1 1 30 CYS CA C -1.925 4.223 4.068 1.00 . A A . 30 CYS CA 1 1 5 1910 1 1 30 CYS CB C -2.717 4.437 2.777 1.00 . A A . 30 CYS CB 1 1 5 1911 1 1 30 CYS H H -1.683 2.196 3.438 1.00 . A A . 30 CYS H 1 1 5 1912 1 1 30 CYS HA H -1.147 4.984 4.114 1.00 . A A . 30 CYS HA 1 1 5 1913 1 1 30 CYS HB3 H -3.565 3.753 2.763 1.00 . A A . 30 CYS HB3 1 1 5 1914 1 1 30 CYS N N -1.307 2.902 4.059 1.00 . A A . 30 CYS N 1 1 5 1915 1 1 30 CYS O O -4.039 4.453 5.209 1.00 . A A . 30 CYS O 1 1 5 1916 1 1 30 CYS SG S -3.352 6.121 2.596 1.00 . A A . 30 CYS SG 1 1 5 1917 1 1 31 THR C C -3.845 5.624 7.828 1.00 . A A . 31 THR C 1 1 5 1918 1 1 31 THR CA C -2.907 4.414 7.757 1.00 . A A . 31 THR CA 1 1 5 1919 1 1 31 THR CB C -1.894 4.347 8.917 1.00 . A A . 31 THR CB 1 1 5 1920 1 1 31 THR CG2 C -0.910 5.521 8.930 1.00 . A A . 31 THR CG2 1 1 5 1921 1 1 31 THR H H -1.193 4.260 6.484 1.00 . A A . 31 THR H 1 1 5 1922 1 1 31 THR HA H -3.532 3.522 7.811 1.00 . A A . 31 THR HA 1 1 5 1923 1 1 31 THR HB H -1.319 3.424 8.819 1.00 . A A . 31 THR HB 1 1 5 1924 1 1 31 THR HG1 H -3.183 5.045 10.188 1.00 . A A . 31 THR HG1 1 1 5 1925 1 1 31 THR HG21 H -0.229 5.404 9.775 1.00 . A A . 31 THR HG21 1 1 5 1926 1 1 31 THR HG22 H -0.319 5.540 8.013 1.00 . A A . 31 THR HG22 1 1 5 1927 1 1 31 THR HG23 H -1.437 6.469 9.038 1.00 . A A . 31 THR HG23 1 1 5 1928 1 1 31 THR N N -2.200 4.384 6.485 1.00 . A A . 31 THR N 1 1 5 1929 1 1 31 THR O O -4.108 6.147 8.914 1.00 . A A . 31 THR O 1 1 5 1930 1 1 31 THR OG1 O -2.569 4.298 10.155 1.00 . A A . 31 THR OG1 1 1 6 1931 1 1 1 THR C C -9.502 -6.846 5.223 1.00 . A A . 1 THR C 1 1 6 1932 1 1 1 THR CA C -9.179 -6.616 6.705 1.00 . A A . 1 THR CA 1 1 6 1933 1 1 1 THR CB C -8.787 -5.155 6.972 1.00 . A A . 1 THR CB 1 1 6 1934 1 1 1 THR CG2 C -9.948 -4.177 6.769 1.00 . A A . 1 THR CG2 1 1 6 1935 1 1 1 THR H1 H -7.493 -7.793 6.274 1.00 . A A . 1 THR H1 1 1 6 1936 1 1 1 THR HA H -10.012 -6.894 7.350 1.00 . A A . 1 THR HA 1 1 6 1937 1 1 1 THR HB H -7.968 -4.876 6.305 1.00 . A A . 1 THR HB 1 1 6 1938 1 1 1 THR HG1 H -7.748 -5.776 8.483 1.00 . A A . 1 THR HG1 1 1 6 1939 1 1 1 THR HG21 H -10.763 -4.420 7.452 1.00 . A A . 1 THR HG21 1 1 6 1940 1 1 1 THR HG22 H -9.603 -3.166 6.984 1.00 . A A . 1 THR HG22 1 1 6 1941 1 1 1 THR HG23 H -10.306 -4.212 5.740 1.00 . A A . 1 THR HG23 1 1 6 1942 1 1 1 THR N N -8.055 -7.470 7.053 1.00 . A A . 1 THR N 1 1 6 1943 1 1 1 THR O O -8.568 -6.900 4.422 1.00 . A A . 1 THR O 1 1 6 1944 1 1 1 THR OG1 O -8.344 -5.041 8.309 1.00 . A A . 1 THR OG1 1 1 6 1945 1 1 2 PRO C C -11.084 -5.926 2.622 1.00 . A A . 2 PRO C 1 1 6 1946 1 1 2 PRO CA C -11.156 -7.226 3.437 1.00 . A A . 2 PRO CA 1 1 6 1947 1 1 2 PRO CB C -12.572 -7.810 3.519 1.00 . A A . 2 PRO CB 1 1 6 1948 1 1 2 PRO CD C -11.950 -7.027 5.687 1.00 . A A . 2 PRO CD 1 1 6 1949 1 1 2 PRO CG C -13.153 -7.107 4.745 1.00 . A A . 2 PRO CG 1 1 6 1950 1 1 2 PRO HA H -10.496 -7.964 2.975 1.00 . A A . 2 PRO HA 1 1 6 1951 1 1 2 PRO HB3 H -12.507 -8.878 3.722 1.00 . A A . 2 PRO HB3 1 1 6 1952 1 1 2 PRO HD3 H -11.915 -7.927 6.302 1.00 . A A . 2 PRO HD3 1 1 6 1953 1 1 2 PRO HG3 H -13.987 -7.658 5.182 1.00 . A A . 2 PRO HG3 1 1 6 1954 1 1 2 PRO N N -10.778 -6.986 4.826 1.00 . A A . 2 PRO N 1 1 6 1955 1 1 2 PRO O O -12.066 -5.498 2.022 1.00 . A A . 2 PRO O 1 1 6 1956 1 1 3 PHE C C -8.108 -3.862 1.960 1.00 . A A . 3 PHE C 1 1 6 1957 1 1 3 PHE CA C -9.616 -4.075 1.866 1.00 . A A . 3 PHE CA 1 1 6 1958 1 1 3 PHE CB C -10.375 -2.878 2.452 1.00 . A A . 3 PHE CB 1 1 6 1959 1 1 3 PHE CD1 C -10.833 -1.385 0.463 1.00 . A A . 3 PHE CD1 1 1 6 1960 1 1 3 PHE CD2 C -9.221 -0.643 2.130 1.00 . A A . 3 PHE CD2 1 1 6 1961 1 1 3 PHE CE1 C -10.610 -0.213 -0.276 1.00 . A A . 3 PHE CE1 1 1 6 1962 1 1 3 PHE CE2 C -9.010 0.538 1.397 1.00 . A A . 3 PHE CE2 1 1 6 1963 1 1 3 PHE CG C -10.148 -1.597 1.675 1.00 . A A . 3 PHE CG 1 1 6 1964 1 1 3 PHE CZ C -9.704 0.755 0.194 1.00 . A A . 3 PHE CZ 1 1 6 1965 1 1 3 PHE H H -9.134 -5.713 3.111 1.00 . A A . 3 PHE H 1 1 6 1966 1 1 3 PHE HA H -9.914 -4.211 0.825 1.00 . A A . 3 PHE HA 1 1 6 1967 1 1 3 PHE HB3 H -10.068 -2.733 3.490 1.00 . A A . 3 PHE HB3 1 1 6 1968 1 1 3 PHE HD1 H -11.541 -2.119 0.105 1.00 . A A . 3 PHE HD1 1 1 6 1969 1 1 3 PHE HD2 H -8.678 -0.798 3.053 1.00 . A A . 3 PHE HD2 1 1 6 1970 1 1 3 PHE HE1 H -11.150 -0.044 -1.196 1.00 . A A . 3 PHE HE1 1 1 6 1971 1 1 3 PHE HE2 H -8.333 1.289 1.778 1.00 . A A . 3 PHE HE2 1 1 6 1972 1 1 3 PHE HZ H -9.560 1.671 -0.359 1.00 . A A . 3 PHE HZ 1 1 6 1973 1 1 3 PHE N N -9.908 -5.293 2.605 1.00 . A A . 3 PHE N 1 1 6 1974 1 1 3 PHE O O -7.602 -3.557 3.039 1.00 . A A . 3 PHE O 1 1 6 1975 1 1 4 ALA C C -5.400 -3.660 -0.483 1.00 . A A . 4 ALA C 1 1 6 1976 1 1 4 ALA CA C -5.934 -4.142 0.866 1.00 . A A . 4 ALA CA 1 1 6 1977 1 1 4 ALA CB C -5.496 -5.572 1.209 1.00 . A A . 4 ALA CB 1 1 6 1978 1 1 4 ALA H H -7.858 -4.336 0.001 1.00 . A A . 4 ALA H 1 1 6 1979 1 1 4 ALA HA H -5.539 -3.487 1.644 1.00 . A A . 4 ALA HA 1 1 6 1980 1 1 4 ALA HB1 H -5.769 -6.259 0.408 1.00 . A A . 4 ALA HB1 1 1 6 1981 1 1 4 ALA HB2 H -4.422 -5.600 1.364 1.00 . A A . 4 ALA HB2 1 1 6 1982 1 1 4 ALA HB3 H -5.978 -5.894 2.133 1.00 . A A . 4 ALA HB3 1 1 6 1983 1 1 4 ALA N N -7.385 -4.088 0.860 1.00 . A A . 4 ALA N 1 1 6 1984 1 1 4 ALA O O -5.295 -4.429 -1.436 1.00 . A A . 4 ALA O 1 1 6 1985 1 1 5 ILE C C -3.147 -2.248 -2.026 1.00 . A A . 5 ILE C 1 1 6 1986 1 1 5 ILE CA C -4.572 -1.744 -1.786 1.00 . A A . 5 ILE CA 1 1 6 1987 1 1 5 ILE CB C -4.584 -0.214 -1.618 1.00 . A A . 5 ILE CB 1 1 6 1988 1 1 5 ILE CD1 C -5.958 1.443 -0.301 1.00 . A A . 5 ILE CD1 1 1 6 1989 1 1 5 ILE CG1 C -5.999 0.335 -1.358 1.00 . A A . 5 ILE CG1 1 1 6 1990 1 1 5 ILE CG2 C -3.993 0.457 -2.865 1.00 . A A . 5 ILE CG2 1 1 6 1991 1 1 5 ILE H H -5.195 -1.786 0.245 1.00 . A A . 5 ILE H 1 1 6 1992 1 1 5 ILE HA H -5.214 -2.010 -2.628 1.00 . A A . 5 ILE HA 1 1 6 1993 1 1 5 ILE HB H -3.951 0.034 -0.763 1.00 . A A . 5 ILE HB 1 1 6 1994 1 1 5 ILE HD11 H -5.199 2.179 -0.554 1.00 . A A . 5 ILE HD11 1 1 6 1995 1 1 5 ILE HD12 H -6.930 1.931 -0.246 1.00 . A A . 5 ILE HD12 1 1 6 1996 1 1 5 ILE HD13 H -5.720 1.012 0.671 1.00 . A A . 5 ILE HD13 1 1 6 1997 1 1 5 ILE HG13 H -6.674 -0.441 -0.996 1.00 . A A . 5 ILE HG13 1 1 6 1998 1 1 5 ILE HG21 H -4.097 1.535 -2.788 1.00 . A A . 5 ILE HG21 1 1 6 1999 1 1 5 ILE HG22 H -2.931 0.227 -2.961 1.00 . A A . 5 ILE HG22 1 1 6 2000 1 1 5 ILE HG23 H -4.515 0.116 -3.759 1.00 . A A . 5 ILE HG23 1 1 6 2001 1 1 5 ILE N N -5.087 -2.366 -0.572 1.00 . A A . 5 ILE N 1 1 6 2002 1 1 5 ILE O O -2.277 -2.003 -1.194 1.00 . A A . 5 ILE O 1 1 6 2003 1 1 6 LYS C C -0.517 -2.438 -3.563 1.00 . A A . 6 LYS C 1 1 6 2004 1 1 6 LYS CA C -1.598 -3.521 -3.459 1.00 . A A . 6 LYS CA 1 1 6 2005 1 1 6 LYS CB C -1.677 -4.336 -4.754 1.00 . A A . 6 LYS CB 1 1 6 2006 1 1 6 LYS CD C -2.689 -6.400 -5.868 1.00 . A A . 6 LYS CD 1 1 6 2007 1 1 6 LYS CE C -1.349 -6.958 -6.378 1.00 . A A . 6 LYS CE 1 1 6 2008 1 1 6 LYS CG C -2.527 -5.602 -4.564 1.00 . A A . 6 LYS CG 1 1 6 2009 1 1 6 LYS H H -3.665 -3.106 -3.781 1.00 . A A . 6 LYS H 1 1 6 2010 1 1 6 LYS HA H -1.314 -4.198 -2.656 1.00 . A A . 6 LYS HA 1 1 6 2011 1 1 6 LYS HB3 H -0.663 -4.626 -5.025 1.00 . A A . 6 LYS HB3 1 1 6 2012 1 1 6 LYS HD3 H -3.143 -5.752 -6.622 1.00 . A A . 6 LYS HD3 1 1 6 2013 1 1 6 LYS HE3 H -0.864 -7.516 -5.575 1.00 . A A . 6 LYS HE3 1 1 6 2014 1 1 6 LYS HG3 H -3.521 -5.321 -4.210 1.00 . A A . 6 LYS HG3 1 1 6 2015 1 1 6 LYS HZ1 H -1.951 -7.347 -8.310 1.00 . A A . 6 LYS HZ1 1 1 6 2016 1 1 6 LYS HZ2 H -0.620 -8.190 -7.847 1.00 . A A . 6 LYS HZ2 1 1 6 2017 1 1 6 LYS HZ3 H -2.101 -8.641 -7.300 1.00 . A A . 6 LYS HZ3 1 1 6 2018 1 1 6 LYS N N -2.907 -2.955 -3.136 1.00 . A A . 6 LYS N 1 1 6 2019 1 1 6 LYS NZ N -1.523 -7.849 -7.545 1.00 . A A . 6 LYS NZ 1 1 6 2020 1 1 6 LYS O O -0.799 -1.308 -3.957 1.00 . A A . 6 LYS O 1 1 6 2021 1 1 7 CYS C C 3.128 -2.718 -3.193 1.00 . A A . 7 CYS C 1 1 6 2022 1 1 7 CYS CA C 1.856 -1.890 -3.104 1.00 . A A . 7 CYS CA 1 1 6 2023 1 1 7 CYS CB C 1.773 -1.192 -1.749 1.00 . A A . 7 CYS CB 1 1 6 2024 1 1 7 CYS H H 0.866 -3.739 -2.842 1.00 . A A . 7 CYS H 1 1 6 2025 1 1 7 CYS HA H 1.823 -1.150 -3.903 1.00 . A A . 7 CYS HA 1 1 6 2026 1 1 7 CYS HB3 H 1.826 -1.941 -0.965 1.00 . A A . 7 CYS HB3 1 1 6 2027 1 1 7 CYS N N 0.719 -2.798 -3.202 1.00 . A A . 7 CYS N 1 1 6 2028 1 1 7 CYS O O 3.351 -3.567 -2.332 1.00 . A A . 7 CYS O 1 1 6 2029 1 1 7 CYS SG S 2.978 0.088 -1.335 1.00 . A A . 7 CYS SG 1 1 6 2030 1 1 8 ALA C C 6.330 -2.248 -3.830 1.00 . A A . 8 ALA C 1 1 6 2031 1 1 8 ALA CA C 5.235 -3.171 -4.361 1.00 . A A . 8 ALA CA 1 1 6 2032 1 1 8 ALA CB C 5.480 -3.524 -5.830 1.00 . A A . 8 ALA CB 1 1 6 2033 1 1 8 ALA H H 3.759 -1.752 -4.886 1.00 . A A . 8 ALA H 1 1 6 2034 1 1 8 ALA HA H 5.260 -4.101 -3.790 1.00 . A A . 8 ALA HA 1 1 6 2035 1 1 8 ALA HB1 H 5.471 -2.621 -6.444 1.00 . A A . 8 ALA HB1 1 1 6 2036 1 1 8 ALA HB2 H 6.450 -4.012 -5.930 1.00 . A A . 8 ALA HB2 1 1 6 2037 1 1 8 ALA HB3 H 4.702 -4.203 -6.181 1.00 . A A . 8 ALA HB3 1 1 6 2038 1 1 8 ALA N N 3.943 -2.514 -4.229 1.00 . A A . 8 ALA N 1 1 6 2039 1 1 8 ALA O O 7.303 -2.711 -3.241 1.00 . A A . 8 ALA O 1 1 6 2040 1 1 9 THR C C 6.617 1.228 -3.024 1.00 . A A . 9 THR C 1 1 6 2041 1 1 9 THR CA C 7.181 0.075 -3.852 1.00 . A A . 9 THR CA 1 1 6 2042 1 1 9 THR CB C 7.627 0.595 -5.224 1.00 . A A . 9 THR CB 1 1 6 2043 1 1 9 THR CG2 C 8.351 -0.485 -6.032 1.00 . A A . 9 THR CG2 1 1 6 2044 1 1 9 THR H H 5.331 -0.645 -4.559 1.00 . A A . 9 THR H 1 1 6 2045 1 1 9 THR HA H 8.045 -0.339 -3.329 1.00 . A A . 9 THR HA 1 1 6 2046 1 1 9 THR HB H 8.320 1.428 -5.078 1.00 . A A . 9 THR HB 1 1 6 2047 1 1 9 THR HG1 H 5.811 0.377 -5.994 1.00 . A A . 9 THR HG1 1 1 6 2048 1 1 9 THR HG21 H 9.197 -0.870 -5.462 1.00 . A A . 9 THR HG21 1 1 6 2049 1 1 9 THR HG22 H 7.676 -1.307 -6.270 1.00 . A A . 9 THR HG22 1 1 6 2050 1 1 9 THR HG23 H 8.720 -0.052 -6.963 1.00 . A A . 9 THR HG23 1 1 6 2051 1 1 9 THR N N 6.172 -0.945 -4.070 1.00 . A A . 9 THR N 1 1 6 2052 1 1 9 THR O O 5.421 1.516 -3.072 1.00 . A A . 9 THR O 1 1 6 2053 1 1 9 THR OG1 O 6.509 1.056 -5.964 1.00 . A A . 9 THR OG1 1 1 6 2054 1 1 10 ASP C C 6.492 4.105 -2.912 1.00 . A A . 10 ASP C 1 1 6 2055 1 1 10 ASP CA C 7.304 3.313 -1.879 1.00 . A A . 10 ASP CA 1 1 6 2056 1 1 10 ASP CB C 8.688 3.945 -1.651 1.00 . A A . 10 ASP CB 1 1 6 2057 1 1 10 ASP CG C 9.626 3.590 -2.794 1.00 . A A . 10 ASP CG 1 1 6 2058 1 1 10 ASP H H 8.483 1.653 -2.375 1.00 . A A . 10 ASP H 1 1 6 2059 1 1 10 ASP HA H 6.755 3.307 -0.936 1.00 . A A . 10 ASP HA 1 1 6 2060 1 1 10 ASP HB3 H 9.114 3.555 -0.727 1.00 . A A . 10 ASP HB3 1 1 6 2061 1 1 10 ASP N N 7.505 1.938 -2.326 1.00 . A A . 10 ASP N 1 1 6 2062 1 1 10 ASP O O 5.425 4.623 -2.589 1.00 . A A . 10 ASP O 1 1 6 2063 1 1 10 ASP OD1 O 9.637 4.357 -3.779 1.00 . A A . 10 ASP OD1 1 1 6 2064 1 1 10 ASP OD2 O 10.150 2.457 -2.742 1.00 . A A . 10 ASP OD2 1 1 6 2065 1 1 11 ALA C C 4.798 4.437 -5.367 1.00 . A A . 11 ALA C 1 1 6 2066 1 1 11 ALA CA C 6.293 4.773 -5.296 1.00 . A A . 11 ALA CA 1 1 6 2067 1 1 11 ALA CB C 7.014 4.406 -6.594 1.00 . A A . 11 ALA CB 1 1 6 2068 1 1 11 ALA H H 7.957 3.933 -4.278 1.00 . A A . 11 ALA H 1 1 6 2069 1 1 11 ALA HA H 6.391 5.852 -5.196 1.00 . A A . 11 ALA HA 1 1 6 2070 1 1 11 ALA HB1 H 6.562 4.947 -7.426 1.00 . A A . 11 ALA HB1 1 1 6 2071 1 1 11 ALA HB2 H 8.067 4.681 -6.522 1.00 . A A . 11 ALA HB2 1 1 6 2072 1 1 11 ALA HB3 H 6.939 3.338 -6.788 1.00 . A A . 11 ALA HB3 1 1 6 2073 1 1 11 ALA N N 6.973 4.169 -4.158 1.00 . A A . 11 ALA N 1 1 6 2074 1 1 11 ALA O O 4.003 5.324 -5.663 1.00 . A A . 11 ALA O 1 1 6 2075 1 1 12 ASP C C 2.155 3.594 -4.144 1.00 . A A . 12 ASP C 1 1 6 2076 1 1 12 ASP CA C 2.970 2.827 -5.181 1.00 . A A . 12 ASP CA 1 1 6 2077 1 1 12 ASP CB C 2.761 1.319 -5.008 1.00 . A A . 12 ASP CB 1 1 6 2078 1 1 12 ASP CG C 3.374 0.521 -6.138 1.00 . A A . 12 ASP CG 1 1 6 2079 1 1 12 ASP H H 5.057 2.486 -4.816 1.00 . A A . 12 ASP H 1 1 6 2080 1 1 12 ASP HA H 2.597 3.110 -6.164 1.00 . A A . 12 ASP HA 1 1 6 2081 1 1 12 ASP HB3 H 1.691 1.110 -4.993 1.00 . A A . 12 ASP HB3 1 1 6 2082 1 1 12 ASP N N 4.384 3.190 -5.109 1.00 . A A . 12 ASP N 1 1 6 2083 1 1 12 ASP O O 1.111 4.169 -4.468 1.00 . A A . 12 ASP O 1 1 6 2084 1 1 12 ASP OD1 O 2.968 0.786 -7.291 1.00 . A A . 12 ASP OD1 1 1 6 2085 1 1 12 ASP OD2 O 4.225 -0.343 -5.825 1.00 . A A . 12 ASP OD2 1 1 6 2086 1 1 13 CYS C C 2.049 5.897 -2.345 1.00 . A A . 13 CYS C 1 1 6 2087 1 1 13 CYS CA C 1.998 4.448 -1.881 1.00 . A A . 13 CYS CA 1 1 6 2088 1 1 13 CYS CB C 2.657 4.325 -0.503 1.00 . A A . 13 CYS CB 1 1 6 2089 1 1 13 CYS H H 3.516 3.160 -2.705 1.00 . A A . 13 CYS H 1 1 6 2090 1 1 13 CYS HA H 0.948 4.167 -1.800 1.00 . A A . 13 CYS HA 1 1 6 2091 1 1 13 CYS HB3 H 2.421 5.233 0.050 1.00 . A A . 13 CYS HB3 1 1 6 2092 1 1 13 CYS N N 2.626 3.612 -2.893 1.00 . A A . 13 CYS N 1 1 6 2093 1 1 13 CYS O O 1.007 6.538 -2.431 1.00 . A A . 13 CYS O 1 1 6 2094 1 1 13 CYS SG S 2.123 2.984 0.587 1.00 . A A . 13 CYS SG 1 1 6 2095 1 1 14 SER C C 3.044 7.993 -4.561 1.00 . A A . 14 SER C 1 1 6 2096 1 1 14 SER CA C 3.551 7.745 -3.133 1.00 . A A . 14 SER CA 1 1 6 2097 1 1 14 SER CB C 5.070 7.943 -3.041 1.00 . A A . 14 SER CB 1 1 6 2098 1 1 14 SER H H 4.021 5.734 -2.626 1.00 . A A . 14 SER H 1 1 6 2099 1 1 14 SER HA H 3.070 8.460 -2.464 1.00 . A A . 14 SER HA 1 1 6 2100 1 1 14 SER HB3 H 5.564 7.220 -3.687 1.00 . A A . 14 SER HB3 1 1 6 2101 1 1 14 SER HG H 5.138 9.360 -4.356 1.00 . A A . 14 SER HG 1 1 6 2102 1 1 14 SER N N 3.247 6.387 -2.678 1.00 . A A . 14 SER N 1 1 6 2103 1 1 14 SER O O 3.791 8.442 -5.430 1.00 . A A . 14 SER O 1 1 6 2104 1 1 14 SER OG O 5.459 9.243 -3.449 1.00 . A A . 14 SER OG 1 1 6 2105 1 1 15 ARG C C -0.427 7.528 -5.686 1.00 . A A . 15 ARG C 1 1 6 2106 1 1 15 ARG CA C 1.047 7.722 -6.036 1.00 . A A . 15 ARG CA 1 1 6 2107 1 1 15 ARG CB C 1.593 6.609 -6.946 1.00 . A A . 15 ARG CB 1 1 6 2108 1 1 15 ARG CD C 1.540 5.442 -9.181 1.00 . A A . 15 ARG CD 1 1 6 2109 1 1 15 ARG CG C 0.849 6.479 -8.277 1.00 . A A . 15 ARG CG 1 1 6 2110 1 1 15 ARG CZ C 0.572 3.220 -8.535 1.00 . A A . 15 ARG CZ 1 1 6 2111 1 1 15 ARG H H 1.235 7.450 -3.955 1.00 . A A . 15 ARG H 1 1 6 2112 1 1 15 ARG HA H 1.179 8.688 -6.526 1.00 . A A . 15 ARG HA 1 1 6 2113 1 1 15 ARG HB3 H 1.540 5.658 -6.417 1.00 . A A . 15 ARG HB3 1 1 6 2114 1 1 15 ARG HD3 H 2.568 5.771 -9.349 1.00 . A A . 15 ARG HD3 1 1 6 2115 1 1 15 ARG HE H 2.492 3.793 -8.224 1.00 . A A . 15 ARG HE 1 1 6 2116 1 1 15 ARG HG3 H 0.866 7.446 -8.781 1.00 . A A . 15 ARG HG3 1 1 6 2117 1 1 15 ARG HH11 H -0.761 4.540 -9.295 1.00 . A A . 15 ARG HH11 1 1 6 2118 1 1 15 ARG HH12 H -1.427 2.971 -8.945 1.00 . A A . 15 ARG HH12 1 1 6 2119 1 1 15 ARG HH21 H 1.685 1.640 -7.809 1.00 . A A . 15 ARG HH21 1 1 6 2120 1 1 15 ARG HH22 H 0.001 1.313 -8.005 1.00 . A A . 15 ARG HH22 1 1 6 2121 1 1 15 ARG N N 1.759 7.725 -4.772 1.00 . A A . 15 ARG N 1 1 6 2122 1 1 15 ARG NE N 1.593 4.090 -8.585 1.00 . A A . 15 ARG NE 1 1 6 2123 1 1 15 ARG NH1 N -0.638 3.598 -8.958 1.00 . A A . 15 ARG NH1 1 1 6 2124 1 1 15 ARG NH2 N 0.752 1.978 -8.078 1.00 . A A . 15 ARG NH2 1 1 6 2125 1 1 15 ARG O O -1.275 8.290 -6.140 1.00 . A A . 15 ARG O 1 1 6 2126 1 1 16 LYS C C -2.395 7.472 -3.252 1.00 . A A . 16 LYS C 1 1 6 2127 1 1 16 LYS CA C -2.075 6.385 -4.290 1.00 . A A . 16 LYS CA 1 1 6 2128 1 1 16 LYS CB C -2.242 4.974 -3.696 1.00 . A A . 16 LYS CB 1 1 6 2129 1 1 16 LYS CD C -4.253 4.186 -2.258 1.00 . A A . 16 LYS CD 1 1 6 2130 1 1 16 LYS CE C -4.478 5.449 -1.423 1.00 . A A . 16 LYS CE 1 1 6 2131 1 1 16 LYS CG C -3.715 4.516 -3.659 1.00 . A A . 16 LYS CG 1 1 6 2132 1 1 16 LYS H H -0.004 5.901 -4.523 1.00 . A A . 16 LYS H 1 1 6 2133 1 1 16 LYS HA H -2.771 6.487 -5.123 1.00 . A A . 16 LYS HA 1 1 6 2134 1 1 16 LYS HB3 H -1.789 4.932 -2.704 1.00 . A A . 16 LYS HB3 1 1 6 2135 1 1 16 LYS HD3 H -3.551 3.521 -1.752 1.00 . A A . 16 LYS HD3 1 1 6 2136 1 1 16 LYS HE3 H -5.095 6.153 -1.987 1.00 . A A . 16 LYS HE3 1 1 6 2137 1 1 16 LYS HG3 H -3.785 3.609 -4.263 1.00 . A A . 16 LYS HG3 1 1 6 2138 1 1 16 LYS HZ1 H -6.040 4.755 -0.262 1.00 . A A . 16 LYS HZ1 1 1 6 2139 1 1 16 LYS HZ2 H -4.587 4.594 0.494 1.00 . A A . 16 LYS HZ2 1 1 6 2140 1 1 16 LYS HZ3 H -5.273 6.062 0.365 1.00 . A A . 16 LYS HZ3 1 1 6 2141 1 1 16 LYS N N -0.732 6.540 -4.835 1.00 . A A . 16 LYS N 1 1 6 2142 1 1 16 LYS NZ N -5.138 5.190 -0.125 1.00 . A A . 16 LYS NZ 1 1 6 2143 1 1 16 LYS O O -3.556 7.847 -3.107 1.00 . A A . 16 LYS O 1 1 6 2144 1 1 17 CYS C C -0.324 9.501 -0.908 1.00 . A A . 17 CYS C 1 1 6 2145 1 1 17 CYS CA C -1.606 8.739 -1.277 1.00 . A A . 17 CYS CA 1 1 6 2146 1 1 17 CYS CB C -2.070 7.822 -0.140 1.00 . A A . 17 CYS CB 1 1 6 2147 1 1 17 CYS H H -0.465 7.557 -2.600 1.00 . A A . 17 CYS H 1 1 6 2148 1 1 17 CYS HA H -2.399 9.455 -1.494 1.00 . A A . 17 CYS HA 1 1 6 2149 1 1 17 CYS HB3 H -1.664 6.822 -0.292 1.00 . A A . 17 CYS HB3 1 1 6 2150 1 1 17 CYS N N -1.404 7.919 -2.469 1.00 . A A . 17 CYS N 1 1 6 2151 1 1 17 CYS O O 0.769 8.974 -1.094 1.00 . A A . 17 CYS O 1 1 6 2152 1 1 17 CYS SG S -1.619 8.253 1.550 1.00 . A A . 17 CYS SG 1 1 6 2153 1 1 18 PRO C C 1.377 11.136 1.212 1.00 . A A . 18 PRO C 1 1 6 2154 1 1 18 PRO CA C 0.725 11.581 -0.103 1.00 . A A . 18 PRO CA 1 1 6 2155 1 1 18 PRO CB C 0.164 13.005 -0.001 1.00 . A A . 18 PRO CB 1 1 6 2156 1 1 18 PRO CD C -1.665 11.490 -0.203 1.00 . A A . 18 PRO CD 1 1 6 2157 1 1 18 PRO CG C -1.253 12.773 0.520 1.00 . A A . 18 PRO CG 1 1 6 2158 1 1 18 PRO HA H 1.466 11.536 -0.901 1.00 . A A . 18 PRO HA 1 1 6 2159 1 1 18 PRO HB3 H 0.110 13.441 -0.999 1.00 . A A . 18 PRO HB3 1 1 6 2160 1 1 18 PRO HD3 H -2.111 11.751 -1.165 1.00 . A A . 18 PRO HD3 1 1 6 2161 1 1 18 PRO HG3 H -1.920 13.606 0.302 1.00 . A A . 18 PRO HG3 1 1 6 2162 1 1 18 PRO N N -0.430 10.753 -0.430 1.00 . A A . 18 PRO N 1 1 6 2163 1 1 18 PRO O O 0.901 10.223 1.884 1.00 . A A . 18 PRO O 1 1 6 2164 1 1 19 GLY C C 4.077 10.330 2.825 1.00 . A A . 19 GLY C 1 1 6 2165 1 1 19 GLY CA C 3.160 11.556 2.854 1.00 . A A . 19 GLY CA 1 1 6 2166 1 1 19 GLY H H 2.846 12.516 0.985 1.00 . A A . 19 GLY H 1 1 6 2167 1 1 19 GLY HA2 H 3.770 12.430 3.085 1.00 . A A . 19 GLY HA2 1 1 6 2168 1 1 19 GLY HA3 H 2.429 11.430 3.653 1.00 . A A . 19 GLY HA3 1 1 6 2169 1 1 19 GLY N N 2.476 11.796 1.587 1.00 . A A . 19 GLY N 1 1 6 2170 1 1 19 GLY O O 4.723 10.025 3.822 1.00 . A A . 19 GLY O 1 1 6 2171 1 1 20 ASN C C 5.163 7.500 2.530 1.00 . A A . 20 ASN C 1 1 6 2172 1 1 20 ASN CA C 5.072 8.544 1.404 1.00 . A A . 20 ASN CA 1 1 6 2173 1 1 20 ASN CB C 6.448 9.121 1.020 1.00 . A A . 20 ASN CB 1 1 6 2174 1 1 20 ASN CG C 6.367 9.876 -0.304 1.00 . A A . 20 ASN CG 1 1 6 2175 1 1 20 ASN H H 3.613 9.980 0.896 1.00 . A A . 20 ASN H 1 1 6 2176 1 1 20 ASN HA H 4.692 8.012 0.531 1.00 . A A . 20 ASN HA 1 1 6 2177 1 1 20 ASN HB3 H 7.162 8.303 0.910 1.00 . A A . 20 ASN HB3 1 1 6 2178 1 1 20 ASN HD21 H 7.827 8.727 -1.158 1.00 . A A . 20 ASN HD21 1 1 6 2179 1 1 20 ASN HD22 H 6.885 9.758 -2.229 1.00 . A A . 20 ASN HD22 1 1 6 2180 1 1 20 ASN N N 4.151 9.640 1.681 1.00 . A A . 20 ASN N 1 1 6 2181 1 1 20 ASN ND2 N 7.155 9.466 -1.293 1.00 . A A . 20 ASN ND2 1 1 6 2182 1 1 20 ASN O O 6.264 7.168 2.966 1.00 . A A . 20 ASN O 1 1 6 2183 1 1 20 ASN OD1 O 5.558 10.786 -0.463 1.00 . A A . 20 ASN OD1 1 1 6 2184 1 1 21 PRO C C 4.555 4.542 3.096 1.00 . A A . 21 PRO C 1 1 6 2185 1 1 21 PRO CA C 4.054 5.778 3.864 1.00 . A A . 21 PRO CA 1 1 6 2186 1 1 21 PRO CB C 2.613 5.615 4.349 1.00 . A A . 21 PRO CB 1 1 6 2187 1 1 21 PRO CD C 2.667 7.288 2.620 1.00 . A A . 21 PRO CD 1 1 6 2188 1 1 21 PRO CG C 1.780 6.194 3.208 1.00 . A A . 21 PRO CG 1 1 6 2189 1 1 21 PRO HA H 4.705 5.986 4.714 1.00 . A A . 21 PRO HA 1 1 6 2190 1 1 21 PRO HB3 H 2.463 6.221 5.243 1.00 . A A . 21 PRO HB3 1 1 6 2191 1 1 21 PRO HD3 H 2.396 8.228 3.098 1.00 . A A . 21 PRO HD3 1 1 6 2192 1 1 21 PRO HG3 H 0.849 6.615 3.580 1.00 . A A . 21 PRO HG3 1 1 6 2193 1 1 21 PRO N N 4.031 6.932 2.981 1.00 . A A . 21 PRO N 1 1 6 2194 1 1 21 PRO O O 4.586 4.557 1.867 1.00 . A A . 21 PRO O 1 1 6 2195 1 1 22 PRO C C 4.491 1.288 2.725 1.00 . A A . 22 PRO C 1 1 6 2196 1 1 22 PRO CA C 5.554 2.297 3.179 1.00 . A A . 22 PRO CA 1 1 6 2197 1 1 22 PRO CB C 6.434 1.693 4.279 1.00 . A A . 22 PRO CB 1 1 6 2198 1 1 22 PRO CD C 5.093 3.409 5.248 1.00 . A A . 22 PRO CD 1 1 6 2199 1 1 22 PRO CG C 5.644 2.015 5.547 1.00 . A A . 22 PRO CG 1 1 6 2200 1 1 22 PRO HA H 6.176 2.574 2.326 1.00 . A A . 22 PRO HA 1 1 6 2201 1 1 22 PRO HB3 H 7.388 2.218 4.305 1.00 . A A . 22 PRO HB3 1 1 6 2202 1 1 22 PRO HD3 H 5.817 4.154 5.583 1.00 . A A . 22 PRO HD3 1 1 6 2203 1 1 22 PRO HG3 H 6.270 1.998 6.440 1.00 . A A . 22 PRO HG3 1 1 6 2204 1 1 22 PRO N N 4.970 3.477 3.800 1.00 . A A . 22 PRO N 1 1 6 2205 1 1 22 PRO O O 3.320 1.355 3.111 1.00 . A A . 22 PRO O 1 1 6 2206 1 1 23 CYS C C 4.375 -1.808 3.010 1.00 . A A . 23 CYS C 1 1 6 2207 1 1 23 CYS CA C 4.179 -0.940 1.765 1.00 . A A . 23 CYS CA 1 1 6 2208 1 1 23 CYS CB C 4.658 -1.730 0.539 1.00 . A A . 23 CYS CB 1 1 6 2209 1 1 23 CYS H H 5.899 0.289 1.665 1.00 . A A . 23 CYS H 1 1 6 2210 1 1 23 CYS HA H 3.126 -0.701 1.636 1.00 . A A . 23 CYS HA 1 1 6 2211 1 1 23 CYS HB3 H 3.963 -2.556 0.386 1.00 . A A . 23 CYS HB3 1 1 6 2212 1 1 23 CYS N N 4.931 0.293 1.949 1.00 . A A . 23 CYS N 1 1 6 2213 1 1 23 CYS O O 5.429 -1.755 3.643 1.00 . A A . 23 CYS O 1 1 6 2214 1 1 23 CYS SG S 4.802 -0.869 -1.045 1.00 . A A . 23 CYS SG 1 1 6 2215 1 1 24 ARG C C 2.774 -4.918 3.779 1.00 . A A . 24 ARG C 1 1 6 2216 1 1 24 ARG CA C 3.510 -3.701 4.332 1.00 . A A . 24 ARG CA 1 1 6 2217 1 1 24 ARG CB C 2.926 -3.224 5.669 1.00 . A A . 24 ARG CB 1 1 6 2218 1 1 24 ARG CD C 2.706 -3.715 8.136 1.00 . A A . 24 ARG CD 1 1 6 2219 1 1 24 ARG CG C 3.184 -4.249 6.782 1.00 . A A . 24 ARG CG 1 1 6 2220 1 1 24 ARG CZ C 2.746 -4.469 10.517 1.00 . A A . 24 ARG CZ 1 1 6 2221 1 1 24 ARG H H 2.530 -2.622 2.809 1.00 . A A . 24 ARG H 1 1 6 2222 1 1 24 ARG HA H 4.563 -3.949 4.475 1.00 . A A . 24 ARG HA 1 1 6 2223 1 1 24 ARG HB3 H 1.854 -3.054 5.560 1.00 . A A . 24 ARG HB3 1 1 6 2224 1 1 24 ARG HD3 H 1.631 -3.532 8.077 1.00 . A A . 24 ARG HD3 1 1 6 2225 1 1 24 ARG HE H 3.421 -5.548 8.929 1.00 . A A . 24 ARG HE 1 1 6 2226 1 1 24 ARG HG3 H 4.257 -4.448 6.836 1.00 . A A . 24 ARG HG3 1 1 6 2227 1 1 24 ARG HH11 H 1.936 -2.629 10.220 1.00 . A A . 24 ARG HH11 1 1 6 2228 1 1 24 ARG HH12 H 1.977 -3.132 11.882 1.00 . A A . 24 ARG HH12 1 1 6 2229 1 1 24 ARG HH21 H 3.500 -6.270 11.128 1.00 . A A . 24 ARG HH21 1 1 6 2230 1 1 24 ARG HH22 H 2.891 -5.269 12.402 1.00 . A A . 24 ARG HH22 1 1 6 2231 1 1 24 ARG N N 3.395 -2.649 3.338 1.00 . A A . 24 ARG N 1 1 6 2232 1 1 24 ARG NE N 2.994 -4.675 9.213 1.00 . A A . 24 ARG NE 1 1 6 2233 1 1 24 ARG NH1 N 2.175 -3.325 10.911 1.00 . A A . 24 ARG NH1 1 1 6 2234 1 1 24 ARG NH2 N 3.067 -5.404 11.418 1.00 . A A . 24 ARG NH2 1 1 6 2235 1 1 24 ARG O O 1.654 -4.790 3.290 1.00 . A A . 24 ARG O 1 1 6 2236 1 1 25 ASN C C 2.386 -7.163 1.811 1.00 . A A . 25 ASN C 1 1 6 2237 1 1 25 ASN CA C 2.891 -7.335 3.254 1.00 . A A . 25 ASN CA 1 1 6 2238 1 1 25 ASN CB C 1.804 -7.897 4.185 1.00 . A A . 25 ASN CB 1 1 6 2239 1 1 25 ASN CG C 1.387 -9.316 3.798 1.00 . A A . 25 ASN CG 1 1 6 2240 1 1 25 ASN H H 4.348 -6.115 4.202 1.00 . A A . 25 ASN H 1 1 6 2241 1 1 25 ASN HA H 3.719 -8.044 3.223 1.00 . A A . 25 ASN HA 1 1 6 2242 1 1 25 ASN HB3 H 0.934 -7.240 4.166 1.00 . A A . 25 ASN HB3 1 1 6 2243 1 1 25 ASN HD21 H -0.577 -8.954 4.219 1.00 . A A . 25 ASN HD21 1 1 6 2244 1 1 25 ASN HD22 H -0.181 -10.570 3.661 1.00 . A A . 25 ASN HD22 1 1 6 2245 1 1 25 ASN N N 3.422 -6.088 3.804 1.00 . A A . 25 ASN N 1 1 6 2246 1 1 25 ASN ND2 N 0.099 -9.635 3.911 1.00 . A A . 25 ASN ND2 1 1 6 2247 1 1 25 ASN O O 1.431 -7.807 1.398 1.00 . A A . 25 ASN O 1 1 6 2248 1 1 25 ASN OD1 O 2.220 -10.134 3.425 1.00 . A A . 25 ASN OD1 1 1 6 2249 1 1 26 GLY C C 1.423 -5.134 -0.501 1.00 . A A . 26 GLY C 1 1 6 2250 1 1 26 GLY CA C 2.669 -6.015 -0.341 1.00 . A A . 26 GLY CA 1 1 6 2251 1 1 26 GLY H H 3.822 -5.787 1.427 1.00 . A A . 26 GLY H 1 1 6 2252 1 1 26 GLY HA2 H 3.517 -5.520 -0.812 1.00 . A A . 26 GLY HA2 1 1 6 2253 1 1 26 GLY HA3 H 2.501 -6.958 -0.863 1.00 . A A . 26 GLY HA3 1 1 6 2254 1 1 26 GLY N N 3.032 -6.281 1.043 1.00 . A A . 26 GLY N 1 1 6 2255 1 1 26 GLY O O 0.849 -5.103 -1.592 1.00 . A A . 26 GLY O 1 1 6 2256 1 1 27 PHE C C 0.210 -2.152 1.114 1.00 . A A . 27 PHE C 1 1 6 2257 1 1 27 PHE CA C -0.149 -3.512 0.515 1.00 . A A . 27 PHE CA 1 1 6 2258 1 1 27 PHE CB C -1.315 -4.144 1.280 1.00 . A A . 27 PHE CB 1 1 6 2259 1 1 27 PHE CD1 C -2.456 -5.642 -0.414 1.00 . A A . 27 PHE CD1 1 1 6 2260 1 1 27 PHE CD2 C -1.353 -6.669 1.493 1.00 . A A . 27 PHE CD2 1 1 6 2261 1 1 27 PHE CE1 C -2.873 -6.909 -0.859 1.00 . A A . 27 PHE CE1 1 1 6 2262 1 1 27 PHE CE2 C -1.718 -7.940 1.018 1.00 . A A . 27 PHE CE2 1 1 6 2263 1 1 27 PHE CG C -1.720 -5.515 0.778 1.00 . A A . 27 PHE CG 1 1 6 2264 1 1 27 PHE CZ C -2.494 -8.061 -0.148 1.00 . A A . 27 PHE CZ 1 1 6 2265 1 1 27 PHE H H 1.476 -4.501 1.442 1.00 . A A . 27 PHE H 1 1 6 2266 1 1 27 PHE HA H -0.442 -3.365 -0.519 1.00 . A A . 27 PHE HA 1 1 6 2267 1 1 27 PHE HB3 H -2.176 -3.476 1.207 1.00 . A A . 27 PHE HB3 1 1 6 2268 1 1 27 PHE HD1 H -2.756 -4.764 -0.957 1.00 . A A . 27 PHE HD1 1 1 6 2269 1 1 27 PHE HD2 H -0.729 -6.587 2.370 1.00 . A A . 27 PHE HD2 1 1 6 2270 1 1 27 PHE HE1 H -3.503 -6.991 -1.731 1.00 . A A . 27 PHE HE1 1 1 6 2271 1 1 27 PHE HE2 H -1.367 -8.824 1.530 1.00 . A A . 27 PHE HE2 1 1 6 2272 1 1 27 PHE HZ H -2.790 -9.038 -0.500 1.00 . A A . 27 PHE HZ 1 1 6 2273 1 1 27 PHE N N 1.007 -4.407 0.548 1.00 . A A . 27 PHE N 1 1 6 2274 1 1 27 PHE O O 1.014 -2.088 2.039 1.00 . A A . 27 PHE O 1 1 6 2275 1 1 28 CYS C C -0.442 0.639 2.366 1.00 . A A . 28 CYS C 1 1 6 2276 1 1 28 CYS CA C 0.083 0.289 0.978 1.00 . A A . 28 CYS CA 1 1 6 2277 1 1 28 CYS CB C -0.396 1.362 -0.009 1.00 . A A . 28 CYS CB 1 1 6 2278 1 1 28 CYS H H -1.032 -1.165 -0.149 1.00 . A A . 28 CYS H 1 1 6 2279 1 1 28 CYS HA H 1.171 0.315 0.998 1.00 . A A . 28 CYS HA 1 1 6 2280 1 1 28 CYS HB3 H -1.480 1.309 -0.107 1.00 . A A . 28 CYS HB3 1 1 6 2281 1 1 28 CYS N N -0.339 -1.054 0.583 1.00 . A A . 28 CYS N 1 1 6 2282 1 1 28 CYS O O -1.651 0.570 2.596 1.00 . A A . 28 CYS O 1 1 6 2283 1 1 28 CYS SG S 0.038 3.016 0.583 1.00 . A A . 28 CYS SG 1 1 6 2284 1 1 29 ALA C C -0.614 2.975 4.477 1.00 . A A . 29 ALA C 1 1 6 2285 1 1 29 ALA CA C 0.006 1.573 4.584 1.00 . A A . 29 ALA CA 1 1 6 2286 1 1 29 ALA CB C 1.195 1.539 5.549 1.00 . A A . 29 ALA CB 1 1 6 2287 1 1 29 ALA H H 1.423 1.143 3.055 1.00 . A A . 29 ALA H 1 1 6 2288 1 1 29 ALA HA H -0.753 0.901 4.987 1.00 . A A . 29 ALA HA 1 1 6 2289 1 1 29 ALA HB1 H 0.870 1.836 6.547 1.00 . A A . 29 ALA HB1 1 1 6 2290 1 1 29 ALA HB2 H 1.604 0.527 5.597 1.00 . A A . 29 ALA HB2 1 1 6 2291 1 1 29 ALA HB3 H 1.975 2.221 5.211 1.00 . A A . 29 ALA HB3 1 1 6 2292 1 1 29 ALA N N 0.430 1.083 3.280 1.00 . A A . 29 ALA N 1 1 6 2293 1 1 29 ALA O O -0.151 3.914 5.122 1.00 . A A . 29 ALA O 1 1 6 2294 1 1 30 CYS C C -3.928 4.008 3.285 1.00 . A A . 30 CYS C 1 1 6 2295 1 1 30 CYS CA C -2.478 4.347 3.614 1.00 . A A . 30 CYS CA 1 1 6 2296 1 1 30 CYS CB C -1.902 5.349 2.612 1.00 . A A . 30 CYS CB 1 1 6 2297 1 1 30 CYS H H -2.008 2.302 3.185 1.00 . A A . 30 CYS H 1 1 6 2298 1 1 30 CYS HA H -2.464 4.837 4.590 1.00 . A A . 30 CYS HA 1 1 6 2299 1 1 30 CYS HB3 H -1.935 4.952 1.598 1.00 . A A . 30 CYS HB3 1 1 6 2300 1 1 30 CYS N N -1.688 3.121 3.691 1.00 . A A . 30 CYS N 1 1 6 2301 1 1 30 CYS O O -4.346 4.068 2.125 1.00 . A A . 30 CYS O 1 1 6 2302 1 1 30 CYS SG S -2.792 6.925 2.653 1.00 . A A . 30 CYS SG 1 1 6 2303 1 1 31 THR C C -6.865 3.972 5.355 1.00 . A A . 31 THR C 1 1 6 2304 1 1 31 THR CA C -6.087 3.263 4.239 1.00 . A A . 31 THR CA 1 1 6 2305 1 1 31 THR CB C -6.211 1.727 4.274 1.00 . A A . 31 THR CB 1 1 6 2306 1 1 31 THR CG2 C -5.537 1.085 5.491 1.00 . A A . 31 THR CG2 1 1 6 2307 1 1 31 THR H H -4.241 3.590 5.228 1.00 . A A . 31 THR H 1 1 6 2308 1 1 31 THR HA H -6.515 3.611 3.299 1.00 . A A . 31 THR HA 1 1 6 2309 1 1 31 THR HB H -5.735 1.323 3.378 1.00 . A A . 31 THR HB 1 1 6 2310 1 1 31 THR HG1 H -8.012 1.764 4.994 1.00 . A A . 31 THR HG1 1 1 6 2311 1 1 31 THR HG21 H -5.705 0.008 5.464 1.00 . A A . 31 THR HG21 1 1 6 2312 1 1 31 THR HG22 H -4.461 1.263 5.472 1.00 . A A . 31 THR HG22 1 1 6 2313 1 1 31 THR HG23 H -5.953 1.478 6.419 1.00 . A A . 31 THR HG23 1 1 6 2314 1 1 31 THR N N -4.682 3.637 4.319 1.00 . A A . 31 THR N 1 1 6 2315 1 1 31 THR O O -7.753 3.389 5.974 1.00 . A A . 31 THR O 1 1 6 2316 1 1 31 THR OG1 O -7.569 1.344 4.245 1.00 . A A . 31 THR OG1 1 1 7 2317 1 1 1 THR C C -11.472 -7.514 4.088 1.00 . A A . 1 THR C 1 1 7 2318 1 1 1 THR CA C -12.935 -7.780 4.471 1.00 . A A . 1 THR CA 1 1 7 2319 1 1 1 THR CB C -13.912 -6.960 3.609 1.00 . A A . 1 THR CB 1 1 7 2320 1 1 1 THR CG2 C -15.365 -7.269 3.985 1.00 . A A . 1 THR CG2 1 1 7 2321 1 1 1 THR H1 H -12.464 -6.717 6.197 1.00 . A A . 1 THR H1 1 1 7 2322 1 1 1 THR HA H -13.158 -8.842 4.369 1.00 . A A . 1 THR HA 1 1 7 2323 1 1 1 THR HB H -13.769 -7.208 2.557 1.00 . A A . 1 THR HB 1 1 7 2324 1 1 1 THR HG1 H -14.388 -5.083 3.357 1.00 . A A . 1 THR HG1 1 1 7 2325 1 1 1 THR HG21 H -15.564 -6.964 5.014 1.00 . A A . 1 THR HG21 1 1 7 2326 1 1 1 THR HG22 H -16.043 -6.733 3.321 1.00 . A A . 1 THR HG22 1 1 7 2327 1 1 1 THR HG23 H -15.551 -8.339 3.888 1.00 . A A . 1 THR HG23 1 1 7 2328 1 1 1 THR N N -13.107 -7.427 5.868 1.00 . A A . 1 THR N 1 1 7 2329 1 1 1 THR O O -10.828 -6.676 4.723 1.00 . A A . 1 THR O 1 1 7 2330 1 1 1 THR OG1 O -13.679 -5.573 3.777 1.00 . A A . 1 THR OG1 1 1 7 2331 1 1 2 PRO C C -9.353 -6.735 1.849 1.00 . A A . 2 PRO C 1 1 7 2332 1 1 2 PRO CA C -9.529 -8.026 2.667 1.00 . A A . 2 PRO CA 1 1 7 2333 1 1 2 PRO CB C -9.202 -9.294 1.868 1.00 . A A . 2 PRO CB 1 1 7 2334 1 1 2 PRO CD C -11.542 -9.275 2.318 1.00 . A A . 2 PRO CD 1 1 7 2335 1 1 2 PRO CG C -10.542 -9.643 1.222 1.00 . A A . 2 PRO CG 1 1 7 2336 1 1 2 PRO HA H -8.872 -7.977 3.537 1.00 . A A . 2 PRO HA 1 1 7 2337 1 1 2 PRO HB3 H -8.928 -10.091 2.563 1.00 . A A . 2 PRO HB3 1 1 7 2338 1 1 2 PRO HD3 H -11.689 -10.136 2.972 1.00 . A A . 2 PRO HD3 1 1 7 2339 1 1 2 PRO HG3 H -10.605 -10.694 0.936 1.00 . A A . 2 PRO HG3 1 1 7 2340 1 1 2 PRO N N -10.918 -8.199 3.073 1.00 . A A . 2 PRO N 1 1 7 2341 1 1 2 PRO O O -8.829 -6.753 0.735 1.00 . A A . 2 PRO O 1 1 7 2342 1 1 3 PHE C C -8.242 -3.782 1.873 1.00 . A A . 3 PHE C 1 1 7 2343 1 1 3 PHE CA C -9.677 -4.300 1.742 1.00 . A A . 3 PHE CA 1 1 7 2344 1 1 3 PHE CB C -10.719 -3.337 2.328 1.00 . A A . 3 PHE CB 1 1 7 2345 1 1 3 PHE CD1 C -11.546 -2.046 0.310 1.00 . A A . 3 PHE CD1 1 1 7 2346 1 1 3 PHE CD2 C -10.249 -0.865 1.997 1.00 . A A . 3 PHE CD2 1 1 7 2347 1 1 3 PHE CE1 C -11.616 -0.872 -0.459 1.00 . A A . 3 PHE CE1 1 1 7 2348 1 1 3 PHE CE2 C -10.314 0.309 1.226 1.00 . A A . 3 PHE CE2 1 1 7 2349 1 1 3 PHE CG C -10.861 -2.046 1.542 1.00 . A A . 3 PHE CG 1 1 7 2350 1 1 3 PHE CZ C -10.998 0.307 -0.001 1.00 . A A . 3 PHE CZ 1 1 7 2351 1 1 3 PHE H H -10.140 -5.628 3.348 1.00 . A A . 3 PHE H 1 1 7 2352 1 1 3 PHE HA H -9.904 -4.426 0.682 1.00 . A A . 3 PHE HA 1 1 7 2353 1 1 3 PHE HB3 H -10.461 -3.112 3.363 1.00 . A A . 3 PHE HB3 1 1 7 2354 1 1 3 PHE HD1 H -12.013 -2.951 -0.052 1.00 . A A . 3 PHE HD1 1 1 7 2355 1 1 3 PHE HD2 H -9.692 -0.861 2.925 1.00 . A A . 3 PHE HD2 1 1 7 2356 1 1 3 PHE HE1 H -12.144 -0.876 -1.401 1.00 . A A . 3 PHE HE1 1 1 7 2357 1 1 3 PHE HE2 H -9.836 1.211 1.578 1.00 . A A . 3 PHE HE2 1 1 7 2358 1 1 3 PHE HZ H -11.055 1.209 -0.592 1.00 . A A . 3 PHE HZ 1 1 7 2359 1 1 3 PHE N N -9.775 -5.595 2.402 1.00 . A A . 3 PHE N 1 1 7 2360 1 1 3 PHE O O -7.974 -2.837 2.613 1.00 . A A . 3 PHE O 1 1 7 2361 1 1 4 ALA C C -5.350 -3.814 -0.126 1.00 . A A . 4 ALA C 1 1 7 2362 1 1 4 ALA CA C -5.886 -4.175 1.262 1.00 . A A . 4 ALA CA 1 1 7 2363 1 1 4 ALA CB C -5.195 -5.402 1.863 1.00 . A A . 4 ALA CB 1 1 7 2364 1 1 4 ALA H H -7.621 -5.247 0.640 1.00 . A A . 4 ALA H 1 1 7 2365 1 1 4 ALA HA H -5.690 -3.342 1.939 1.00 . A A . 4 ALA HA 1 1 7 2366 1 1 4 ALA HB1 H -5.259 -6.251 1.180 1.00 . A A . 4 ALA HB1 1 1 7 2367 1 1 4 ALA HB2 H -4.151 -5.169 2.062 1.00 . A A . 4 ALA HB2 1 1 7 2368 1 1 4 ALA HB3 H -5.672 -5.664 2.807 1.00 . A A . 4 ALA HB3 1 1 7 2369 1 1 4 ALA N N -7.313 -4.442 1.179 1.00 . A A . 4 ALA N 1 1 7 2370 1 1 4 ALA O O -5.241 -4.672 -1.002 1.00 . A A . 4 ALA O 1 1 7 2371 1 1 5 ILE C C -3.055 -2.391 -1.747 1.00 . A A . 5 ILE C 1 1 7 2372 1 1 5 ILE CA C -4.539 -2.030 -1.619 1.00 . A A . 5 ILE CA 1 1 7 2373 1 1 5 ILE CB C -4.786 -0.512 -1.719 1.00 . A A . 5 ILE CB 1 1 7 2374 1 1 5 ILE CD1 C -6.614 1.287 -1.583 1.00 . A A . 5 ILE CD1 1 1 7 2375 1 1 5 ILE CG1 C -6.279 -0.203 -1.493 1.00 . A A . 5 ILE CG1 1 1 7 2376 1 1 5 ILE CG2 C -4.321 0.000 -3.092 1.00 . A A . 5 ILE CG2 1 1 7 2377 1 1 5 ILE H H -5.118 -1.879 0.422 1.00 . A A . 5 ILE H 1 1 7 2378 1 1 5 ILE HA H -5.101 -2.514 -2.421 1.00 . A A . 5 ILE HA 1 1 7 2379 1 1 5 ILE HB H -4.202 -0.006 -0.945 1.00 . A A . 5 ILE HB 1 1 7 2380 1 1 5 ILE HD11 H -5.926 1.863 -0.963 1.00 . A A . 5 ILE HD11 1 1 7 2381 1 1 5 ILE HD12 H -6.555 1.624 -2.618 1.00 . A A . 5 ILE HD12 1 1 7 2382 1 1 5 ILE HD13 H -7.631 1.446 -1.229 1.00 . A A . 5 ILE HD13 1 1 7 2383 1 1 5 ILE HG13 H -6.574 -0.529 -0.496 1.00 . A A . 5 ILE HG13 1 1 7 2384 1 1 5 ILE HG21 H -3.265 -0.221 -3.247 1.00 . A A . 5 ILE HG21 1 1 7 2385 1 1 5 ILE HG22 H -4.903 -0.471 -3.883 1.00 . A A . 5 ILE HG22 1 1 7 2386 1 1 5 ILE HG23 H -4.439 1.079 -3.155 1.00 . A A . 5 ILE HG23 1 1 7 2387 1 1 5 ILE N N -5.030 -2.536 -0.342 1.00 . A A . 5 ILE N 1 1 7 2388 1 1 5 ILE O O -2.268 -2.050 -0.867 1.00 . A A . 5 ILE O 1 1 7 2389 1 1 6 LYS C C -0.278 -2.545 -3.107 1.00 . A A . 6 LYS C 1 1 7 2390 1 1 6 LYS CA C -1.343 -3.645 -3.017 1.00 . A A . 6 LYS CA 1 1 7 2391 1 1 6 LYS CB C -1.321 -4.524 -4.275 1.00 . A A . 6 LYS CB 1 1 7 2392 1 1 6 LYS CD C -2.121 -6.635 -5.372 1.00 . A A . 6 LYS CD 1 1 7 2393 1 1 6 LYS CE C -2.982 -7.896 -5.216 1.00 . A A . 6 LYS CE 1 1 7 2394 1 1 6 LYS CG C -2.184 -5.780 -4.099 1.00 . A A . 6 LYS CG 1 1 7 2395 1 1 6 LYS H H -3.385 -3.316 -3.511 1.00 . A A . 6 LYS H 1 1 7 2396 1 1 6 LYS HA H -1.102 -4.281 -2.168 1.00 . A A . 6 LYS HA 1 1 7 2397 1 1 6 LYS HB3 H -0.292 -4.836 -4.464 1.00 . A A . 6 LYS HB3 1 1 7 2398 1 1 6 LYS HD3 H -1.077 -6.910 -5.550 1.00 . A A . 6 LYS HD3 1 1 7 2399 1 1 6 LYS HE3 H -4.018 -7.602 -5.029 1.00 . A A . 6 LYS HE3 1 1 7 2400 1 1 6 LYS HG3 H -3.220 -5.497 -3.897 1.00 . A A . 6 LYS HG3 1 1 7 2401 1 1 6 LYS HZ1 H -3.281 -8.240 -7.226 1.00 . A A . 6 LYS HZ1 1 1 7 2402 1 1 6 LYS HZ2 H -1.989 -9.052 -6.604 1.00 . A A . 6 LYS HZ2 1 1 7 2403 1 1 6 LYS HZ3 H -3.517 -9.567 -6.285 1.00 . A A . 6 LYS HZ3 1 1 7 2404 1 1 6 LYS N N -2.688 -3.109 -2.814 1.00 . A A . 6 LYS N 1 1 7 2405 1 1 6 LYS NZ N -2.939 -8.749 -6.423 1.00 . A A . 6 LYS NZ 1 1 7 2406 1 1 6 LYS O O -0.582 -1.407 -3.459 1.00 . A A . 6 LYS O 1 1 7 2407 1 1 7 CYS C C 3.391 -2.823 -2.763 1.00 . A A . 7 CYS C 1 1 7 2408 1 1 7 CYS CA C 2.114 -1.995 -2.739 1.00 . A A . 7 CYS CA 1 1 7 2409 1 1 7 CYS CB C 2.042 -1.202 -1.434 1.00 . A A . 7 CYS CB 1 1 7 2410 1 1 7 CYS H H 1.132 -3.843 -2.433 1.00 . A A . 7 CYS H 1 1 7 2411 1 1 7 CYS HA H 2.088 -1.308 -3.588 1.00 . A A . 7 CYS HA 1 1 7 2412 1 1 7 CYS HB3 H 2.071 -1.892 -0.594 1.00 . A A . 7 CYS HB3 1 1 7 2413 1 1 7 CYS N N 0.972 -2.900 -2.782 1.00 . A A . 7 CYS N 1 1 7 2414 1 1 7 CYS O O 3.585 -3.634 -1.860 1.00 . A A . 7 CYS O 1 1 7 2415 1 1 7 CYS SG S 3.280 0.071 -1.122 1.00 . A A . 7 CYS SG 1 1 7 2416 1 1 8 ALA C C 6.625 -2.322 -3.360 1.00 . A A . 8 ALA C 1 1 7 2417 1 1 8 ALA CA C 5.548 -3.301 -3.825 1.00 . A A . 8 ALA CA 1 1 7 2418 1 1 8 ALA CB C 5.824 -3.788 -5.250 1.00 . A A . 8 ALA CB 1 1 7 2419 1 1 8 ALA H H 4.073 -1.938 -4.486 1.00 . A A . 8 ALA H 1 1 7 2420 1 1 8 ALA HA H 5.576 -4.175 -3.170 1.00 . A A . 8 ALA HA 1 1 7 2421 1 1 8 ALA HB1 H 5.058 -4.506 -5.546 1.00 . A A . 8 ALA HB1 1 1 7 2422 1 1 8 ALA HB2 H 5.818 -2.952 -5.948 1.00 . A A . 8 ALA HB2 1 1 7 2423 1 1 8 ALA HB3 H 6.800 -4.273 -5.286 1.00 . A A . 8 ALA HB3 1 1 7 2424 1 1 8 ALA N N 4.245 -2.653 -3.774 1.00 . A A . 8 ALA N 1 1 7 2425 1 1 8 ALA O O 7.574 -2.714 -2.685 1.00 . A A . 8 ALA O 1 1 7 2426 1 1 9 THR C C 6.957 1.163 -2.771 1.00 . A A . 9 THR C 1 1 7 2427 1 1 9 THR CA C 7.482 -0.013 -3.598 1.00 . A A . 9 THR CA 1 1 7 2428 1 1 9 THR CB C 7.872 0.480 -4.998 1.00 . A A . 9 THR CB 1 1 7 2429 1 1 9 THR CG2 C 8.558 -0.617 -5.815 1.00 . A A . 9 THR CG2 1 1 7 2430 1 1 9 THR H H 5.661 -0.814 -4.299 1.00 . A A . 9 THR H 1 1 7 2431 1 1 9 THR HA H 8.374 -0.406 -3.107 1.00 . A A . 9 THR HA 1 1 7 2432 1 1 9 THR HB H 8.571 1.314 -4.899 1.00 . A A . 9 THR HB 1 1 7 2433 1 1 9 THR HG1 H 6.076 0.198 -5.772 1.00 . A A . 9 THR HG1 1 1 7 2434 1 1 9 THR HG21 H 8.875 -0.206 -6.774 1.00 . A A . 9 THR HG21 1 1 7 2435 1 1 9 THR HG22 H 9.435 -0.982 -5.279 1.00 . A A . 9 THR HG22 1 1 7 2436 1 1 9 THR HG23 H 7.875 -1.448 -5.998 1.00 . A A . 9 THR HG23 1 1 7 2437 1 1 9 THR N N 6.481 -1.053 -3.745 1.00 . A A . 9 THR N 1 1 7 2438 1 1 9 THR O O 5.757 1.440 -2.736 1.00 . A A . 9 THR O 1 1 7 2439 1 1 9 THR OG1 O 6.721 0.923 -5.698 1.00 . A A . 9 THR OG1 1 1 7 2440 1 1 10 ASP C C 6.891 4.028 -2.905 1.00 . A A . 10 ASP C 1 1 7 2441 1 1 10 ASP CA C 7.744 3.315 -1.846 1.00 . A A . 10 ASP CA 1 1 7 2442 1 1 10 ASP CB C 9.150 3.936 -1.747 1.00 . A A . 10 ASP CB 1 1 7 2443 1 1 10 ASP CG C 10.025 3.455 -2.896 1.00 . A A . 10 ASP CG 1 1 7 2444 1 1 10 ASP H H 8.865 1.600 -2.273 1.00 . A A . 10 ASP H 1 1 7 2445 1 1 10 ASP HA H 7.247 3.405 -0.879 1.00 . A A . 10 ASP HA 1 1 7 2446 1 1 10 ASP HB3 H 9.616 3.624 -0.812 1.00 . A A . 10 ASP HB3 1 1 7 2447 1 1 10 ASP N N 7.893 1.903 -2.178 1.00 . A A . 10 ASP N 1 1 7 2448 1 1 10 ASP O O 5.839 4.566 -2.573 1.00 . A A . 10 ASP O 1 1 7 2449 1 1 10 ASP OD1 O 10.516 2.313 -2.763 1.00 . A A . 10 ASP OD1 1 1 7 2450 1 1 10 ASP OD2 O 10.014 4.127 -3.947 1.00 . A A . 10 ASP OD2 1 1 7 2451 1 1 11 ALA C C 5.130 4.247 -5.335 1.00 . A A . 11 ALA C 1 1 7 2452 1 1 11 ALA CA C 6.620 4.602 -5.297 1.00 . A A . 11 ALA CA 1 1 7 2453 1 1 11 ALA CB C 7.323 4.229 -6.605 1.00 . A A . 11 ALA CB 1 1 7 2454 1 1 11 ALA H H 8.302 3.756 -4.317 1.00 . A A . 11 ALA H 1 1 7 2455 1 1 11 ALA HA H 6.698 5.686 -5.194 1.00 . A A . 11 ALA HA 1 1 7 2456 1 1 11 ALA HB1 H 8.367 4.540 -6.565 1.00 . A A . 11 ALA HB1 1 1 7 2457 1 1 11 ALA HB2 H 7.279 3.153 -6.771 1.00 . A A . 11 ALA HB2 1 1 7 2458 1 1 11 ALA HB3 H 6.833 4.734 -7.438 1.00 . A A . 11 ALA HB3 1 1 7 2459 1 1 11 ALA N N 7.327 4.017 -4.168 1.00 . A A . 11 ALA N 1 1 7 2460 1 1 11 ALA O O 4.315 5.156 -5.466 1.00 . A A . 11 ALA O 1 1 7 2461 1 1 12 ASP C C 2.530 3.375 -4.276 1.00 . A A . 12 ASP C 1 1 7 2462 1 1 12 ASP CA C 3.344 2.553 -5.270 1.00 . A A . 12 ASP CA 1 1 7 2463 1 1 12 ASP CB C 3.159 1.068 -4.921 1.00 . A A . 12 ASP CB 1 1 7 2464 1 1 12 ASP CG C 3.682 0.116 -5.975 1.00 . A A . 12 ASP CG 1 1 7 2465 1 1 12 ASP H H 5.474 2.247 -5.149 1.00 . A A . 12 ASP H 1 1 7 2466 1 1 12 ASP HA H 2.953 2.731 -6.273 1.00 . A A . 12 ASP HA 1 1 7 2467 1 1 12 ASP HB3 H 2.091 0.870 -4.823 1.00 . A A . 12 ASP HB3 1 1 7 2468 1 1 12 ASP N N 4.754 2.963 -5.231 1.00 . A A . 12 ASP N 1 1 7 2469 1 1 12 ASP O O 1.554 4.039 -4.640 1.00 . A A . 12 ASP O 1 1 7 2470 1 1 12 ASP OD1 O 3.161 0.156 -7.107 1.00 . A A . 12 ASP OD1 1 1 7 2471 1 1 12 ASP OD2 O 4.587 -0.666 -5.603 1.00 . A A . 12 ASP OD2 1 1 7 2472 1 1 13 CYS C C 2.340 5.589 -2.391 1.00 . A A . 13 CYS C 1 1 7 2473 1 1 13 CYS CA C 2.311 4.125 -1.967 1.00 . A A . 13 CYS CA 1 1 7 2474 1 1 13 CYS CB C 3.016 3.990 -0.614 1.00 . A A . 13 CYS CB 1 1 7 2475 1 1 13 CYS H H 3.771 2.778 -2.794 1.00 . A A . 13 CYS H 1 1 7 2476 1 1 13 CYS HA H 1.269 3.822 -1.875 1.00 . A A . 13 CYS HA 1 1 7 2477 1 1 13 CYS HB3 H 2.978 4.966 -0.134 1.00 . A A . 13 CYS HB3 1 1 7 2478 1 1 13 CYS N N 2.940 3.321 -3.005 1.00 . A A . 13 CYS N 1 1 7 2479 1 1 13 CYS O O 1.288 6.210 -2.507 1.00 . A A . 13 CYS O 1 1 7 2480 1 1 13 CYS SG S 2.339 2.855 0.622 1.00 . A A . 13 CYS SG 1 1 7 2481 1 1 14 SER C C 3.430 7.862 -4.383 1.00 . A A . 14 SER C 1 1 7 2482 1 1 14 SER CA C 3.826 7.522 -2.937 1.00 . A A . 14 SER CA 1 1 7 2483 1 1 14 SER CB C 5.316 7.781 -2.664 1.00 . A A . 14 SER CB 1 1 7 2484 1 1 14 SER H H 4.324 5.488 -2.600 1.00 . A A . 14 SER H 1 1 7 2485 1 1 14 SER HA H 3.239 8.142 -2.259 1.00 . A A . 14 SER HA 1 1 7 2486 1 1 14 SER HB3 H 5.916 7.512 -3.536 1.00 . A A . 14 SER HB3 1 1 7 2487 1 1 14 SER HG H 6.472 9.232 -2.096 1.00 . A A . 14 SER HG 1 1 7 2488 1 1 14 SER N N 3.537 6.125 -2.630 1.00 . A A . 14 SER N 1 1 7 2489 1 1 14 SER O O 4.223 8.376 -5.170 1.00 . A A . 14 SER O 1 1 7 2490 1 1 14 SER OG O 5.534 9.133 -2.312 1.00 . A A . 14 SER OG 1 1 7 2491 1 1 15 ARG C C 0.073 7.357 -5.849 1.00 . A A . 15 ARG C 1 1 7 2492 1 1 15 ARG CA C 1.553 7.688 -6.018 1.00 . A A . 15 ARG CA 1 1 7 2493 1 1 15 ARG CB C 2.227 6.757 -7.042 1.00 . A A . 15 ARG CB 1 1 7 2494 1 1 15 ARG CD C 0.500 6.046 -8.803 1.00 . A A . 15 ARG CD 1 1 7 2495 1 1 15 ARG CG C 1.683 6.966 -8.463 1.00 . A A . 15 ARG CG 1 1 7 2496 1 1 15 ARG CZ C -1.019 7.498 -10.162 1.00 . A A . 15 ARG CZ 1 1 7 2497 1 1 15 ARG H H 1.602 7.216 -3.960 1.00 . A A . 15 ARG H 1 1 7 2498 1 1 15 ARG HA H 1.654 8.722 -6.349 1.00 . A A . 15 ARG HA 1 1 7 2499 1 1 15 ARG HB3 H 2.114 5.713 -6.747 1.00 . A A . 15 ARG HB3 1 1 7 2500 1 1 15 ARG HD3 H -0.233 5.985 -8.001 1.00 . A A . 15 ARG HD3 1 1 7 2501 1 1 15 ARG HE H 0.083 5.936 -10.869 1.00 . A A . 15 ARG HE 1 1 7 2502 1 1 15 ARG HG3 H 2.487 6.740 -9.166 1.00 . A A . 15 ARG HG3 1 1 7 2503 1 1 15 ARG HH11 H -1.010 8.008 -8.164 1.00 . A A . 15 ARG HH11 1 1 7 2504 1 1 15 ARG HH12 H -2.001 9.007 -9.168 1.00 . A A . 15 ARG HH12 1 1 7 2505 1 1 15 ARG HH21 H -1.255 7.270 -12.181 1.00 . A A . 15 ARG HH21 1 1 7 2506 1 1 15 ARG HH22 H -2.160 8.574 -11.487 1.00 . A A . 15 ARG HH22 1 1 7 2507 1 1 15 ARG N N 2.173 7.573 -4.711 1.00 . A A . 15 ARG N 1 1 7 2508 1 1 15 ARG NE N -0.160 6.469 -10.045 1.00 . A A . 15 ARG NE 1 1 7 2509 1 1 15 ARG NH1 N -1.375 8.223 -9.094 1.00 . A A . 15 ARG NH1 1 1 7 2510 1 1 15 ARG NH2 N -1.521 7.802 -11.364 1.00 . A A . 15 ARG NH2 1 1 7 2511 1 1 15 ARG O O -0.776 8.012 -6.456 1.00 . A A . 15 ARG O 1 1 7 2512 1 1 16 LYS C C -2.136 6.899 -3.582 1.00 . A A . 16 LYS C 1 1 7 2513 1 1 16 LYS CA C -1.609 5.983 -4.698 1.00 . A A . 16 LYS CA 1 1 7 2514 1 1 16 LYS CB C -1.671 4.492 -4.321 1.00 . A A . 16 LYS CB 1 1 7 2515 1 1 16 LYS CD C -3.755 4.153 -2.856 1.00 . A A . 16 LYS CD 1 1 7 2516 1 1 16 LYS CE C -5.250 4.504 -2.924 1.00 . A A . 16 LYS CE 1 1 7 2517 1 1 16 LYS CG C -3.104 3.936 -4.235 1.00 . A A . 16 LYS CG 1 1 7 2518 1 1 16 LYS H H 0.506 5.738 -4.685 1.00 . A A . 16 LYS H 1 1 7 2519 1 1 16 LYS HA H -2.236 6.127 -5.580 1.00 . A A . 16 LYS HA 1 1 7 2520 1 1 16 LYS HB3 H -1.133 4.308 -3.390 1.00 . A A . 16 LYS HB3 1 1 7 2521 1 1 16 LYS HD3 H -3.230 4.923 -2.294 1.00 . A A . 16 LYS HD3 1 1 7 2522 1 1 16 LYS HE3 H -5.623 4.578 -1.899 1.00 . A A . 16 LYS HE3 1 1 7 2523 1 1 16 LYS HG3 H -3.049 2.859 -4.408 1.00 . A A . 16 LYS HG3 1 1 7 2524 1 1 16 LYS HZ1 H -4.830 6.491 -3.310 1.00 . A A . 16 LYS HZ1 1 1 7 2525 1 1 16 LYS HZ2 H -5.394 5.686 -4.607 1.00 . A A . 16 LYS HZ2 1 1 7 2526 1 1 16 LYS HZ3 H -6.440 6.121 -3.416 1.00 . A A . 16 LYS HZ3 1 1 7 2527 1 1 16 LYS N N -0.241 6.326 -5.057 1.00 . A A . 16 LYS N 1 1 7 2528 1 1 16 LYS NZ N -5.506 5.789 -3.610 1.00 . A A . 16 LYS NZ 1 1 7 2529 1 1 16 LYS O O -3.319 7.241 -3.585 1.00 . A A . 16 LYS O 1 1 7 2530 1 1 17 CYS C C -0.521 8.851 -0.929 1.00 . A A . 17 CYS C 1 1 7 2531 1 1 17 CYS CA C -1.671 7.934 -1.370 1.00 . A A . 17 CYS CA 1 1 7 2532 1 1 17 CYS CB C -2.013 6.897 -0.296 1.00 . A A . 17 CYS CB 1 1 7 2533 1 1 17 CYS H H -0.335 6.922 -2.647 1.00 . A A . 17 CYS H 1 1 7 2534 1 1 17 CYS HA H -2.567 8.522 -1.560 1.00 . A A . 17 CYS HA 1 1 7 2535 1 1 17 CYS HB3 H -1.272 6.097 -0.289 1.00 . A A . 17 CYS HB3 1 1 7 2536 1 1 17 CYS N N -1.298 7.233 -2.596 1.00 . A A . 17 CYS N 1 1 7 2537 1 1 17 CYS O O 0.622 8.404 -0.884 1.00 . A A . 17 CYS O 1 1 7 2538 1 1 17 CYS SG S -2.135 7.532 1.391 1.00 . A A . 17 CYS SG 1 1 7 2539 1 1 18 PRO C C 0.956 10.920 0.926 1.00 . A A . 18 PRO C 1 1 7 2540 1 1 18 PRO CA C 0.276 11.123 -0.432 1.00 . A A . 18 PRO CA 1 1 7 2541 1 1 18 PRO CB C -0.417 12.486 -0.522 1.00 . A A . 18 PRO CB 1 1 7 2542 1 1 18 PRO CD C -2.084 10.783 -0.620 1.00 . A A . 18 PRO CD 1 1 7 2543 1 1 18 PRO CG C -1.838 12.178 -0.049 1.00 . A A . 18 PRO CG 1 1 7 2544 1 1 18 PRO HA H 1.030 11.049 -1.218 1.00 . A A . 18 PRO HA 1 1 7 2545 1 1 18 PRO HB3 H -0.451 12.804 -1.566 1.00 . A A . 18 PRO HB3 1 1 7 2546 1 1 18 PRO HD3 H -2.478 10.873 -1.634 1.00 . A A . 18 PRO HD3 1 1 7 2547 1 1 18 PRO HG3 H -2.564 12.910 -0.407 1.00 . A A . 18 PRO HG3 1 1 7 2548 1 1 18 PRO N N -0.777 10.144 -0.661 1.00 . A A . 18 PRO N 1 1 7 2549 1 1 18 PRO O O 0.485 10.157 1.765 1.00 . A A . 18 PRO O 1 1 7 2550 1 1 19 GLY C C 3.883 10.478 2.399 1.00 . A A . 19 GLY C 1 1 7 2551 1 1 19 GLY CA C 2.840 11.598 2.375 1.00 . A A . 19 GLY CA 1 1 7 2552 1 1 19 GLY H H 2.388 12.256 0.408 1.00 . A A . 19 GLY H 1 1 7 2553 1 1 19 GLY HA2 H 3.362 12.550 2.479 1.00 . A A . 19 GLY HA2 1 1 7 2554 1 1 19 GLY HA3 H 2.173 11.481 3.229 1.00 . A A . 19 GLY HA3 1 1 7 2555 1 1 19 GLY N N 2.070 11.632 1.135 1.00 . A A . 19 GLY N 1 1 7 2556 1 1 19 GLY O O 4.445 10.188 3.451 1.00 . A A . 19 GLY O 1 1 7 2557 1 1 20 ASN C C 5.026 7.699 2.187 1.00 . A A . 20 ASN C 1 1 7 2558 1 1 20 ASN CA C 5.101 8.760 1.072 1.00 . A A . 20 ASN CA 1 1 7 2559 1 1 20 ASN CB C 6.514 9.344 0.899 1.00 . A A . 20 ASN CB 1 1 7 2560 1 1 20 ASN CG C 7.459 8.391 0.167 1.00 . A A . 20 ASN CG 1 1 7 2561 1 1 20 ASN H H 3.631 10.137 0.425 1.00 . A A . 20 ASN H 1 1 7 2562 1 1 20 ASN HA H 4.834 8.263 0.141 1.00 . A A . 20 ASN HA 1 1 7 2563 1 1 20 ASN HB3 H 6.937 9.619 1.866 1.00 . A A . 20 ASN HB3 1 1 7 2564 1 1 20 ASN HD21 H 7.463 7.073 1.706 1.00 . A A . 20 ASN HD21 1 1 7 2565 1 1 20 ASN HD22 H 8.440 6.625 0.306 1.00 . A A . 20 ASN HD22 1 1 7 2566 1 1 20 ASN N N 4.146 9.853 1.244 1.00 . A A . 20 ASN N 1 1 7 2567 1 1 20 ASN ND2 N 7.829 7.271 0.778 1.00 . A A . 20 ASN ND2 1 1 7 2568 1 1 20 ASN O O 6.041 7.394 2.815 1.00 . A A . 20 ASN O 1 1 7 2569 1 1 20 ASN OD1 O 7.848 8.661 -0.966 1.00 . A A . 20 ASN OD1 1 1 7 2570 1 1 21 PRO C C 4.438 4.779 2.923 1.00 . A A . 21 PRO C 1 1 7 2571 1 1 21 PRO CA C 3.715 6.043 3.421 1.00 . A A . 21 PRO CA 1 1 7 2572 1 1 21 PRO CB C 2.206 5.836 3.594 1.00 . A A . 21 PRO CB 1 1 7 2573 1 1 21 PRO CD C 2.575 7.407 1.811 1.00 . A A . 21 PRO CD 1 1 7 2574 1 1 21 PRO CG C 1.615 6.313 2.265 1.00 . A A . 21 PRO CG 1 1 7 2575 1 1 21 PRO HA H 4.146 6.374 4.367 1.00 . A A . 21 PRO HA 1 1 7 2576 1 1 21 PRO HB3 H 1.848 6.486 4.393 1.00 . A A . 21 PRO HB3 1 1 7 2577 1 1 21 PRO HD3 H 2.198 8.353 2.191 1.00 . A A . 21 PRO HD3 1 1 7 2578 1 1 21 PRO HG3 H 0.608 6.712 2.364 1.00 . A A . 21 PRO HG3 1 1 7 2579 1 1 21 PRO N N 3.847 7.111 2.443 1.00 . A A . 21 PRO N 1 1 7 2580 1 1 21 PRO O O 4.719 4.665 1.731 1.00 . A A . 21 PRO O 1 1 7 2581 1 1 22 PRO C C 4.484 1.519 2.983 1.00 . A A . 22 PRO C 1 1 7 2582 1 1 22 PRO CA C 5.460 2.605 3.452 1.00 . A A . 22 PRO CA 1 1 7 2583 1 1 22 PRO CB C 6.164 2.170 4.741 1.00 . A A . 22 PRO CB 1 1 7 2584 1 1 22 PRO CD C 4.667 3.958 5.261 1.00 . A A . 22 PRO CD 1 1 7 2585 1 1 22 PRO CG C 5.194 2.637 5.827 1.00 . A A . 22 PRO CG 1 1 7 2586 1 1 22 PRO HA H 6.204 2.791 2.674 1.00 . A A . 22 PRO HA 1 1 7 2587 1 1 22 PRO HB3 H 7.104 2.715 4.841 1.00 . A A . 22 PRO HB3 1 1 7 2588 1 1 22 PRO HD3 H 5.315 4.769 5.597 1.00 . A A . 22 PRO HD3 1 1 7 2589 1 1 22 PRO HG3 H 5.682 2.765 6.793 1.00 . A A . 22 PRO HG3 1 1 7 2590 1 1 22 PRO N N 4.768 3.832 3.815 1.00 . A A . 22 PRO N 1 1 7 2591 1 1 22 PRO O O 3.300 1.527 3.329 1.00 . A A . 22 PRO O 1 1 7 2592 1 1 23 CYS C C 4.404 -1.515 3.389 1.00 . A A . 23 CYS C 1 1 7 2593 1 1 23 CYS CA C 4.302 -0.737 2.077 1.00 . A A . 23 CYS CA 1 1 7 2594 1 1 23 CYS CB C 4.892 -1.597 0.948 1.00 . A A . 23 CYS CB 1 1 7 2595 1 1 23 CYS H H 5.975 0.566 1.983 1.00 . A A . 23 CYS H 1 1 7 2596 1 1 23 CYS HA H 3.257 -0.540 1.842 1.00 . A A . 23 CYS HA 1 1 7 2597 1 1 23 CYS HB3 H 4.243 -2.465 0.830 1.00 . A A . 23 CYS HB3 1 1 7 2598 1 1 23 CYS N N 5.001 0.530 2.243 1.00 . A A . 23 CYS N 1 1 7 2599 1 1 23 CYS O O 5.403 -1.415 4.098 1.00 . A A . 23 CYS O 1 1 7 2600 1 1 23 CYS SG S 5.082 -0.876 -0.698 1.00 . A A . 23 CYS SG 1 1 7 2601 1 1 24 ARG C C 2.729 -4.514 4.342 1.00 . A A . 24 ARG C 1 1 7 2602 1 1 24 ARG CA C 3.339 -3.207 4.842 1.00 . A A . 24 ARG CA 1 1 7 2603 1 1 24 ARG CB C 2.518 -2.544 5.960 1.00 . A A . 24 ARG CB 1 1 7 2604 1 1 24 ARG CD C 1.609 -4.427 7.453 1.00 . A A . 24 ARG CD 1 1 7 2605 1 1 24 ARG CG C 2.605 -3.265 7.315 1.00 . A A . 24 ARG CG 1 1 7 2606 1 1 24 ARG CZ C 2.565 -5.934 9.214 1.00 . A A . 24 ARG CZ 1 1 7 2607 1 1 24 ARG H H 2.578 -2.324 3.092 1.00 . A A . 24 ARG H 1 1 7 2608 1 1 24 ARG HA H 4.350 -3.391 5.207 1.00 . A A . 24 ARG HA 1 1 7 2609 1 1 24 ARG HB3 H 1.477 -2.435 5.652 1.00 . A A . 24 ARG HB3 1 1 7 2610 1 1 24 ARG HD3 H 1.760 -5.189 6.693 1.00 . A A . 24 ARG HD3 1 1 7 2611 1 1 24 ARG HE H 0.930 -4.744 9.434 1.00 . A A . 24 ARG HE 1 1 7 2612 1 1 24 ARG HG3 H 2.360 -2.531 8.087 1.00 . A A . 24 ARG HG3 1 1 7 2613 1 1 24 ARG HH11 H 3.617 -5.897 7.482 1.00 . A A . 24 ARG HH11 1 1 7 2614 1 1 24 ARG HH12 H 4.246 -6.996 8.674 1.00 . A A . 24 ARG HH12 1 1 7 2615 1 1 24 ARG HH21 H 1.741 -6.165 11.074 1.00 . A A . 24 ARG HH21 1 1 7 2616 1 1 24 ARG HH22 H 3.151 -7.125 10.780 1.00 . A A . 24 ARG HH22 1 1 7 2617 1 1 24 ARG N N 3.387 -2.316 3.700 1.00 . A A . 24 ARG N 1 1 7 2618 1 1 24 ARG NE N 1.660 -5.033 8.797 1.00 . A A . 24 ARG NE 1 1 7 2619 1 1 24 ARG NH1 N 3.551 -6.318 8.396 1.00 . A A . 24 ARG NH1 1 1 7 2620 1 1 24 ARG NH2 N 2.481 -6.448 10.447 1.00 . A A . 24 ARG NH2 1 1 7 2621 1 1 24 ARG O O 1.608 -4.525 3.837 1.00 . A A . 24 ARG O 1 1 7 2622 1 1 25 ASN C C 2.572 -6.909 2.519 1.00 . A A . 25 ASN C 1 1 7 2623 1 1 25 ASN CA C 3.064 -6.939 3.974 1.00 . A A . 25 ASN CA 1 1 7 2624 1 1 25 ASN CB C 2.010 -7.531 4.926 1.00 . A A . 25 ASN CB 1 1 7 2625 1 1 25 ASN CG C 1.724 -9.003 4.629 1.00 . A A . 25 ASN CG 1 1 7 2626 1 1 25 ASN H H 4.422 -5.524 4.794 1.00 . A A . 25 ASN H 1 1 7 2627 1 1 25 ASN HA H 3.946 -7.580 4.002 1.00 . A A . 25 ASN HA 1 1 7 2628 1 1 25 ASN HB3 H 1.088 -6.954 4.853 1.00 . A A . 25 ASN HB3 1 1 7 2629 1 1 25 ASN HD21 H -0.297 -8.739 4.751 1.00 . A A . 25 ASN HD21 1 1 7 2630 1 1 25 ASN HD22 H 0.261 -10.369 4.416 1.00 . A A . 25 ASN HD22 1 1 7 2631 1 1 25 ASN N N 3.480 -5.616 4.441 1.00 . A A . 25 ASN N 1 1 7 2632 1 1 25 ASN ND2 N 0.453 -9.398 4.614 1.00 . A A . 25 ASN ND2 1 1 7 2633 1 1 25 ASN O O 1.657 -7.637 2.150 1.00 . A A . 25 ASN O 1 1 7 2634 1 1 25 ASN OD1 O 2.646 -9.788 4.447 1.00 . A A . 25 ASN OD1 1 1 7 2635 1 1 26 GLY C C 1.582 -5.100 0.011 1.00 . A A . 26 GLY C 1 1 7 2636 1 1 26 GLY CA C 2.836 -5.941 0.281 1.00 . A A . 26 GLY CA 1 1 7 2637 1 1 26 GLY H H 3.933 -5.487 2.039 1.00 . A A . 26 GLY H 1 1 7 2638 1 1 26 GLY HA2 H 3.685 -5.485 -0.226 1.00 . A A . 26 GLY HA2 1 1 7 2639 1 1 26 GLY HA3 H 2.689 -6.934 -0.146 1.00 . A A . 26 GLY HA3 1 1 7 2640 1 1 26 GLY N N 3.180 -6.056 1.691 1.00 . A A . 26 GLY N 1 1 7 2641 1 1 26 GLY O O 1.061 -5.144 -1.105 1.00 . A A . 26 GLY O 1 1 7 2642 1 1 27 PHE C C 0.266 -2.060 1.371 1.00 . A A . 27 PHE C 1 1 7 2643 1 1 27 PHE CA C -0.067 -3.456 0.852 1.00 . A A . 27 PHE CA 1 1 7 2644 1 1 27 PHE CB C -1.252 -4.048 1.621 1.00 . A A . 27 PHE CB 1 1 7 2645 1 1 27 PHE CD1 C -2.366 -5.691 0.047 1.00 . A A . 27 PHE CD1 1 1 7 2646 1 1 27 PHE CD2 C -1.175 -6.555 1.981 1.00 . A A . 27 PHE CD2 1 1 7 2647 1 1 27 PHE CE1 C -2.743 -6.996 -0.310 1.00 . A A . 27 PHE CE1 1 1 7 2648 1 1 27 PHE CE2 C -1.496 -7.866 1.590 1.00 . A A . 27 PHE CE2 1 1 7 2649 1 1 27 PHE CG C -1.608 -5.462 1.209 1.00 . A A . 27 PHE CG 1 1 7 2650 1 1 27 PHE CZ C -2.299 -8.087 0.458 1.00 . A A . 27 PHE CZ 1 1 7 2651 1 1 27 PHE H H 1.522 -4.357 1.917 1.00 . A A . 27 PHE H 1 1 7 2652 1 1 27 PHE HA H -0.329 -3.375 -0.198 1.00 . A A . 27 PHE HA 1 1 7 2653 1 1 27 PHE HB3 H -2.119 -3.404 1.467 1.00 . A A . 27 PHE HB3 1 1 7 2654 1 1 27 PHE HD1 H -2.702 -4.860 -0.548 1.00 . A A . 27 PHE HD1 1 1 7 2655 1 1 27 PHE HD2 H -0.541 -6.393 2.840 1.00 . A A . 27 PHE HD2 1 1 7 2656 1 1 27 PHE HE1 H -3.390 -7.156 -1.159 1.00 . A A . 27 PHE HE1 1 1 7 2657 1 1 27 PHE HE2 H -1.097 -8.704 2.145 1.00 . A A . 27 PHE HE2 1 1 7 2658 1 1 27 PHE HZ H -2.564 -9.095 0.173 1.00 . A A . 27 PHE HZ 1 1 7 2659 1 1 27 PHE N N 1.098 -4.328 0.996 1.00 . A A . 27 PHE N 1 1 7 2660 1 1 27 PHE O O 1.038 -1.940 2.316 1.00 . A A . 27 PHE O 1 1 7 2661 1 1 28 CYS C C -0.412 0.703 2.514 1.00 . A A . 28 CYS C 1 1 7 2662 1 1 28 CYS CA C 0.145 0.357 1.137 1.00 . A A . 28 CYS CA 1 1 7 2663 1 1 28 CYS CB C -0.300 1.419 0.123 1.00 . A A . 28 CYS CB 1 1 7 2664 1 1 28 CYS H H -0.945 -1.135 0.023 1.00 . A A . 28 CYS H 1 1 7 2665 1 1 28 CYS HA H 1.232 0.374 1.180 1.00 . A A . 28 CYS HA 1 1 7 2666 1 1 28 CYS HB3 H -1.388 1.430 0.058 1.00 . A A . 28 CYS HB3 1 1 7 2667 1 1 28 CYS N N -0.259 -0.995 0.757 1.00 . A A . 28 CYS N 1 1 7 2668 1 1 28 CYS O O -1.614 0.571 2.729 1.00 . A A . 28 CYS O 1 1 7 2669 1 1 28 CYS SG S 0.266 3.063 0.626 1.00 . A A . 28 CYS SG 1 1 7 2670 1 1 29 ALA C C -1.048 2.621 4.751 1.00 . A A . 29 ALA C 1 1 7 2671 1 1 29 ALA CA C -0.012 1.493 4.787 1.00 . A A . 29 ALA CA 1 1 7 2672 1 1 29 ALA CB C 1.191 1.875 5.654 1.00 . A A . 29 ALA CB 1 1 7 2673 1 1 29 ALA H H 1.434 1.223 3.242 1.00 . A A . 29 ALA H 1 1 7 2674 1 1 29 ALA HA H -0.479 0.613 5.232 1.00 . A A . 29 ALA HA 1 1 7 2675 1 1 29 ALA HB1 H 1.689 2.749 5.236 1.00 . A A . 29 ALA HB1 1 1 7 2676 1 1 29 ALA HB2 H 0.856 2.103 6.666 1.00 . A A . 29 ALA HB2 1 1 7 2677 1 1 29 ALA HB3 H 1.894 1.044 5.694 1.00 . A A . 29 ALA HB3 1 1 7 2678 1 1 29 ALA N N 0.441 1.144 3.447 1.00 . A A . 29 ALA N 1 1 7 2679 1 1 29 ALA O O -2.059 2.546 5.441 1.00 . A A . 29 ALA O 1 1 7 2680 1 1 30 CYS C C -2.258 5.304 5.129 1.00 . A A . 30 CYS C 1 1 7 2681 1 1 30 CYS CA C -1.587 4.877 3.817 1.00 . A A . 30 CYS CA 1 1 7 2682 1 1 30 CYS CB C -2.594 4.721 2.675 1.00 . A A . 30 CYS CB 1 1 7 2683 1 1 30 CYS H H 0.061 3.597 3.395 1.00 . A A . 30 CYS H 1 1 7 2684 1 1 30 CYS HA H -0.918 5.686 3.542 1.00 . A A . 30 CYS HA 1 1 7 2685 1 1 30 CYS HB3 H -3.318 3.955 2.955 1.00 . A A . 30 CYS HB3 1 1 7 2686 1 1 30 CYS N N -0.772 3.669 3.961 1.00 . A A . 30 CYS N 1 1 7 2687 1 1 30 CYS O O -3.479 5.359 5.245 1.00 . A A . 30 CYS O 1 1 7 2688 1 1 30 CYS SG S -3.513 6.230 2.267 1.00 . A A . 30 CYS SG 1 1 7 2689 1 1 31 THR C C -0.673 6.649 8.170 1.00 . A A . 31 THR C 1 1 7 2690 1 1 31 THR CA C -1.878 6.058 7.444 1.00 . A A . 31 THR CA 1 1 7 2691 1 1 31 THR CB C -2.524 4.904 8.232 1.00 . A A . 31 THR CB 1 1 7 2692 1 1 31 THR CG2 C -1.528 3.795 8.593 1.00 . A A . 31 THR CG2 1 1 7 2693 1 1 31 THR H H -0.433 5.564 6.005 1.00 . A A . 31 THR H 1 1 7 2694 1 1 31 THR HA H -2.614 6.852 7.308 1.00 . A A . 31 THR HA 1 1 7 2695 1 1 31 THR HB H -3.327 4.460 7.642 1.00 . A A . 31 THR HB 1 1 7 2696 1 1 31 THR HG1 H -3.924 5.829 9.223 1.00 . A A . 31 THR HG1 1 1 7 2697 1 1 31 THR HG21 H -0.772 4.164 9.285 1.00 . A A . 31 THR HG21 1 1 7 2698 1 1 31 THR HG22 H -2.068 2.977 9.072 1.00 . A A . 31 THR HG22 1 1 7 2699 1 1 31 THR HG23 H -1.043 3.416 7.697 1.00 . A A . 31 THR HG23 1 1 7 2700 1 1 31 THR N N -1.436 5.604 6.136 1.00 . A A . 31 THR N 1 1 7 2701 1 1 31 THR O O 0.447 6.548 7.661 1.00 . A A . 31 THR O 1 1 7 2702 1 1 31 THR OG1 O -3.082 5.410 9.427 1.00 . A A . 31 THR OG1 1 1 8 2703 1 1 1 THR C C -5.415 -8.778 5.865 1.00 . A A . 1 THR C 1 1 8 2704 1 1 1 THR CA C -5.991 -9.256 7.205 1.00 . A A . 1 THR CA 1 1 8 2705 1 1 1 THR CB C -6.729 -8.119 7.931 1.00 . A A . 1 THR CB 1 1 8 2706 1 1 1 THR CG2 C -7.467 -8.627 9.174 1.00 . A A . 1 THR CG2 1 1 8 2707 1 1 1 THR H1 H -4.632 -9.026 8.764 1.00 . A A . 1 THR H1 1 1 8 2708 1 1 1 THR HA H -6.697 -10.069 7.041 1.00 . A A . 1 THR HA 1 1 8 2709 1 1 1 THR HB H -7.457 -7.665 7.255 1.00 . A A . 1 THR HB 1 1 8 2710 1 1 1 THR HG1 H -5.371 -6.816 7.523 1.00 . A A . 1 THR HG1 1 1 8 2711 1 1 1 THR HG21 H -6.765 -9.058 9.888 1.00 . A A . 1 THR HG21 1 1 8 2712 1 1 1 THR HG22 H -7.987 -7.796 9.649 1.00 . A A . 1 THR HG22 1 1 8 2713 1 1 1 THR HG23 H -8.199 -9.385 8.890 1.00 . A A . 1 THR HG23 1 1 8 2714 1 1 1 THR N N -4.910 -9.701 8.063 1.00 . A A . 1 THR N 1 1 8 2715 1 1 1 THR O O -5.277 -7.568 5.669 1.00 . A A . 1 THR O 1 1 8 2716 1 1 1 THR OG1 O -5.785 -7.148 8.331 1.00 . A A . 1 THR OG1 1 1 8 2717 1 1 2 PRO C C -5.451 -8.816 2.669 1.00 . A A . 2 PRO C 1 1 8 2718 1 1 2 PRO CA C -4.420 -9.352 3.676 1.00 . A A . 2 PRO CA 1 1 8 2719 1 1 2 PRO CB C -3.761 -10.664 3.226 1.00 . A A . 2 PRO CB 1 1 8 2720 1 1 2 PRO CD C -5.136 -11.132 5.118 1.00 . A A . 2 PRO CD 1 1 8 2721 1 1 2 PRO CG C -4.706 -11.730 3.778 1.00 . A A . 2 PRO CG 1 1 8 2722 1 1 2 PRO HA H -3.649 -8.594 3.819 1.00 . A A . 2 PRO HA 1 1 8 2723 1 1 2 PRO HB3 H -2.793 -10.762 3.719 1.00 . A A . 2 PRO HB3 1 1 8 2724 1 1 2 PRO HD3 H -4.436 -11.440 5.897 1.00 . A A . 2 PRO HD3 1 1 8 2725 1 1 2 PRO HG3 H -4.221 -12.701 3.893 1.00 . A A . 2 PRO HG3 1 1 8 2726 1 1 2 PRO N N -5.060 -9.690 4.945 1.00 . A A . 2 PRO N 1 1 8 2727 1 1 2 PRO O O -5.567 -9.319 1.552 1.00 . A A . 2 PRO O 1 1 8 2728 1 1 3 PHE C C -7.371 -5.775 2.383 1.00 . A A . 3 PHE C 1 1 8 2729 1 1 3 PHE CA C -7.387 -7.301 2.378 1.00 . A A . 3 PHE CA 1 1 8 2730 1 1 3 PHE CB C -8.643 -7.854 3.074 1.00 . A A . 3 PHE CB 1 1 8 2731 1 1 3 PHE CD1 C -8.536 -10.207 2.128 1.00 . A A . 3 PHE CD1 1 1 8 2732 1 1 3 PHE CD2 C -8.846 -9.928 4.525 1.00 . A A . 3 PHE CD2 1 1 8 2733 1 1 3 PHE CE1 C -8.542 -11.602 2.288 1.00 . A A . 3 PHE CE1 1 1 8 2734 1 1 3 PHE CE2 C -8.873 -11.325 4.682 1.00 . A A . 3 PHE CE2 1 1 8 2735 1 1 3 PHE CG C -8.675 -9.365 3.246 1.00 . A A . 3 PHE CG 1 1 8 2736 1 1 3 PHE CZ C -8.709 -12.162 3.565 1.00 . A A . 3 PHE CZ 1 1 8 2737 1 1 3 PHE H H -5.992 -7.373 3.972 1.00 . A A . 3 PHE H 1 1 8 2738 1 1 3 PHE HA H -7.387 -7.630 1.340 1.00 . A A . 3 PHE HA 1 1 8 2739 1 1 3 PHE HB3 H -9.519 -7.555 2.494 1.00 . A A . 3 PHE HB3 1 1 8 2740 1 1 3 PHE HD1 H -8.392 -9.788 1.143 1.00 . A A . 3 PHE HD1 1 1 8 2741 1 1 3 PHE HD2 H -8.997 -9.297 5.388 1.00 . A A . 3 PHE HD2 1 1 8 2742 1 1 3 PHE HE1 H -8.421 -12.244 1.426 1.00 . A A . 3 PHE HE1 1 1 8 2743 1 1 3 PHE HE2 H -9.031 -11.758 5.660 1.00 . A A . 3 PHE HE2 1 1 8 2744 1 1 3 PHE HZ H -8.731 -13.236 3.684 1.00 . A A . 3 PHE HZ 1 1 8 2745 1 1 3 PHE N N -6.203 -7.786 3.072 1.00 . A A . 3 PHE N 1 1 8 2746 1 1 3 PHE O O -8.149 -5.140 3.091 1.00 . A A . 3 PHE O 1 1 8 2747 1 1 4 ALA C C -5.699 -3.458 0.093 1.00 . A A . 4 ALA C 1 1 8 2748 1 1 4 ALA CA C -6.326 -3.748 1.456 1.00 . A A . 4 ALA CA 1 1 8 2749 1 1 4 ALA CB C -5.471 -3.201 2.607 1.00 . A A . 4 ALA CB 1 1 8 2750 1 1 4 ALA H H -5.881 -5.754 1.004 1.00 . A A . 4 ALA H 1 1 8 2751 1 1 4 ALA HA H -7.309 -3.275 1.487 1.00 . A A . 4 ALA HA 1 1 8 2752 1 1 4 ALA HB1 H -4.479 -3.652 2.585 1.00 . A A . 4 ALA HB1 1 1 8 2753 1 1 4 ALA HB2 H -5.373 -2.119 2.531 1.00 . A A . 4 ALA HB2 1 1 8 2754 1 1 4 ALA HB3 H -5.944 -3.439 3.561 1.00 . A A . 4 ALA HB3 1 1 8 2755 1 1 4 ALA N N -6.470 -5.187 1.596 1.00 . A A . 4 ALA N 1 1 8 2756 1 1 4 ALA O O -5.412 -4.385 -0.667 1.00 . A A . 4 ALA O 1 1 8 2757 1 1 5 ILE C C -3.409 -2.383 -1.465 1.00 . A A . 5 ILE C 1 1 8 2758 1 1 5 ILE CA C -4.796 -1.728 -1.415 1.00 . A A . 5 ILE CA 1 1 8 2759 1 1 5 ILE CB C -4.713 -0.187 -1.397 1.00 . A A . 5 ILE CB 1 1 8 2760 1 1 5 ILE CD1 C -6.118 1.922 -1.045 1.00 . A A . 5 ILE CD1 1 1 8 2761 1 1 5 ILE CG1 C -6.121 0.440 -1.433 1.00 . A A . 5 ILE CG1 1 1 8 2762 1 1 5 ILE CG2 C -3.872 0.334 -2.573 1.00 . A A . 5 ILE CG2 1 1 8 2763 1 1 5 ILE H H -5.708 -1.481 0.483 1.00 . A A . 5 ILE H 1 1 8 2764 1 1 5 ILE HA H -5.380 -2.043 -2.281 1.00 . A A . 5 ILE HA 1 1 8 2765 1 1 5 ILE HB H -4.225 0.113 -0.469 1.00 . A A . 5 ILE HB 1 1 8 2766 1 1 5 ILE HD11 H -5.685 2.041 -0.050 1.00 . A A . 5 ILE HD11 1 1 8 2767 1 1 5 ILE HD12 H -5.553 2.525 -1.753 1.00 . A A . 5 ILE HD12 1 1 8 2768 1 1 5 ILE HD13 H -7.145 2.288 -1.021 1.00 . A A . 5 ILE HD13 1 1 8 2769 1 1 5 ILE HG13 H -6.774 -0.062 -0.719 1.00 . A A . 5 ILE HG13 1 1 8 2770 1 1 5 ILE HG21 H -4.314 0.020 -3.520 1.00 . A A . 5 ILE HG21 1 1 8 2771 1 1 5 ILE HG22 H -3.810 1.416 -2.540 1.00 . A A . 5 ILE HG22 1 1 8 2772 1 1 5 ILE HG23 H -2.856 -0.045 -2.513 1.00 . A A . 5 ILE HG23 1 1 8 2773 1 1 5 ILE N N -5.479 -2.177 -0.207 1.00 . A A . 5 ILE N 1 1 8 2774 1 1 5 ILE O O -2.699 -2.373 -0.463 1.00 . A A . 5 ILE O 1 1 8 2775 1 1 6 LYS C C -0.604 -2.619 -2.915 1.00 . A A . 6 LYS C 1 1 8 2776 1 1 6 LYS CA C -1.748 -3.633 -2.780 1.00 . A A . 6 LYS CA 1 1 8 2777 1 1 6 LYS CB C -1.797 -4.584 -3.989 1.00 . A A . 6 LYS CB 1 1 8 2778 1 1 6 LYS CD C -3.661 -6.044 -3.016 1.00 . A A . 6 LYS CD 1 1 8 2779 1 1 6 LYS CE C -4.133 -7.471 -2.695 1.00 . A A . 6 LYS CE 1 1 8 2780 1 1 6 LYS CG C -2.253 -6.005 -3.625 1.00 . A A . 6 LYS CG 1 1 8 2781 1 1 6 LYS H H -3.643 -2.904 -3.408 1.00 . A A . 6 LYS H 1 1 8 2782 1 1 6 LYS HA H -1.564 -4.229 -1.890 1.00 . A A . 6 LYS HA 1 1 8 2783 1 1 6 LYS HB3 H -0.792 -4.681 -4.403 1.00 . A A . 6 LYS HB3 1 1 8 2784 1 1 6 LYS HD3 H -4.375 -5.544 -3.674 1.00 . A A . 6 LYS HD3 1 1 8 2785 1 1 6 LYS HE3 H -5.082 -7.407 -2.161 1.00 . A A . 6 LYS HE3 1 1 8 2786 1 1 6 LYS HG3 H -1.538 -6.423 -2.911 1.00 . A A . 6 LYS HG3 1 1 8 2787 1 1 6 LYS HZ1 H -4.993 -7.866 -4.523 1.00 . A A . 6 LYS HZ1 1 1 8 2788 1 1 6 LYS HZ2 H -3.446 -8.416 -4.392 1.00 . A A . 6 LYS HZ2 1 1 8 2789 1 1 6 LYS HZ3 H -4.668 -9.211 -3.638 1.00 . A A . 6 LYS HZ3 1 1 8 2790 1 1 6 LYS N N -3.035 -2.964 -2.610 1.00 . A A . 6 LYS N 1 1 8 2791 1 1 6 LYS NZ N -4.324 -8.298 -3.904 1.00 . A A . 6 LYS NZ 1 1 8 2792 1 1 6 LYS O O -0.841 -1.443 -3.190 1.00 . A A . 6 LYS O 1 1 8 2793 1 1 7 CYS C C 3.047 -3.195 -2.993 1.00 . A A . 7 CYS C 1 1 8 2794 1 1 7 CYS CA C 1.850 -2.276 -2.780 1.00 . A A . 7 CYS CA 1 1 8 2795 1 1 7 CYS CB C 1.999 -1.520 -1.463 1.00 . A A . 7 CYS CB 1 1 8 2796 1 1 7 CYS H H 0.747 -4.051 -2.438 1.00 . A A . 7 CYS H 1 1 8 2797 1 1 7 CYS HA H 1.782 -1.558 -3.600 1.00 . A A . 7 CYS HA 1 1 8 2798 1 1 7 CYS HB3 H 2.082 -2.221 -0.635 1.00 . A A . 7 CYS HB3 1 1 8 2799 1 1 7 CYS N N 0.634 -3.082 -2.720 1.00 . A A . 7 CYS N 1 1 8 2800 1 1 7 CYS O O 3.237 -4.118 -2.197 1.00 . A A . 7 CYS O 1 1 8 2801 1 1 7 CYS SG S 3.369 -0.358 -1.349 1.00 . A A . 7 CYS SG 1 1 8 2802 1 1 8 ALA C C 6.237 -2.906 -3.771 1.00 . A A . 8 ALA C 1 1 8 2803 1 1 8 ALA CA C 5.057 -3.696 -4.331 1.00 . A A . 8 ALA CA 1 1 8 2804 1 1 8 ALA CB C 5.205 -3.930 -5.837 1.00 . A A . 8 ALA CB 1 1 8 2805 1 1 8 ALA H H 3.672 -2.140 -4.633 1.00 . A A . 8 ALA H 1 1 8 2806 1 1 8 ALA HA H 5.033 -4.675 -3.847 1.00 . A A . 8 ALA HA 1 1 8 2807 1 1 8 ALA HB1 H 5.275 -2.980 -6.370 1.00 . A A . 8 ALA HB1 1 1 8 2808 1 1 8 ALA HB2 H 6.109 -4.507 -6.027 1.00 . A A . 8 ALA HB2 1 1 8 2809 1 1 8 ALA HB3 H 4.343 -4.484 -6.210 1.00 . A A . 8 ALA HB3 1 1 8 2810 1 1 8 ALA N N 3.828 -2.969 -4.052 1.00 . A A . 8 ALA N 1 1 8 2811 1 1 8 ALA O O 7.067 -3.473 -3.061 1.00 . A A . 8 ALA O 1 1 8 2812 1 1 9 THR C C 6.585 0.552 -2.934 1.00 . A A . 9 THR C 1 1 8 2813 1 1 9 THR CA C 7.282 -0.698 -3.469 1.00 . A A . 9 THR CA 1 1 8 2814 1 1 9 THR CB C 8.377 -0.342 -4.488 1.00 . A A . 9 THR CB 1 1 8 2815 1 1 9 THR CG2 C 9.241 -1.563 -4.817 1.00 . A A . 9 THR CG2 1 1 8 2816 1 1 9 THR H H 5.576 -1.184 -4.650 1.00 . A A . 9 THR H 1 1 8 2817 1 1 9 THR HA H 7.764 -1.174 -2.614 1.00 . A A . 9 THR HA 1 1 8 2818 1 1 9 THR HB H 9.019 0.432 -4.060 1.00 . A A . 9 THR HB 1 1 8 2819 1 1 9 THR HG1 H 8.499 0.385 -6.292 1.00 . A A . 9 THR HG1 1 1 8 2820 1 1 9 THR HG21 H 9.659 -1.978 -3.898 1.00 . A A . 9 THR HG21 1 1 8 2821 1 1 9 THR HG22 H 8.641 -2.328 -5.313 1.00 . A A . 9 THR HG22 1 1 8 2822 1 1 9 THR HG23 H 10.056 -1.270 -5.477 1.00 . A A . 9 THR HG23 1 1 8 2823 1 1 9 THR N N 6.301 -1.603 -4.057 1.00 . A A . 9 THR N 1 1 8 2824 1 1 9 THR O O 5.502 0.916 -3.392 1.00 . A A . 9 THR O 1 1 8 2825 1 1 9 THR OG1 O 7.800 0.138 -5.683 1.00 . A A . 9 THR OG1 1 1 8 2826 1 1 10 ASP C C 6.264 3.415 -2.485 1.00 . A A . 10 ASP C 1 1 8 2827 1 1 10 ASP CA C 6.881 2.513 -1.413 1.00 . A A . 10 ASP CA 1 1 8 2828 1 1 10 ASP CB C 8.162 3.126 -0.824 1.00 . A A . 10 ASP CB 1 1 8 2829 1 1 10 ASP CG C 9.345 2.874 -1.749 1.00 . A A . 10 ASP CG 1 1 8 2830 1 1 10 ASP H H 8.149 0.869 -1.698 1.00 . A A . 10 ASP H 1 1 8 2831 1 1 10 ASP HA H 6.149 2.388 -0.615 1.00 . A A . 10 ASP HA 1 1 8 2832 1 1 10 ASP HB3 H 8.377 2.659 0.136 1.00 . A A . 10 ASP HB3 1 1 8 2833 1 1 10 ASP N N 7.218 1.199 -1.951 1.00 . A A . 10 ASP N 1 1 8 2834 1 1 10 ASP O O 5.128 3.858 -2.333 1.00 . A A . 10 ASP O 1 1 8 2835 1 1 10 ASP OD1 O 9.539 3.705 -2.661 1.00 . A A . 10 ASP OD1 1 1 8 2836 1 1 10 ASP OD2 O 9.905 1.762 -1.634 1.00 . A A . 10 ASP OD2 1 1 8 2837 1 1 11 ALA C C 5.064 4.116 -5.104 1.00 . A A . 11 ALA C 1 1 8 2838 1 1 11 ALA CA C 6.557 4.292 -4.803 1.00 . A A . 11 ALA CA 1 1 8 2839 1 1 11 ALA CB C 7.404 3.784 -5.973 1.00 . A A . 11 ALA CB 1 1 8 2840 1 1 11 ALA H H 7.992 3.426 -3.501 1.00 . A A . 11 ALA H 1 1 8 2841 1 1 11 ALA HA H 6.757 5.359 -4.690 1.00 . A A . 11 ALA HA 1 1 8 2842 1 1 11 ALA HB1 H 7.235 2.719 -6.122 1.00 . A A . 11 ALA HB1 1 1 8 2843 1 1 11 ALA HB2 H 7.129 4.318 -6.883 1.00 . A A . 11 ALA HB2 1 1 8 2844 1 1 11 ALA HB3 H 8.462 3.956 -5.766 1.00 . A A . 11 ALA HB3 1 1 8 2845 1 1 11 ALA N N 6.997 3.642 -3.579 1.00 . A A . 11 ALA N 1 1 8 2846 1 1 11 ALA O O 4.381 5.116 -5.316 1.00 . A A . 11 ALA O 1 1 8 2847 1 1 12 ASP C C 2.239 3.392 -4.534 1.00 . A A . 12 ASP C 1 1 8 2848 1 1 12 ASP CA C 3.153 2.604 -5.471 1.00 . A A . 12 ASP CA 1 1 8 2849 1 1 12 ASP CB C 2.831 1.105 -5.306 1.00 . A A . 12 ASP CB 1 1 8 2850 1 1 12 ASP CG C 3.658 0.176 -6.177 1.00 . A A . 12 ASP CG 1 1 8 2851 1 1 12 ASP H H 5.129 2.099 -4.834 1.00 . A A . 12 ASP H 1 1 8 2852 1 1 12 ASP HA H 2.965 2.904 -6.503 1.00 . A A . 12 ASP HA 1 1 8 2853 1 1 12 ASP HB3 H 1.785 0.945 -5.566 1.00 . A A . 12 ASP HB3 1 1 8 2854 1 1 12 ASP N N 4.550 2.880 -5.132 1.00 . A A . 12 ASP N 1 1 8 2855 1 1 12 ASP O O 1.421 4.223 -4.938 1.00 . A A . 12 ASP O 1 1 8 2856 1 1 12 ASP OD1 O 3.736 0.445 -7.394 1.00 . A A . 12 ASP OD1 1 1 8 2857 1 1 12 ASP OD2 O 4.156 -0.819 -5.603 1.00 . A A . 12 ASP OD2 1 1 8 2858 1 1 13 CYS C C 1.695 5.098 -2.082 1.00 . A A . 13 CYS C 1 1 8 2859 1 1 13 CYS CA C 1.551 3.586 -2.180 1.00 . A A . 13 CYS CA 1 1 8 2860 1 1 13 CYS CB C 1.939 2.876 -0.889 1.00 . A A . 13 CYS CB 1 1 8 2861 1 1 13 CYS H H 3.164 2.473 -3.016 1.00 . A A . 13 CYS H 1 1 8 2862 1 1 13 CYS HA H 0.515 3.347 -2.419 1.00 . A A . 13 CYS HA 1 1 8 2863 1 1 13 CYS HB3 H 2.980 3.084 -0.650 1.00 . A A . 13 CYS HB3 1 1 8 2864 1 1 13 CYS N N 2.392 3.084 -3.248 1.00 . A A . 13 CYS N 1 1 8 2865 1 1 13 CYS O O 0.694 5.810 -2.086 1.00 . A A . 13 CYS O 1 1 8 2866 1 1 13 CYS SG S 0.934 3.257 0.550 1.00 . A A . 13 CYS SG 1 1 8 2867 1 1 14 SER C C 2.584 7.711 -3.280 1.00 . A A . 14 SER C 1 1 8 2868 1 1 14 SER CA C 3.278 6.999 -2.118 1.00 . A A . 14 SER CA 1 1 8 2869 1 1 14 SER CB C 4.804 7.147 -2.218 1.00 . A A . 14 SER CB 1 1 8 2870 1 1 14 SER H H 3.693 4.911 -2.101 1.00 . A A . 14 SER H 1 1 8 2871 1 1 14 SER HA H 2.951 7.447 -1.182 1.00 . A A . 14 SER HA 1 1 8 2872 1 1 14 SER HB3 H 5.154 6.806 -3.194 1.00 . A A . 14 SER HB3 1 1 8 2873 1 1 14 SER HG H 4.839 9.042 -2.715 1.00 . A A . 14 SER HG 1 1 8 2874 1 1 14 SER N N 2.936 5.584 -2.085 1.00 . A A . 14 SER N 1 1 8 2875 1 1 14 SER O O 2.008 8.784 -3.109 1.00 . A A . 14 SER O 1 1 8 2876 1 1 14 SER OG O 5.197 8.492 -2.011 1.00 . A A . 14 SER OG 1 1 8 2877 1 1 15 ARG C C 0.586 7.830 -5.559 1.00 . A A . 15 ARG C 1 1 8 2878 1 1 15 ARG CA C 2.104 7.749 -5.676 1.00 . A A . 15 ARG CA 1 1 8 2879 1 1 15 ARG CB C 2.552 6.985 -6.931 1.00 . A A . 15 ARG CB 1 1 8 2880 1 1 15 ARG CD C 0.744 7.139 -8.745 1.00 . A A . 15 ARG CD 1 1 8 2881 1 1 15 ARG CG C 2.094 7.663 -8.233 1.00 . A A . 15 ARG CG 1 1 8 2882 1 1 15 ARG CZ C -0.401 9.143 -9.724 1.00 . A A . 15 ARG CZ 1 1 8 2883 1 1 15 ARG H H 3.157 6.255 -4.588 1.00 . A A . 15 ARG H 1 1 8 2884 1 1 15 ARG HA H 2.493 8.767 -5.746 1.00 . A A . 15 ARG HA 1 1 8 2885 1 1 15 ARG HB3 H 2.204 5.950 -6.900 1.00 . A A . 15 ARG HB3 1 1 8 2886 1 1 15 ARG HD3 H -0.008 7.074 -7.959 1.00 . A A . 15 ARG HD3 1 1 8 2887 1 1 15 ARG HE H 0.390 7.591 -10.777 1.00 . A A . 15 ARG HE 1 1 8 2888 1 1 15 ARG HG3 H 2.841 7.453 -9.001 1.00 . A A . 15 ARG HG3 1 1 8 2889 1 1 15 ARG HH11 H -0.306 9.208 -7.666 1.00 . A A . 15 ARG HH11 1 1 8 2890 1 1 15 ARG HH12 H -1.096 10.559 -8.399 1.00 . A A . 15 ARG HH12 1 1 8 2891 1 1 15 ARG HH21 H -0.649 9.406 -11.737 1.00 . A A . 15 ARG HH21 1 1 8 2892 1 1 15 ARG HH22 H -1.287 10.679 -10.752 1.00 . A A . 15 ARG HH22 1 1 8 2893 1 1 15 ARG N N 2.669 7.139 -4.484 1.00 . A A . 15 ARG N 1 1 8 2894 1 1 15 ARG NE N 0.234 7.964 -9.851 1.00 . A A . 15 ARG NE 1 1 8 2895 1 1 15 ARG NH1 N -0.624 9.677 -8.518 1.00 . A A . 15 ARG NH1 1 1 8 2896 1 1 15 ARG NH2 N -0.814 9.791 -10.819 1.00 . A A . 15 ARG NH2 1 1 8 2897 1 1 15 ARG O O -0.014 8.794 -6.040 1.00 . A A . 15 ARG O 1 1 8 2898 1 1 16 LYS C C -1.951 7.718 -3.695 1.00 . A A . 16 LYS C 1 1 8 2899 1 1 16 LYS CA C -1.497 6.789 -4.829 1.00 . A A . 16 LYS CA 1 1 8 2900 1 1 16 LYS CB C -1.975 5.349 -4.612 1.00 . A A . 16 LYS CB 1 1 8 2901 1 1 16 LYS CD C -3.969 3.812 -4.616 1.00 . A A . 16 LYS CD 1 1 8 2902 1 1 16 LYS CE C -5.500 3.745 -4.737 1.00 . A A . 16 LYS CE 1 1 8 2903 1 1 16 LYS CG C -3.505 5.269 -4.707 1.00 . A A . 16 LYS CG 1 1 8 2904 1 1 16 LYS H H 0.492 6.000 -4.678 1.00 . A A . 16 LYS H 1 1 8 2905 1 1 16 LYS HA H -1.944 7.146 -5.759 1.00 . A A . 16 LYS HA 1 1 8 2906 1 1 16 LYS HB3 H -1.639 4.991 -3.635 1.00 . A A . 16 LYS HB3 1 1 8 2907 1 1 16 LYS HD3 H -3.639 3.414 -3.655 1.00 . A A . 16 LYS HD3 1 1 8 2908 1 1 16 LYS HE3 H -5.807 4.215 -5.674 1.00 . A A . 16 LYS HE3 1 1 8 2909 1 1 16 LYS HG3 H -3.823 5.695 -5.659 1.00 . A A . 16 LYS HG3 1 1 8 2910 1 1 16 LYS HZ1 H -5.742 1.904 -3.851 1.00 . A A . 16 LYS HZ1 1 1 8 2911 1 1 16 LYS HZ2 H -7.008 2.356 -4.797 1.00 . A A . 16 LYS HZ2 1 1 8 2912 1 1 16 LYS HZ3 H -5.612 1.835 -5.491 1.00 . A A . 16 LYS HZ3 1 1 8 2913 1 1 16 LYS N N -0.050 6.805 -4.988 1.00 . A A . 16 LYS N 1 1 8 2914 1 1 16 LYS NZ N -6.000 2.356 -4.717 1.00 . A A . 16 LYS NZ 1 1 8 2915 1 1 16 LYS O O -2.981 8.377 -3.822 1.00 . A A . 16 LYS O 1 1 8 2916 1 1 17 CYS C C -0.357 9.059 -0.748 1.00 . A A . 17 CYS C 1 1 8 2917 1 1 17 CYS CA C -1.592 8.358 -1.320 1.00 . A A . 17 CYS CA 1 1 8 2918 1 1 17 CYS CB C -2.122 7.280 -0.373 1.00 . A A . 17 CYS CB 1 1 8 2919 1 1 17 CYS H H -0.367 7.175 -2.559 1.00 . A A . 17 CYS H 1 1 8 2920 1 1 17 CYS HA H -2.403 9.065 -1.487 1.00 . A A . 17 CYS HA 1 1 8 2921 1 1 17 CYS HB3 H -1.463 6.410 -0.394 1.00 . A A . 17 CYS HB3 1 1 8 2922 1 1 17 CYS N N -1.222 7.723 -2.579 1.00 . A A . 17 CYS N 1 1 8 2923 1 1 17 CYS O O 0.637 8.389 -0.481 1.00 . A A . 17 CYS O 1 1 8 2924 1 1 17 CYS SG S -2.303 7.769 1.357 1.00 . A A . 17 CYS SG 1 1 8 2925 1 1 18 PRO C C 1.389 11.021 1.040 1.00 . A A . 18 PRO C 1 1 8 2926 1 1 18 PRO CA C 0.840 11.180 -0.381 1.00 . A A . 18 PRO CA 1 1 8 2927 1 1 18 PRO CB C 0.435 12.630 -0.676 1.00 . A A . 18 PRO CB 1 1 8 2928 1 1 18 PRO CD C -1.517 11.272 -0.778 1.00 . A A . 18 PRO CD 1 1 8 2929 1 1 18 PRO CG C -1.050 12.653 -0.321 1.00 . A A . 18 PRO CG 1 1 8 2930 1 1 18 PRO HA H 1.613 10.872 -1.087 1.00 . A A . 18 PRO HA 1 1 8 2931 1 1 18 PRO HB3 H 0.546 12.823 -1.744 1.00 . A A . 18 PRO HB3 1 1 8 2932 1 1 18 PRO HD3 H -1.793 11.312 -1.834 1.00 . A A . 18 PRO HD3 1 1 8 2933 1 1 18 PRO HG3 H -1.588 13.460 -0.817 1.00 . A A . 18 PRO HG3 1 1 8 2934 1 1 18 PRO N N -0.368 10.398 -0.610 1.00 . A A . 18 PRO N 1 1 8 2935 1 1 18 PRO O O 0.766 10.405 1.901 1.00 . A A . 18 PRO O 1 1 8 2936 1 1 19 GLY C C 4.131 10.279 2.673 1.00 . A A . 19 GLY C 1 1 8 2937 1 1 19 GLY CA C 3.277 11.544 2.552 1.00 . A A . 19 GLY CA 1 1 8 2938 1 1 19 GLY H H 3.001 12.129 0.529 1.00 . A A . 19 GLY H 1 1 8 2939 1 1 19 GLY HA2 H 3.934 12.410 2.624 1.00 . A A . 19 GLY HA2 1 1 8 2940 1 1 19 GLY HA3 H 2.568 11.581 3.380 1.00 . A A . 19 GLY HA3 1 1 8 2941 1 1 19 GLY N N 2.569 11.607 1.277 1.00 . A A . 19 GLY N 1 1 8 2942 1 1 19 GLY O O 4.440 9.847 3.779 1.00 . A A . 19 GLY O 1 1 8 2943 1 1 20 ASN C C 4.894 7.378 2.479 1.00 . A A . 20 ASN C 1 1 8 2944 1 1 20 ASN CA C 5.210 8.419 1.393 1.00 . A A . 20 ASN CA 1 1 8 2945 1 1 20 ASN CB C 6.718 8.659 1.227 1.00 . A A . 20 ASN CB 1 1 8 2946 1 1 20 ASN CG C 7.459 7.396 0.775 1.00 . A A . 20 ASN CG 1 1 8 2947 1 1 20 ASN H H 4.194 10.116 0.670 1.00 . A A . 20 ASN H 1 1 8 2948 1 1 20 ASN HA H 4.857 7.989 0.459 1.00 . A A . 20 ASN HA 1 1 8 2949 1 1 20 ASN HB3 H 7.134 9.009 2.174 1.00 . A A . 20 ASN HB3 1 1 8 2950 1 1 20 ASN HD21 H 9.274 8.305 0.963 1.00 . A A . 20 ASN HD21 1 1 8 2951 1 1 20 ASN HD22 H 9.283 6.643 0.390 1.00 . A A . 20 ASN HD22 1 1 8 2952 1 1 20 ASN N N 4.503 9.690 1.530 1.00 . A A . 20 ASN N 1 1 8 2953 1 1 20 ASN ND2 N 8.786 7.462 0.711 1.00 . A A . 20 ASN ND2 1 1 8 2954 1 1 20 ASN O O 5.802 6.901 3.159 1.00 . A A . 20 ASN O 1 1 8 2955 1 1 20 ASN OD1 O 6.855 6.375 0.459 1.00 . A A . 20 ASN OD1 1 1 8 2956 1 1 21 PRO C C 3.951 4.563 2.587 1.00 . A A . 21 PRO C 1 1 8 2957 1 1 21 PRO CA C 3.289 5.741 3.320 1.00 . A A . 21 PRO CA 1 1 8 2958 1 1 21 PRO CB C 1.762 5.647 3.263 1.00 . A A . 21 PRO CB 1 1 8 2959 1 1 21 PRO CD C 2.441 7.579 2.046 1.00 . A A . 21 PRO CD 1 1 8 2960 1 1 21 PRO CG C 1.379 6.489 2.045 1.00 . A A . 21 PRO CG 1 1 8 2961 1 1 21 PRO HA H 3.605 5.819 4.358 1.00 . A A . 21 PRO HA 1 1 8 2962 1 1 21 PRO HB3 H 1.340 6.100 4.162 1.00 . A A . 21 PRO HB3 1 1 8 2963 1 1 21 PRO HD3 H 2.111 8.385 2.698 1.00 . A A . 21 PRO HD3 1 1 8 2964 1 1 21 PRO HG3 H 0.373 6.901 2.120 1.00 . A A . 21 PRO HG3 1 1 8 2965 1 1 21 PRO N N 3.624 6.969 2.625 1.00 . A A . 21 PRO N 1 1 8 2966 1 1 21 PRO O O 3.784 4.444 1.374 1.00 . A A . 21 PRO O 1 1 8 2967 1 1 22 PRO C C 4.482 1.414 2.385 1.00 . A A . 22 PRO C 1 1 8 2968 1 1 22 PRO CA C 5.419 2.598 2.651 1.00 . A A . 22 PRO CA 1 1 8 2969 1 1 22 PRO CB C 6.517 2.231 3.654 1.00 . A A . 22 PRO CB 1 1 8 2970 1 1 22 PRO CD C 5.028 3.775 4.697 1.00 . A A . 22 PRO CD 1 1 8 2971 1 1 22 PRO CG C 5.853 2.526 4.999 1.00 . A A . 22 PRO CG 1 1 8 2972 1 1 22 PRO HA H 5.875 2.918 1.713 1.00 . A A . 22 PRO HA 1 1 8 2973 1 1 22 PRO HB3 H 7.363 2.906 3.519 1.00 . A A . 22 PRO HB3 1 1 8 2974 1 1 22 PRO HD3 H 5.634 4.664 4.882 1.00 . A A . 22 PRO HD3 1 1 8 2975 1 1 22 PRO HG3 H 6.583 2.692 5.794 1.00 . A A . 22 PRO HG3 1 1 8 2976 1 1 22 PRO N N 4.709 3.700 3.279 1.00 . A A . 22 PRO N 1 1 8 2977 1 1 22 PRO O O 3.296 1.433 2.730 1.00 . A A . 22 PRO O 1 1 8 2978 1 1 23 CYS C C 4.430 -1.569 3.190 1.00 . A A . 23 CYS C 1 1 8 2979 1 1 23 CYS CA C 4.339 -0.938 1.804 1.00 . A A . 23 CYS CA 1 1 8 2980 1 1 23 CYS CB C 4.927 -1.940 0.800 1.00 . A A . 23 CYS CB 1 1 8 2981 1 1 23 CYS H H 6.007 0.357 1.544 1.00 . A A . 23 CYS H 1 1 8 2982 1 1 23 CYS HA H 3.299 -0.767 1.533 1.00 . A A . 23 CYS HA 1 1 8 2983 1 1 23 CYS HB3 H 4.276 -2.814 0.824 1.00 . A A . 23 CYS HB3 1 1 8 2984 1 1 23 CYS N N 5.037 0.336 1.822 1.00 . A A . 23 CYS N 1 1 8 2985 1 1 23 CYS O O 5.523 -1.909 3.647 1.00 . A A . 23 CYS O 1 1 8 2986 1 1 23 CYS SG S 5.062 -1.480 -0.938 1.00 . A A . 23 CYS SG 1 1 8 2987 1 1 24 ARG C C 3.362 -4.268 3.735 1.00 . A A . 24 ARG C 1 1 8 2988 1 1 24 ARG CA C 3.206 -3.052 4.659 1.00 . A A . 24 ARG CA 1 1 8 2989 1 1 24 ARG CB C 1.876 -3.045 5.428 1.00 . A A . 24 ARG CB 1 1 8 2990 1 1 24 ARG CD C 0.444 -4.194 7.167 1.00 . A A . 24 ARG CD 1 1 8 2991 1 1 24 ARG CG C 1.760 -4.245 6.380 1.00 . A A . 24 ARG CG 1 1 8 2992 1 1 24 ARG CZ C 0.805 -5.786 9.073 1.00 . A A . 24 ARG CZ 1 1 8 2993 1 1 24 ARG H H 2.432 -1.594 3.347 1.00 . A A . 24 ARG H 1 1 8 2994 1 1 24 ARG HA H 4.019 -3.041 5.387 1.00 . A A . 24 ARG HA 1 1 8 2995 1 1 24 ARG HB3 H 1.045 -3.058 4.722 1.00 . A A . 24 ARG HB3 1 1 8 2996 1 1 24 ARG HD3 H -0.376 -4.086 6.452 1.00 . A A . 24 ARG HD3 1 1 8 2997 1 1 24 ARG HE H -0.465 -6.073 7.511 1.00 . A A . 24 ARG HE 1 1 8 2998 1 1 24 ARG HG3 H 2.611 -4.243 7.062 1.00 . A A . 24 ARG HG3 1 1 8 2999 1 1 24 ARG HH11 H 1.918 -4.095 9.177 1.00 . A A . 24 ARG HH11 1 1 8 3000 1 1 24 ARG HH12 H 2.167 -5.193 10.500 1.00 . A A . 24 ARG HH12 1 1 8 3001 1 1 24 ARG HH21 H -0.166 -7.581 9.237 1.00 . A A . 24 ARG HH21 1 1 8 3002 1 1 24 ARG HH22 H 0.945 -7.236 10.519 1.00 . A A . 24 ARG HH22 1 1 8 3003 1 1 24 ARG N N 3.291 -1.878 3.806 1.00 . A A . 24 ARG N 1 1 8 3004 1 1 24 ARG NE N 0.209 -5.439 7.921 1.00 . A A . 24 ARG NE 1 1 8 3005 1 1 24 ARG NH1 N 1.700 -4.967 9.635 1.00 . A A . 24 ARG NH1 1 1 8 3006 1 1 24 ARG NH2 N 0.506 -6.954 9.655 1.00 . A A . 24 ARG NH2 1 1 8 3007 1 1 24 ARG O O 2.368 -4.902 3.380 1.00 . A A . 24 ARG O 1 1 8 3008 1 1 25 ASN C C 3.961 -6.361 1.739 1.00 . A A . 25 ASN C 1 1 8 3009 1 1 25 ASN CA C 5.087 -5.609 2.449 1.00 . A A . 25 ASN CA 1 1 8 3010 1 1 25 ASN CB C 5.976 -6.580 3.239 1.00 . A A . 25 ASN CB 1 1 8 3011 1 1 25 ASN CG C 7.296 -5.940 3.654 1.00 . A A . 25 ASN CG 1 1 8 3012 1 1 25 ASN H H 5.308 -3.849 3.610 1.00 . A A . 25 ASN H 1 1 8 3013 1 1 25 ASN HA H 5.712 -5.157 1.677 1.00 . A A . 25 ASN HA 1 1 8 3014 1 1 25 ASN HB3 H 6.212 -7.435 2.602 1.00 . A A . 25 ASN HB3 1 1 8 3015 1 1 25 ASN HD21 H 6.477 -5.136 5.338 1.00 . A A . 25 ASN HD21 1 1 8 3016 1 1 25 ASN HD22 H 8.174 -4.789 5.052 1.00 . A A . 25 ASN HD22 1 1 8 3017 1 1 25 ASN N N 4.611 -4.531 3.324 1.00 . A A . 25 ASN N 1 1 8 3018 1 1 25 ASN ND2 N 7.309 -5.227 4.776 1.00 . A A . 25 ASN ND2 1 1 8 3019 1 1 25 ASN O O 3.529 -7.412 2.208 1.00 . A A . 25 ASN O 1 1 8 3020 1 1 25 ASN OD1 O 8.302 -6.078 2.968 1.00 . A A . 25 ASN OD1 1 1 8 3021 1 1 26 GLY C C 1.192 -5.388 -0.173 1.00 . A A . 26 GLY C 1 1 8 3022 1 1 26 GLY CA C 2.361 -6.367 -0.128 1.00 . A A . 26 GLY CA 1 1 8 3023 1 1 26 GLY H H 3.892 -4.967 0.253 1.00 . A A . 26 GLY H 1 1 8 3024 1 1 26 GLY HA2 H 2.691 -6.573 -1.147 1.00 . A A . 26 GLY HA2 1 1 8 3025 1 1 26 GLY HA3 H 2.001 -7.301 0.306 1.00 . A A . 26 GLY HA3 1 1 8 3026 1 1 26 GLY N N 3.482 -5.816 0.616 1.00 . A A . 26 GLY N 1 1 8 3027 1 1 26 GLY O O 0.468 -5.364 -1.167 1.00 . A A . 26 GLY O 1 1 8 3028 1 1 27 PHE C C 0.268 -2.286 1.369 1.00 . A A . 27 PHE C 1 1 8 3029 1 1 27 PHE CA C -0.157 -3.724 1.071 1.00 . A A . 27 PHE CA 1 1 8 3030 1 1 27 PHE CB C -1.034 -4.271 2.199 1.00 . A A . 27 PHE CB 1 1 8 3031 1 1 27 PHE CD1 C -0.893 -6.803 2.224 1.00 . A A . 27 PHE CD1 1 1 8 3032 1 1 27 PHE CD2 C -2.788 -5.737 1.129 1.00 . A A . 27 PHE CD2 1 1 8 3033 1 1 27 PHE CE1 C -1.348 -8.059 1.789 1.00 . A A . 27 PHE CE1 1 1 8 3034 1 1 27 PHE CE2 C -3.275 -6.996 0.743 1.00 . A A . 27 PHE CE2 1 1 8 3035 1 1 27 PHE CG C -1.609 -5.637 1.890 1.00 . A A . 27 PHE CG 1 1 8 3036 1 1 27 PHE CZ C -2.536 -8.153 1.042 1.00 . A A . 27 PHE CZ 1 1 8 3037 1 1 27 PHE H H 1.632 -4.684 1.682 1.00 . A A . 27 PHE H 1 1 8 3038 1 1 27 PHE HA H -0.747 -3.718 0.160 1.00 . A A . 27 PHE HA 1 1 8 3039 1 1 27 PHE HB3 H -1.856 -3.573 2.369 1.00 . A A . 27 PHE HB3 1 1 8 3040 1 1 27 PHE HD1 H 0.047 -6.730 2.756 1.00 . A A . 27 PHE HD1 1 1 8 3041 1 1 27 PHE HD2 H -3.295 -4.843 0.803 1.00 . A A . 27 PHE HD2 1 1 8 3042 1 1 27 PHE HE1 H -0.777 -8.948 2.014 1.00 . A A . 27 PHE HE1 1 1 8 3043 1 1 27 PHE HE2 H -4.206 -7.076 0.205 1.00 . A A . 27 PHE HE2 1 1 8 3044 1 1 27 PHE HZ H -2.885 -9.116 0.698 1.00 . A A . 27 PHE HZ 1 1 8 3045 1 1 27 PHE N N 0.999 -4.598 0.893 1.00 . A A . 27 PHE N 1 1 8 3046 1 1 27 PHE O O 1.232 -2.066 2.092 1.00 . A A . 27 PHE O 1 1 8 3047 1 1 28 CYS C C -0.535 0.655 2.298 1.00 . A A . 28 CYS C 1 1 8 3048 1 1 28 CYS CA C -0.132 0.118 0.927 1.00 . A A . 28 CYS CA 1 1 8 3049 1 1 28 CYS CB C -0.878 0.871 -0.178 1.00 . A A . 28 CYS CB 1 1 8 3050 1 1 28 CYS H H -1.259 -1.567 0.273 1.00 . A A . 28 CYS H 1 1 8 3051 1 1 28 CYS HA H 0.940 0.267 0.790 1.00 . A A . 28 CYS HA 1 1 8 3052 1 1 28 CYS HB3 H -1.905 0.512 -0.228 1.00 . A A . 28 CYS HB3 1 1 8 3053 1 1 28 CYS N N -0.444 -1.305 0.814 1.00 . A A . 28 CYS N 1 1 8 3054 1 1 28 CYS O O -1.723 0.685 2.616 1.00 . A A . 28 CYS O 1 1 8 3055 1 1 28 CYS SG S -0.979 2.666 0.009 1.00 . A A . 28 CYS SG 1 1 8 3056 1 1 29 ALA C C -0.406 3.034 4.456 1.00 . A A . 29 ALA C 1 1 8 3057 1 1 29 ALA CA C 0.135 1.597 4.460 1.00 . A A . 29 ALA CA 1 1 8 3058 1 1 29 ALA CB C 1.399 1.470 5.319 1.00 . A A . 29 ALA CB 1 1 8 3059 1 1 29 ALA H H 1.392 1.147 2.795 1.00 . A A . 29 ALA H 1 1 8 3060 1 1 29 ALA HA H -0.624 0.957 4.913 1.00 . A A . 29 ALA HA 1 1 8 3061 1 1 29 ALA HB1 H 2.166 2.158 4.962 1.00 . A A . 29 ALA HB1 1 1 8 3062 1 1 29 ALA HB2 H 1.165 1.710 6.358 1.00 . A A . 29 ALA HB2 1 1 8 3063 1 1 29 ALA HB3 H 1.782 0.450 5.269 1.00 . A A . 29 ALA HB3 1 1 8 3064 1 1 29 ALA N N 0.423 1.115 3.112 1.00 . A A . 29 ALA N 1 1 8 3065 1 1 29 ALA O O 0.012 3.854 5.275 1.00 . A A . 29 ALA O 1 1 8 3066 1 1 30 CYS C C -2.862 4.879 4.716 1.00 . A A . 30 CYS C 1 1 8 3067 1 1 30 CYS CA C -1.972 4.675 3.489 1.00 . A A . 30 CYS CA 1 1 8 3068 1 1 30 CYS CB C -2.788 4.823 2.205 1.00 . A A . 30 CYS CB 1 1 8 3069 1 1 30 CYS H H -1.699 2.615 2.959 1.00 . A A . 30 CYS H 1 1 8 3070 1 1 30 CYS HA H -1.200 5.447 3.481 1.00 . A A . 30 CYS HA 1 1 8 3071 1 1 30 CYS HB3 H -3.520 4.016 2.165 1.00 . A A . 30 CYS HB3 1 1 8 3072 1 1 30 CYS N N -1.345 3.355 3.559 1.00 . A A . 30 CYS N 1 1 8 3073 1 1 30 CYS O O -4.065 4.627 4.683 1.00 . A A . 30 CYS O 1 1 8 3074 1 1 30 CYS SG S -3.693 6.383 2.061 1.00 . A A . 30 CYS SG 1 1 8 3075 1 1 31 THR C C -4.189 6.190 7.056 1.00 . A A . 31 THR C 1 1 8 3076 1 1 31 THR CA C -2.894 5.373 7.129 1.00 . A A . 31 THR CA 1 1 8 3077 1 1 31 THR CB C -1.867 5.935 8.125 1.00 . A A . 31 THR CB 1 1 8 3078 1 1 31 THR CG2 C -2.160 5.484 9.557 1.00 . A A . 31 THR CG2 1 1 8 3079 1 1 31 THR H H -1.240 5.368 5.822 1.00 . A A . 31 THR H 1 1 8 3080 1 1 31 THR HA H -3.157 4.356 7.426 1.00 . A A . 31 THR HA 1 1 8 3081 1 1 31 THR HB H -1.871 7.026 8.084 1.00 . A A . 31 THR HB 1 1 8 3082 1 1 31 THR HG1 H -0.577 4.559 7.570 1.00 . A A . 31 THR HG1 1 1 8 3083 1 1 31 THR HG21 H -3.148 5.831 9.864 1.00 . A A . 31 THR HG21 1 1 8 3084 1 1 31 THR HG22 H -2.122 4.397 9.630 1.00 . A A . 31 THR HG22 1 1 8 3085 1 1 31 THR HG23 H -1.415 5.911 10.230 1.00 . A A . 31 THR HG23 1 1 8 3086 1 1 31 THR N N -2.255 5.287 5.829 1.00 . A A . 31 THR N 1 1 8 3087 1 1 31 THR O O -4.394 7.131 7.822 1.00 . A A . 31 THR O 1 1 8 3088 1 1 31 THR OG1 O -0.567 5.503 7.758 1.00 . A A . 31 THR OG1 1 1 9 3089 1 1 1 THR C C -10.569 -4.788 7.347 1.00 . A A . 1 THR C 1 1 9 3090 1 1 1 THR CA C -10.937 -3.824 8.481 1.00 . A A . 1 THR CA 1 1 9 3091 1 1 1 THR CB C -11.518 -2.505 7.941 1.00 . A A . 1 THR CB 1 1 9 3092 1 1 1 THR CG2 C -12.057 -1.636 9.081 1.00 . A A . 1 THR CG2 1 1 9 3093 1 1 1 THR H1 H -8.881 -3.899 8.812 1.00 . A A . 1 THR H1 1 1 9 3094 1 1 1 THR HA H -11.655 -4.300 9.148 1.00 . A A . 1 THR HA 1 1 9 3095 1 1 1 THR HB H -12.335 -2.705 7.248 1.00 . A A . 1 THR HB 1 1 9 3096 1 1 1 THR HG1 H -9.754 -1.719 7.822 1.00 . A A . 1 THR HG1 1 1 9 3097 1 1 1 THR HG21 H -12.466 -0.712 8.671 1.00 . A A . 1 THR HG21 1 1 9 3098 1 1 1 THR HG22 H -12.847 -2.168 9.611 1.00 . A A . 1 THR HG22 1 1 9 3099 1 1 1 THR HG23 H -11.258 -1.389 9.783 1.00 . A A . 1 THR HG23 1 1 9 3100 1 1 1 THR N N -9.730 -3.540 9.238 1.00 . A A . 1 THR N 1 1 9 3101 1 1 1 THR O O -9.389 -4.867 6.991 1.00 . A A . 1 THR O 1 1 9 3102 1 1 1 THR OG1 O -10.524 -1.779 7.251 1.00 . A A . 1 THR OG1 1 1 9 3103 1 1 2 PRO C C -11.109 -5.523 4.366 1.00 . A A . 2 PRO C 1 1 9 3104 1 1 2 PRO CA C -11.278 -6.388 5.624 1.00 . A A . 2 PRO CA 1 1 9 3105 1 1 2 PRO CB C -12.491 -7.322 5.559 1.00 . A A . 2 PRO CB 1 1 9 3106 1 1 2 PRO CD C -12.912 -5.649 7.211 1.00 . A A . 2 PRO CD 1 1 9 3107 1 1 2 PRO CG C -13.620 -6.461 6.126 1.00 . A A . 2 PRO CG 1 1 9 3108 1 1 2 PRO HA H -10.374 -6.986 5.765 1.00 . A A . 2 PRO HA 1 1 9 3109 1 1 2 PRO HB3 H -12.324 -8.170 6.227 1.00 . A A . 2 PRO HB3 1 1 9 3110 1 1 2 PRO HD3 H -12.939 -6.202 8.151 1.00 . A A . 2 PRO HD3 1 1 9 3111 1 1 2 PRO HG3 H -14.440 -7.060 6.522 1.00 . A A . 2 PRO HG3 1 1 9 3112 1 1 2 PRO N N -11.529 -5.530 6.772 1.00 . A A . 2 PRO N 1 1 9 3113 1 1 2 PRO O O -11.949 -5.539 3.469 1.00 . A A . 2 PRO O 1 1 9 3114 1 1 3 PHE C C -8.243 -3.524 3.242 1.00 . A A . 3 PHE C 1 1 9 3115 1 1 3 PHE CA C -9.742 -3.811 3.237 1.00 . A A . 3 PHE CA 1 1 9 3116 1 1 3 PHE CB C -10.539 -2.520 3.456 1.00 . A A . 3 PHE CB 1 1 9 3117 1 1 3 PHE CD1 C -10.940 -1.523 1.165 1.00 . A A . 3 PHE CD1 1 1 9 3118 1 1 3 PHE CD2 C -9.354 -0.427 2.654 1.00 . A A . 3 PHE CD2 1 1 9 3119 1 1 3 PHE CE1 C -10.715 -0.530 0.195 1.00 . A A . 3 PHE CE1 1 1 9 3120 1 1 3 PHE CE2 C -9.132 0.567 1.685 1.00 . A A . 3 PHE CE2 1 1 9 3121 1 1 3 PHE CG C -10.278 -1.459 2.404 1.00 . A A . 3 PHE CG 1 1 9 3122 1 1 3 PHE CZ C -9.822 0.523 0.460 1.00 . A A . 3 PHE CZ 1 1 9 3123 1 1 3 PHE H H -9.386 -4.741 5.103 1.00 . A A . 3 PHE H 1 1 9 3124 1 1 3 PHE HA H -10.029 -4.256 2.281 1.00 . A A . 3 PHE HA 1 1 9 3125 1 1 3 PHE HB3 H -10.293 -2.119 4.441 1.00 . A A . 3 PHE HB3 1 1 9 3126 1 1 3 PHE HD1 H -11.647 -2.315 0.965 1.00 . A A . 3 PHE HD1 1 1 9 3127 1 1 3 PHE HD2 H -8.834 -0.379 3.600 1.00 . A A . 3 PHE HD2 1 1 9 3128 1 1 3 PHE HE1 H -11.257 -0.558 -0.740 1.00 . A A . 3 PHE HE1 1 1 9 3129 1 1 3 PHE HE2 H -8.456 1.383 1.899 1.00 . A A . 3 PHE HE2 1 1 9 3130 1 1 3 PHE HZ H -9.689 1.310 -0.264 1.00 . A A . 3 PHE HZ 1 1 9 3131 1 1 3 PHE N N -10.027 -4.743 4.312 1.00 . A A . 3 PHE N 1 1 9 3132 1 1 3 PHE O O -7.690 -3.206 4.291 1.00 . A A . 3 PHE O 1 1 9 3133 1 1 4 ALA C C -5.813 -3.177 0.488 1.00 . A A . 4 ALA C 1 1 9 3134 1 1 4 ALA CA C -6.153 -3.427 1.958 1.00 . A A . 4 ALA CA 1 1 9 3135 1 1 4 ALA CB C -5.386 -4.629 2.521 1.00 . A A . 4 ALA CB 1 1 9 3136 1 1 4 ALA H H -8.094 -3.917 1.256 1.00 . A A . 4 ALA H 1 1 9 3137 1 1 4 ALA HA H -5.876 -2.548 2.544 1.00 . A A . 4 ALA HA 1 1 9 3138 1 1 4 ALA HB1 H -5.629 -5.531 1.957 1.00 . A A . 4 ALA HB1 1 1 9 3139 1 1 4 ALA HB2 H -4.316 -4.437 2.456 1.00 . A A . 4 ALA HB2 1 1 9 3140 1 1 4 ALA HB3 H -5.645 -4.785 3.568 1.00 . A A . 4 ALA HB3 1 1 9 3141 1 1 4 ALA N N -7.586 -3.653 2.087 1.00 . A A . 4 ALA N 1 1 9 3142 1 1 4 ALA O O -5.800 -4.105 -0.317 1.00 . A A . 4 ALA O 1 1 9 3143 1 1 5 ILE C C -3.729 -2.195 -1.464 1.00 . A A . 5 ILE C 1 1 9 3144 1 1 5 ILE CA C -5.093 -1.542 -1.203 1.00 . A A . 5 ILE CA 1 1 9 3145 1 1 5 ILE CB C -5.048 -0.004 -1.297 1.00 . A A . 5 ILE CB 1 1 9 3146 1 1 5 ILE CD1 C -6.455 2.069 -0.800 1.00 . A A . 5 ILE CD1 1 1 9 3147 1 1 5 ILE CG1 C -6.469 0.586 -1.188 1.00 . A A . 5 ILE CG1 1 1 9 3148 1 1 5 ILE CG2 C -4.386 0.460 -2.602 1.00 . A A . 5 ILE CG2 1 1 9 3149 1 1 5 ILE H H -5.564 -1.204 0.844 1.00 . A A . 5 ILE H 1 1 9 3150 1 1 5 ILE HA H -5.815 -1.919 -1.932 1.00 . A A . 5 ILE HA 1 1 9 3151 1 1 5 ILE HB H -4.459 0.371 -0.461 1.00 . A A . 5 ILE HB 1 1 9 3152 1 1 5 ILE HD11 H -5.940 2.673 -1.545 1.00 . A A . 5 ILE HD11 1 1 9 3153 1 1 5 ILE HD12 H -7.481 2.429 -0.711 1.00 . A A . 5 ILE HD12 1 1 9 3154 1 1 5 ILE HD13 H -5.959 2.193 0.162 1.00 . A A . 5 ILE HD13 1 1 9 3155 1 1 5 ILE HG13 H -7.030 0.065 -0.413 1.00 . A A . 5 ILE HG13 1 1 9 3156 1 1 5 ILE HG21 H -3.339 0.161 -2.619 1.00 . A A . 5 ILE HG21 1 1 9 3157 1 1 5 ILE HG22 H -4.898 0.029 -3.462 1.00 . A A . 5 ILE HG22 1 1 9 3158 1 1 5 ILE HG23 H -4.407 1.543 -2.678 1.00 . A A . 5 ILE HG23 1 1 9 3159 1 1 5 ILE N N -5.539 -1.919 0.134 1.00 . A A . 5 ILE N 1 1 9 3160 1 1 5 ILE O O -2.901 -2.266 -0.558 1.00 . A A . 5 ILE O 1 1 9 3161 1 1 6 LYS C C -1.104 -2.366 -3.238 1.00 . A A . 6 LYS C 1 1 9 3162 1 1 6 LYS CA C -2.252 -3.372 -3.053 1.00 . A A . 6 LYS CA 1 1 9 3163 1 1 6 LYS CB C -2.481 -4.205 -4.329 1.00 . A A . 6 LYS CB 1 1 9 3164 1 1 6 LYS CD C -2.734 -6.521 -3.356 1.00 . A A . 6 LYS CD 1 1 9 3165 1 1 6 LYS CE C -1.979 -7.772 -2.887 1.00 . A A . 6 LYS CE 1 1 9 3166 1 1 6 LYS CG C -1.852 -5.599 -4.217 1.00 . A A . 6 LYS CG 1 1 9 3167 1 1 6 LYS H H -4.193 -2.573 -3.399 1.00 . A A . 6 LYS H 1 1 9 3168 1 1 6 LYS HA H -1.993 -4.042 -2.235 1.00 . A A . 6 LYS HA 1 1 9 3169 1 1 6 LYS HB3 H -2.045 -3.683 -5.182 1.00 . A A . 6 LYS HB3 1 1 9 3170 1 1 6 LYS HD3 H -3.585 -6.834 -3.966 1.00 . A A . 6 LYS HD3 1 1 9 3171 1 1 6 LYS HE3 H -1.439 -8.207 -3.730 1.00 . A A . 6 LYS HE3 1 1 9 3172 1 1 6 LYS HG3 H -0.842 -5.505 -3.821 1.00 . A A . 6 LYS HG3 1 1 9 3173 1 1 6 LYS HZ1 H -0.406 -6.715 -2.034 1.00 . A A . 6 LYS HZ1 1 1 9 3174 1 1 6 LYS HZ2 H -1.537 -7.171 -0.961 1.00 . A A . 6 LYS HZ2 1 1 9 3175 1 1 6 LYS HZ3 H -0.496 -8.289 -1.547 1.00 . A A . 6 LYS HZ3 1 1 9 3176 1 1 6 LYS N N -3.492 -2.692 -2.685 1.00 . A A . 6 LYS N 1 1 9 3177 1 1 6 LYS NZ N -1.037 -7.471 -1.788 1.00 . A A . 6 LYS NZ 1 1 9 3178 1 1 6 LYS O O -1.356 -1.197 -3.514 1.00 . A A . 6 LYS O 1 1 9 3179 1 1 7 CYS C C 2.555 -2.832 -3.469 1.00 . A A . 7 CYS C 1 1 9 3180 1 1 7 CYS CA C 1.334 -1.958 -3.201 1.00 . A A . 7 CYS CA 1 1 9 3181 1 1 7 CYS CB C 1.500 -1.221 -1.874 1.00 . A A . 7 CYS CB 1 1 9 3182 1 1 7 CYS H H 0.322 -3.774 -2.811 1.00 . A A . 7 CYS H 1 1 9 3183 1 1 7 CYS HA H 1.210 -1.233 -4.010 1.00 . A A . 7 CYS HA 1 1 9 3184 1 1 7 CYS HB3 H 1.612 -1.954 -1.082 1.00 . A A . 7 CYS HB3 1 1 9 3185 1 1 7 CYS N N 0.151 -2.812 -3.093 1.00 . A A . 7 CYS N 1 1 9 3186 1 1 7 CYS O O 2.673 -3.870 -2.824 1.00 . A A . 7 CYS O 1 1 9 3187 1 1 7 CYS SG S 2.895 -0.097 -1.721 1.00 . A A . 7 CYS SG 1 1 9 3188 1 1 8 ALA C C 5.871 -2.470 -4.103 1.00 . A A . 8 ALA C 1 1 9 3189 1 1 8 ALA CA C 4.663 -3.215 -4.673 1.00 . A A . 8 ALA CA 1 1 9 3190 1 1 8 ALA CB C 4.806 -3.484 -6.173 1.00 . A A . 8 ALA CB 1 1 9 3191 1 1 8 ALA H H 3.322 -1.582 -4.894 1.00 . A A . 8 ALA H 1 1 9 3192 1 1 8 ALA HA H 4.628 -4.193 -4.190 1.00 . A A . 8 ALA HA 1 1 9 3193 1 1 8 ALA HB1 H 5.708 -4.070 -6.352 1.00 . A A . 8 ALA HB1 1 1 9 3194 1 1 8 ALA HB2 H 3.942 -4.046 -6.529 1.00 . A A . 8 ALA HB2 1 1 9 3195 1 1 8 ALA HB3 H 4.877 -2.554 -6.736 1.00 . A A . 8 ALA HB3 1 1 9 3196 1 1 8 ALA N N 3.441 -2.458 -4.403 1.00 . A A . 8 ALA N 1 1 9 3197 1 1 8 ALA O O 6.619 -3.025 -3.300 1.00 . A A . 8 ALA O 1 1 9 3198 1 1 9 THR C C 6.415 0.765 -3.131 1.00 . A A . 9 THR C 1 1 9 3199 1 1 9 THR CA C 7.063 -0.301 -4.012 1.00 . A A . 9 THR CA 1 1 9 3200 1 1 9 THR CB C 7.778 0.354 -5.205 1.00 . A A . 9 THR CB 1 1 9 3201 1 1 9 THR CG2 C 8.480 -0.694 -6.072 1.00 . A A . 9 THR CG2 1 1 9 3202 1 1 9 THR H H 5.365 -0.818 -5.156 1.00 . A A . 9 THR H 1 1 9 3203 1 1 9 THR HA H 7.804 -0.841 -3.416 1.00 . A A . 9 THR HA 1 1 9 3204 1 1 9 THR HB H 8.533 1.044 -4.823 1.00 . A A . 9 THR HB 1 1 9 3205 1 1 9 THR HG1 H 6.095 0.540 -6.221 1.00 . A A . 9 THR HG1 1 1 9 3206 1 1 9 THR HG21 H 7.750 -1.365 -6.528 1.00 . A A . 9 THR HG21 1 1 9 3207 1 1 9 THR HG22 H 9.036 -0.192 -6.863 1.00 . A A . 9 THR HG22 1 1 9 3208 1 1 9 THR HG23 H 9.171 -1.275 -5.463 1.00 . A A . 9 THR HG23 1 1 9 3209 1 1 9 THR N N 6.038 -1.210 -4.499 1.00 . A A . 9 THR N 1 1 9 3210 1 1 9 THR O O 5.236 1.073 -3.294 1.00 . A A . 9 THR O 1 1 9 3211 1 1 9 THR OG1 O 6.873 1.086 -6.013 1.00 . A A . 9 THR OG1 1 1 9 3212 1 1 10 ASP C C 6.154 3.574 -2.561 1.00 . A A . 10 ASP C 1 1 9 3213 1 1 10 ASP CA C 6.852 2.630 -1.573 1.00 . A A . 10 ASP CA 1 1 9 3214 1 1 10 ASP CB C 8.146 3.243 -1.015 1.00 . A A . 10 ASP CB 1 1 9 3215 1 1 10 ASP CG C 9.276 3.101 -2.026 1.00 . A A . 10 ASP CG 1 1 9 3216 1 1 10 ASP H H 8.171 1.100 -2.169 1.00 . A A . 10 ASP H 1 1 9 3217 1 1 10 ASP HA H 6.162 2.429 -0.755 1.00 . A A . 10 ASP HA 1 1 9 3218 1 1 10 ASP HB3 H 8.436 2.713 -0.107 1.00 . A A . 10 ASP HB3 1 1 9 3219 1 1 10 ASP N N 7.187 1.366 -2.225 1.00 . A A . 10 ASP N 1 1 9 3220 1 1 10 ASP O O 4.998 3.943 -2.354 1.00 . A A . 10 ASP O 1 1 9 3221 1 1 10 ASP OD1 O 9.399 4.011 -2.870 1.00 . A A . 10 ASP OD1 1 1 9 3222 1 1 10 ASP OD2 O 9.849 1.990 -2.054 1.00 . A A . 10 ASP OD2 1 1 9 3223 1 1 11 ALA C C 5.019 4.228 -5.434 1.00 . A A . 11 ALA C 1 1 9 3224 1 1 11 ALA CA C 6.334 4.695 -4.785 1.00 . A A . 11 ALA CA 1 1 9 3225 1 1 11 ALA CB C 7.444 4.784 -5.836 1.00 . A A . 11 ALA CB 1 1 9 3226 1 1 11 ALA H H 7.824 3.697 -3.658 1.00 . A A . 11 ALA H 1 1 9 3227 1 1 11 ALA HA H 6.166 5.705 -4.410 1.00 . A A . 11 ALA HA 1 1 9 3228 1 1 11 ALA HB1 H 7.150 5.466 -6.634 1.00 . A A . 11 ALA HB1 1 1 9 3229 1 1 11 ALA HB2 H 8.359 5.159 -5.375 1.00 . A A . 11 ALA HB2 1 1 9 3230 1 1 11 ALA HB3 H 7.634 3.797 -6.257 1.00 . A A . 11 ALA HB3 1 1 9 3231 1 1 11 ALA N N 6.821 3.888 -3.673 1.00 . A A . 11 ALA N 1 1 9 3232 1 1 11 ALA O O 4.574 4.885 -6.376 1.00 . A A . 11 ALA O 1 1 9 3233 1 1 12 ASP C C 2.047 3.286 -4.334 1.00 . A A . 12 ASP C 1 1 9 3234 1 1 12 ASP CA C 3.027 2.755 -5.370 1.00 . A A . 12 ASP CA 1 1 9 3235 1 1 12 ASP CB C 2.845 1.240 -5.540 1.00 . A A . 12 ASP CB 1 1 9 3236 1 1 12 ASP CG C 3.627 0.679 -6.713 1.00 . A A . 12 ASP CG 1 1 9 3237 1 1 12 ASP H H 4.849 2.554 -4.297 1.00 . A A . 12 ASP H 1 1 9 3238 1 1 12 ASP HA H 2.747 3.223 -6.307 1.00 . A A . 12 ASP HA 1 1 9 3239 1 1 12 ASP HB3 H 1.791 1.034 -5.724 1.00 . A A . 12 ASP HB3 1 1 9 3240 1 1 12 ASP N N 4.399 3.120 -5.007 1.00 . A A . 12 ASP N 1 1 9 3241 1 1 12 ASP O O 0.991 3.799 -4.701 1.00 . A A . 12 ASP O 1 1 9 3242 1 1 12 ASP OD1 O 3.319 1.076 -7.862 1.00 . A A . 12 ASP OD1 1 1 9 3243 1 1 12 ASP OD2 O 4.542 -0.125 -6.440 1.00 . A A . 12 ASP OD2 1 1 9 3244 1 1 13 CYS C C 1.642 5.274 -2.078 1.00 . A A . 13 CYS C 1 1 9 3245 1 1 13 CYS CA C 1.500 3.756 -2.024 1.00 . A A . 13 CYS CA 1 1 9 3246 1 1 13 CYS CB C 1.773 3.191 -0.624 1.00 . A A . 13 CYS CB 1 1 9 3247 1 1 13 CYS H H 3.298 2.855 -2.788 1.00 . A A . 13 CYS H 1 1 9 3248 1 1 13 CYS HA H 0.474 3.506 -2.289 1.00 . A A . 13 CYS HA 1 1 9 3249 1 1 13 CYS HB3 H 2.714 3.575 -0.236 1.00 . A A . 13 CYS HB3 1 1 9 3250 1 1 13 CYS N N 2.367 3.175 -3.041 1.00 . A A . 13 CYS N 1 1 9 3251 1 1 13 CYS O O 0.654 5.990 -2.253 1.00 . A A . 13 CYS O 1 1 9 3252 1 1 13 CYS SG S 0.439 3.565 0.533 1.00 . A A . 13 CYS SG 1 1 9 3253 1 1 14 SER C C 3.065 7.417 -3.800 1.00 . A A . 14 SER C 1 1 9 3254 1 1 14 SER CA C 3.291 7.112 -2.317 1.00 . A A . 14 SER CA 1 1 9 3255 1 1 14 SER CB C 4.747 7.342 -1.886 1.00 . A A . 14 SER CB 1 1 9 3256 1 1 14 SER H H 3.641 5.059 -1.934 1.00 . A A . 14 SER H 1 1 9 3257 1 1 14 SER HA H 2.662 7.778 -1.726 1.00 . A A . 14 SER HA 1 1 9 3258 1 1 14 SER HB3 H 5.429 6.818 -2.554 1.00 . A A . 14 SER HB3 1 1 9 3259 1 1 14 SER HG H 4.364 9.203 -1.428 1.00 . A A . 14 SER HG 1 1 9 3260 1 1 14 SER N N 2.896 5.742 -2.032 1.00 . A A . 14 SER N 1 1 9 3261 1 1 14 SER O O 3.997 7.504 -4.596 1.00 . A A . 14 SER O 1 1 9 3262 1 1 14 SER OG O 5.039 8.729 -1.915 1.00 . A A . 14 SER OG 1 1 9 3263 1 1 15 ARG C C -0.244 8.044 -5.290 1.00 . A A . 15 ARG C 1 1 9 3264 1 1 15 ARG CA C 1.256 7.845 -5.472 1.00 . A A . 15 ARG CA 1 1 9 3265 1 1 15 ARG CB C 1.544 6.686 -6.441 1.00 . A A . 15 ARG CB 1 1 9 3266 1 1 15 ARG CD C 1.273 5.752 -8.772 1.00 . A A . 15 ARG CD 1 1 9 3267 1 1 15 ARG CG C 1.168 7.008 -7.895 1.00 . A A . 15 ARG CG 1 1 9 3268 1 1 15 ARG CZ C 2.929 3.866 -8.811 1.00 . A A . 15 ARG CZ 1 1 9 3269 1 1 15 ARG H H 1.126 7.416 -3.396 1.00 . A A . 15 ARG H 1 1 9 3270 1 1 15 ARG HA H 1.711 8.762 -5.850 1.00 . A A . 15 ARG HA 1 1 9 3271 1 1 15 ARG HB3 H 0.989 5.807 -6.120 1.00 . A A . 15 ARG HB3 1 1 9 3272 1 1 15 ARG HD3 H 1.032 6.016 -9.804 1.00 . A A . 15 ARG HD3 1 1 9 3273 1 1 15 ARG HE H 3.368 5.795 -8.430 1.00 . A A . 15 ARG HE 1 1 9 3274 1 1 15 ARG HG3 H 1.830 7.788 -8.276 1.00 . A A . 15 ARG HG3 1 1 9 3275 1 1 15 ARG HH11 H 1.064 3.188 -9.359 1.00 . A A . 15 ARG HH11 1 1 9 3276 1 1 15 ARG HH12 H 2.264 1.984 -8.856 1.00 . A A . 15 ARG HH12 1 1 9 3277 1 1 15 ARG HH21 H 4.726 4.052 -7.936 1.00 . A A . 15 ARG HH21 1 1 9 3278 1 1 15 ARG HH22 H 4.235 2.432 -8.379 1.00 . A A . 15 ARG HH22 1 1 9 3279 1 1 15 ARG N N 1.790 7.560 -4.149 1.00 . A A . 15 ARG N 1 1 9 3280 1 1 15 ARG NE N 2.625 5.171 -8.721 1.00 . A A . 15 ARG NE 1 1 9 3281 1 1 15 ARG NH1 N 2.010 2.947 -9.113 1.00 . A A . 15 ARG NH1 1 1 9 3282 1 1 15 ARG NH2 N 4.156 3.445 -8.521 1.00 . A A . 15 ARG NH2 1 1 9 3283 1 1 15 ARG O O -0.808 9.032 -5.754 1.00 . A A . 15 ARG O 1 1 9 3284 1 1 16 LYS C C -2.511 7.883 -2.924 1.00 . A A . 16 LYS C 1 1 9 3285 1 1 16 LYS CA C -2.295 7.162 -4.258 1.00 . A A . 16 LYS CA 1 1 9 3286 1 1 16 LYS CB C -2.862 5.736 -4.238 1.00 . A A . 16 LYS CB 1 1 9 3287 1 1 16 LYS CD C -4.933 4.316 -4.282 1.00 . A A . 16 LYS CD 1 1 9 3288 1 1 16 LYS CE C -6.468 4.316 -4.249 1.00 . A A . 16 LYS CE 1 1 9 3289 1 1 16 LYS CG C -4.395 5.748 -4.174 1.00 . A A . 16 LYS CG 1 1 9 3290 1 1 16 LYS H H -0.340 6.328 -4.215 1.00 . A A . 16 LYS H 1 1 9 3291 1 1 16 LYS HA H -2.817 7.717 -5.038 1.00 . A A . 16 LYS HA 1 1 9 3292 1 1 16 LYS HB3 H -2.456 5.188 -3.384 1.00 . A A . 16 LYS HB3 1 1 9 3293 1 1 16 LYS HD3 H -4.531 3.741 -3.446 1.00 . A A . 16 LYS HD3 1 1 9 3294 1 1 16 LYS HE3 H -6.842 4.945 -5.059 1.00 . A A . 16 LYS HE3 1 1 9 3295 1 1 16 LYS HG3 H -4.779 6.347 -5.004 1.00 . A A . 16 LYS HG3 1 1 9 3296 1 1 16 LYS HZ1 H -6.742 2.561 -5.288 1.00 . A A . 16 LYS HZ1 1 1 9 3297 1 1 16 LYS HZ2 H -6.709 2.359 -3.653 1.00 . A A . 16 LYS HZ2 1 1 9 3298 1 1 16 LYS HZ3 H -8.038 3.002 -4.377 1.00 . A A . 16 LYS HZ3 1 1 9 3299 1 1 16 LYS N N -0.880 7.102 -4.583 1.00 . A A . 16 LYS N 1 1 9 3300 1 1 16 LYS NZ N -7.026 2.957 -4.403 1.00 . A A . 16 LYS NZ 1 1 9 3301 1 1 16 LYS O O -3.460 8.651 -2.793 1.00 . A A . 16 LYS O 1 1 9 3302 1 1 17 CYS C C -0.489 8.964 -0.263 1.00 . A A . 17 CYS C 1 1 9 3303 1 1 17 CYS CA C -1.759 8.163 -0.582 1.00 . A A . 17 CYS CA 1 1 9 3304 1 1 17 CYS CB C -1.986 7.018 0.407 1.00 . A A . 17 CYS CB 1 1 9 3305 1 1 17 CYS H H -0.870 6.996 -2.106 1.00 . A A . 17 CYS H 1 1 9 3306 1 1 17 CYS HA H -2.641 8.795 -0.505 1.00 . A A . 17 CYS HA 1 1 9 3307 1 1 17 CYS HB3 H -1.246 6.230 0.258 1.00 . A A . 17 CYS HB3 1 1 9 3308 1 1 17 CYS N N -1.657 7.612 -1.929 1.00 . A A . 17 CYS N 1 1 9 3309 1 1 17 CYS O O 0.604 8.410 -0.366 1.00 . A A . 17 CYS O 1 1 9 3310 1 1 17 CYS SG S -1.928 7.513 2.142 1.00 . A A . 17 CYS SG 1 1 9 3311 1 1 18 PRO C C 1.248 10.968 1.550 1.00 . A A . 18 PRO C 1 1 9 3312 1 1 18 PRO CA C 0.564 11.145 0.189 1.00 . A A . 18 PRO CA 1 1 9 3313 1 1 18 PRO CB C 0.002 12.561 0.018 1.00 . A A . 18 PRO CB 1 1 9 3314 1 1 18 PRO CD C -1.825 11.032 0.165 1.00 . A A . 18 PRO CD 1 1 9 3315 1 1 18 PRO CG C -1.403 12.436 0.602 1.00 . A A . 18 PRO CG 1 1 9 3316 1 1 18 PRO HA H 1.292 10.948 -0.599 1.00 . A A . 18 PRO HA 1 1 9 3317 1 1 18 PRO HB3 H -0.074 12.791 -1.046 1.00 . A A . 18 PRO HB3 1 1 9 3318 1 1 18 PRO HD3 H -2.313 11.090 -0.809 1.00 . A A . 18 PRO HD3 1 1 9 3319 1 1 18 PRO HG3 H -2.081 13.208 0.230 1.00 . A A . 18 PRO HG3 1 1 9 3320 1 1 18 PRO N N -0.592 10.269 0.045 1.00 . A A . 18 PRO N 1 1 9 3321 1 1 18 PRO O O 0.786 10.207 2.395 1.00 . A A . 18 PRO O 1 1 9 3322 1 1 19 GLY C C 4.131 10.495 2.998 1.00 . A A . 19 GLY C 1 1 9 3323 1 1 19 GLY CA C 3.139 11.658 2.993 1.00 . A A . 19 GLY CA 1 1 9 3324 1 1 19 GLY H H 2.655 12.326 1.033 1.00 . A A . 19 GLY H 1 1 9 3325 1 1 19 GLY HA2 H 3.697 12.590 3.077 1.00 . A A . 19 GLY HA2 1 1 9 3326 1 1 19 GLY HA3 H 2.475 11.576 3.856 1.00 . A A . 19 GLY HA3 1 1 9 3327 1 1 19 GLY N N 2.357 11.691 1.757 1.00 . A A . 19 GLY N 1 1 9 3328 1 1 19 GLY O O 4.333 9.853 4.025 1.00 . A A . 19 GLY O 1 1 9 3329 1 1 20 ASN C C 5.389 7.841 2.392 1.00 . A A . 20 ASN C 1 1 9 3330 1 1 20 ASN CA C 5.589 9.087 1.514 1.00 . A A . 20 ASN CA 1 1 9 3331 1 1 20 ASN CB C 7.065 9.505 1.442 1.00 . A A . 20 ASN CB 1 1 9 3332 1 1 20 ASN CG C 7.931 8.389 0.849 1.00 . A A . 20 ASN CG 1 1 9 3333 1 1 20 ASN H H 4.499 10.837 1.063 1.00 . A A . 20 ASN H 1 1 9 3334 1 1 20 ASN HA H 5.313 8.797 0.508 1.00 . A A . 20 ASN HA 1 1 9 3335 1 1 20 ASN HB3 H 7.420 9.755 2.441 1.00 . A A . 20 ASN HB3 1 1 9 3336 1 1 20 ASN HD21 H 9.655 9.267 1.495 1.00 . A A . 20 ASN HD21 1 1 9 3337 1 1 20 ASN HD22 H 9.824 7.763 0.601 1.00 . A A . 20 ASN HD22 1 1 9 3338 1 1 20 ASN N N 4.732 10.228 1.831 1.00 . A A . 20 ASN N 1 1 9 3339 1 1 20 ASN ND2 N 9.248 8.492 0.995 1.00 . A A . 20 ASN ND2 1 1 9 3340 1 1 20 ASN O O 6.311 7.428 3.095 1.00 . A A . 20 ASN O 1 1 9 3341 1 1 20 ASN OD1 O 7.426 7.446 0.248 1.00 . A A . 20 ASN OD1 1 1 9 3342 1 1 21 PRO C C 4.626 4.801 2.286 1.00 . A A . 21 PRO C 1 1 9 3343 1 1 21 PRO CA C 3.969 5.965 3.043 1.00 . A A . 21 PRO CA 1 1 9 3344 1 1 21 PRO CB C 2.452 5.805 3.049 1.00 . A A . 21 PRO CB 1 1 9 3345 1 1 21 PRO CD C 3.004 7.657 1.663 1.00 . A A . 21 PRO CD 1 1 9 3346 1 1 21 PRO CG C 2.027 6.493 1.751 1.00 . A A . 21 PRO CG 1 1 9 3347 1 1 21 PRO HA H 4.331 6.049 4.068 1.00 . A A . 21 PRO HA 1 1 9 3348 1 1 21 PRO HB3 H 2.033 6.345 3.901 1.00 . A A . 21 PRO HB3 1 1 9 3349 1 1 21 PRO HD3 H 2.577 8.490 2.216 1.00 . A A . 21 PRO HD3 1 1 9 3350 1 1 21 PRO HG3 H 0.992 6.835 1.773 1.00 . A A . 21 PRO HG3 1 1 9 3351 1 1 21 PRO N N 4.208 7.210 2.343 1.00 . A A . 21 PRO N 1 1 9 3352 1 1 21 PRO O O 4.594 4.785 1.055 1.00 . A A . 21 PRO O 1 1 9 3353 1 1 22 PRO C C 4.576 1.624 2.025 1.00 . A A . 22 PRO C 1 1 9 3354 1 1 22 PRO CA C 5.709 2.601 2.376 1.00 . A A . 22 PRO CA 1 1 9 3355 1 1 22 PRO CB C 6.647 2.012 3.437 1.00 . A A . 22 PRO CB 1 1 9 3356 1 1 22 PRO CD C 5.386 3.780 4.434 1.00 . A A . 22 PRO CD 1 1 9 3357 1 1 22 PRO CG C 5.962 2.399 4.748 1.00 . A A . 22 PRO CG 1 1 9 3358 1 1 22 PRO HA H 6.282 2.843 1.482 1.00 . A A . 22 PRO HA 1 1 9 3359 1 1 22 PRO HB3 H 7.613 2.517 3.378 1.00 . A A . 22 PRO HB3 1 1 9 3360 1 1 22 PRO HD3 H 6.114 4.548 4.702 1.00 . A A . 22 PRO HD3 1 1 9 3361 1 1 22 PRO HG3 H 6.657 2.422 5.588 1.00 . A A . 22 PRO HG3 1 1 9 3362 1 1 22 PRO N N 5.182 3.806 2.993 1.00 . A A . 22 PRO N 1 1 9 3363 1 1 22 PRO O O 3.397 1.877 2.294 1.00 . A A . 22 PRO O 1 1 9 3364 1 1 23 CYS C C 4.114 -1.349 2.843 1.00 . A A . 23 CYS C 1 1 9 3365 1 1 23 CYS CA C 4.045 -0.682 1.471 1.00 . A A . 23 CYS CA 1 1 9 3366 1 1 23 CYS CB C 4.425 -1.742 0.427 1.00 . A A . 23 CYS CB 1 1 9 3367 1 1 23 CYS H H 5.916 0.299 1.264 1.00 . A A . 23 CYS H 1 1 9 3368 1 1 23 CYS HA H 3.032 -0.344 1.255 1.00 . A A . 23 CYS HA 1 1 9 3369 1 1 23 CYS HB3 H 3.659 -2.515 0.471 1.00 . A A . 23 CYS HB3 1 1 9 3370 1 1 23 CYS N N 4.943 0.462 1.477 1.00 . A A . 23 CYS N 1 1 9 3371 1 1 23 CYS O O 5.194 -1.743 3.284 1.00 . A A . 23 CYS O 1 1 9 3372 1 1 23 CYS SG S 4.560 -1.272 -1.310 1.00 . A A . 23 CYS SG 1 1 9 3373 1 1 24 ARG C C 2.955 -3.998 3.507 1.00 . A A . 24 ARG C 1 1 9 3374 1 1 24 ARG CA C 2.833 -2.732 4.365 1.00 . A A . 24 ARG CA 1 1 9 3375 1 1 24 ARG CB C 1.494 -2.653 5.119 1.00 . A A . 24 ARG CB 1 1 9 3376 1 1 24 ARG CD C 0.140 -4.685 5.841 1.00 . A A . 24 ARG CD 1 1 9 3377 1 1 24 ARG CG C 1.348 -3.789 6.148 1.00 . A A . 24 ARG CG 1 1 9 3378 1 1 24 ARG CZ C -0.307 -5.972 7.948 1.00 . A A . 24 ARG CZ 1 1 9 3379 1 1 24 ARG H H 2.121 -1.313 2.991 1.00 . A A . 24 ARG H 1 1 9 3380 1 1 24 ARG HA H 3.636 -2.711 5.104 1.00 . A A . 24 ARG HA 1 1 9 3381 1 1 24 ARG HB3 H 0.667 -2.668 4.406 1.00 . A A . 24 ARG HB3 1 1 9 3382 1 1 24 ARG HD3 H 0.207 -5.023 4.806 1.00 . A A . 24 ARG HD3 1 1 9 3383 1 1 24 ARG HE H 0.484 -6.732 6.235 1.00 . A A . 24 ARG HE 1 1 9 3384 1 1 24 ARG HG3 H 1.240 -3.348 7.140 1.00 . A A . 24 ARG HG3 1 1 9 3385 1 1 24 ARG HH11 H -0.755 -3.999 8.065 1.00 . A A . 24 ARG HH11 1 1 9 3386 1 1 24 ARG HH12 H -1.104 -4.896 9.511 1.00 . A A . 24 ARG HH12 1 1 9 3387 1 1 24 ARG HH21 H 0.068 -7.976 8.138 1.00 . A A . 24 ARG HH21 1 1 9 3388 1 1 24 ARG HH22 H -0.601 -7.224 9.548 1.00 . A A . 24 ARG HH22 1 1 9 3389 1 1 24 ARG N N 2.967 -1.597 3.471 1.00 . A A . 24 ARG N 1 1 9 3390 1 1 24 ARG NE N 0.131 -5.897 6.680 1.00 . A A . 24 ARG NE 1 1 9 3391 1 1 24 ARG NH1 N -0.762 -4.876 8.563 1.00 . A A . 24 ARG NH1 1 1 9 3392 1 1 24 ARG NH2 N -0.280 -7.144 8.594 1.00 . A A . 24 ARG NH2 1 1 9 3393 1 1 24 ARG O O 1.952 -4.603 3.136 1.00 . A A . 24 ARG O 1 1 9 3394 1 1 25 ASN C C 3.572 -6.188 1.594 1.00 . A A . 25 ASN C 1 1 9 3395 1 1 25 ASN CA C 4.616 -5.622 2.557 1.00 . A A . 25 ASN CA 1 1 9 3396 1 1 25 ASN CB C 4.974 -6.646 3.645 1.00 . A A . 25 ASN CB 1 1 9 3397 1 1 25 ASN CG C 6.104 -6.160 4.544 1.00 . A A . 25 ASN CG 1 1 9 3398 1 1 25 ASN H H 4.930 -3.703 3.434 1.00 . A A . 25 ASN H 1 1 9 3399 1 1 25 ASN HA H 5.520 -5.421 1.981 1.00 . A A . 25 ASN HA 1 1 9 3400 1 1 25 ASN HB3 H 5.278 -7.583 3.175 1.00 . A A . 25 ASN HB3 1 1 9 3401 1 1 25 ASN HD21 H 7.526 -6.551 3.129 1.00 . A A . 25 ASN HD21 1 1 9 3402 1 1 25 ASN HD22 H 8.096 -5.870 4.640 1.00 . A A . 25 ASN HD22 1 1 9 3403 1 1 25 ASN N N 4.200 -4.362 3.177 1.00 . A A . 25 ASN N 1 1 9 3404 1 1 25 ASN ND2 N 7.342 -6.200 4.055 1.00 . A A . 25 ASN ND2 1 1 9 3405 1 1 25 ASN O O 2.896 -7.169 1.903 1.00 . A A . 25 ASN O 1 1 9 3406 1 1 25 ASN OD1 O 5.867 -5.740 5.672 1.00 . A A . 25 ASN OD1 1 1 9 3407 1 1 26 GLY C C 1.220 -5.196 -0.636 1.00 . A A . 26 GLY C 1 1 9 3408 1 1 26 GLY CA C 2.508 -6.022 -0.610 1.00 . A A . 26 GLY CA 1 1 9 3409 1 1 26 GLY H H 4.015 -4.769 0.209 1.00 . A A . 26 GLY H 1 1 9 3410 1 1 26 GLY HA2 H 3.007 -5.955 -1.575 1.00 . A A . 26 GLY HA2 1 1 9 3411 1 1 26 GLY HA3 H 2.240 -7.068 -0.460 1.00 . A A . 26 GLY HA3 1 1 9 3412 1 1 26 GLY N N 3.437 -5.572 0.416 1.00 . A A . 26 GLY N 1 1 9 3413 1 1 26 GLY O O 0.454 -5.298 -1.601 1.00 . A A . 26 GLY O 1 1 9 3414 1 1 27 PHE C C 0.142 -2.199 0.990 1.00 . A A . 27 PHE C 1 1 9 3415 1 1 27 PHE CA C -0.257 -3.599 0.534 1.00 . A A . 27 PHE CA 1 1 9 3416 1 1 27 PHE CB C -1.228 -4.242 1.526 1.00 . A A . 27 PHE CB 1 1 9 3417 1 1 27 PHE CD1 C -1.005 -6.769 1.563 1.00 . A A . 27 PHE CD1 1 1 9 3418 1 1 27 PHE CD2 C -2.913 -5.776 0.427 1.00 . A A . 27 PHE CD2 1 1 9 3419 1 1 27 PHE CE1 C -1.563 -8.048 1.379 1.00 . A A . 27 PHE CE1 1 1 9 3420 1 1 27 PHE CE2 C -3.497 -7.047 0.287 1.00 . A A . 27 PHE CE2 1 1 9 3421 1 1 27 PHE CG C -1.704 -5.627 1.130 1.00 . A A . 27 PHE CG 1 1 9 3422 1 1 27 PHE CZ C -2.826 -8.184 0.772 1.00 . A A . 27 PHE CZ 1 1 9 3423 1 1 27 PHE H H 1.564 -4.410 1.219 1.00 . A A . 27 PHE H 1 1 9 3424 1 1 27 PHE HA H -0.743 -3.509 -0.434 1.00 . A A . 27 PHE HA 1 1 9 3425 1 1 27 PHE HB3 H -2.090 -3.583 1.635 1.00 . A A . 27 PHE HB3 1 1 9 3426 1 1 27 PHE HD1 H -0.071 -6.665 2.100 1.00 . A A . 27 PHE HD1 1 1 9 3427 1 1 27 PHE HD2 H -3.447 -4.902 0.082 1.00 . A A . 27 PHE HD2 1 1 9 3428 1 1 27 PHE HE1 H -1.063 -8.916 1.788 1.00 . A A . 27 PHE HE1 1 1 9 3429 1 1 27 PHE HE2 H -4.489 -7.139 -0.137 1.00 . A A . 27 PHE HE2 1 1 9 3430 1 1 27 PHE HZ H -3.302 -9.154 0.724 1.00 . A A . 27 PHE HZ 1 1 9 3431 1 1 27 PHE N N 0.935 -4.427 0.421 1.00 . A A . 27 PHE N 1 1 9 3432 1 1 27 PHE O O 1.205 -2.037 1.576 1.00 . A A . 27 PHE O 1 1 9 3433 1 1 28 CYS C C -0.252 0.267 2.611 1.00 . A A . 28 CYS C 1 1 9 3434 1 1 28 CYS CA C -0.381 0.203 1.087 1.00 . A A . 28 CYS CA 1 1 9 3435 1 1 28 CYS CB C -1.545 1.116 0.658 1.00 . A A . 28 CYS CB 1 1 9 3436 1 1 28 CYS H H -1.531 -1.385 0.220 1.00 . A A . 28 CYS H 1 1 9 3437 1 1 28 CYS HA H 0.546 0.527 0.613 1.00 . A A . 28 CYS HA 1 1 9 3438 1 1 28 CYS HB3 H -2.068 1.474 1.546 1.00 . A A . 28 CYS HB3 1 1 9 3439 1 1 28 CYS N N -0.661 -1.179 0.695 1.00 . A A . 28 CYS N 1 1 9 3440 1 1 28 CYS O O -1.124 -0.262 3.296 1.00 . A A . 28 CYS O 1 1 9 3441 1 1 28 CYS SG S -1.193 2.593 -0.330 1.00 . A A . 28 CYS SG 1 1 9 3442 1 1 29 ALA C C -0.285 2.464 4.702 1.00 . A A . 29 ALA C 1 1 9 3443 1 1 29 ALA CA C 0.708 1.306 4.566 1.00 . A A . 29 ALA CA 1 1 9 3444 1 1 29 ALA CB C 2.094 1.692 5.091 1.00 . A A . 29 ALA CB 1 1 9 3445 1 1 29 ALA H H 1.529 1.306 2.587 1.00 . A A . 29 ALA H 1 1 9 3446 1 1 29 ALA HA H 0.355 0.467 5.166 1.00 . A A . 29 ALA HA 1 1 9 3447 1 1 29 ALA HB1 H 2.472 2.570 4.567 1.00 . A A . 29 ALA HB1 1 1 9 3448 1 1 29 ALA HB2 H 2.027 1.922 6.155 1.00 . A A . 29 ALA HB2 1 1 9 3449 1 1 29 ALA HB3 H 2.785 0.862 4.953 1.00 . A A . 29 ALA HB3 1 1 9 3450 1 1 29 ALA N N 0.777 0.924 3.160 1.00 . A A . 29 ALA N 1 1 9 3451 1 1 29 ALA O O -1.241 2.395 5.470 1.00 . A A . 29 ALA O 1 1 9 3452 1 1 30 CYS C C -0.944 5.490 5.185 1.00 . A A . 30 CYS C 1 1 9 3453 1 1 30 CYS CA C -0.802 4.765 3.845 1.00 . A A . 30 CYS CA 1 1 9 3454 1 1 30 CYS CB C -2.153 4.578 3.158 1.00 . A A . 30 CYS CB 1 1 9 3455 1 1 30 CYS H H 0.744 3.426 3.296 1.00 . A A . 30 CYS H 1 1 9 3456 1 1 30 CYS HA H -0.229 5.426 3.200 1.00 . A A . 30 CYS HA 1 1 9 3457 1 1 30 CYS HB3 H -2.743 3.826 3.682 1.00 . A A . 30 CYS HB3 1 1 9 3458 1 1 30 CYS N N -0.049 3.516 3.915 1.00 . A A . 30 CYS N 1 1 9 3459 1 1 30 CYS O O -0.339 6.540 5.383 1.00 . A A . 30 CYS O 1 1 9 3460 1 1 30 CYS SG S -3.134 6.099 3.097 1.00 . A A . 30 CYS SG 1 1 9 3461 1 1 31 THR C C -0.756 5.838 8.173 1.00 . A A . 31 THR C 1 1 9 3462 1 1 31 THR CA C -2.041 5.623 7.369 1.00 . A A . 31 THR CA 1 1 9 3463 1 1 31 THR CB C -3.142 4.862 8.134 1.00 . A A . 31 THR CB 1 1 9 3464 1 1 31 THR CG2 C -2.773 3.415 8.482 1.00 . A A . 31 THR CG2 1 1 9 3465 1 1 31 THR H H -2.093 4.019 5.940 1.00 . A A . 31 THR H 1 1 9 3466 1 1 31 THR HA H -2.437 6.613 7.134 1.00 . A A . 31 THR HA 1 1 9 3467 1 1 31 THR HB H -4.041 4.841 7.514 1.00 . A A . 31 THR HB 1 1 9 3468 1 1 31 THR HG1 H -2.647 5.671 9.825 1.00 . A A . 31 THR HG1 1 1 9 3469 1 1 31 THR HG21 H -1.858 3.379 9.073 1.00 . A A . 31 THR HG21 1 1 9 3470 1 1 31 THR HG22 H -3.582 2.975 9.066 1.00 . A A . 31 THR HG22 1 1 9 3471 1 1 31 THR HG23 H -2.643 2.822 7.580 1.00 . A A . 31 THR HG23 1 1 9 3472 1 1 31 THR N N -1.742 4.955 6.109 1.00 . A A . 31 THR N 1 1 9 3473 1 1 31 THR O O -0.772 5.781 9.404 1.00 . A A . 31 THR O 1 1 9 3474 1 1 31 THR OG1 O -3.466 5.546 9.325 1.00 . A A . 31 THR OG1 1 1 10 3475 1 1 1 THR C C -10.675 -4.003 6.415 1.00 . A A . 1 THR C 1 1 10 3476 1 1 1 THR CA C -10.980 -3.474 7.821 1.00 . A A . 1 THR CA 1 1 10 3477 1 1 1 THR CB C -11.338 -1.977 7.796 1.00 . A A . 1 THR CB 1 1 10 3478 1 1 1 THR CG2 C -11.834 -1.511 9.168 1.00 . A A . 1 THR CG2 1 1 10 3479 1 1 1 THR H1 H -8.979 -3.983 8.131 1.00 . A A . 1 THR H1 1 1 10 3480 1 1 1 THR HA H -11.797 -4.045 8.260 1.00 . A A . 1 THR HA 1 1 10 3481 1 1 1 THR HB H -12.122 -1.786 7.064 1.00 . A A . 1 THR HB 1 1 10 3482 1 1 1 THR HG1 H -9.486 -1.464 8.032 1.00 . A A . 1 THR HG1 1 1 10 3483 1 1 1 THR HG21 H -12.083 -0.450 9.124 1.00 . A A . 1 THR HG21 1 1 10 3484 1 1 1 THR HG22 H -12.726 -2.071 9.450 1.00 . A A . 1 THR HG22 1 1 10 3485 1 1 1 THR HG23 H -11.064 -1.663 9.926 1.00 . A A . 1 THR HG23 1 1 10 3486 1 1 1 THR N N -9.798 -3.671 8.643 1.00 . A A . 1 THR N 1 1 10 3487 1 1 1 THR O O -9.500 -4.105 6.057 1.00 . A A . 1 THR O 1 1 10 3488 1 1 1 THR OG1 O -10.202 -1.215 7.441 1.00 . A A . 1 THR OG1 1 1 10 3489 1 1 2 PRO C C -11.142 -3.567 3.350 1.00 . A A . 2 PRO C 1 1 10 3490 1 1 2 PRO CA C -11.494 -4.777 4.228 1.00 . A A . 2 PRO CA 1 1 10 3491 1 1 2 PRO CB C -12.816 -5.449 3.835 1.00 . A A . 2 PRO CB 1 1 10 3492 1 1 2 PRO CD C -13.100 -4.411 5.968 1.00 . A A . 2 PRO CD 1 1 10 3493 1 1 2 PRO CG C -13.848 -4.683 4.661 1.00 . A A . 2 PRO CG 1 1 10 3494 1 1 2 PRO HA H -10.689 -5.510 4.158 1.00 . A A . 2 PRO HA 1 1 10 3495 1 1 2 PRO HB3 H -12.799 -6.488 4.167 1.00 . A A . 2 PRO HB3 1 1 10 3496 1 1 2 PRO HD3 H -13.253 -5.249 6.651 1.00 . A A . 2 PRO HD3 1 1 10 3497 1 1 2 PRO HG3 H -14.763 -5.257 4.817 1.00 . A A . 2 PRO HG3 1 1 10 3498 1 1 2 PRO N N -11.692 -4.346 5.605 1.00 . A A . 2 PRO N 1 1 10 3499 1 1 2 PRO O O -11.901 -3.184 2.464 1.00 . A A . 2 PRO O 1 1 10 3500 1 1 3 PHE C C -8.022 -2.053 2.497 1.00 . A A . 3 PHE C 1 1 10 3501 1 1 3 PHE CA C -9.472 -1.786 2.908 1.00 . A A . 3 PHE CA 1 1 10 3502 1 1 3 PHE CB C -9.625 -0.566 3.829 1.00 . A A . 3 PHE CB 1 1 10 3503 1 1 3 PHE CD1 C -10.682 1.200 2.364 1.00 . A A . 3 PHE CD1 1 1 10 3504 1 1 3 PHE CD2 C -8.466 1.624 3.282 1.00 . A A . 3 PHE CD2 1 1 10 3505 1 1 3 PHE CE1 C -10.691 2.484 1.789 1.00 . A A . 3 PHE CE1 1 1 10 3506 1 1 3 PHE CE2 C -8.486 2.916 2.724 1.00 . A A . 3 PHE CE2 1 1 10 3507 1 1 3 PHE CG C -9.575 0.773 3.122 1.00 . A A . 3 PHE CG 1 1 10 3508 1 1 3 PHE CZ C -9.598 3.347 1.980 1.00 . A A . 3 PHE CZ 1 1 10 3509 1 1 3 PHE H H -9.414 -3.333 4.365 1.00 . A A . 3 PHE H 1 1 10 3510 1 1 3 PHE HA H -10.049 -1.614 1.997 1.00 . A A . 3 PHE HA 1 1 10 3511 1 1 3 PHE HB3 H -8.864 -0.609 4.612 1.00 . A A . 3 PHE HB3 1 1 10 3512 1 1 3 PHE HD1 H -11.539 0.553 2.241 1.00 . A A . 3 PHE HD1 1 1 10 3513 1 1 3 PHE HD2 H -7.601 1.291 3.836 1.00 . A A . 3 PHE HD2 1 1 10 3514 1 1 3 PHE HE1 H -11.550 2.814 1.223 1.00 . A A . 3 PHE HE1 1 1 10 3515 1 1 3 PHE HE2 H -7.639 3.572 2.857 1.00 . A A . 3 PHE HE2 1 1 10 3516 1 1 3 PHE HZ H -9.616 4.341 1.558 1.00 . A A . 3 PHE HZ 1 1 10 3517 1 1 3 PHE N N -9.977 -2.963 3.604 1.00 . A A . 3 PHE N 1 1 10 3518 1 1 3 PHE O O -7.131 -1.220 2.662 1.00 . A A . 3 PHE O 1 1 10 3519 1 1 4 ALA C C -5.876 -3.187 0.425 1.00 . A A . 4 ALA C 1 1 10 3520 1 1 4 ALA CA C -6.443 -3.777 1.719 1.00 . A A . 4 ALA CA 1 1 10 3521 1 1 4 ALA CB C -6.502 -5.308 1.692 1.00 . A A . 4 ALA CB 1 1 10 3522 1 1 4 ALA H H -8.560 -3.884 1.860 1.00 . A A . 4 ALA H 1 1 10 3523 1 1 4 ALA HA H -5.781 -3.493 2.541 1.00 . A A . 4 ALA HA 1 1 10 3524 1 1 4 ALA HB1 H -6.920 -5.678 2.629 1.00 . A A . 4 ALA HB1 1 1 10 3525 1 1 4 ALA HB2 H -7.126 -5.649 0.864 1.00 . A A . 4 ALA HB2 1 1 10 3526 1 1 4 ALA HB3 H -5.499 -5.713 1.576 1.00 . A A . 4 ALA HB3 1 1 10 3527 1 1 4 ALA N N -7.776 -3.263 1.987 1.00 . A A . 4 ALA N 1 1 10 3528 1 1 4 ALA O O -5.658 -3.903 -0.551 1.00 . A A . 4 ALA O 1 1 10 3529 1 1 5 ILE C C -3.609 -1.827 -0.948 1.00 . A A . 5 ILE C 1 1 10 3530 1 1 5 ILE CA C -4.983 -1.194 -0.701 1.00 . A A . 5 ILE CA 1 1 10 3531 1 1 5 ILE CB C -4.883 0.322 -0.431 1.00 . A A . 5 ILE CB 1 1 10 3532 1 1 5 ILE CD1 C -6.282 2.394 0.144 1.00 . A A . 5 ILE CD1 1 1 10 3533 1 1 5 ILE CG1 C -6.291 0.937 -0.332 1.00 . A A . 5 ILE CG1 1 1 10 3534 1 1 5 ILE CG2 C -4.085 1.009 -1.555 1.00 . A A . 5 ILE CG2 1 1 10 3535 1 1 5 ILE H H -5.857 -1.347 1.253 1.00 . A A . 5 ILE H 1 1 10 3536 1 1 5 ILE HA H -5.606 -1.340 -1.587 1.00 . A A . 5 ILE HA 1 1 10 3537 1 1 5 ILE HB H -4.358 0.477 0.513 1.00 . A A . 5 ILE HB 1 1 10 3538 1 1 5 ILE HD11 H -7.311 2.740 0.226 1.00 . A A . 5 ILE HD11 1 1 10 3539 1 1 5 ILE HD12 H -5.805 2.457 1.123 1.00 . A A . 5 ILE HD12 1 1 10 3540 1 1 5 ILE HD13 H -5.762 3.048 -0.552 1.00 . A A . 5 ILE HD13 1 1 10 3541 1 1 5 ILE HG13 H -6.888 0.378 0.390 1.00 . A A . 5 ILE HG13 1 1 10 3542 1 1 5 ILE HG21 H -4.568 0.833 -2.515 1.00 . A A . 5 ILE HG21 1 1 10 3543 1 1 5 ILE HG22 H -4.000 2.079 -1.376 1.00 . A A . 5 ILE HG22 1 1 10 3544 1 1 5 ILE HG23 H -3.069 0.621 -1.602 1.00 . A A . 5 ILE HG23 1 1 10 3545 1 1 5 ILE N N -5.619 -1.877 0.419 1.00 . A A . 5 ILE N 1 1 10 3546 1 1 5 ILE O O -2.701 -1.676 -0.130 1.00 . A A . 5 ILE O 1 1 10 3547 1 1 6 LYS C C -1.110 -1.988 -2.612 1.00 . A A . 6 LYS C 1 1 10 3548 1 1 6 LYS CA C -2.155 -3.088 -2.431 1.00 . A A . 6 LYS CA 1 1 10 3549 1 1 6 LYS CB C -2.219 -3.935 -3.710 1.00 . A A . 6 LYS CB 1 1 10 3550 1 1 6 LYS CD C -2.049 -6.309 -4.525 1.00 . A A . 6 LYS CD 1 1 10 3551 1 1 6 LYS CE C -0.707 -6.968 -4.140 1.00 . A A . 6 LYS CE 1 1 10 3552 1 1 6 LYS CG C -2.637 -5.388 -3.444 1.00 . A A . 6 LYS CG 1 1 10 3553 1 1 6 LYS H H -4.235 -2.682 -2.682 1.00 . A A . 6 LYS H 1 1 10 3554 1 1 6 LYS HA H -1.832 -3.731 -1.617 1.00 . A A . 6 LYS HA 1 1 10 3555 1 1 6 LYS HB3 H -1.223 -3.945 -4.151 1.00 . A A . 6 LYS HB3 1 1 10 3556 1 1 6 LYS HD3 H -1.951 -5.763 -5.467 1.00 . A A . 6 LYS HD3 1 1 10 3557 1 1 6 LYS HE3 H -0.309 -7.472 -5.023 1.00 . A A . 6 LYS HE3 1 1 10 3558 1 1 6 LYS HG3 H -3.728 -5.432 -3.471 1.00 . A A . 6 LYS HG3 1 1 10 3559 1 1 6 LYS HZ1 H 0.548 -5.248 -4.201 1.00 . A A . 6 LYS HZ1 1 1 10 3560 1 1 6 LYS HZ2 H 0.059 -5.665 -2.701 1.00 . A A . 6 LYS HZ2 1 1 10 3561 1 1 6 LYS HZ3 H 1.184 -6.541 -3.458 1.00 . A A . 6 LYS HZ3 1 1 10 3562 1 1 6 LYS N N -3.447 -2.537 -2.069 1.00 . A A . 6 LYS N 1 1 10 3563 1 1 6 LYS NZ N 0.321 -6.043 -3.607 1.00 . A A . 6 LYS NZ 1 1 10 3564 1 1 6 LYS O O -1.412 -0.863 -3.003 1.00 . A A . 6 LYS O 1 1 10 3565 1 1 7 CYS C C 2.075 -2.629 -3.755 1.00 . A A . 7 CYS C 1 1 10 3566 1 1 7 CYS CA C 1.352 -1.709 -2.769 1.00 . A A . 7 CYS CA 1 1 10 3567 1 1 7 CYS CB C 2.165 -1.443 -1.500 1.00 . A A . 7 CYS CB 1 1 10 3568 1 1 7 CYS H H 0.265 -3.341 -2.064 1.00 . A A . 7 CYS H 1 1 10 3569 1 1 7 CYS HA H 1.137 -0.760 -3.263 1.00 . A A . 7 CYS HA 1 1 10 3570 1 1 7 CYS HB3 H 2.131 -2.300 -0.835 1.00 . A A . 7 CYS HB3 1 1 10 3571 1 1 7 CYS N N 0.135 -2.386 -2.374 1.00 . A A . 7 CYS N 1 1 10 3572 1 1 7 CYS O O 1.764 -3.825 -3.821 1.00 . A A . 7 CYS O 1 1 10 3573 1 1 7 CYS SG S 3.903 -1.027 -1.703 1.00 . A A . 7 CYS SG 1 1 10 3574 1 1 8 ALA C C 5.335 -2.267 -5.036 1.00 . A A . 8 ALA C 1 1 10 3575 1 1 8 ALA CA C 3.951 -2.834 -5.336 1.00 . A A . 8 ALA CA 1 1 10 3576 1 1 8 ALA CB C 3.563 -2.818 -6.816 1.00 . A A . 8 ALA CB 1 1 10 3577 1 1 8 ALA H H 3.192 -1.084 -4.438 1.00 . A A . 8 ALA H 1 1 10 3578 1 1 8 ALA HA H 3.963 -3.877 -5.014 1.00 . A A . 8 ALA HA 1 1 10 3579 1 1 8 ALA HB1 H 3.354 -1.805 -7.150 1.00 . A A . 8 ALA HB1 1 1 10 3580 1 1 8 ALA HB2 H 4.367 -3.243 -7.416 1.00 . A A . 8 ALA HB2 1 1 10 3581 1 1 8 ALA HB3 H 2.661 -3.417 -6.957 1.00 . A A . 8 ALA HB3 1 1 10 3582 1 1 8 ALA N N 3.003 -2.075 -4.537 1.00 . A A . 8 ALA N 1 1 10 3583 1 1 8 ALA O O 6.041 -2.844 -4.211 1.00 . A A . 8 ALA O 1 1 10 3584 1 1 9 THR C C 6.377 0.484 -3.897 1.00 . A A . 9 THR C 1 1 10 3585 1 1 9 THR CA C 6.840 -0.369 -5.083 1.00 . A A . 9 THR CA 1 1 10 3586 1 1 9 THR CB C 7.493 0.491 -6.171 1.00 . A A . 9 THR CB 1 1 10 3587 1 1 9 THR CG2 C 8.009 -0.364 -7.330 1.00 . A A . 9 THR CG2 1 1 10 3588 1 1 9 THR H H 5.102 -0.652 -6.298 1.00 . A A . 9 THR H 1 1 10 3589 1 1 9 THR HA H 7.608 -1.058 -4.723 1.00 . A A . 9 THR HA 1 1 10 3590 1 1 9 THR HB H 8.337 1.029 -5.735 1.00 . A A . 9 THR HB 1 1 10 3591 1 1 9 THR HG1 H 5.883 0.958 -7.161 1.00 . A A . 9 THR HG1 1 1 10 3592 1 1 9 THR HG21 H 7.183 -0.882 -7.822 1.00 . A A . 9 THR HG21 1 1 10 3593 1 1 9 THR HG22 H 8.507 0.276 -8.058 1.00 . A A . 9 THR HG22 1 1 10 3594 1 1 9 THR HG23 H 8.723 -1.100 -6.958 1.00 . A A . 9 THR HG23 1 1 10 3595 1 1 9 THR N N 5.702 -1.117 -5.609 1.00 . A A . 9 THR N 1 1 10 3596 1 1 9 THR O O 5.194 0.806 -3.773 1.00 . A A . 9 THR O 1 1 10 3597 1 1 9 THR OG1 O 6.573 1.433 -6.668 1.00 . A A . 9 THR OG1 1 1 10 3598 1 1 10 ASP C C 6.565 3.187 -2.812 1.00 . A A . 10 ASP C 1 1 10 3599 1 1 10 ASP CA C 7.127 1.963 -2.085 1.00 . A A . 10 ASP CA 1 1 10 3600 1 1 10 ASP CB C 8.469 2.276 -1.402 1.00 . A A . 10 ASP CB 1 1 10 3601 1 1 10 ASP CG C 9.555 2.736 -2.372 1.00 . A A . 10 ASP CG 1 1 10 3602 1 1 10 ASP H H 8.294 0.760 -3.310 1.00 . A A . 10 ASP H 1 1 10 3603 1 1 10 ASP HA H 6.413 1.640 -1.327 1.00 . A A . 10 ASP HA 1 1 10 3604 1 1 10 ASP HB3 H 8.828 1.389 -0.881 1.00 . A A . 10 ASP HB3 1 1 10 3605 1 1 10 ASP N N 7.320 0.892 -3.050 1.00 . A A . 10 ASP N 1 1 10 3606 1 1 10 ASP O O 5.580 3.782 -2.375 1.00 . A A . 10 ASP O 1 1 10 3607 1 1 10 ASP OD1 O 9.518 2.255 -3.530 1.00 . A A . 10 ASP OD1 1 1 10 3608 1 1 10 ASP OD2 O 10.381 3.569 -1.950 1.00 . A A . 10 ASP OD2 1 1 10 3609 1 1 11 ALA C C 5.199 4.422 -5.122 1.00 . A A . 11 ALA C 1 1 10 3610 1 1 11 ALA CA C 6.697 4.570 -4.842 1.00 . A A . 11 ALA CA 1 1 10 3611 1 1 11 ALA CB C 7.533 4.627 -6.122 1.00 . A A . 11 ALA CB 1 1 10 3612 1 1 11 ALA H H 8.035 3.025 -4.171 1.00 . A A . 11 ALA H 1 1 10 3613 1 1 11 ALA HA H 6.853 5.519 -4.329 1.00 . A A . 11 ALA HA 1 1 10 3614 1 1 11 ALA HB1 H 7.214 5.478 -6.725 1.00 . A A . 11 ALA HB1 1 1 10 3615 1 1 11 ALA HB2 H 8.586 4.751 -5.867 1.00 . A A . 11 ALA HB2 1 1 10 3616 1 1 11 ALA HB3 H 7.418 3.720 -6.710 1.00 . A A . 11 ALA HB3 1 1 10 3617 1 1 11 ALA N N 7.167 3.519 -3.959 1.00 . A A . 11 ALA N 1 1 10 3618 1 1 11 ALA O O 4.472 5.394 -4.963 1.00 . A A . 11 ALA O 1 1 10 3619 1 1 12 ASP C C 2.394 3.416 -4.613 1.00 . A A . 12 ASP C 1 1 10 3620 1 1 12 ASP CA C 3.290 3.027 -5.786 1.00 . A A . 12 ASP CA 1 1 10 3621 1 1 12 ASP CB C 2.987 1.584 -6.206 1.00 . A A . 12 ASP CB 1 1 10 3622 1 1 12 ASP CG C 3.581 1.265 -7.560 1.00 . A A . 12 ASP CG 1 1 10 3623 1 1 12 ASP H H 5.362 2.465 -5.639 1.00 . A A . 12 ASP H 1 1 10 3624 1 1 12 ASP HA H 3.030 3.677 -6.619 1.00 . A A . 12 ASP HA 1 1 10 3625 1 1 12 ASP HB3 H 1.906 1.461 -6.291 1.00 . A A . 12 ASP HB3 1 1 10 3626 1 1 12 ASP N N 4.712 3.235 -5.499 1.00 . A A . 12 ASP N 1 1 10 3627 1 1 12 ASP O O 1.344 4.032 -4.801 1.00 . A A . 12 ASP O 1 1 10 3628 1 1 12 ASP OD1 O 3.228 1.990 -8.517 1.00 . A A . 12 ASP OD1 1 1 10 3629 1 1 12 ASP OD2 O 4.406 0.325 -7.595 1.00 . A A . 12 ASP OD2 1 1 10 3630 1 1 13 CYS C C 2.133 5.018 -2.103 1.00 . A A . 13 CYS C 1 1 10 3631 1 1 13 CYS CA C 2.050 3.497 -2.218 1.00 . A A . 13 CYS CA 1 1 10 3632 1 1 13 CYS CB C 2.583 2.798 -0.975 1.00 . A A . 13 CYS CB 1 1 10 3633 1 1 13 CYS H H 3.670 2.562 -3.292 1.00 . A A . 13 CYS H 1 1 10 3634 1 1 13 CYS HA H 1.002 3.218 -2.340 1.00 . A A . 13 CYS HA 1 1 10 3635 1 1 13 CYS HB3 H 3.657 2.951 -0.884 1.00 . A A . 13 CYS HB3 1 1 10 3636 1 1 13 CYS N N 2.788 3.051 -3.393 1.00 . A A . 13 CYS N 1 1 10 3637 1 1 13 CYS O O 1.105 5.697 -2.062 1.00 . A A . 13 CYS O 1 1 10 3638 1 1 13 CYS SG S 1.836 3.325 0.579 1.00 . A A . 13 CYS SG 1 1 10 3639 1 1 14 SER C C 3.355 7.619 -3.538 1.00 . A A . 14 SER C 1 1 10 3640 1 1 14 SER CA C 3.683 6.973 -2.179 1.00 . A A . 14 SER CA 1 1 10 3641 1 1 14 SER CB C 5.175 7.098 -1.836 1.00 . A A . 14 SER CB 1 1 10 3642 1 1 14 SER H H 4.128 4.898 -2.265 1.00 . A A . 14 SER H 1 1 10 3643 1 1 14 SER HA H 3.104 7.485 -1.410 1.00 . A A . 14 SER HA 1 1 10 3644 1 1 14 SER HB3 H 5.761 6.573 -2.590 1.00 . A A . 14 SER HB3 1 1 10 3645 1 1 14 SER HG H 5.380 8.821 -2.688 1.00 . A A . 14 SER HG 1 1 10 3646 1 1 14 SER N N 3.355 5.549 -2.158 1.00 . A A . 14 SER N 1 1 10 3647 1 1 14 SER O O 4.177 8.338 -4.106 1.00 . A A . 14 SER O 1 1 10 3648 1 1 14 SER OG O 5.584 8.449 -1.817 1.00 . A A . 14 SER OG 1 1 10 3649 1 1 15 ARG C C 0.165 7.554 -5.356 1.00 . A A . 15 ARG C 1 1 10 3650 1 1 15 ARG CA C 1.680 7.726 -5.384 1.00 . A A . 15 ARG CA 1 1 10 3651 1 1 15 ARG CB C 2.359 6.824 -6.430 1.00 . A A . 15 ARG CB 1 1 10 3652 1 1 15 ARG CD C 2.321 5.605 -8.602 1.00 . A A . 15 ARG CD 1 1 10 3653 1 1 15 ARG CG C 1.818 6.860 -7.866 1.00 . A A . 15 ARG CG 1 1 10 3654 1 1 15 ARG CZ C 2.405 4.726 -10.944 1.00 . A A . 15 ARG CZ 1 1 10 3655 1 1 15 ARG H H 1.521 6.841 -3.457 1.00 . A A . 15 ARG H 1 1 10 3656 1 1 15 ARG HA H 1.918 8.771 -5.595 1.00 . A A . 15 ARG HA 1 1 10 3657 1 1 15 ARG HB3 H 2.263 5.802 -6.084 1.00 . A A . 15 ARG HB3 1 1 10 3658 1 1 15 ARG HD3 H 1.800 4.731 -8.204 1.00 . A A . 15 ARG HD3 1 1 10 3659 1 1 15 ARG HE H 1.686 6.547 -10.382 1.00 . A A . 15 ARG HE 1 1 10 3660 1 1 15 ARG HG3 H 2.178 7.769 -8.351 1.00 . A A . 15 ARG HG3 1 1 10 3661 1 1 15 ARG HH11 H 2.976 3.240 -9.583 1.00 . A A . 15 ARG HH11 1 1 10 3662 1 1 15 ARG HH12 H 3.161 2.831 -11.227 1.00 . A A . 15 ARG HH12 1 1 10 3663 1 1 15 ARG HH21 H 1.877 5.861 -12.562 1.00 . A A . 15 ARG HH21 1 1 10 3664 1 1 15 ARG HH22 H 2.470 4.275 -12.939 1.00 . A A . 15 ARG HH22 1 1 10 3665 1 1 15 ARG N N 2.150 7.369 -4.050 1.00 . A A . 15 ARG N 1 1 10 3666 1 1 15 ARG NE N 2.083 5.679 -10.050 1.00 . A A . 15 ARG NE 1 1 10 3667 1 1 15 ARG NH1 N 2.894 3.541 -10.566 1.00 . A A . 15 ARG NH1 1 1 10 3668 1 1 15 ARG NH2 N 2.234 4.971 -12.249 1.00 . A A . 15 ARG NH2 1 1 10 3669 1 1 15 ARG O O -0.572 8.483 -5.670 1.00 . A A . 15 ARG O 1 1 10 3670 1 1 16 LYS C C -2.115 7.122 -3.481 1.00 . A A . 16 LYS C 1 1 10 3671 1 1 16 LYS CA C -1.709 6.170 -4.617 1.00 . A A . 16 LYS CA 1 1 10 3672 1 1 16 LYS CB C -1.955 4.692 -4.258 1.00 . A A . 16 LYS CB 1 1 10 3673 1 1 16 LYS CD C -4.490 4.888 -3.835 1.00 . A A . 16 LYS CD 1 1 10 3674 1 1 16 LYS CE C -5.887 4.327 -4.139 1.00 . A A . 16 LYS CE 1 1 10 3675 1 1 16 LYS CG C -3.363 4.173 -4.599 1.00 . A A . 16 LYS CG 1 1 10 3676 1 1 16 LYS H H 0.351 5.617 -4.741 1.00 . A A . 16 LYS H 1 1 10 3677 1 1 16 LYS HA H -2.285 6.416 -5.512 1.00 . A A . 16 LYS HA 1 1 10 3678 1 1 16 LYS HB3 H -1.736 4.520 -3.204 1.00 . A A . 16 LYS HB3 1 1 10 3679 1 1 16 LYS HD3 H -4.518 5.929 -4.159 1.00 . A A . 16 LYS HD3 1 1 10 3680 1 1 16 LYS HE3 H -6.074 4.390 -5.213 1.00 . A A . 16 LYS HE3 1 1 10 3681 1 1 16 LYS HG3 H -3.363 3.110 -4.361 1.00 . A A . 16 LYS HG3 1 1 10 3682 1 1 16 LYS HZ1 H -7.006 2.628 -3.879 1.00 . A A . 16 LYS HZ1 1 1 10 3683 1 1 16 LYS HZ2 H -5.421 2.323 -4.184 1.00 . A A . 16 LYS HZ2 1 1 10 3684 1 1 16 LYS HZ3 H -5.888 2.858 -2.697 1.00 . A A . 16 LYS HZ3 1 1 10 3685 1 1 16 LYS N N -0.303 6.374 -4.926 1.00 . A A . 16 LYS N 1 1 10 3686 1 1 16 LYS NZ N -6.060 2.930 -3.690 1.00 . A A . 16 LYS NZ 1 1 10 3687 1 1 16 LYS O O -3.144 7.787 -3.574 1.00 . A A . 16 LYS O 1 1 10 3688 1 1 17 CYS C C -0.504 8.869 -0.834 1.00 . A A . 17 CYS C 1 1 10 3689 1 1 17 CYS CA C -1.646 7.908 -1.188 1.00 . A A . 17 CYS CA 1 1 10 3690 1 1 17 CYS CB C -1.909 6.905 -0.068 1.00 . A A . 17 CYS CB 1 1 10 3691 1 1 17 CYS H H -0.465 6.623 -2.388 1.00 . A A . 17 CYS H 1 1 10 3692 1 1 17 CYS HA H -2.569 8.463 -1.332 1.00 . A A . 17 CYS HA 1 1 10 3693 1 1 17 CYS HB3 H -1.086 6.194 0.001 1.00 . A A . 17 CYS HB3 1 1 10 3694 1 1 17 CYS N N -1.327 7.163 -2.402 1.00 . A A . 17 CYS N 1 1 10 3695 1 1 17 CYS O O 0.655 8.463 -0.887 1.00 . A A . 17 CYS O 1 1 10 3696 1 1 17 CYS SG S -2.157 7.612 1.577 1.00 . A A . 17 CYS SG 1 1 10 3697 1 1 18 PRO C C 0.759 10.886 1.236 1.00 . A A . 18 PRO C 1 1 10 3698 1 1 18 PRO CA C 0.219 11.128 -0.178 1.00 . A A . 18 PRO CA 1 1 10 3699 1 1 18 PRO CB C -0.491 12.481 -0.299 1.00 . A A . 18 PRO CB 1 1 10 3700 1 1 18 PRO CD C -2.122 10.747 -0.470 1.00 . A A . 18 PRO CD 1 1 10 3701 1 1 18 PRO CG C -1.923 12.145 0.112 1.00 . A A . 18 PRO CG 1 1 10 3702 1 1 18 PRO HA H 1.048 11.085 -0.887 1.00 . A A . 18 PRO HA 1 1 10 3703 1 1 18 PRO HB3 H -0.486 12.797 -1.343 1.00 . A A . 18 PRO HB3 1 1 10 3704 1 1 18 PRO HD3 H -2.514 10.830 -1.487 1.00 . A A . 18 PRO HD3 1 1 10 3705 1 1 18 PRO HG3 H -2.647 12.864 -0.273 1.00 . A A . 18 PRO HG3 1 1 10 3706 1 1 18 PRO N N -0.797 10.143 -0.515 1.00 . A A . 18 PRO N 1 1 10 3707 1 1 18 PRO O O 0.343 9.954 1.920 1.00 . A A . 18 PRO O 1 1 10 3708 1 1 19 GLY C C 3.254 10.305 2.909 1.00 . A A . 19 GLY C 1 1 10 3709 1 1 19 GLY CA C 2.375 11.553 2.951 1.00 . A A . 19 GLY CA 1 1 10 3710 1 1 19 GLY H H 1.992 12.490 1.079 1.00 . A A . 19 GLY H 1 1 10 3711 1 1 19 GLY HA2 H 3.004 12.423 3.146 1.00 . A A . 19 GLY HA2 1 1 10 3712 1 1 19 GLY HA3 H 1.644 11.462 3.757 1.00 . A A . 19 GLY HA3 1 1 10 3713 1 1 19 GLY N N 1.693 11.733 1.676 1.00 . A A . 19 GLY N 1 1 10 3714 1 1 19 GLY O O 3.325 9.560 3.880 1.00 . A A . 19 GLY O 1 1 10 3715 1 1 20 ASN C C 4.771 7.810 2.306 1.00 . A A . 20 ASN C 1 1 10 3716 1 1 20 ASN CA C 4.769 9.004 1.342 1.00 . A A . 20 ASN CA 1 1 10 3717 1 1 20 ASN CB C 6.195 9.527 1.088 1.00 . A A . 20 ASN CB 1 1 10 3718 1 1 20 ASN CG C 6.266 10.647 0.045 1.00 . A A . 20 ASN CG 1 1 10 3719 1 1 20 ASN H H 3.819 10.837 1.055 1.00 . A A . 20 ASN H 1 1 10 3720 1 1 20 ASN HA H 4.383 8.649 0.389 1.00 . A A . 20 ASN HA 1 1 10 3721 1 1 20 ASN HB3 H 6.809 8.694 0.743 1.00 . A A . 20 ASN HB3 1 1 10 3722 1 1 20 ASN HD21 H 8.217 10.239 -0.360 1.00 . A A . 20 ASN HD21 1 1 10 3723 1 1 20 ASN HD22 H 7.501 11.570 -1.254 1.00 . A A . 20 ASN HD22 1 1 10 3724 1 1 20 ASN N N 3.910 10.111 1.757 1.00 . A A . 20 ASN N 1 1 10 3725 1 1 20 ASN ND2 N 7.435 10.847 -0.556 1.00 . A A . 20 ASN ND2 1 1 10 3726 1 1 20 ASN O O 5.769 7.591 2.995 1.00 . A A . 20 ASN O 1 1 10 3727 1 1 20 ASN OD1 O 5.291 11.354 -0.204 1.00 . A A . 20 ASN OD1 1 1 10 3728 1 1 21 PRO C C 4.409 4.775 2.991 1.00 . A A . 21 PRO C 1 1 10 3729 1 1 21 PRO CA C 3.559 5.990 3.384 1.00 . A A . 21 PRO CA 1 1 10 3730 1 1 21 PRO CB C 2.066 5.639 3.460 1.00 . A A . 21 PRO CB 1 1 10 3731 1 1 21 PRO CD C 2.449 7.149 1.621 1.00 . A A . 21 PRO CD 1 1 10 3732 1 1 21 PRO CG C 1.360 6.670 2.575 1.00 . A A . 21 PRO CG 1 1 10 3733 1 1 21 PRO HA H 3.875 6.410 4.340 1.00 . A A . 21 PRO HA 1 1 10 3734 1 1 21 PRO HB3 H 1.704 5.704 4.485 1.00 . A A . 21 PRO HB3 1 1 10 3735 1 1 21 PRO HD3 H 2.226 8.158 1.280 1.00 . A A . 21 PRO HD3 1 1 10 3736 1 1 21 PRO HG3 H 1.034 7.511 3.190 1.00 . A A . 21 PRO HG3 1 1 10 3737 1 1 21 PRO N N 3.681 7.031 2.381 1.00 . A A . 21 PRO N 1 1 10 3738 1 1 21 PRO O O 4.611 4.530 1.800 1.00 . A A . 21 PRO O 1 1 10 3739 1 1 22 PRO C C 4.622 1.657 3.283 1.00 . A A . 22 PRO C 1 1 10 3740 1 1 22 PRO CA C 5.610 2.754 3.707 1.00 . A A . 22 PRO CA 1 1 10 3741 1 1 22 PRO CB C 6.308 2.426 5.031 1.00 . A A . 22 PRO CB 1 1 10 3742 1 1 22 PRO CD C 4.789 4.240 5.397 1.00 . A A . 22 PRO CD 1 1 10 3743 1 1 22 PRO CG C 5.345 2.988 6.076 1.00 . A A . 22 PRO CG 1 1 10 3744 1 1 22 PRO HA H 6.353 2.887 2.919 1.00 . A A . 22 PRO HA 1 1 10 3745 1 1 22 PRO HB3 H 7.248 2.979 5.082 1.00 . A A . 22 PRO HB3 1 1 10 3746 1 1 22 PRO HD3 H 5.407 5.101 5.659 1.00 . A A . 22 PRO HD3 1 1 10 3747 1 1 22 PRO HG3 H 5.845 3.218 7.019 1.00 . A A . 22 PRO HG3 1 1 10 3748 1 1 22 PRO N N 4.900 3.996 3.967 1.00 . A A . 22 PRO N 1 1 10 3749 1 1 22 PRO O O 3.417 1.894 3.178 1.00 . A A . 22 PRO O 1 1 10 3750 1 1 23 CYS C C 4.572 -1.848 3.704 1.00 . A A . 23 CYS C 1 1 10 3751 1 1 23 CYS CA C 4.308 -0.718 2.724 1.00 . A A . 23 CYS CA 1 1 10 3752 1 1 23 CYS CB C 4.574 -1.194 1.292 1.00 . A A . 23 CYS CB 1 1 10 3753 1 1 23 CYS H H 6.110 0.267 3.224 1.00 . A A . 23 CYS H 1 1 10 3754 1 1 23 CYS HA H 3.255 -0.451 2.793 1.00 . A A . 23 CYS HA 1 1 10 3755 1 1 23 CYS HB3 H 3.895 -2.020 1.086 1.00 . A A . 23 CYS HB3 1 1 10 3756 1 1 23 CYS N N 5.128 0.438 3.066 1.00 . A A . 23 CYS N 1 1 10 3757 1 1 23 CYS O O 5.655 -1.936 4.278 1.00 . A A . 23 CYS O 1 1 10 3758 1 1 23 CYS SG S 4.276 0.056 0.030 1.00 . A A . 23 CYS SG 1 1 10 3759 1 1 24 ARG C C 3.094 -5.075 3.846 1.00 . A A . 24 ARG C 1 1 10 3760 1 1 24 ARG CA C 3.668 -3.933 4.681 1.00 . A A . 24 ARG CA 1 1 10 3761 1 1 24 ARG CB C 2.882 -3.726 5.983 1.00 . A A . 24 ARG CB 1 1 10 3762 1 1 24 ARG CD C 2.227 -4.679 8.218 1.00 . A A . 24 ARG CD 1 1 10 3763 1 1 24 ARG CG C 2.983 -4.944 6.910 1.00 . A A . 24 ARG CG 1 1 10 3764 1 1 24 ARG CZ C 1.718 -5.914 10.326 1.00 . A A . 24 ARG CZ 1 1 10 3765 1 1 24 ARG H H 2.717 -2.574 3.363 1.00 . A A . 24 ARG H 1 1 10 3766 1 1 24 ARG HA H 4.708 -4.150 4.930 1.00 . A A . 24 ARG HA 1 1 10 3767 1 1 24 ARG HB3 H 1.834 -3.534 5.745 1.00 . A A . 24 ARG HB3 1 1 10 3768 1 1 24 ARG HD3 H 1.183 -4.465 7.975 1.00 . A A . 24 ARG HD3 1 1 10 3769 1 1 24 ARG HE H 2.828 -6.634 8.780 1.00 . A A . 24 ARG HE 1 1 10 3770 1 1 24 ARG HG3 H 4.033 -5.140 7.130 1.00 . A A . 24 ARG HG3 1 1 10 3771 1 1 24 ARG HH11 H 0.937 -4.040 10.223 1.00 . A A . 24 ARG HH11 1 1 10 3772 1 1 24 ARG HH12 H 0.567 -4.887 11.693 1.00 . A A . 24 ARG HH12 1 1 10 3773 1 1 24 ARG HH21 H 2.365 -7.812 10.722 1.00 . A A . 24 ARG HH21 1 1 10 3774 1 1 24 ARG HH22 H 1.412 -7.096 11.975 1.00 . A A . 24 ARG HH22 1 1 10 3775 1 1 24 ARG N N 3.582 -2.728 3.875 1.00 . A A . 24 ARG N 1 1 10 3776 1 1 24 ARG NE N 2.298 -5.842 9.118 1.00 . A A . 24 ARG NE 1 1 10 3777 1 1 24 ARG NH1 N 1.018 -4.872 10.790 1.00 . A A . 24 ARG NH1 1 1 10 3778 1 1 24 ARG NH2 N 1.839 -7.022 11.064 1.00 . A A . 24 ARG NH2 1 1 10 3779 1 1 24 ARG O O 1.947 -4.994 3.413 1.00 . A A . 24 ARG O 1 1 10 3780 1 1 25 ASN C C 2.794 -6.954 1.530 1.00 . A A . 25 ASN C 1 1 10 3781 1 1 25 ASN CA C 3.479 -7.315 2.858 1.00 . A A . 25 ASN CA 1 1 10 3782 1 1 25 ASN CB C 2.604 -8.202 3.763 1.00 . A A . 25 ASN CB 1 1 10 3783 1 1 25 ASN CG C 2.608 -9.673 3.346 1.00 . A A . 25 ASN CG 1 1 10 3784 1 1 25 ASN H H 4.831 -6.103 3.964 1.00 . A A . 25 ASN H 1 1 10 3785 1 1 25 ASN HA H 4.388 -7.869 2.622 1.00 . A A . 25 ASN HA 1 1 10 3786 1 1 25 ASN HB3 H 1.581 -7.827 3.788 1.00 . A A . 25 ASN HB3 1 1 10 3787 1 1 25 ASN HD21 H 1.596 -9.285 1.631 1.00 . A A . 25 ASN HD21 1 1 10 3788 1 1 25 ASN HD22 H 1.990 -10.980 1.933 1.00 . A A . 25 ASN HD22 1 1 10 3789 1 1 25 ASN N N 3.889 -6.119 3.595 1.00 . A A . 25 ASN N 1 1 10 3790 1 1 25 ASN ND2 N 2.001 -10.012 2.215 1.00 . A A . 25 ASN ND2 1 1 10 3791 1 1 25 ASN O O 1.796 -7.551 1.137 1.00 . A A . 25 ASN O 1 1 10 3792 1 1 25 ASN OD1 O 3.155 -10.512 4.052 1.00 . A A . 25 ASN OD1 1 1 10 3793 1 1 26 GLY C C 1.366 -4.889 -0.279 1.00 . A A . 26 GLY C 1 1 10 3794 1 1 26 GLY CA C 2.769 -5.486 -0.428 1.00 . A A . 26 GLY CA 1 1 10 3795 1 1 26 GLY H H 4.153 -5.492 1.189 1.00 . A A . 26 GLY H 1 1 10 3796 1 1 26 GLY HA2 H 3.426 -4.717 -0.836 1.00 . A A . 26 GLY HA2 1 1 10 3797 1 1 26 GLY HA3 H 2.735 -6.316 -1.135 1.00 . A A . 26 GLY HA3 1 1 10 3798 1 1 26 GLY N N 3.330 -5.950 0.830 1.00 . A A . 26 GLY N 1 1 10 3799 1 1 26 GLY O O 0.581 -4.939 -1.231 1.00 . A A . 26 GLY O 1 1 10 3800 1 1 27 PHE C C 0.415 -2.032 1.527 1.00 . A A . 27 PHE C 1 1 10 3801 1 1 27 PHE CA C -0.080 -3.398 1.071 1.00 . A A . 27 PHE CA 1 1 10 3802 1 1 27 PHE CB C -1.054 -4.020 2.074 1.00 . A A . 27 PHE CB 1 1 10 3803 1 1 27 PHE CD1 C -2.756 -5.262 0.675 1.00 . A A . 27 PHE CD1 1 1 10 3804 1 1 27 PHE CD2 C -1.081 -6.545 1.885 1.00 . A A . 27 PHE CD2 1 1 10 3805 1 1 27 PHE CE1 C -3.260 -6.447 0.112 1.00 . A A . 27 PHE CE1 1 1 10 3806 1 1 27 PHE CE2 C -1.576 -7.731 1.312 1.00 . A A . 27 PHE CE2 1 1 10 3807 1 1 27 PHE CG C -1.670 -5.309 1.567 1.00 . A A . 27 PHE CG 1 1 10 3808 1 1 27 PHE CZ C -2.669 -7.683 0.429 1.00 . A A . 27 PHE CZ 1 1 10 3809 1 1 27 PHE H H 1.712 -4.337 1.650 1.00 . A A . 27 PHE H 1 1 10 3810 1 1 27 PHE HA H -0.612 -3.260 0.134 1.00 . A A . 27 PHE HA 1 1 10 3811 1 1 27 PHE HB3 H -1.855 -3.303 2.266 1.00 . A A . 27 PHE HB3 1 1 10 3812 1 1 27 PHE HD1 H -3.205 -4.317 0.418 1.00 . A A . 27 PHE HD1 1 1 10 3813 1 1 27 PHE HD2 H -0.221 -6.583 2.538 1.00 . A A . 27 PHE HD2 1 1 10 3814 1 1 27 PHE HE1 H -4.119 -6.405 -0.545 1.00 . A A . 27 PHE HE1 1 1 10 3815 1 1 27 PHE HE2 H -1.112 -8.677 1.550 1.00 . A A . 27 PHE HE2 1 1 10 3816 1 1 27 PHE HZ H -3.066 -8.596 0.009 1.00 . A A . 27 PHE HZ 1 1 10 3817 1 1 27 PHE N N 1.072 -4.266 0.866 1.00 . A A . 27 PHE N 1 1 10 3818 1 1 27 PHE O O 1.386 -1.952 2.278 1.00 . A A . 27 PHE O 1 1 10 3819 1 1 28 CYS C C -0.267 0.908 2.590 1.00 . A A . 28 CYS C 1 1 10 3820 1 1 28 CYS CA C 0.205 0.414 1.228 1.00 . A A . 28 CYS CA 1 1 10 3821 1 1 28 CYS CB C -0.412 1.272 0.122 1.00 . A A . 28 CYS CB 1 1 10 3822 1 1 28 CYS H H -1.063 -1.126 0.491 1.00 . A A . 28 CYS H 1 1 10 3823 1 1 28 CYS HA H 1.292 0.482 1.169 1.00 . A A . 28 CYS HA 1 1 10 3824 1 1 28 CYS HB3 H -1.485 1.088 0.087 1.00 . A A . 28 CYS HB3 1 1 10 3825 1 1 28 CYS N N -0.215 -0.967 1.028 1.00 . A A . 28 CYS N 1 1 10 3826 1 1 28 CYS O O -1.471 0.915 2.847 1.00 . A A . 28 CYS O 1 1 10 3827 1 1 28 CYS SG S -0.206 3.058 0.310 1.00 . A A . 28 CYS SG 1 1 10 3828 1 1 29 ALA C C -0.269 3.181 4.836 1.00 . A A . 29 ALA C 1 1 10 3829 1 1 29 ALA CA C 0.294 1.754 4.821 1.00 . A A . 29 ALA CA 1 1 10 3830 1 1 29 ALA CB C 1.516 1.614 5.734 1.00 . A A . 29 ALA CB 1 1 10 3831 1 1 29 ALA H H 1.625 1.401 3.194 1.00 . A A . 29 ALA H 1 1 10 3832 1 1 29 ALA HA H -0.477 1.087 5.211 1.00 . A A . 29 ALA HA 1 1 10 3833 1 1 29 ALA HB1 H 1.227 1.804 6.767 1.00 . A A . 29 ALA HB1 1 1 10 3834 1 1 29 ALA HB2 H 1.923 0.604 5.657 1.00 . A A . 29 ALA HB2 1 1 10 3835 1 1 29 ALA HB3 H 2.279 2.335 5.442 1.00 . A A . 29 ALA HB3 1 1 10 3836 1 1 29 ALA N N 0.646 1.339 3.467 1.00 . A A . 29 ALA N 1 1 10 3837 1 1 29 ALA O O 0.147 4.010 5.642 1.00 . A A . 29 ALA O 1 1 10 3838 1 1 30 CYS C C -2.705 5.032 5.099 1.00 . A A . 30 CYS C 1 1 10 3839 1 1 30 CYS CA C -1.869 4.773 3.849 1.00 . A A . 30 CYS CA 1 1 10 3840 1 1 30 CYS CB C -2.765 4.793 2.611 1.00 . A A . 30 CYS CB 1 1 10 3841 1 1 30 CYS H H -1.542 2.721 3.347 1.00 . A A . 30 CYS H 1 1 10 3842 1 1 30 CYS HA H -1.112 5.553 3.758 1.00 . A A . 30 CYS HA 1 1 10 3843 1 1 30 CYS HB3 H -3.522 4.016 2.701 1.00 . A A . 30 CYS HB3 1 1 10 3844 1 1 30 CYS N N -1.224 3.469 3.950 1.00 . A A . 30 CYS N 1 1 10 3845 1 1 30 CYS O O -2.535 6.029 5.795 1.00 . A A . 30 CYS O 1 1 10 3846 1 1 30 CYS SG S -3.628 6.356 2.352 1.00 . A A . 30 CYS SG 1 1 10 3847 1 1 31 THR C C -3.661 4.250 7.837 1.00 . A A . 31 THR C 1 1 10 3848 1 1 31 THR CA C -4.489 4.154 6.552 1.00 . A A . 31 THR CA 1 1 10 3849 1 1 31 THR CB C -5.386 2.909 6.499 1.00 . A A . 31 THR CB 1 1 10 3850 1 1 31 THR CG2 C -6.605 3.026 7.418 1.00 . A A . 31 THR CG2 1 1 10 3851 1 1 31 THR H H -3.743 3.311 4.783 1.00 . A A . 31 THR H 1 1 10 3852 1 1 31 THR HA H -5.109 5.049 6.476 1.00 . A A . 31 THR HA 1 1 10 3853 1 1 31 THR HB H -4.810 2.023 6.777 1.00 . A A . 31 THR HB 1 1 10 3854 1 1 31 THR HG1 H -6.397 3.475 4.936 1.00 . A A . 31 THR HG1 1 1 10 3855 1 1 31 THR HG21 H -7.224 2.133 7.311 1.00 . A A . 31 THR HG21 1 1 10 3856 1 1 31 THR HG22 H -6.282 3.104 8.457 1.00 . A A . 31 THR HG22 1 1 10 3857 1 1 31 THR HG23 H -7.198 3.902 7.158 1.00 . A A . 31 THR HG23 1 1 10 3858 1 1 31 THR N N -3.617 4.103 5.395 1.00 . A A . 31 THR N 1 1 10 3859 1 1 31 THR O O -3.406 3.243 8.498 1.00 . A A . 31 THR O 1 1 10 3860 1 1 31 THR OG1 O -5.829 2.737 5.166 1.00 . A A . 31 THR OG1 1 1 11 3861 1 1 1 THR C C -9.358 -6.708 4.001 1.00 . A A . 1 THR C 1 1 11 3862 1 1 1 THR CA C -8.678 -7.620 5.037 1.00 . A A . 1 THR CA 1 1 11 3863 1 1 1 THR CB C -7.197 -7.881 4.712 1.00 . A A . 1 THR CB 1 1 11 3864 1 1 1 THR CG2 C -6.328 -6.632 4.884 1.00 . A A . 1 THR CG2 1 1 11 3865 1 1 1 THR H1 H -9.909 -9.195 4.292 1.00 . A A . 1 THR H1 1 1 11 3866 1 1 1 THR HA H -8.722 -7.152 6.020 1.00 . A A . 1 THR HA 1 1 11 3867 1 1 1 THR HB H -7.105 -8.252 3.689 1.00 . A A . 1 THR HB 1 1 11 3868 1 1 1 THR HG1 H -7.347 -9.571 5.651 1.00 . A A . 1 THR HG1 1 1 11 3869 1 1 1 THR HG21 H -6.343 -6.324 5.928 1.00 . A A . 1 THR HG21 1 1 11 3870 1 1 1 THR HG22 H -5.300 -6.865 4.601 1.00 . A A . 1 THR HG22 1 1 11 3871 1 1 1 THR HG23 H -6.687 -5.812 4.261 1.00 . A A . 1 THR HG23 1 1 11 3872 1 1 1 THR N N -9.381 -8.894 5.099 1.00 . A A . 1 THR N 1 1 11 3873 1 1 1 THR O O -8.822 -6.518 2.907 1.00 . A A . 1 THR O 1 1 11 3874 1 1 1 THR OG1 O -6.694 -8.868 5.590 1.00 . A A . 1 THR OG1 1 1 11 3875 1 1 2 PRO C C -10.765 -3.932 3.194 1.00 . A A . 2 PRO C 1 1 11 3876 1 1 2 PRO CA C -11.328 -5.354 3.364 1.00 . A A . 2 PRO CA 1 1 11 3877 1 1 2 PRO CB C -12.751 -5.378 3.936 1.00 . A A . 2 PRO CB 1 1 11 3878 1 1 2 PRO CD C -11.272 -6.327 5.552 1.00 . A A . 2 PRO CD 1 1 11 3879 1 1 2 PRO CG C -12.509 -5.435 5.443 1.00 . A A . 2 PRO CG 1 1 11 3880 1 1 2 PRO HA H -11.339 -5.833 2.384 1.00 . A A . 2 PRO HA 1 1 11 3881 1 1 2 PRO HB3 H -13.244 -6.301 3.623 1.00 . A A . 2 PRO HB3 1 1 11 3882 1 1 2 PRO HD3 H -11.586 -7.370 5.634 1.00 . A A . 2 PRO HD3 1 1 11 3883 1 1 2 PRO HG3 H -13.364 -5.844 5.985 1.00 . A A . 2 PRO HG3 1 1 11 3884 1 1 2 PRO N N -10.537 -6.139 4.309 1.00 . A A . 2 PRO N 1 1 11 3885 1 1 2 PRO O O -11.485 -2.943 3.294 1.00 . A A . 2 PRO O 1 1 11 3886 1 1 3 PHE C C -7.332 -2.955 2.097 1.00 . A A . 3 PHE C 1 1 11 3887 1 1 3 PHE CA C -8.709 -2.614 2.687 1.00 . A A . 3 PHE CA 1 1 11 3888 1 1 3 PHE CB C -8.593 -1.812 3.993 1.00 . A A . 3 PHE CB 1 1 11 3889 1 1 3 PHE CD1 C -6.739 -2.797 5.421 1.00 . A A . 3 PHE CD1 1 1 11 3890 1 1 3 PHE CD2 C -9.051 -3.191 6.072 1.00 . A A . 3 PHE CD2 1 1 11 3891 1 1 3 PHE CE1 C -6.301 -3.532 6.534 1.00 . A A . 3 PHE CE1 1 1 11 3892 1 1 3 PHE CE2 C -8.613 -3.936 7.180 1.00 . A A . 3 PHE CE2 1 1 11 3893 1 1 3 PHE CG C -8.116 -2.619 5.188 1.00 . A A . 3 PHE CG 1 1 11 3894 1 1 3 PHE CZ C -7.238 -4.104 7.415 1.00 . A A . 3 PHE CZ 1 1 11 3895 1 1 3 PHE H H -8.940 -4.703 2.929 1.00 . A A . 3 PHE H 1 1 11 3896 1 1 3 PHE HA H -9.242 -2.006 1.953 1.00 . A A . 3 PHE HA 1 1 11 3897 1 1 3 PHE HB3 H -9.575 -1.395 4.226 1.00 . A A . 3 PHE HB3 1 1 11 3898 1 1 3 PHE HD1 H -6.011 -2.345 4.760 1.00 . A A . 3 PHE HD1 1 1 11 3899 1 1 3 PHE HD2 H -10.109 -3.037 5.917 1.00 . A A . 3 PHE HD2 1 1 11 3900 1 1 3 PHE HE1 H -5.244 -3.655 6.718 1.00 . A A . 3 PHE HE1 1 1 11 3901 1 1 3 PHE HE2 H -9.333 -4.346 7.874 1.00 . A A . 3 PHE HE2 1 1 11 3902 1 1 3 PHE HZ H -6.902 -4.662 8.278 1.00 . A A . 3 PHE HZ 1 1 11 3903 1 1 3 PHE N N -9.462 -3.840 2.926 1.00 . A A . 3 PHE N 1 1 11 3904 1 1 3 PHE O O -6.404 -2.149 2.150 1.00 . A A . 3 PHE O 1 1 11 3905 1 1 4 ALA C C -5.630 -3.970 -0.360 1.00 . A A . 4 ALA C 1 1 11 3906 1 1 4 ALA CA C -5.923 -4.640 0.983 1.00 . A A . 4 ALA CA 1 1 11 3907 1 1 4 ALA CB C -6.005 -6.167 0.863 1.00 . A A . 4 ALA CB 1 1 11 3908 1 1 4 ALA H H -7.974 -4.779 1.467 1.00 . A A . 4 ALA H 1 1 11 3909 1 1 4 ALA HA H -5.113 -4.405 1.676 1.00 . A A . 4 ALA HA 1 1 11 3910 1 1 4 ALA HB1 H -6.132 -6.605 1.853 1.00 . A A . 4 ALA HB1 1 1 11 3911 1 1 4 ALA HB2 H -6.847 -6.455 0.237 1.00 . A A . 4 ALA HB2 1 1 11 3912 1 1 4 ALA HB3 H -5.086 -6.556 0.427 1.00 . A A . 4 ALA HB3 1 1 11 3913 1 1 4 ALA N N -7.183 -4.154 1.521 1.00 . A A . 4 ALA N 1 1 11 3914 1 1 4 ALA O O -5.720 -4.619 -1.407 1.00 . A A . 4 ALA O 1 1 11 3915 1 1 5 ILE C C -3.412 -2.258 -1.809 1.00 . A A . 5 ILE C 1 1 11 3916 1 1 5 ILE CA C -4.863 -1.889 -1.483 1.00 . A A . 5 ILE CA 1 1 11 3917 1 1 5 ILE CB C -5.014 -0.385 -1.169 1.00 . A A . 5 ILE CB 1 1 11 3918 1 1 5 ILE CD1 C -6.701 1.389 -0.410 1.00 . A A . 5 ILE CD1 1 1 11 3919 1 1 5 ILE CG1 C -6.493 -0.046 -0.898 1.00 . A A . 5 ILE CG1 1 1 11 3920 1 1 5 ILE CG2 C -4.472 0.470 -2.326 1.00 . A A . 5 ILE CG2 1 1 11 3921 1 1 5 ILE H H -5.310 -2.222 0.578 1.00 . A A . 5 ILE H 1 1 11 3922 1 1 5 ILE HA H -5.503 -2.127 -2.333 1.00 . A A . 5 ILE HA 1 1 11 3923 1 1 5 ILE HB H -4.434 -0.156 -0.273 1.00 . A A . 5 ILE HB 1 1 11 3924 1 1 5 ILE HD11 H -7.740 1.513 -0.095 1.00 . A A . 5 ILE HD11 1 1 11 3925 1 1 5 ILE HD12 H -6.051 1.592 0.442 1.00 . A A . 5 ILE HD12 1 1 11 3926 1 1 5 ILE HD13 H -6.497 2.104 -1.204 1.00 . A A . 5 ILE HD13 1 1 11 3927 1 1 5 ILE HG13 H -6.884 -0.703 -0.119 1.00 . A A . 5 ILE HG13 1 1 11 3928 1 1 5 ILE HG21 H -5.048 0.279 -3.233 1.00 . A A . 5 ILE HG21 1 1 11 3929 1 1 5 ILE HG22 H -4.537 1.528 -2.080 1.00 . A A . 5 ILE HG22 1 1 11 3930 1 1 5 ILE HG23 H -3.422 0.247 -2.518 1.00 . A A . 5 ILE HG23 1 1 11 3931 1 1 5 ILE N N -5.282 -2.680 -0.329 1.00 . A A . 5 ILE N 1 1 11 3932 1 1 5 ILE O O -2.526 -2.024 -0.990 1.00 . A A . 5 ILE O 1 1 11 3933 1 1 6 LYS C C -0.768 -2.461 -3.436 1.00 . A A . 6 LYS C 1 1 11 3934 1 1 6 LYS CA C -1.900 -3.487 -3.328 1.00 . A A . 6 LYS CA 1 1 11 3935 1 1 6 LYS CB C -2.031 -4.299 -4.630 1.00 . A A . 6 LYS CB 1 1 11 3936 1 1 6 LYS CD C -4.026 -5.614 -3.765 1.00 . A A . 6 LYS CD 1 1 11 3937 1 1 6 LYS CE C -4.740 -6.961 -3.629 1.00 . A A . 6 LYS CE 1 1 11 3938 1 1 6 LYS CG C -2.657 -5.693 -4.444 1.00 . A A . 6 LYS CG 1 1 11 3939 1 1 6 LYS H H -3.933 -2.948 -3.634 1.00 . A A . 6 LYS H 1 1 11 3940 1 1 6 LYS HA H -1.642 -4.180 -2.526 1.00 . A A . 6 LYS HA 1 1 11 3941 1 1 6 LYS HB3 H -1.034 -4.456 -5.044 1.00 . A A . 6 LYS HB3 1 1 11 3942 1 1 6 LYS HD3 H -4.658 -4.918 -4.320 1.00 . A A . 6 LYS HD3 1 1 11 3943 1 1 6 LYS HE3 H -4.122 -7.628 -3.025 1.00 . A A . 6 LYS HE3 1 1 11 3944 1 1 6 LYS HG3 H -1.983 -6.306 -3.841 1.00 . A A . 6 LYS HG3 1 1 11 3945 1 1 6 LYS HZ1 H -5.943 -6.146 -2.174 1.00 . A A . 6 LYS HZ1 1 1 11 3946 1 1 6 LYS HZ2 H -6.709 -6.359 -3.602 1.00 . A A . 6 LYS HZ2 1 1 11 3947 1 1 6 LYS HZ3 H -6.417 -7.666 -2.645 1.00 . A A . 6 LYS HZ3 1 1 11 3948 1 1 6 LYS N N -3.173 -2.856 -2.982 1.00 . A A . 6 LYS N 1 1 11 3949 1 1 6 LYS NZ N -6.049 -6.782 -2.966 1.00 . A A . 6 LYS NZ 1 1 11 3950 1 1 6 LYS O O -0.987 -1.326 -3.870 1.00 . A A . 6 LYS O 1 1 11 3951 1 1 7 CYS C C 2.860 -2.969 -3.198 1.00 . A A . 7 CYS C 1 1 11 3952 1 1 7 CYS CA C 1.647 -2.063 -3.017 1.00 . A A . 7 CYS CA 1 1 11 3953 1 1 7 CYS CB C 1.702 -1.373 -1.659 1.00 . A A . 7 CYS CB 1 1 11 3954 1 1 7 CYS H H 0.534 -3.814 -2.665 1.00 . A A . 7 CYS H 1 1 11 3955 1 1 7 CYS HA H 1.620 -1.313 -3.807 1.00 . A A . 7 CYS HA 1 1 11 3956 1 1 7 CYS HB3 H 1.724 -2.115 -0.863 1.00 . A A . 7 CYS HB3 1 1 11 3957 1 1 7 CYS N N 0.442 -2.879 -3.056 1.00 . A A . 7 CYS N 1 1 11 3958 1 1 7 CYS O O 2.988 -3.940 -2.452 1.00 . A A . 7 CYS O 1 1 11 3959 1 1 7 CYS SG S 3.082 -0.244 -1.402 1.00 . A A . 7 CYS SG 1 1 11 3960 1 1 8 ALA C C 6.155 -2.550 -4.104 1.00 . A A . 8 ALA C 1 1 11 3961 1 1 8 ALA CA C 4.949 -3.431 -4.423 1.00 . A A . 8 ALA CA 1 1 11 3962 1 1 8 ALA CB C 4.973 -3.894 -5.883 1.00 . A A . 8 ALA CB 1 1 11 3963 1 1 8 ALA H H 3.578 -1.856 -4.764 1.00 . A A . 8 ALA H 1 1 11 3964 1 1 8 ALA HA H 5.001 -4.319 -3.790 1.00 . A A . 8 ALA HA 1 1 11 3965 1 1 8 ALA HB1 H 4.917 -3.037 -6.555 1.00 . A A . 8 ALA HB1 1 1 11 3966 1 1 8 ALA HB2 H 5.896 -4.443 -6.077 1.00 . A A . 8 ALA HB2 1 1 11 3967 1 1 8 ALA HB3 H 4.123 -4.549 -6.073 1.00 . A A . 8 ALA HB3 1 1 11 3968 1 1 8 ALA N N 3.722 -2.680 -4.179 1.00 . A A . 8 ALA N 1 1 11 3969 1 1 8 ALA O O 7.047 -2.944 -3.360 1.00 . A A . 8 ALA O 1 1 11 3970 1 1 9 THR C C 6.702 0.587 -3.332 1.00 . A A . 9 THR C 1 1 11 3971 1 1 9 THR CA C 7.176 -0.323 -4.464 1.00 . A A . 9 THR CA 1 1 11 3972 1 1 9 THR CB C 7.320 0.473 -5.768 1.00 . A A . 9 THR CB 1 1 11 3973 1 1 9 THR CG2 C 7.836 -0.412 -6.907 1.00 . A A . 9 THR CG2 1 1 11 3974 1 1 9 THR H H 5.334 -1.075 -5.197 1.00 . A A . 9 THR H 1 1 11 3975 1 1 9 THR HA H 8.134 -0.769 -4.197 1.00 . A A . 9 THR HA 1 1 11 3976 1 1 9 THR HB H 8.037 1.279 -5.608 1.00 . A A . 9 THR HB 1 1 11 3977 1 1 9 THR HG1 H 5.379 0.358 -6.188 1.00 . A A . 9 THR HG1 1 1 11 3978 1 1 9 THR HG21 H 8.785 -0.866 -6.623 1.00 . A A . 9 THR HG21 1 1 11 3979 1 1 9 THR HG22 H 7.117 -1.196 -7.143 1.00 . A A . 9 THR HG22 1 1 11 3980 1 1 9 THR HG23 H 7.990 0.201 -7.798 1.00 . A A . 9 THR HG23 1 1 11 3981 1 1 9 THR N N 6.168 -1.351 -4.679 1.00 . A A . 9 THR N 1 1 11 3982 1 1 9 THR O O 5.503 0.655 -3.091 1.00 . A A . 9 THR O 1 1 11 3983 1 1 9 THR OG1 O 6.076 1.036 -6.157 1.00 . A A . 9 THR OG1 1 1 11 3984 1 1 10 ASP C C 6.272 3.390 -2.682 1.00 . A A . 10 ASP C 1 1 11 3985 1 1 10 ASP CA C 7.049 2.404 -1.796 1.00 . A A . 10 ASP CA 1 1 11 3986 1 1 10 ASP CB C 8.156 3.066 -0.962 1.00 . A A . 10 ASP CB 1 1 11 3987 1 1 10 ASP CG C 8.896 4.146 -1.727 1.00 . A A . 10 ASP CG 1 1 11 3988 1 1 10 ASP H H 8.557 1.357 -2.881 1.00 . A A . 10 ASP H 1 1 11 3989 1 1 10 ASP HA H 6.351 1.953 -1.088 1.00 . A A . 10 ASP HA 1 1 11 3990 1 1 10 ASP HB3 H 8.864 2.318 -0.605 1.00 . A A . 10 ASP HB3 1 1 11 3991 1 1 10 ASP N N 7.572 1.344 -2.654 1.00 . A A . 10 ASP N 1 1 11 3992 1 1 10 ASP O O 5.139 3.747 -2.369 1.00 . A A . 10 ASP O 1 1 11 3993 1 1 10 ASP OD1 O 9.344 3.815 -2.848 1.00 . A A . 10 ASP OD1 1 1 11 3994 1 1 10 ASP OD2 O 8.931 5.282 -1.203 1.00 . A A . 10 ASP OD2 1 1 11 3995 1 1 11 ALA C C 4.817 4.313 -5.154 1.00 . A A . 11 ALA C 1 1 11 3996 1 1 11 ALA CA C 6.307 4.565 -4.899 1.00 . A A . 11 ALA CA 1 1 11 3997 1 1 11 ALA CB C 7.130 4.384 -6.177 1.00 . A A . 11 ALA CB 1 1 11 3998 1 1 11 ALA H H 7.872 3.564 -3.844 1.00 . A A . 11 ALA H 1 1 11 3999 1 1 11 ALA HA H 6.423 5.606 -4.603 1.00 . A A . 11 ALA HA 1 1 11 4000 1 1 11 ALA HB1 H 7.044 3.365 -6.549 1.00 . A A . 11 ALA HB1 1 1 11 4001 1 1 11 ALA HB2 H 6.765 5.070 -6.943 1.00 . A A . 11 ALA HB2 1 1 11 4002 1 1 11 ALA HB3 H 8.178 4.605 -5.975 1.00 . A A . 11 ALA HB3 1 1 11 4003 1 1 11 ALA N N 6.866 3.747 -3.827 1.00 . A A . 11 ALA N 1 1 11 4004 1 1 11 ALA O O 4.065 5.276 -5.272 1.00 . A A . 11 ALA O 1 1 11 4005 1 1 12 ASP C C 2.155 3.551 -4.318 1.00 . A A . 12 ASP C 1 1 11 4006 1 1 12 ASP CA C 2.955 2.686 -5.290 1.00 . A A . 12 ASP CA 1 1 11 4007 1 1 12 ASP CB C 2.747 1.232 -4.821 1.00 . A A . 12 ASP CB 1 1 11 4008 1 1 12 ASP CG C 2.848 0.175 -5.894 1.00 . A A . 12 ASP CG 1 1 11 4009 1 1 12 ASP H H 5.060 2.300 -5.213 1.00 . A A . 12 ASP H 1 1 11 4010 1 1 12 ASP HA H 2.570 2.820 -6.300 1.00 . A A . 12 ASP HA 1 1 11 4011 1 1 12 ASP HB3 H 1.756 1.125 -4.386 1.00 . A A . 12 ASP HB3 1 1 11 4012 1 1 12 ASP N N 4.375 3.049 -5.233 1.00 . A A . 12 ASP N 1 1 11 4013 1 1 12 ASP O O 1.220 4.264 -4.682 1.00 . A A . 12 ASP O 1 1 11 4014 1 1 12 ASP OD1 O 1.803 -0.002 -6.559 1.00 . A A . 12 ASP OD1 1 1 11 4015 1 1 12 ASP OD2 O 3.896 -0.509 -5.932 1.00 . A A . 12 ASP OD2 1 1 11 4016 1 1 13 CYS C C 2.028 5.407 -1.830 1.00 . A A . 13 CYS C 1 1 11 4017 1 1 13 CYS CA C 1.751 3.917 -1.932 1.00 . A A . 13 CYS CA 1 1 11 4018 1 1 13 CYS CB C 2.105 3.123 -0.681 1.00 . A A . 13 CYS CB 1 1 11 4019 1 1 13 CYS H H 3.370 2.900 -2.855 1.00 . A A . 13 CYS H 1 1 11 4020 1 1 13 CYS HA H 0.689 3.774 -2.128 1.00 . A A . 13 CYS HA 1 1 11 4021 1 1 13 CYS HB3 H 3.161 3.242 -0.448 1.00 . A A . 13 CYS HB3 1 1 11 4022 1 1 13 CYS N N 2.496 3.378 -3.047 1.00 . A A . 13 CYS N 1 1 11 4023 1 1 13 CYS O O 1.082 6.181 -1.737 1.00 . A A . 13 CYS O 1 1 11 4024 1 1 13 CYS SG S 1.125 3.474 0.783 1.00 . A A . 13 CYS SG 1 1 11 4025 1 1 14 SER C C 3.328 7.748 -3.540 1.00 . A A . 14 SER C 1 1 11 4026 1 1 14 SER CA C 3.732 7.200 -2.160 1.00 . A A . 14 SER CA 1 1 11 4027 1 1 14 SER CB C 5.254 7.266 -1.959 1.00 . A A . 14 SER CB 1 1 11 4028 1 1 14 SER H H 3.991 5.091 -2.090 1.00 . A A . 14 SER H 1 1 11 4029 1 1 14 SER HA H 3.258 7.812 -1.392 1.00 . A A . 14 SER HA 1 1 11 4030 1 1 14 SER HB3 H 5.756 6.795 -2.803 1.00 . A A . 14 SER HB3 1 1 11 4031 1 1 14 SER HG H 6.645 8.637 -1.823 1.00 . A A . 14 SER HG 1 1 11 4032 1 1 14 SER N N 3.292 5.817 -1.989 1.00 . A A . 14 SER N 1 1 11 4033 1 1 14 SER O O 4.155 8.247 -4.301 1.00 . A A . 14 SER O 1 1 11 4034 1 1 14 SER OG O 5.677 8.613 -1.861 1.00 . A A . 14 SER OG 1 1 11 4035 1 1 15 ARG C C -0.087 7.820 -4.942 1.00 . A A . 15 ARG C 1 1 11 4036 1 1 15 ARG CA C 1.408 8.068 -5.106 1.00 . A A . 15 ARG CA 1 1 11 4037 1 1 15 ARG CB C 2.003 7.309 -6.306 1.00 . A A . 15 ARG CB 1 1 11 4038 1 1 15 ARG CD C 0.185 7.196 -8.111 1.00 . A A . 15 ARG CD 1 1 11 4039 1 1 15 ARG CG C 1.525 7.810 -7.676 1.00 . A A . 15 ARG CG 1 1 11 4040 1 1 15 ARG CZ C 0.556 6.628 -10.519 1.00 . A A . 15 ARG CZ 1 1 11 4041 1 1 15 ARG H H 1.435 7.291 -3.133 1.00 . A A . 15 ARG H 1 1 11 4042 1 1 15 ARG HA H 1.583 9.137 -5.239 1.00 . A A . 15 ARG HA 1 1 11 4043 1 1 15 ARG HB3 H 1.822 6.240 -6.212 1.00 . A A . 15 ARG HB3 1 1 11 4044 1 1 15 ARG HD3 H -0.625 7.708 -7.591 1.00 . A A . 15 ARG HD3 1 1 11 4045 1 1 15 ARG HE H -0.693 8.079 -9.823 1.00 . A A . 15 ARG HE 1 1 11 4046 1 1 15 ARG HG3 H 2.300 7.536 -8.392 1.00 . A A . 15 ARG HG3 1 1 11 4047 1 1 15 ARG HH11 H 1.687 5.561 -9.213 1.00 . A A . 15 ARG HH11 1 1 11 4048 1 1 15 ARG HH12 H 1.913 5.117 -10.877 1.00 . A A . 15 ARG HH12 1 1 11 4049 1 1 15 ARG HH21 H -0.401 7.561 -12.067 1.00 . A A . 15 ARG HH21 1 1 11 4050 1 1 15 ARG HH22 H 0.702 6.313 -12.541 1.00 . A A . 15 ARG HH22 1 1 11 4051 1 1 15 ARG N N 2.036 7.659 -3.857 1.00 . A A . 15 ARG N 1 1 11 4052 1 1 15 ARG NE N -0.036 7.358 -9.557 1.00 . A A . 15 ARG NE 1 1 11 4053 1 1 15 ARG NH1 N 1.444 5.684 -10.185 1.00 . A A . 15 ARG NH1 1 1 11 4054 1 1 15 ARG NH2 N 0.262 6.847 -11.806 1.00 . A A . 15 ARG NH2 1 1 11 4055 1 1 15 ARG O O -0.893 8.722 -5.151 1.00 . A A . 15 ARG O 1 1 11 4056 1 1 16 LYS C C -2.260 7.103 -2.887 1.00 . A A . 16 LYS C 1 1 11 4057 1 1 16 LYS CA C -1.833 6.305 -4.131 1.00 . A A . 16 LYS CA 1 1 11 4058 1 1 16 LYS CB C -2.016 4.784 -3.969 1.00 . A A . 16 LYS CB 1 1 11 4059 1 1 16 LYS CD C -2.160 2.590 -5.352 1.00 . A A . 16 LYS CD 1 1 11 4060 1 1 16 LYS CE C -0.723 2.037 -5.337 1.00 . A A . 16 LYS CE 1 1 11 4061 1 1 16 LYS CG C -2.167 4.130 -5.356 1.00 . A A . 16 LYS CG 1 1 11 4062 1 1 16 LYS H H 0.245 5.878 -4.418 1.00 . A A . 16 LYS H 1 1 11 4063 1 1 16 LYS HA H -2.496 6.634 -4.934 1.00 . A A . 16 LYS HA 1 1 11 4064 1 1 16 LYS HB3 H -2.925 4.587 -3.399 1.00 . A A . 16 LYS HB3 1 1 11 4065 1 1 16 LYS HD3 H -2.653 2.264 -6.269 1.00 . A A . 16 LYS HD3 1 1 11 4066 1 1 16 LYS HE3 H -0.298 2.195 -4.346 1.00 . A A . 16 LYS HE3 1 1 11 4067 1 1 16 LYS HG3 H -1.381 4.499 -6.016 1.00 . A A . 16 LYS HG3 1 1 11 4068 1 1 16 LYS HZ1 H -0.916 -0.001 -4.925 1.00 . A A . 16 LYS HZ1 1 1 11 4069 1 1 16 LYS HZ2 H -1.162 0.385 -6.515 1.00 . A A . 16 LYS HZ2 1 1 11 4070 1 1 16 LYS HZ3 H 0.339 0.368 -5.910 1.00 . A A . 16 LYS HZ3 1 1 11 4071 1 1 16 LYS N N -0.461 6.605 -4.526 1.00 . A A . 16 LYS N 1 1 11 4072 1 1 16 LYS NZ N -0.630 0.603 -5.691 1.00 . A A . 16 LYS NZ 1 1 11 4073 1 1 16 LYS O O -3.450 7.359 -2.717 1.00 . A A . 16 LYS O 1 1 11 4074 1 1 17 CYS C C -0.372 9.088 -0.389 1.00 . A A . 17 CYS C 1 1 11 4075 1 1 17 CYS CA C -1.598 8.244 -0.790 1.00 . A A . 17 CYS CA 1 1 11 4076 1 1 17 CYS CB C -1.992 7.239 0.293 1.00 . A A . 17 CYS CB 1 1 11 4077 1 1 17 CYS H H -0.362 7.202 -2.142 1.00 . A A . 17 CYS H 1 1 11 4078 1 1 17 CYS HA H -2.450 8.898 -0.965 1.00 . A A . 17 CYS HA 1 1 11 4079 1 1 17 CYS HB3 H -1.306 6.391 0.279 1.00 . A A . 17 CYS HB3 1 1 11 4080 1 1 17 CYS N N -1.322 7.501 -2.016 1.00 . A A . 17 CYS N 1 1 11 4081 1 1 17 CYS O O 0.752 8.604 -0.493 1.00 . A A . 17 CYS O 1 1 11 4082 1 1 17 CYS SG S -2.038 7.851 1.989 1.00 . A A . 17 CYS SG 1 1 11 4083 1 1 18 PRO C C 1.288 11.002 1.559 1.00 . A A . 18 PRO C 1 1 11 4084 1 1 18 PRO CA C 0.582 11.272 0.223 1.00 . A A . 18 PRO CA 1 1 11 4085 1 1 18 PRO CB C -0.032 12.676 0.190 1.00 . A A . 18 PRO CB 1 1 11 4086 1 1 18 PRO CD C -1.802 11.076 0.123 1.00 . A A . 18 PRO CD 1 1 11 4087 1 1 18 PRO CG C -1.446 12.438 0.718 1.00 . A A . 18 PRO CG 1 1 11 4088 1 1 18 PRO HA H 1.310 11.179 -0.585 1.00 . A A . 18 PRO HA 1 1 11 4089 1 1 18 PRO HB3 H -0.090 13.020 -0.845 1.00 . A A . 18 PRO HB3 1 1 11 4090 1 1 18 PRO HD3 H -2.235 11.222 -0.869 1.00 . A A . 18 PRO HD3 1 1 11 4091 1 1 18 PRO HG3 H -2.143 13.220 0.412 1.00 . A A . 18 PRO HG3 1 1 11 4092 1 1 18 PRO N N -0.539 10.366 -0.004 1.00 . A A . 18 PRO N 1 1 11 4093 1 1 18 PRO O O 0.775 10.277 2.406 1.00 . A A . 18 PRO O 1 1 11 4094 1 1 19 GLY C C 4.260 10.386 2.950 1.00 . A A . 19 GLY C 1 1 11 4095 1 1 19 GLY CA C 3.260 11.548 2.972 1.00 . A A . 19 GLY CA 1 1 11 4096 1 1 19 GLY H H 2.795 12.232 1.014 1.00 . A A . 19 GLY H 1 1 11 4097 1 1 19 GLY HA2 H 3.820 12.476 3.076 1.00 . A A . 19 GLY HA2 1 1 11 4098 1 1 19 GLY HA3 H 2.608 11.443 3.841 1.00 . A A . 19 GLY HA3 1 1 11 4099 1 1 19 GLY N N 2.460 11.624 1.748 1.00 . A A . 19 GLY N 1 1 11 4100 1 1 19 GLY O O 4.615 9.851 3.995 1.00 . A A . 19 GLY O 1 1 11 4101 1 1 20 ASN C C 5.257 7.586 2.350 1.00 . A A . 20 ASN C 1 1 11 4102 1 1 20 ASN CA C 5.497 8.808 1.449 1.00 . A A . 20 ASN CA 1 1 11 4103 1 1 20 ASN CB C 6.986 9.179 1.325 1.00 . A A . 20 ASN CB 1 1 11 4104 1 1 20 ASN CG C 7.729 8.266 0.343 1.00 . A A . 20 ASN CG 1 1 11 4105 1 1 20 ASN H H 4.336 10.493 0.950 1.00 . A A . 20 ASN H 1 1 11 4106 1 1 20 ASN HA H 5.157 8.500 0.468 1.00 . A A . 20 ASN HA 1 1 11 4107 1 1 20 ASN HB3 H 7.472 9.163 2.301 1.00 . A A . 20 ASN HB3 1 1 11 4108 1 1 20 ASN HD21 H 7.500 6.627 1.524 1.00 . A A . 20 ASN HD21 1 1 11 4109 1 1 20 ASN HD22 H 8.326 6.352 -0.035 1.00 . A A . 20 ASN HD22 1 1 11 4110 1 1 20 ASN N N 4.687 9.990 1.748 1.00 . A A . 20 ASN N 1 1 11 4111 1 1 20 ASN ND2 N 7.865 6.980 0.644 1.00 . A A . 20 ASN ND2 1 1 11 4112 1 1 20 ASN O O 6.219 6.994 2.846 1.00 . A A . 20 ASN O 1 1 11 4113 1 1 20 ASN OD1 O 8.145 8.722 -0.719 1.00 . A A . 20 ASN OD1 1 1 11 4114 1 1 21 PRO C C 4.327 4.724 2.426 1.00 . A A . 21 PRO C 1 1 11 4115 1 1 21 PRO CA C 3.716 5.894 3.212 1.00 . A A . 21 PRO CA 1 1 11 4116 1 1 21 PRO CB C 2.188 5.800 3.258 1.00 . A A . 21 PRO CB 1 1 11 4117 1 1 21 PRO CD C 2.777 7.748 2.039 1.00 . A A . 21 PRO CD 1 1 11 4118 1 1 21 PRO CG C 1.739 6.639 2.059 1.00 . A A . 21 PRO CG 1 1 11 4119 1 1 21 PRO HA H 4.100 5.954 4.229 1.00 . A A . 21 PRO HA 1 1 11 4120 1 1 21 PRO HB3 H 1.826 6.265 4.174 1.00 . A A . 21 PRO HB3 1 1 11 4121 1 1 21 PRO HD3 H 2.456 8.507 2.749 1.00 . A A . 21 PRO HD3 1 1 11 4122 1 1 21 PRO HG3 H 0.728 7.024 2.171 1.00 . A A . 21 PRO HG3 1 1 11 4123 1 1 21 PRO N N 4.002 7.143 2.531 1.00 . A A . 21 PRO N 1 1 11 4124 1 1 21 PRO O O 4.241 4.716 1.198 1.00 . A A . 21 PRO O 1 1 11 4125 1 1 22 PRO C C 4.513 1.491 2.207 1.00 . A A . 22 PRO C 1 1 11 4126 1 1 22 PRO CA C 5.555 2.590 2.448 1.00 . A A . 22 PRO CA 1 1 11 4127 1 1 22 PRO CB C 6.624 2.122 3.443 1.00 . A A . 22 PRO CB 1 1 11 4128 1 1 22 PRO CD C 5.231 3.730 4.525 1.00 . A A . 22 PRO CD 1 1 11 4129 1 1 22 PRO CG C 5.968 2.416 4.793 1.00 . A A . 22 PRO CG 1 1 11 4130 1 1 22 PRO HA H 6.021 2.862 1.502 1.00 . A A . 22 PRO HA 1 1 11 4131 1 1 22 PRO HB3 H 7.512 2.746 3.332 1.00 . A A . 22 PRO HB3 1 1 11 4132 1 1 22 PRO HD3 H 5.891 4.565 4.771 1.00 . A A . 22 PRO HD3 1 1 11 4133 1 1 22 PRO HG3 H 6.698 2.508 5.597 1.00 . A A . 22 PRO HG3 1 1 11 4134 1 1 22 PRO N N 4.954 3.745 3.098 1.00 . A A . 22 PRO N 1 1 11 4135 1 1 22 PRO O O 3.337 1.631 2.554 1.00 . A A . 22 PRO O 1 1 11 4136 1 1 23 CYS C C 4.277 -1.487 3.087 1.00 . A A . 23 CYS C 1 1 11 4137 1 1 23 CYS CA C 4.155 -0.860 1.704 1.00 . A A . 23 CYS CA 1 1 11 4138 1 1 23 CYS CB C 4.610 -1.909 0.678 1.00 . A A . 23 CYS CB 1 1 11 4139 1 1 23 CYS H H 5.925 0.274 1.393 1.00 . A A . 23 CYS H 1 1 11 4140 1 1 23 CYS HA H 3.116 -0.612 1.490 1.00 . A A . 23 CYS HA 1 1 11 4141 1 1 23 CYS HB3 H 3.869 -2.707 0.697 1.00 . A A . 23 CYS HB3 1 1 11 4142 1 1 23 CYS N N 4.958 0.352 1.669 1.00 . A A . 23 CYS N 1 1 11 4143 1 1 23 CYS O O 5.379 -1.822 3.517 1.00 . A A . 23 CYS O 1 1 11 4144 1 1 23 CYS SG S 4.769 -1.404 -1.043 1.00 . A A . 23 CYS SG 1 1 11 4145 1 1 24 ARG C C 3.176 -4.157 3.742 1.00 . A A . 24 ARG C 1 1 11 4146 1 1 24 ARG CA C 3.089 -2.913 4.632 1.00 . A A . 24 ARG CA 1 1 11 4147 1 1 24 ARG CB C 1.803 -2.859 5.469 1.00 . A A . 24 ARG CB 1 1 11 4148 1 1 24 ARG CD C 0.542 -3.888 7.403 1.00 . A A . 24 ARG CD 1 1 11 4149 1 1 24 ARG CG C 1.765 -4.007 6.491 1.00 . A A . 24 ARG CG 1 1 11 4150 1 1 24 ARG CZ C -0.416 -5.150 9.334 1.00 . A A . 24 ARG CZ 1 1 11 4151 1 1 24 ARG H H 2.278 -1.490 3.307 1.00 . A A . 24 ARG H 1 1 11 4152 1 1 24 ARG HA H 3.939 -2.892 5.317 1.00 . A A . 24 ARG HA 1 1 11 4153 1 1 24 ARG HB3 H 0.930 -2.914 4.817 1.00 . A A . 24 ARG HB3 1 1 11 4154 1 1 24 ARG HD3 H -0.357 -3.900 6.783 1.00 . A A . 24 ARG HD3 1 1 11 4155 1 1 24 ARG HE H 1.224 -5.700 8.263 1.00 . A A . 24 ARG HE 1 1 11 4156 1 1 24 ARG HG3 H 2.672 -3.973 7.098 1.00 . A A . 24 ARG HG3 1 1 11 4157 1 1 24 ARG HH11 H -1.414 -3.448 8.851 1.00 . A A . 24 ARG HH11 1 1 11 4158 1 1 24 ARG HH12 H -2.087 -4.313 10.199 1.00 . A A . 24 ARG HH12 1 1 11 4159 1 1 24 ARG HH21 H 0.370 -6.897 10.052 1.00 . A A . 24 ARG HH21 1 1 11 4160 1 1 24 ARG HH22 H -1.037 -6.336 10.892 1.00 . A A . 24 ARG HH22 1 1 11 4161 1 1 24 ARG N N 3.151 -1.772 3.737 1.00 . A A . 24 ARG N 1 1 11 4162 1 1 24 ARG NE N 0.500 -5.003 8.364 1.00 . A A . 24 ARG NE 1 1 11 4163 1 1 24 ARG NH1 N -1.385 -4.239 9.478 1.00 . A A . 24 ARG NH1 1 1 11 4164 1 1 24 ARG NH2 N -0.360 -6.206 10.155 1.00 . A A . 24 ARG NH2 1 1 11 4165 1 1 24 ARG O O 2.149 -4.737 3.392 1.00 . A A . 24 ARG O 1 1 11 4166 1 1 25 ASN C C 3.689 -6.323 1.788 1.00 . A A . 25 ASN C 1 1 11 4167 1 1 25 ASN CA C 4.836 -5.642 2.538 1.00 . A A . 25 ASN CA 1 1 11 4168 1 1 25 ASN CB C 5.601 -6.652 3.410 1.00 . A A . 25 ASN CB 1 1 11 4169 1 1 25 ASN CG C 6.901 -6.090 3.983 1.00 . A A . 25 ASN CG 1 1 11 4170 1 1 25 ASN H H 5.163 -3.886 3.651 1.00 . A A . 25 ASN H 1 1 11 4171 1 1 25 ASN HA H 5.534 -5.271 1.786 1.00 . A A . 25 ASN HA 1 1 11 4172 1 1 25 ASN HB3 H 5.851 -7.517 2.795 1.00 . A A . 25 ASN HB3 1 1 11 4173 1 1 25 ASN HD21 H 7.660 -7.955 4.300 1.00 . A A . 25 ASN HD21 1 1 11 4174 1 1 25 ASN HD22 H 8.687 -6.607 4.757 1.00 . A A . 25 ASN HD22 1 1 11 4175 1 1 25 ASN N N 4.410 -4.500 3.346 1.00 . A A . 25 ASN N 1 1 11 4176 1 1 25 ASN ND2 N 7.821 -6.963 4.381 1.00 . A A . 25 ASN ND2 1 1 11 4177 1 1 25 ASN O O 3.261 -7.413 2.169 1.00 . A A . 25 ASN O 1 1 11 4178 1 1 25 ASN OD1 O 7.084 -4.879 4.076 1.00 . A A . 25 ASN OD1 1 1 11 4179 1 1 26 GLY C C 0.985 -5.113 -0.185 1.00 . A A . 26 GLY C 1 1 11 4180 1 1 26 GLY CA C 2.080 -6.167 -0.064 1.00 . A A . 26 GLY CA 1 1 11 4181 1 1 26 GLY H H 3.610 -4.800 0.448 1.00 . A A . 26 GLY H 1 1 11 4182 1 1 26 GLY HA2 H 2.444 -6.418 -1.062 1.00 . A A . 26 GLY HA2 1 1 11 4183 1 1 26 GLY HA3 H 1.634 -7.061 0.374 1.00 . A A . 26 GLY HA3 1 1 11 4184 1 1 26 GLY N N 3.199 -5.680 0.725 1.00 . A A . 26 GLY N 1 1 11 4185 1 1 26 GLY O O 0.376 -4.996 -1.251 1.00 . A A . 26 GLY O 1 1 11 4186 1 1 27 PHE C C 0.062 -2.013 1.334 1.00 . A A . 27 PHE C 1 1 11 4187 1 1 27 PHE CA C -0.399 -3.416 0.945 1.00 . A A . 27 PHE CA 1 1 11 4188 1 1 27 PHE CB C -1.478 -3.924 1.909 1.00 . A A . 27 PHE CB 1 1 11 4189 1 1 27 PHE CD1 C -2.286 -5.777 0.383 1.00 . A A . 27 PHE CD1 1 1 11 4190 1 1 27 PHE CD2 C -1.764 -6.316 2.696 1.00 . A A . 27 PHE CD2 1 1 11 4191 1 1 27 PHE CE1 C -2.451 -7.144 0.100 1.00 . A A . 27 PHE CE1 1 1 11 4192 1 1 27 PHE CE2 C -1.993 -7.677 2.428 1.00 . A A . 27 PHE CE2 1 1 11 4193 1 1 27 PHE CG C -1.901 -5.362 1.671 1.00 . A A . 27 PHE CG 1 1 11 4194 1 1 27 PHE CZ C -2.323 -8.093 1.128 1.00 . A A . 27 PHE CZ 1 1 11 4195 1 1 27 PHE H H 1.253 -4.507 1.745 1.00 . A A . 27 PHE H 1 1 11 4196 1 1 27 PHE HA H -0.833 -3.347 -0.046 1.00 . A A . 27 PHE HA 1 1 11 4197 1 1 27 PHE HB3 H -2.355 -3.281 1.819 1.00 . A A . 27 PHE HB3 1 1 11 4198 1 1 27 PHE HD1 H -2.353 -5.058 -0.419 1.00 . A A . 27 PHE HD1 1 1 11 4199 1 1 27 PHE HD2 H -1.427 -6.023 3.680 1.00 . A A . 27 PHE HD2 1 1 11 4200 1 1 27 PHE HE1 H -2.638 -7.469 -0.911 1.00 . A A . 27 PHE HE1 1 1 11 4201 1 1 27 PHE HE2 H -1.860 -8.411 3.212 1.00 . A A . 27 PHE HE2 1 1 11 4202 1 1 27 PHE HZ H -2.439 -9.147 0.912 1.00 . A A . 27 PHE HZ 1 1 11 4203 1 1 27 PHE N N 0.717 -4.359 0.892 1.00 . A A . 27 PHE N 1 1 11 4204 1 1 27 PHE O O 0.963 -1.862 2.150 1.00 . A A . 27 PHE O 1 1 11 4205 1 1 28 CYS C C -0.465 0.876 2.376 1.00 . A A . 28 CYS C 1 1 11 4206 1 1 28 CYS CA C -0.162 0.414 0.951 1.00 . A A . 28 CYS CA 1 1 11 4207 1 1 28 CYS CB C -0.888 1.291 -0.077 1.00 . A A . 28 CYS CB 1 1 11 4208 1 1 28 CYS H H -1.306 -1.184 0.102 1.00 . A A . 28 CYS H 1 1 11 4209 1 1 28 CYS HA H 0.911 0.506 0.775 1.00 . A A . 28 CYS HA 1 1 11 4210 1 1 28 CYS HB3 H -1.942 1.013 -0.119 1.00 . A A . 28 CYS HB3 1 1 11 4211 1 1 28 CYS N N -0.547 -0.981 0.748 1.00 . A A . 28 CYS N 1 1 11 4212 1 1 28 CYS O O -1.630 0.935 2.770 1.00 . A A . 28 CYS O 1 1 11 4213 1 1 28 CYS SG S -0.836 3.076 0.223 1.00 . A A . 28 CYS SG 1 1 11 4214 1 1 29 ALA C C -0.042 3.111 4.629 1.00 . A A . 29 ALA C 1 1 11 4215 1 1 29 ALA CA C 0.395 1.644 4.545 1.00 . A A . 29 ALA CA 1 1 11 4216 1 1 29 ALA CB C 1.695 1.396 5.316 1.00 . A A . 29 ALA CB 1 1 11 4217 1 1 29 ALA H H 1.504 1.257 2.771 1.00 . A A . 29 ALA H 1 1 11 4218 1 1 29 ALA HA H -0.380 1.032 5.012 1.00 . A A . 29 ALA HA 1 1 11 4219 1 1 29 ALA HB1 H 2.487 2.045 4.942 1.00 . A A . 29 ALA HB1 1 1 11 4220 1 1 29 ALA HB2 H 1.540 1.605 6.376 1.00 . A A . 29 ALA HB2 1 1 11 4221 1 1 29 ALA HB3 H 2.002 0.358 5.202 1.00 . A A . 29 ALA HB3 1 1 11 4222 1 1 29 ALA N N 0.563 1.226 3.158 1.00 . A A . 29 ALA N 1 1 11 4223 1 1 29 ALA O O 0.607 3.919 5.293 1.00 . A A . 29 ALA O 1 1 11 4224 1 1 30 CYS C C -2.314 5.099 5.394 1.00 . A A . 30 CYS C 1 1 11 4225 1 1 30 CYS CA C -1.713 4.813 4.014 1.00 . A A . 30 CYS CA 1 1 11 4226 1 1 30 CYS CB C -2.768 4.983 2.921 1.00 . A A . 30 CYS CB 1 1 11 4227 1 1 30 CYS H H -1.649 2.738 3.464 1.00 . A A . 30 CYS H 1 1 11 4228 1 1 30 CYS HA H -0.918 5.535 3.819 1.00 . A A . 30 CYS HA 1 1 11 4229 1 1 30 CYS HB3 H -3.576 4.274 3.099 1.00 . A A . 30 CYS HB3 1 1 11 4230 1 1 30 CYS N N -1.155 3.463 3.977 1.00 . A A . 30 CYS N 1 1 11 4231 1 1 30 CYS O O -3.527 5.095 5.577 1.00 . A A . 30 CYS O 1 1 11 4232 1 1 30 CYS SG S -3.503 6.637 2.842 1.00 . A A . 30 CYS SG 1 1 11 4233 1 1 31 THR C C -2.747 6.790 7.865 1.00 . A A . 31 THR C 1 1 11 4234 1 1 31 THR CA C -1.847 5.556 7.766 1.00 . A A . 31 THR CA 1 1 11 4235 1 1 31 THR CB C -0.592 5.665 8.649 1.00 . A A . 31 THR CB 1 1 11 4236 1 1 31 THR CG2 C 0.333 6.816 8.240 1.00 . A A . 31 THR CG2 1 1 11 4237 1 1 31 THR H H -0.466 5.188 6.173 1.00 . A A . 31 THR H 1 1 11 4238 1 1 31 THR HA H -2.423 4.691 8.103 1.00 . A A . 31 THR HA 1 1 11 4239 1 1 31 THR HB H -0.030 4.731 8.571 1.00 . A A . 31 THR HB 1 1 11 4240 1 1 31 THR HG1 H -1.503 5.110 10.288 1.00 . A A . 31 THR HG1 1 1 11 4241 1 1 31 THR HG21 H 0.685 6.689 7.215 1.00 . A A . 31 THR HG21 1 1 11 4242 1 1 31 THR HG22 H -0.183 7.772 8.329 1.00 . A A . 31 THR HG22 1 1 11 4243 1 1 31 THR HG23 H 1.199 6.828 8.903 1.00 . A A . 31 THR HG23 1 1 11 4244 1 1 31 THR N N -1.451 5.316 6.386 1.00 . A A . 31 THR N 1 1 11 4245 1 1 31 THR O O -3.808 6.747 8.486 1.00 . A A . 31 THR O 1 1 11 4246 1 1 31 THR OG1 O -0.954 5.845 10.001 1.00 . A A . 31 THR OG1 1 1 12 4247 1 1 1 THR C C -10.257 -6.367 0.912 1.00 . A A . 1 THR C 1 1 12 4248 1 1 1 THR CA C -10.368 -7.769 1.525 1.00 . A A . 1 THR CA 1 1 12 4249 1 1 1 THR CB C -9.517 -7.904 2.798 1.00 . A A . 1 THR CB 1 1 12 4250 1 1 1 THR CG2 C -10.005 -7.015 3.943 1.00 . A A . 1 THR CG2 1 1 12 4251 1 1 1 THR H1 H -9.284 -8.350 -0.184 1.00 . A A . 1 THR H1 1 1 12 4252 1 1 1 THR HA H -11.401 -8.033 1.746 1.00 . A A . 1 THR HA 1 1 12 4253 1 1 1 THR HB H -8.484 -7.644 2.563 1.00 . A A . 1 THR HB 1 1 12 4254 1 1 1 THR HG1 H -9.429 -9.809 2.463 1.00 . A A . 1 THR HG1 1 1 12 4255 1 1 1 THR HG21 H -9.970 -5.969 3.651 1.00 . A A . 1 THR HG21 1 1 12 4256 1 1 1 THR HG22 H -11.022 -7.291 4.221 1.00 . A A . 1 THR HG22 1 1 12 4257 1 1 1 THR HG23 H -9.356 -7.162 4.809 1.00 . A A . 1 THR HG23 1 1 12 4258 1 1 1 THR N N -9.880 -8.725 0.544 1.00 . A A . 1 THR N 1 1 12 4259 1 1 1 THR O O -9.188 -6.038 0.398 1.00 . A A . 1 THR O 1 1 12 4260 1 1 1 THR OG1 O -9.553 -9.246 3.234 1.00 . A A . 1 THR OG1 1 1 12 4261 1 1 2 PRO C C -10.167 -3.355 0.755 1.00 . A A . 2 PRO C 1 1 12 4262 1 1 2 PRO CA C -11.311 -4.242 0.261 1.00 . A A . 2 PRO CA 1 1 12 4263 1 1 2 PRO CB C -12.689 -3.627 0.533 1.00 . A A . 2 PRO CB 1 1 12 4264 1 1 2 PRO CD C -12.566 -5.742 1.644 1.00 . A A . 2 PRO CD 1 1 12 4265 1 1 2 PRO CG C -13.179 -4.350 1.788 1.00 . A A . 2 PRO CG 1 1 12 4266 1 1 2 PRO HA H -11.192 -4.389 -0.815 1.00 . A A . 2 PRO HA 1 1 12 4267 1 1 2 PRO HB3 H -13.357 -3.869 -0.296 1.00 . A A . 2 PRO HB3 1 1 12 4268 1 1 2 PRO HD3 H -13.220 -6.374 1.040 1.00 . A A . 2 PRO HD3 1 1 12 4269 1 1 2 PRO HG3 H -14.267 -4.382 1.852 1.00 . A A . 2 PRO HG3 1 1 12 4270 1 1 2 PRO N N -11.312 -5.535 0.937 1.00 . A A . 2 PRO N 1 1 12 4271 1 1 2 PRO O O -9.517 -2.672 -0.032 1.00 . A A . 2 PRO O 1 1 12 4272 1 1 3 PHE C C -7.442 -3.009 2.172 1.00 . A A . 3 PHE C 1 1 12 4273 1 1 3 PHE CA C -8.835 -2.628 2.690 1.00 . A A . 3 PHE CA 1 1 12 4274 1 1 3 PHE CB C -8.913 -2.805 4.214 1.00 . A A . 3 PHE CB 1 1 12 4275 1 1 3 PHE CD1 C -11.155 -1.657 4.501 1.00 . A A . 3 PHE CD1 1 1 12 4276 1 1 3 PHE CD2 C -10.829 -3.843 5.519 1.00 . A A . 3 PHE CD2 1 1 12 4277 1 1 3 PHE CE1 C -12.498 -1.662 4.918 1.00 . A A . 3 PHE CE1 1 1 12 4278 1 1 3 PHE CE2 C -12.172 -3.850 5.933 1.00 . A A . 3 PHE CE2 1 1 12 4279 1 1 3 PHE CG C -10.321 -2.754 4.786 1.00 . A A . 3 PHE CG 1 1 12 4280 1 1 3 PHE CZ C -13.009 -2.764 5.628 1.00 . A A . 3 PHE CZ 1 1 12 4281 1 1 3 PHE H H -10.510 -3.931 2.660 1.00 . A A . 3 PHE H 1 1 12 4282 1 1 3 PHE HA H -9.000 -1.575 2.456 1.00 . A A . 3 PHE HA 1 1 12 4283 1 1 3 PHE HB3 H -8.313 -2.024 4.684 1.00 . A A . 3 PHE HB3 1 1 12 4284 1 1 3 PHE HD1 H -10.777 -0.809 3.948 1.00 . A A . 3 PHE HD1 1 1 12 4285 1 1 3 PHE HD2 H -10.193 -4.674 5.789 1.00 . A A . 3 PHE HD2 1 1 12 4286 1 1 3 PHE HE1 H -13.136 -0.818 4.699 1.00 . A A . 3 PHE HE1 1 1 12 4287 1 1 3 PHE HE2 H -12.559 -4.685 6.502 1.00 . A A . 3 PHE HE2 1 1 12 4288 1 1 3 PHE HZ H -14.038 -2.763 5.958 1.00 . A A . 3 PHE HZ 1 1 12 4289 1 1 3 PHE N N -9.898 -3.396 2.060 1.00 . A A . 3 PHE N 1 1 12 4290 1 1 3 PHE O O -6.500 -2.238 2.346 1.00 . A A . 3 PHE O 1 1 12 4291 1 1 4 ALA C C -5.564 -4.004 -0.188 1.00 . A A . 4 ALA C 1 1 12 4292 1 1 4 ALA CA C -5.980 -4.679 1.122 1.00 . A A . 4 ALA CA 1 1 12 4293 1 1 4 ALA CB C -6.017 -6.207 1.003 1.00 . A A . 4 ALA CB 1 1 12 4294 1 1 4 ALA H H -8.090 -4.759 1.340 1.00 . A A . 4 ALA H 1 1 12 4295 1 1 4 ALA HA H -5.231 -4.438 1.880 1.00 . A A . 4 ALA HA 1 1 12 4296 1 1 4 ALA HB1 H -5.025 -6.578 0.751 1.00 . A A . 4 ALA HB1 1 1 12 4297 1 1 4 ALA HB2 H -6.322 -6.643 1.954 1.00 . A A . 4 ALA HB2 1 1 12 4298 1 1 4 ALA HB3 H -6.711 -6.513 0.222 1.00 . A A . 4 ALA HB3 1 1 12 4299 1 1 4 ALA N N -7.279 -4.193 1.567 1.00 . A A . 4 ALA N 1 1 12 4300 1 1 4 ALA O O -5.376 -4.663 -1.209 1.00 . A A . 4 ALA O 1 1 12 4301 1 1 5 ILE C C -3.384 -2.401 -1.459 1.00 . A A . 5 ILE C 1 1 12 4302 1 1 5 ILE CA C -4.825 -1.924 -1.266 1.00 . A A . 5 ILE CA 1 1 12 4303 1 1 5 ILE CB C -4.906 -0.412 -0.968 1.00 . A A . 5 ILE CB 1 1 12 4304 1 1 5 ILE CD1 C -6.526 1.484 -0.370 1.00 . A A . 5 ILE CD1 1 1 12 4305 1 1 5 ILE CG1 C -6.373 0.012 -0.760 1.00 . A A . 5 ILE CG1 1 1 12 4306 1 1 5 ILE CG2 C -4.272 0.390 -2.116 1.00 . A A . 5 ILE CG2 1 1 12 4307 1 1 5 ILE H H -5.552 -2.206 0.727 1.00 . A A . 5 ILE H 1 1 12 4308 1 1 5 ILE HA H -5.410 -2.133 -2.161 1.00 . A A . 5 ILE HA 1 1 12 4309 1 1 5 ILE HB H -4.349 -0.204 -0.052 1.00 . A A . 5 ILE HB 1 1 12 4310 1 1 5 ILE HD11 H -5.882 1.713 0.479 1.00 . A A . 5 ILE HD11 1 1 12 4311 1 1 5 ILE HD12 H -6.275 2.137 -1.206 1.00 . A A . 5 ILE HD12 1 1 12 4312 1 1 5 ILE HD13 H -7.563 1.673 -0.088 1.00 . A A . 5 ILE HD13 1 1 12 4313 1 1 5 ILE HG13 H -6.813 -0.574 0.047 1.00 . A A . 5 ILE HG13 1 1 12 4314 1 1 5 ILE HG21 H -4.840 0.234 -3.033 1.00 . A A . 5 ILE HG21 1 1 12 4315 1 1 5 ILE HG22 H -4.257 1.451 -1.875 1.00 . A A . 5 ILE HG22 1 1 12 4316 1 1 5 ILE HG23 H -3.239 0.080 -2.282 1.00 . A A . 5 ILE HG23 1 1 12 4317 1 1 5 ILE N N -5.380 -2.682 -0.155 1.00 . A A . 5 ILE N 1 1 12 4318 1 1 5 ILE O O -2.571 -2.246 -0.552 1.00 . A A . 5 ILE O 1 1 12 4319 1 1 6 LYS C C -0.663 -2.566 -2.976 1.00 . A A . 6 LYS C 1 1 12 4320 1 1 6 LYS CA C -1.774 -3.620 -2.857 1.00 . A A . 6 LYS CA 1 1 12 4321 1 1 6 LYS CB C -1.828 -4.518 -4.109 1.00 . A A . 6 LYS CB 1 1 12 4322 1 1 6 LYS CD C -3.303 -6.365 -3.043 1.00 . A A . 6 LYS CD 1 1 12 4323 1 1 6 LYS CE C -4.589 -6.038 -3.816 1.00 . A A . 6 LYS CE 1 1 12 4324 1 1 6 LYS CG C -1.997 -6.008 -3.770 1.00 . A A . 6 LYS CG 1 1 12 4325 1 1 6 LYS H H -3.784 -3.075 -3.319 1.00 . A A . 6 LYS H 1 1 12 4326 1 1 6 LYS HA H -1.538 -4.241 -1.995 1.00 . A A . 6 LYS HA 1 1 12 4327 1 1 6 LYS HB3 H -0.879 -4.435 -4.638 1.00 . A A . 6 LYS HB3 1 1 12 4328 1 1 6 LYS HD3 H -3.329 -5.830 -2.094 1.00 . A A . 6 LYS HD3 1 1 12 4329 1 1 6 LYS HE3 H -4.682 -4.961 -3.945 1.00 . A A . 6 LYS HE3 1 1 12 4330 1 1 6 LYS HG3 H -1.164 -6.293 -3.118 1.00 . A A . 6 LYS HG3 1 1 12 4331 1 1 6 LYS HZ1 H -5.523 -6.482 -5.587 1.00 . A A . 6 LYS HZ1 1 1 12 4332 1 1 6 LYS HZ2 H -3.889 -6.370 -5.718 1.00 . A A . 6 LYS HZ2 1 1 12 4333 1 1 6 LYS HZ3 H -4.573 -7.701 -5.026 1.00 . A A . 6 LYS HZ3 1 1 12 4334 1 1 6 LYS N N -3.078 -3.014 -2.605 1.00 . A A . 6 LYS N 1 1 12 4335 1 1 6 LYS NZ N -4.646 -6.700 -5.136 1.00 . A A . 6 LYS NZ 1 1 12 4336 1 1 6 LYS O O -0.929 -1.402 -3.270 1.00 . A A . 6 LYS O 1 1 12 4337 1 1 7 CYS C C 2.981 -3.138 -3.003 1.00 . A A . 7 CYS C 1 1 12 4338 1 1 7 CYS CA C 1.795 -2.197 -2.823 1.00 . A A . 7 CYS CA 1 1 12 4339 1 1 7 CYS CB C 1.939 -1.428 -1.512 1.00 . A A . 7 CYS CB 1 1 12 4340 1 1 7 CYS H H 0.702 -3.962 -2.441 1.00 . A A . 7 CYS H 1 1 12 4341 1 1 7 CYS HA H 1.738 -1.496 -3.657 1.00 . A A . 7 CYS HA 1 1 12 4342 1 1 7 CYS HB3 H 1.990 -2.120 -0.673 1.00 . A A . 7 CYS HB3 1 1 12 4343 1 1 7 CYS N N 0.581 -3.003 -2.755 1.00 . A A . 7 CYS N 1 1 12 4344 1 1 7 CYS O O 3.156 -4.029 -2.173 1.00 . A A . 7 CYS O 1 1 12 4345 1 1 7 CYS SG S 3.353 -0.319 -1.398 1.00 . A A . 7 CYS SG 1 1 12 4346 1 1 8 ALA C C 6.197 -3.006 -3.838 1.00 . A A . 8 ALA C 1 1 12 4347 1 1 8 ALA CA C 4.965 -3.788 -4.293 1.00 . A A . 8 ALA CA 1 1 12 4348 1 1 8 ALA CB C 5.066 -4.157 -5.775 1.00 . A A . 8 ALA CB 1 1 12 4349 1 1 8 ALA H H 3.643 -2.183 -4.703 1.00 . A A . 8 ALA H 1 1 12 4350 1 1 8 ALA HA H 4.918 -4.719 -3.726 1.00 . A A . 8 ALA HA 1 1 12 4351 1 1 8 ALA HB1 H 5.952 -4.770 -5.939 1.00 . A A . 8 ALA HB1 1 1 12 4352 1 1 8 ALA HB2 H 4.183 -4.720 -6.074 1.00 . A A . 8 ALA HB2 1 1 12 4353 1 1 8 ALA HB3 H 5.141 -3.258 -6.389 1.00 . A A . 8 ALA HB3 1 1 12 4354 1 1 8 ALA N N 3.772 -2.977 -4.069 1.00 . A A . 8 ALA N 1 1 12 4355 1 1 8 ALA O O 7.101 -3.558 -3.214 1.00 . A A . 8 ALA O 1 1 12 4356 1 1 9 THR C C 6.690 0.387 -3.093 1.00 . A A . 9 THR C 1 1 12 4357 1 1 9 THR CA C 7.271 -0.765 -3.910 1.00 . A A . 9 THR CA 1 1 12 4358 1 1 9 THR CB C 7.781 -0.246 -5.262 1.00 . A A . 9 THR CB 1 1 12 4359 1 1 9 THR CG2 C 8.442 -1.365 -6.070 1.00 . A A . 9 THR CG2 1 1 12 4360 1 1 9 THR H H 5.396 -1.343 -4.645 1.00 . A A . 9 THR H 1 1 12 4361 1 1 9 THR HA H 8.090 -1.226 -3.357 1.00 . A A . 9 THR HA 1 1 12 4362 1 1 9 THR HB H 8.526 0.531 -5.077 1.00 . A A . 9 THR HB 1 1 12 4363 1 1 9 THR HG1 H 5.939 -0.264 -6.009 1.00 . A A . 9 THR HG1 1 1 12 4364 1 1 9 THR HG21 H 7.713 -2.132 -6.335 1.00 . A A . 9 THR HG21 1 1 12 4365 1 1 9 THR HG22 H 8.861 -0.948 -6.986 1.00 . A A . 9 THR HG22 1 1 12 4366 1 1 9 THR HG23 H 9.245 -1.818 -5.487 1.00 . A A . 9 THR HG23 1 1 12 4367 1 1 9 THR N N 6.211 -1.718 -4.162 1.00 . A A . 9 THR N 1 1 12 4368 1 1 9 THR O O 5.538 0.760 -3.302 1.00 . A A . 9 THR O 1 1 12 4369 1 1 9 THR OG1 O 6.724 0.311 -6.027 1.00 . A A . 9 THR OG1 1 1 12 4370 1 1 10 ASP C C 6.505 3.199 -2.523 1.00 . A A . 10 ASP C 1 1 12 4371 1 1 10 ASP CA C 7.209 2.246 -1.547 1.00 . A A . 10 ASP CA 1 1 12 4372 1 1 10 ASP CB C 8.535 2.832 -1.040 1.00 . A A . 10 ASP CB 1 1 12 4373 1 1 10 ASP CG C 9.632 2.637 -2.077 1.00 . A A . 10 ASP CG 1 1 12 4374 1 1 10 ASP H H 8.452 0.647 -2.118 1.00 . A A . 10 ASP H 1 1 12 4375 1 1 10 ASP HA H 6.546 2.079 -0.697 1.00 . A A . 10 ASP HA 1 1 12 4376 1 1 10 ASP HB3 H 8.835 2.311 -0.130 1.00 . A A . 10 ASP HB3 1 1 12 4377 1 1 10 ASP N N 7.486 0.966 -2.191 1.00 . A A . 10 ASP N 1 1 12 4378 1 1 10 ASP O O 5.380 3.625 -2.263 1.00 . A A . 10 ASP O 1 1 12 4379 1 1 10 ASP OD1 O 9.746 3.517 -2.953 1.00 . A A . 10 ASP OD1 1 1 12 4380 1 1 10 ASP OD2 O 10.193 1.520 -2.075 1.00 . A A . 10 ASP OD2 1 1 12 4381 1 1 11 ALA C C 5.114 3.971 -5.070 1.00 . A A . 11 ALA C 1 1 12 4382 1 1 11 ALA CA C 6.608 4.206 -4.802 1.00 . A A . 11 ALA CA 1 1 12 4383 1 1 11 ALA CB C 7.440 3.884 -6.046 1.00 . A A . 11 ALA CB 1 1 12 4384 1 1 11 ALA H H 8.140 3.261 -3.682 1.00 . A A . 11 ALA H 1 1 12 4385 1 1 11 ALA HA H 6.742 5.268 -4.590 1.00 . A A . 11 ALA HA 1 1 12 4386 1 1 11 ALA HB1 H 7.345 2.829 -6.300 1.00 . A A . 11 ALA HB1 1 1 12 4387 1 1 11 ALA HB2 H 7.089 4.485 -6.886 1.00 . A A . 11 ALA HB2 1 1 12 4388 1 1 11 ALA HB3 H 8.490 4.113 -5.857 1.00 . A A . 11 ALA HB3 1 1 12 4389 1 1 11 ALA N N 7.141 3.473 -3.664 1.00 . A A . 11 ALA N 1 1 12 4390 1 1 11 ALA O O 4.397 4.946 -5.269 1.00 . A A . 11 ALA O 1 1 12 4391 1 1 12 ASP C C 2.347 3.217 -4.388 1.00 . A A . 12 ASP C 1 1 12 4392 1 1 12 ASP CA C 3.218 2.438 -5.370 1.00 . A A . 12 ASP CA 1 1 12 4393 1 1 12 ASP CB C 2.885 0.944 -5.204 1.00 . A A . 12 ASP CB 1 1 12 4394 1 1 12 ASP CG C 3.522 0.038 -6.237 1.00 . A A . 12 ASP CG 1 1 12 4395 1 1 12 ASP H H 5.236 1.943 -4.843 1.00 . A A . 12 ASP H 1 1 12 4396 1 1 12 ASP HA H 2.979 2.750 -6.389 1.00 . A A . 12 ASP HA 1 1 12 4397 1 1 12 ASP HB3 H 1.806 0.819 -5.301 1.00 . A A . 12 ASP HB3 1 1 12 4398 1 1 12 ASP N N 4.631 2.719 -5.095 1.00 . A A . 12 ASP N 1 1 12 4399 1 1 12 ASP O O 1.461 3.990 -4.763 1.00 . A A . 12 ASP O 1 1 12 4400 1 1 12 ASP OD1 O 3.215 0.223 -7.430 1.00 . A A . 12 ASP OD1 1 1 12 4401 1 1 12 ASP OD2 O 4.281 -0.860 -5.799 1.00 . A A . 12 ASP OD2 1 1 12 4402 1 1 13 CYS C C 2.027 5.048 -1.978 1.00 . A A . 13 CYS C 1 1 12 4403 1 1 13 CYS CA C 1.799 3.545 -2.036 1.00 . A A . 13 CYS CA 1 1 12 4404 1 1 13 CYS CB C 2.121 2.849 -0.725 1.00 . A A . 13 CYS CB 1 1 12 4405 1 1 13 CYS H H 3.398 2.399 -2.880 1.00 . A A . 13 CYS H 1 1 12 4406 1 1 13 CYS HA H 0.749 3.361 -2.263 1.00 . A A . 13 CYS HA 1 1 12 4407 1 1 13 CYS HB3 H 3.174 2.975 -0.479 1.00 . A A . 13 CYS HB3 1 1 12 4408 1 1 13 CYS N N 2.590 2.969 -3.104 1.00 . A A . 13 CYS N 1 1 12 4409 1 1 13 CYS O O 1.065 5.814 -1.981 1.00 . A A . 13 CYS O 1 1 12 4410 1 1 13 CYS SG S 1.118 3.356 0.674 1.00 . A A . 13 CYS SG 1 1 12 4411 1 1 14 SER C C 3.455 7.407 -3.597 1.00 . A A . 14 SER C 1 1 12 4412 1 1 14 SER CA C 3.730 6.856 -2.189 1.00 . A A . 14 SER CA 1 1 12 4413 1 1 14 SER CB C 5.224 6.932 -1.838 1.00 . A A . 14 SER CB 1 1 12 4414 1 1 14 SER H H 4.007 4.754 -2.083 1.00 . A A . 14 SER H 1 1 12 4415 1 1 14 SER HA H 3.180 7.468 -1.475 1.00 . A A . 14 SER HA 1 1 12 4416 1 1 14 SER HB3 H 5.798 6.337 -2.551 1.00 . A A . 14 SER HB3 1 1 12 4417 1 1 14 SER HG H 5.530 8.577 -2.806 1.00 . A A . 14 SER HG 1 1 12 4418 1 1 14 SER N N 3.292 5.470 -2.053 1.00 . A A . 14 SER N 1 1 12 4419 1 1 14 SER O O 4.315 8.049 -4.202 1.00 . A A . 14 SER O 1 1 12 4420 1 1 14 SER OG O 5.673 8.275 -1.898 1.00 . A A . 14 SER OG 1 1 12 4421 1 1 15 ARG C C 0.220 7.417 -5.384 1.00 . A A . 15 ARG C 1 1 12 4422 1 1 15 ARG CA C 1.729 7.633 -5.383 1.00 . A A . 15 ARG CA 1 1 12 4423 1 1 15 ARG CB C 2.421 6.893 -6.540 1.00 . A A . 15 ARG CB 1 1 12 4424 1 1 15 ARG CD C 0.779 6.613 -8.484 1.00 . A A . 15 ARG CD 1 1 12 4425 1 1 15 ARG CG C 1.965 7.405 -7.913 1.00 . A A . 15 ARG CG 1 1 12 4426 1 1 15 ARG CZ C -0.629 8.323 -9.653 1.00 . A A . 15 ARG CZ 1 1 12 4427 1 1 15 ARG H H 1.587 6.742 -3.465 1.00 . A A . 15 ARG H 1 1 12 4428 1 1 15 ARG HA H 1.928 8.701 -5.477 1.00 . A A . 15 ARG HA 1 1 12 4429 1 1 15 ARG HB3 H 2.253 5.818 -6.469 1.00 . A A . 15 ARG HB3 1 1 12 4430 1 1 15 ARG HD3 H -0.008 6.444 -7.752 1.00 . A A . 15 ARG HD3 1 1 12 4431 1 1 15 ARG HE H 0.511 6.899 -10.560 1.00 . A A . 15 ARG HE 1 1 12 4432 1 1 15 ARG HG3 H 2.802 7.294 -8.609 1.00 . A A . 15 ARG HG3 1 1 12 4433 1 1 15 ARG HH11 H -0.713 8.500 -7.599 1.00 . A A . 15 ARG HH11 1 1 12 4434 1 1 15 ARG HH12 H -1.664 9.649 -8.468 1.00 . A A . 15 ARG HH12 1 1 12 4435 1 1 15 ARG HH21 H -0.758 8.447 -11.691 1.00 . A A . 15 ARG HH21 1 1 12 4436 1 1 15 ARG HH22 H -1.692 9.625 -10.831 1.00 . A A . 15 ARG HH22 1 1 12 4437 1 1 15 ARG N N 2.237 7.195 -4.091 1.00 . A A . 15 ARG N 1 1 12 4438 1 1 15 ARG NE N 0.215 7.278 -9.669 1.00 . A A . 15 ARG NE 1 1 12 4439 1 1 15 ARG NH1 N -1.039 8.862 -8.497 1.00 . A A . 15 ARG NH1 1 1 12 4440 1 1 15 ARG NH2 N -1.064 8.835 -10.810 1.00 . A A . 15 ARG NH2 1 1 12 4441 1 1 15 ARG O O -0.522 8.246 -5.911 1.00 . A A . 15 ARG O 1 1 12 4442 1 1 16 LYS C C -2.048 7.189 -3.394 1.00 . A A . 16 LYS C 1 1 12 4443 1 1 16 LYS CA C -1.636 6.132 -4.428 1.00 . A A . 16 LYS CA 1 1 12 4444 1 1 16 LYS CB C -1.850 4.724 -3.853 1.00 . A A . 16 LYS CB 1 1 12 4445 1 1 16 LYS CD C -2.995 3.505 -5.827 1.00 . A A . 16 LYS CD 1 1 12 4446 1 1 16 LYS CE C -4.254 3.052 -5.069 1.00 . A A . 16 LYS CE 1 1 12 4447 1 1 16 LYS CG C -1.765 3.610 -4.910 1.00 . A A . 16 LYS CG 1 1 12 4448 1 1 16 LYS H H 0.423 5.578 -4.536 1.00 . A A . 16 LYS H 1 1 12 4449 1 1 16 LYS HA H -2.265 6.269 -5.307 1.00 . A A . 16 LYS HA 1 1 12 4450 1 1 16 LYS HB3 H -2.810 4.683 -3.341 1.00 . A A . 16 LYS HB3 1 1 12 4451 1 1 16 LYS HD3 H -2.753 2.769 -6.597 1.00 . A A . 16 LYS HD3 1 1 12 4452 1 1 16 LYS HE3 H -4.541 3.801 -4.332 1.00 . A A . 16 LYS HE3 1 1 12 4453 1 1 16 LYS HG3 H -1.619 2.658 -4.397 1.00 . A A . 16 LYS HG3 1 1 12 4454 1 1 16 LYS HZ1 H -5.184 2.129 -6.659 1.00 . A A . 16 LYS HZ1 1 1 12 4455 1 1 16 LYS HZ2 H -6.204 2.533 -5.434 1.00 . A A . 16 LYS HZ2 1 1 12 4456 1 1 16 LYS HZ3 H -5.639 3.698 -6.445 1.00 . A A . 16 LYS HZ3 1 1 12 4457 1 1 16 LYS N N -0.241 6.302 -4.806 1.00 . A A . 16 LYS N 1 1 12 4458 1 1 16 LYS NZ N -5.404 2.838 -5.972 1.00 . A A . 16 LYS NZ 1 1 12 4459 1 1 16 LYS O O -3.137 7.748 -3.497 1.00 . A A . 16 LYS O 1 1 12 4460 1 1 17 CYS C C -0.288 9.024 -0.779 1.00 . A A . 17 CYS C 1 1 12 4461 1 1 17 CYS CA C -1.524 8.212 -1.199 1.00 . A A . 17 CYS CA 1 1 12 4462 1 1 17 CYS CB C -1.991 7.245 -0.109 1.00 . A A . 17 CYS CB 1 1 12 4463 1 1 17 CYS H H -0.322 6.922 -2.350 1.00 . A A . 17 CYS H 1 1 12 4464 1 1 17 CYS HA H -2.353 8.880 -1.425 1.00 . A A . 17 CYS HA 1 1 12 4465 1 1 17 CYS HB3 H -1.319 6.386 -0.065 1.00 . A A . 17 CYS HB3 1 1 12 4466 1 1 17 CYS N N -1.207 7.422 -2.382 1.00 . A A . 17 CYS N 1 1 12 4467 1 1 17 CYS O O 0.816 8.483 -0.797 1.00 . A A . 17 CYS O 1 1 12 4468 1 1 17 CYS SG S -2.119 7.895 1.569 1.00 . A A . 17 CYS SG 1 1 12 4469 1 1 18 PRO C C 1.321 11.042 1.128 1.00 . A A . 18 PRO C 1 1 12 4470 1 1 18 PRO CA C 0.713 11.217 -0.268 1.00 . A A . 18 PRO CA 1 1 12 4471 1 1 18 PRO CB C 0.148 12.629 -0.454 1.00 . A A . 18 PRO CB 1 1 12 4472 1 1 18 PRO CD C -1.668 11.084 -0.458 1.00 . A A . 18 PRO CD 1 1 12 4473 1 1 18 PRO CG C -1.290 12.481 0.037 1.00 . A A . 18 PRO CG 1 1 12 4474 1 1 18 PRO HA H 1.486 11.032 -1.018 1.00 . A A . 18 PRO HA 1 1 12 4475 1 1 18 PRO HB3 H 0.141 12.878 -1.518 1.00 . A A . 18 PRO HB3 1 1 12 4476 1 1 18 PRO HD3 H -2.068 11.163 -1.469 1.00 . A A . 18 PRO HD3 1 1 12 4477 1 1 18 PRO HG3 H -1.947 13.256 -0.359 1.00 . A A . 18 PRO HG3 1 1 12 4478 1 1 18 PRO N N -0.424 10.329 -0.485 1.00 . A A . 18 PRO N 1 1 12 4479 1 1 18 PRO O O 0.750 10.370 1.984 1.00 . A A . 18 PRO O 1 1 12 4480 1 1 19 GLY C C 4.124 10.498 2.790 1.00 . A A . 19 GLY C 1 1 12 4481 1 1 19 GLY CA C 3.174 11.688 2.640 1.00 . A A . 19 GLY CA 1 1 12 4482 1 1 19 GLY H H 2.861 12.243 0.612 1.00 . A A . 19 GLY H 1 1 12 4483 1 1 19 GLY HA2 H 3.761 12.604 2.707 1.00 . A A . 19 GLY HA2 1 1 12 4484 1 1 19 GLY HA3 H 2.455 11.683 3.461 1.00 . A A . 19 GLY HA3 1 1 12 4485 1 1 19 GLY N N 2.473 11.684 1.356 1.00 . A A . 19 GLY N 1 1 12 4486 1 1 19 GLY O O 4.350 10.020 3.898 1.00 . A A . 19 GLY O 1 1 12 4487 1 1 20 ASN C C 5.127 7.670 2.495 1.00 . A A . 20 ASN C 1 1 12 4488 1 1 20 ASN CA C 5.496 8.820 1.541 1.00 . A A . 20 ASN CA 1 1 12 4489 1 1 20 ASN CB C 6.986 9.183 1.616 1.00 . A A . 20 ASN CB 1 1 12 4490 1 1 20 ASN CG C 7.887 8.010 1.221 1.00 . A A . 20 ASN CG 1 1 12 4491 1 1 20 ASN H H 4.411 10.472 0.802 1.00 . A A . 20 ASN H 1 1 12 4492 1 1 20 ASN HA H 5.314 8.451 0.537 1.00 . A A . 20 ASN HA 1 1 12 4493 1 1 20 ASN HB3 H 7.227 9.504 2.630 1.00 . A A . 20 ASN HB3 1 1 12 4494 1 1 20 ASN HD21 H 9.556 8.969 1.900 1.00 . A A . 20 ASN HD21 1 1 12 4495 1 1 20 ASN HD22 H 9.796 7.376 1.199 1.00 . A A . 20 ASN HD22 1 1 12 4496 1 1 20 ASN N N 4.665 10.019 1.665 1.00 . A A . 20 ASN N 1 1 12 4497 1 1 20 ASN ND2 N 9.190 8.138 1.463 1.00 . A A . 20 ASN ND2 1 1 12 4498 1 1 20 ASN O O 5.973 7.201 3.257 1.00 . A A . 20 ASN O 1 1 12 4499 1 1 20 ASN OD1 O 7.435 7.001 0.689 1.00 . A A . 20 ASN OD1 1 1 12 4500 1 1 21 PRO C C 4.184 4.757 2.389 1.00 . A A . 21 PRO C 1 1 12 4501 1 1 21 PRO CA C 3.513 5.939 3.110 1.00 . A A . 21 PRO CA 1 1 12 4502 1 1 21 PRO CB C 1.990 5.874 2.998 1.00 . A A . 21 PRO CB 1 1 12 4503 1 1 21 PRO CD C 2.745 7.744 1.749 1.00 . A A . 21 PRO CD 1 1 12 4504 1 1 21 PRO CG C 1.688 6.651 1.717 1.00 . A A . 21 PRO CG 1 1 12 4505 1 1 21 PRO HA H 3.789 5.996 4.162 1.00 . A A . 21 PRO HA 1 1 12 4506 1 1 21 PRO HB3 H 1.547 6.396 3.847 1.00 . A A . 21 PRO HB3 1 1 12 4507 1 1 21 PRO HD3 H 2.357 8.560 2.352 1.00 . A A . 21 PRO HD3 1 1 12 4508 1 1 21 PRO HG3 H 0.679 7.060 1.702 1.00 . A A . 21 PRO HG3 1 1 12 4509 1 1 21 PRO N N 3.883 7.173 2.447 1.00 . A A . 21 PRO N 1 1 12 4510 1 1 21 PRO O O 4.099 4.677 1.165 1.00 . A A . 21 PRO O 1 1 12 4511 1 1 22 PRO C C 4.553 1.541 2.268 1.00 . A A . 22 PRO C 1 1 12 4512 1 1 22 PRO CA C 5.527 2.702 2.506 1.00 . A A . 22 PRO CA 1 1 12 4513 1 1 22 PRO CB C 6.599 2.317 3.532 1.00 . A A . 22 PRO CB 1 1 12 4514 1 1 22 PRO CD C 5.121 3.901 4.536 1.00 . A A . 22 PRO CD 1 1 12 4515 1 1 22 PRO CG C 5.912 2.634 4.862 1.00 . A A . 22 PRO CG 1 1 12 4516 1 1 22 PRO HA H 6.005 2.976 1.565 1.00 . A A . 22 PRO HA 1 1 12 4517 1 1 22 PRO HB3 H 7.461 2.974 3.413 1.00 . A A . 22 PRO HB3 1 1 12 4518 1 1 22 PRO HD3 H 5.738 4.775 4.750 1.00 . A A . 22 PRO HD3 1 1 12 4519 1 1 22 PRO HG3 H 6.624 2.787 5.673 1.00 . A A . 22 PRO HG3 1 1 12 4520 1 1 22 PRO N N 4.854 3.843 3.107 1.00 . A A . 22 PRO N 1 1 12 4521 1 1 22 PRO O O 3.370 1.610 2.611 1.00 . A A . 22 PRO O 1 1 12 4522 1 1 23 CYS C C 4.417 -1.413 3.169 1.00 . A A . 23 CYS C 1 1 12 4523 1 1 23 CYS CA C 4.332 -0.827 1.762 1.00 . A A . 23 CYS CA 1 1 12 4524 1 1 23 CYS CB C 4.877 -1.878 0.783 1.00 . A A . 23 CYS CB 1 1 12 4525 1 1 23 CYS H H 6.038 0.406 1.457 1.00 . A A . 23 CYS H 1 1 12 4526 1 1 23 CYS HA H 3.293 -0.634 1.496 1.00 . A A . 23 CYS HA 1 1 12 4527 1 1 23 CYS HB3 H 4.194 -2.726 0.833 1.00 . A A . 23 CYS HB3 1 1 12 4528 1 1 23 CYS N N 5.068 0.428 1.734 1.00 . A A . 23 CYS N 1 1 12 4529 1 1 23 CYS O O 5.501 -1.795 3.613 1.00 . A A . 23 CYS O 1 1 12 4530 1 1 23 CYS SG S 5.025 -1.467 -0.968 1.00 . A A . 23 CYS SG 1 1 12 4531 1 1 24 ARG C C 3.249 -4.010 3.931 1.00 . A A . 24 ARG C 1 1 12 4532 1 1 24 ARG CA C 3.162 -2.725 4.764 1.00 . A A . 24 ARG CA 1 1 12 4533 1 1 24 ARG CB C 1.848 -2.619 5.555 1.00 . A A . 24 ARG CB 1 1 12 4534 1 1 24 ARG CD C 0.459 -3.595 7.432 1.00 . A A . 24 ARG CD 1 1 12 4535 1 1 24 ARG CG C 1.736 -3.741 6.598 1.00 . A A . 24 ARG CG 1 1 12 4536 1 1 24 ARG CZ C -0.651 -4.835 9.295 1.00 . A A . 24 ARG CZ 1 1 12 4537 1 1 24 ARG H H 2.423 -1.323 3.375 1.00 . A A . 24 ARG H 1 1 12 4538 1 1 24 ARG HA H 3.988 -2.693 5.478 1.00 . A A . 24 ARG HA 1 1 12 4539 1 1 24 ARG HB3 H 0.999 -2.662 4.872 1.00 . A A . 24 ARG HB3 1 1 12 4540 1 1 24 ARG HD3 H -0.399 -3.603 6.754 1.00 . A A . 24 ARG HD3 1 1 12 4541 1 1 24 ARG HE H 1.065 -5.399 8.359 1.00 . A A . 24 ARG HE 1 1 12 4542 1 1 24 ARG HG3 H 2.605 -3.703 7.258 1.00 . A A . 24 ARG HG3 1 1 12 4543 1 1 24 ARG HH11 H -1.602 -3.137 8.720 1.00 . A A . 24 ARG HH11 1 1 12 4544 1 1 24 ARG HH12 H -2.382 -3.988 10.020 1.00 . A A . 24 ARG HH12 1 1 12 4545 1 1 24 ARG HH21 H 0.070 -6.581 10.083 1.00 . A A . 24 ARG HH21 1 1 12 4546 1 1 24 ARG HH22 H -1.395 -6.007 10.808 1.00 . A A . 24 ARG HH22 1 1 12 4547 1 1 24 ARG N N 3.281 -1.620 3.829 1.00 . A A . 24 ARG N 1 1 12 4548 1 1 24 ARG NE N 0.338 -4.699 8.398 1.00 . A A . 24 ARG NE 1 1 12 4549 1 1 24 ARG NH1 N -1.625 -3.921 9.356 1.00 . A A . 24 ARG NH1 1 1 12 4550 1 1 24 ARG NH2 N -0.662 -5.885 10.125 1.00 . A A . 24 ARG NH2 1 1 12 4551 1 1 24 ARG O O 2.222 -4.585 3.577 1.00 . A A . 24 ARG O 1 1 12 4552 1 1 25 ASN C C 3.750 -6.251 2.067 1.00 . A A . 25 ASN C 1 1 12 4553 1 1 25 ASN CA C 4.890 -5.599 2.857 1.00 . A A . 25 ASN CA 1 1 12 4554 1 1 25 ASN CB C 5.546 -6.592 3.826 1.00 . A A . 25 ASN CB 1 1 12 4555 1 1 25 ASN CG C 5.986 -7.877 3.125 1.00 . A A . 25 ASN CG 1 1 12 4556 1 1 25 ASN H H 5.223 -3.746 3.840 1.00 . A A . 25 ASN H 1 1 12 4557 1 1 25 ASN HA H 5.649 -5.285 2.141 1.00 . A A . 25 ASN HA 1 1 12 4558 1 1 25 ASN HB3 H 4.835 -6.849 4.613 1.00 . A A . 25 ASN HB3 1 1 12 4559 1 1 25 ASN HD21 H 7.130 -6.868 1.760 1.00 . A A . 25 ASN HD21 1 1 12 4560 1 1 25 ASN HD22 H 7.084 -8.612 1.612 1.00 . A A . 25 ASN HD22 1 1 12 4561 1 1 25 ASN N N 4.486 -4.397 3.589 1.00 . A A . 25 ASN N 1 1 12 4562 1 1 25 ASN ND2 N 6.792 -7.764 2.073 1.00 . A A . 25 ASN ND2 1 1 12 4563 1 1 25 ASN O O 3.136 -7.206 2.537 1.00 . A A . 25 ASN O 1 1 12 4564 1 1 25 ASN OD1 O 5.621 -8.973 3.534 1.00 . A A . 25 ASN OD1 1 1 12 4565 1 1 26 GLY C C 1.252 -5.214 -0.083 1.00 . A A . 26 GLY C 1 1 12 4566 1 1 26 GLY CA C 2.403 -6.213 0.014 1.00 . A A . 26 GLY CA 1 1 12 4567 1 1 26 GLY H H 4.009 -4.941 0.531 1.00 . A A . 26 GLY H 1 1 12 4568 1 1 26 GLY HA2 H 2.811 -6.377 -0.983 1.00 . A A . 26 GLY HA2 1 1 12 4569 1 1 26 GLY HA3 H 1.999 -7.161 0.369 1.00 . A A . 26 GLY HA3 1 1 12 4570 1 1 26 GLY N N 3.471 -5.724 0.873 1.00 . A A . 26 GLY N 1 1 12 4571 1 1 26 GLY O O 0.544 -5.216 -1.090 1.00 . A A . 26 GLY O 1 1 12 4572 1 1 27 PHE C C 0.255 -2.090 1.418 1.00 . A A . 27 PHE C 1 1 12 4573 1 1 27 PHE CA C -0.132 -3.528 1.074 1.00 . A A . 27 PHE CA 1 1 12 4574 1 1 27 PHE CB C -1.062 -4.117 2.138 1.00 . A A . 27 PHE CB 1 1 12 4575 1 1 27 PHE CD1 C -2.212 -5.998 0.906 1.00 . A A . 27 PHE CD1 1 1 12 4576 1 1 27 PHE CD2 C -0.537 -6.551 2.584 1.00 . A A . 27 PHE CD2 1 1 12 4577 1 1 27 PHE CE1 C -2.309 -7.358 0.558 1.00 . A A . 27 PHE CE1 1 1 12 4578 1 1 27 PHE CE2 C -0.620 -7.906 2.223 1.00 . A A . 27 PHE CE2 1 1 12 4579 1 1 27 PHE CG C -1.338 -5.593 1.932 1.00 . A A . 27 PHE CG 1 1 12 4580 1 1 27 PHE CZ C -1.514 -8.311 1.217 1.00 . A A . 27 PHE CZ 1 1 12 4581 1 1 27 PHE H H 1.644 -4.452 1.767 1.00 . A A . 27 PHE H 1 1 12 4582 1 1 27 PHE HA H -0.659 -3.521 0.126 1.00 . A A . 27 PHE HA 1 1 12 4583 1 1 27 PHE HB3 H -2.004 -3.566 2.125 1.00 . A A . 27 PHE HB3 1 1 12 4584 1 1 27 PHE HD1 H -2.764 -5.256 0.346 1.00 . A A . 27 PHE HD1 1 1 12 4585 1 1 27 PHE HD2 H 0.213 -6.243 3.300 1.00 . A A . 27 PHE HD2 1 1 12 4586 1 1 27 PHE HE1 H -2.978 -7.670 -0.227 1.00 . A A . 27 PHE HE1 1 1 12 4587 1 1 27 PHE HE2 H 0.037 -8.626 2.690 1.00 . A A . 27 PHE HE2 1 1 12 4588 1 1 27 PHE HZ H -1.570 -9.352 0.933 1.00 . A A . 27 PHE HZ 1 1 12 4589 1 1 27 PHE N N 1.048 -4.380 0.948 1.00 . A A . 27 PHE N 1 1 12 4590 1 1 27 PHE O O 1.195 -1.871 2.172 1.00 . A A . 27 PHE O 1 1 12 4591 1 1 28 CYS C C -0.455 0.843 2.388 1.00 . A A . 28 CYS C 1 1 12 4592 1 1 28 CYS CA C -0.112 0.312 0.996 1.00 . A A . 28 CYS CA 1 1 12 4593 1 1 28 CYS CB C -0.860 1.109 -0.079 1.00 . A A . 28 CYS CB 1 1 12 4594 1 1 28 CYS H H -1.241 -1.354 0.283 1.00 . A A . 28 CYS H 1 1 12 4595 1 1 28 CYS HA H 0.958 0.431 0.831 1.00 . A A . 28 CYS HA 1 1 12 4596 1 1 28 CYS HB3 H -1.908 0.812 -0.094 1.00 . A A . 28 CYS HB3 1 1 12 4597 1 1 28 CYS N N -0.448 -1.104 0.863 1.00 . A A . 28 CYS N 1 1 12 4598 1 1 28 CYS O O -1.631 0.920 2.743 1.00 . A A . 28 CYS O 1 1 12 4599 1 1 28 CYS SG S -0.829 2.908 0.109 1.00 . A A . 28 CYS SG 1 1 12 4600 1 1 29 ALA C C -0.100 3.257 4.462 1.00 . A A . 29 ALA C 1 1 12 4601 1 1 29 ALA CA C 0.325 1.782 4.515 1.00 . A A . 29 ALA CA 1 1 12 4602 1 1 29 ALA CB C 1.599 1.597 5.348 1.00 . A A . 29 ALA CB 1 1 12 4603 1 1 29 ALA H H 1.501 1.264 2.815 1.00 . A A . 29 ALA H 1 1 12 4604 1 1 29 ALA HA H -0.468 1.218 5.004 1.00 . A A . 29 ALA HA 1 1 12 4605 1 1 29 ALA HB1 H 1.412 1.889 6.380 1.00 . A A . 29 ALA HB1 1 1 12 4606 1 1 29 ALA HB2 H 1.908 0.553 5.324 1.00 . A A . 29 ALA HB2 1 1 12 4607 1 1 29 ALA HB3 H 2.404 2.212 4.946 1.00 . A A . 29 ALA HB3 1 1 12 4608 1 1 29 ALA N N 0.547 1.250 3.175 1.00 . A A . 29 ALA N 1 1 12 4609 1 1 29 ALA O O 0.498 4.102 5.126 1.00 . A A . 29 ALA O 1 1 12 4610 1 1 30 CYS C C -2.126 5.451 4.907 1.00 . A A . 30 CYS C 1 1 12 4611 1 1 30 CYS CA C -1.630 4.945 3.553 1.00 . A A . 30 CYS CA 1 1 12 4612 1 1 30 CYS CB C -2.774 5.014 2.542 1.00 . A A . 30 CYS CB 1 1 12 4613 1 1 30 CYS H H -1.601 2.827 3.176 1.00 . A A . 30 CYS H 1 1 12 4614 1 1 30 CYS HA H -0.821 5.586 3.201 1.00 . A A . 30 CYS HA 1 1 12 4615 1 1 30 CYS HB3 H -3.546 4.306 2.843 1.00 . A A . 30 CYS HB3 1 1 12 4616 1 1 30 CYS N N -1.125 3.578 3.667 1.00 . A A . 30 CYS N 1 1 12 4617 1 1 30 CYS O O -2.736 4.703 5.668 1.00 . A A . 30 CYS O 1 1 12 4618 1 1 30 CYS SG S -3.562 6.640 2.406 1.00 . A A . 30 CYS SG 1 1 12 4619 1 1 31 THR C C -3.965 7.217 6.395 1.00 . A A . 31 THR C 1 1 12 4620 1 1 31 THR CA C -2.443 7.383 6.380 1.00 . A A . 31 THR CA 1 1 12 4621 1 1 31 THR CB C -2.054 8.866 6.308 1.00 . A A . 31 THR CB 1 1 12 4622 1 1 31 THR CG2 C -0.558 9.064 6.565 1.00 . A A . 31 THR CG2 1 1 12 4623 1 1 31 THR H H -1.461 7.340 4.525 1.00 . A A . 31 THR H 1 1 12 4624 1 1 31 THR HA H -2.036 6.934 7.285 1.00 . A A . 31 THR HA 1 1 12 4625 1 1 31 THR HB H -2.620 9.433 7.050 1.00 . A A . 31 THR HB 1 1 12 4626 1 1 31 THR HG1 H -3.291 9.146 4.845 1.00 . A A . 31 THR HG1 1 1 12 4627 1 1 31 THR HG21 H 0.034 8.533 5.819 1.00 . A A . 31 THR HG21 1 1 12 4628 1 1 31 THR HG22 H -0.322 10.126 6.511 1.00 . A A . 31 THR HG22 1 1 12 4629 1 1 31 THR HG23 H -0.300 8.693 7.559 1.00 . A A . 31 THR HG23 1 1 12 4630 1 1 31 THR N N -1.894 6.730 5.204 1.00 . A A . 31 THR N 1 1 12 4631 1 1 31 THR O O -4.658 7.954 5.692 1.00 . A A . 31 THR O 1 1 12 4632 1 1 31 THR OG1 O -2.358 9.339 5.011 1.00 . A A . 31 THR OG1 1 1 13 4633 1 1 1 THR C C -10.086 -5.359 -1.762 1.00 . A A . 1 THR C 1 1 13 4634 1 1 1 THR CA C -9.038 -5.743 -2.824 1.00 . A A . 1 THR CA 1 1 13 4635 1 1 1 THR CB C -7.639 -5.924 -2.209 1.00 . A A . 1 THR CB 1 1 13 4636 1 1 1 THR CG2 C -6.800 -6.881 -3.059 1.00 . A A . 1 THR CG2 1 1 13 4637 1 1 1 THR H1 H -8.209 -4.046 -3.645 1.00 . A A . 1 THR H1 1 1 13 4638 1 1 1 THR HA H -9.353 -6.661 -3.316 1.00 . A A . 1 THR HA 1 1 13 4639 1 1 1 THR HB H -7.721 -6.340 -1.203 1.00 . A A . 1 THR HB 1 1 13 4640 1 1 1 THR HG1 H -6.449 -4.659 -1.347 1.00 . A A . 1 THR HG1 1 1 13 4641 1 1 1 THR HG21 H -7.281 -7.857 -3.111 1.00 . A A . 1 THR HG21 1 1 13 4642 1 1 1 THR HG22 H -6.688 -6.481 -4.068 1.00 . A A . 1 THR HG22 1 1 13 4643 1 1 1 THR HG23 H -5.815 -7.000 -2.608 1.00 . A A . 1 THR HG23 1 1 13 4644 1 1 1 THR N N -8.935 -4.723 -3.850 1.00 . A A . 1 THR N 1 1 13 4645 1 1 1 THR O O -10.384 -4.176 -1.580 1.00 . A A . 1 THR O 1 1 13 4646 1 1 1 THR OG1 O -6.963 -4.680 -2.166 1.00 . A A . 1 THR OG1 1 1 13 4647 1 1 2 PRO C C -10.970 -5.513 1.213 1.00 . A A . 2 PRO C 1 1 13 4648 1 1 2 PRO CA C -11.660 -6.110 -0.017 1.00 . A A . 2 PRO CA 1 1 13 4649 1 1 2 PRO CB C -12.290 -7.482 0.255 1.00 . A A . 2 PRO CB 1 1 13 4650 1 1 2 PRO CD C -10.444 -7.773 -1.231 1.00 . A A . 2 PRO CD 1 1 13 4651 1 1 2 PRO CG C -11.150 -8.450 -0.056 1.00 . A A . 2 PRO CG 1 1 13 4652 1 1 2 PRO HA H -12.438 -5.423 -0.360 1.00 . A A . 2 PRO HA 1 1 13 4653 1 1 2 PRO HB3 H -13.101 -7.649 -0.454 1.00 . A A . 2 PRO HB3 1 1 13 4654 1 1 2 PRO HD3 H -10.902 -8.103 -2.164 1.00 . A A . 2 PRO HD3 1 1 13 4655 1 1 2 PRO HG3 H -11.510 -9.451 -0.306 1.00 . A A . 2 PRO HG3 1 1 13 4656 1 1 2 PRO N N -10.673 -6.347 -1.060 1.00 . A A . 2 PRO N 1 1 13 4657 1 1 2 PRO O O -10.713 -6.212 2.191 1.00 . A A . 2 PRO O 1 1 13 4658 1 1 3 PHE C C -8.283 -4.085 1.741 1.00 . A A . 3 PHE C 1 1 13 4659 1 1 3 PHE CA C -9.695 -3.548 2.018 1.00 . A A . 3 PHE CA 1 1 13 4660 1 1 3 PHE CB C -10.129 -3.636 3.494 1.00 . A A . 3 PHE CB 1 1 13 4661 1 1 3 PHE CD1 C -9.589 -1.274 4.234 1.00 . A A . 3 PHE CD1 1 1 13 4662 1 1 3 PHE CD2 C -8.547 -3.131 5.414 1.00 . A A . 3 PHE CD2 1 1 13 4663 1 1 3 PHE CE1 C -8.851 -0.365 5.013 1.00 . A A . 3 PHE CE1 1 1 13 4664 1 1 3 PHE CE2 C -7.808 -2.221 6.191 1.00 . A A . 3 PHE CE2 1 1 13 4665 1 1 3 PHE CG C -9.430 -2.660 4.424 1.00 . A A . 3 PHE CG 1 1 13 4666 1 1 3 PHE CZ C -7.956 -0.839 5.987 1.00 . A A . 3 PHE CZ 1 1 13 4667 1 1 3 PHE H H -10.800 -3.784 0.233 1.00 . A A . 3 PHE H 1 1 13 4668 1 1 3 PHE HA H -9.702 -2.499 1.720 1.00 . A A . 3 PHE HA 1 1 13 4669 1 1 3 PHE HB3 H -9.964 -4.648 3.861 1.00 . A A . 3 PHE HB3 1 1 13 4670 1 1 3 PHE HD1 H -10.286 -0.901 3.498 1.00 . A A . 3 PHE HD1 1 1 13 4671 1 1 3 PHE HD2 H -8.424 -4.193 5.581 1.00 . A A . 3 PHE HD2 1 1 13 4672 1 1 3 PHE HE1 H -8.989 0.699 4.876 1.00 . A A . 3 PHE HE1 1 1 13 4673 1 1 3 PHE HE2 H -7.139 -2.585 6.960 1.00 . A A . 3 PHE HE2 1 1 13 4674 1 1 3 PHE HZ H -7.405 -0.139 6.600 1.00 . A A . 3 PHE HZ 1 1 13 4675 1 1 3 PHE N N -10.644 -4.219 1.137 1.00 . A A . 3 PHE N 1 1 13 4676 1 1 3 PHE O O -8.092 -4.874 0.817 1.00 . A A . 3 PHE O 1 1 13 4677 1 1 4 ALA C C -5.508 -3.594 0.825 1.00 . A A . 4 ALA C 1 1 13 4678 1 1 4 ALA CA C -5.877 -3.943 2.268 1.00 . A A . 4 ALA CA 1 1 13 4679 1 1 4 ALA CB C -5.582 -5.404 2.628 1.00 . A A . 4 ALA CB 1 1 13 4680 1 1 4 ALA H H -7.501 -2.970 3.236 1.00 . A A . 4 ALA H 1 1 13 4681 1 1 4 ALA HA H -5.279 -3.316 2.931 1.00 . A A . 4 ALA HA 1 1 13 4682 1 1 4 ALA HB1 H -4.513 -5.594 2.525 1.00 . A A . 4 ALA HB1 1 1 13 4683 1 1 4 ALA HB2 H -5.874 -5.594 3.660 1.00 . A A . 4 ALA HB2 1 1 13 4684 1 1 4 ALA HB3 H -6.125 -6.086 1.973 1.00 . A A . 4 ALA HB3 1 1 13 4685 1 1 4 ALA N N -7.281 -3.624 2.501 1.00 . A A . 4 ALA N 1 1 13 4686 1 1 4 ALA O O -5.263 -4.469 -0.005 1.00 . A A . 4 ALA O 1 1 13 4687 1 1 5 ILE C C -3.821 -2.298 -1.240 1.00 . A A . 5 ILE C 1 1 13 4688 1 1 5 ILE CA C -5.201 -1.788 -0.816 1.00 . A A . 5 ILE CA 1 1 13 4689 1 1 5 ILE CB C -5.283 -0.245 -0.827 1.00 . A A . 5 ILE CB 1 1 13 4690 1 1 5 ILE CD1 C -6.827 1.739 -0.312 1.00 . A A . 5 ILE CD1 1 1 13 4691 1 1 5 ILE CG1 C -6.696 0.217 -0.419 1.00 . A A . 5 ILE CG1 1 1 13 4692 1 1 5 ILE CG2 C -4.920 0.301 -2.218 1.00 . A A . 5 ILE CG2 1 1 13 4693 1 1 5 ILE H H -5.688 -1.629 1.251 1.00 . A A . 5 ILE H 1 1 13 4694 1 1 5 ILE HA H -5.957 -2.176 -1.502 1.00 . A A . 5 ILE HA 1 1 13 4695 1 1 5 ILE HB H -4.562 0.146 -0.105 1.00 . A A . 5 ILE HB 1 1 13 4696 1 1 5 ILE HD11 H -6.021 2.142 0.303 1.00 . A A . 5 ILE HD11 1 1 13 4697 1 1 5 ILE HD12 H -6.802 2.197 -1.299 1.00 . A A . 5 ILE HD12 1 1 13 4698 1 1 5 ILE HD13 H -7.782 1.982 0.152 1.00 . A A . 5 ILE HD13 1 1 13 4699 1 1 5 ILE HG13 H -6.949 -0.186 0.562 1.00 . A A . 5 ILE HG13 1 1 13 4700 1 1 5 ILE HG21 H -3.911 0.001 -2.500 1.00 . A A . 5 ILE HG21 1 1 13 4701 1 1 5 ILE HG22 H -5.625 -0.073 -2.961 1.00 . A A . 5 ILE HG22 1 1 13 4702 1 1 5 ILE HG23 H -4.944 1.388 -2.219 1.00 . A A . 5 ILE HG23 1 1 13 4703 1 1 5 ILE N N -5.497 -2.294 0.518 1.00 . A A . 5 ILE N 1 1 13 4704 1 1 5 ILE O O -2.853 -2.153 -0.494 1.00 . A A . 5 ILE O 1 1 13 4705 1 1 6 LYS C C -1.427 -2.309 -3.074 1.00 . A A . 6 LYS C 1 1 13 4706 1 1 6 LYS CA C -2.462 -3.425 -2.937 1.00 . A A . 6 LYS CA 1 1 13 4707 1 1 6 LYS CB C -2.678 -4.102 -4.299 1.00 . A A . 6 LYS CB 1 1 13 4708 1 1 6 LYS CD C -2.358 -6.660 -4.335 1.00 . A A . 6 LYS CD 1 1 13 4709 1 1 6 LYS CE C -1.277 -6.748 -3.243 1.00 . A A . 6 LYS CE 1 1 13 4710 1 1 6 LYS CG C -3.338 -5.481 -4.173 1.00 . A A . 6 LYS CG 1 1 13 4711 1 1 6 LYS H H -4.555 -3.020 -2.987 1.00 . A A . 6 LYS H 1 1 13 4712 1 1 6 LYS HA H -2.087 -4.152 -2.221 1.00 . A A . 6 LYS HA 1 1 13 4713 1 1 6 LYS HB3 H -1.731 -4.201 -4.828 1.00 . A A . 6 LYS HB3 1 1 13 4714 1 1 6 LYS HD3 H -1.911 -6.644 -5.332 1.00 . A A . 6 LYS HD3 1 1 13 4715 1 1 6 LYS HE3 H -1.061 -7.801 -3.050 1.00 . A A . 6 LYS HE3 1 1 13 4716 1 1 6 LYS HG3 H -4.078 -5.566 -4.972 1.00 . A A . 6 LYS HG3 1 1 13 4717 1 1 6 LYS HZ1 H 0.540 -6.661 -4.255 1.00 . A A . 6 LYS HZ1 1 1 13 4718 1 1 6 LYS HZ2 H -0.076 -5.167 -4.000 1.00 . A A . 6 LYS HZ2 1 1 13 4719 1 1 6 LYS HZ3 H 0.549 -5.963 -2.762 1.00 . A A . 6 LYS HZ3 1 1 13 4720 1 1 6 LYS N N -3.726 -2.915 -2.423 1.00 . A A . 6 LYS N 1 1 13 4721 1 1 6 LYS NZ N 0.003 -6.101 -3.610 1.00 . A A . 6 LYS NZ 1 1 13 4722 1 1 6 LYS O O -1.730 -1.223 -3.562 1.00 . A A . 6 LYS O 1 1 13 4723 1 1 7 CYS C C 1.832 -2.788 -3.979 1.00 . A A . 7 CYS C 1 1 13 4724 1 1 7 CYS CA C 1.010 -1.890 -3.053 1.00 . A A . 7 CYS CA 1 1 13 4725 1 1 7 CYS CB C 1.757 -1.552 -1.764 1.00 . A A . 7 CYS CB 1 1 13 4726 1 1 7 CYS H H -0.028 -3.526 -2.257 1.00 . A A . 7 CYS H 1 1 13 4727 1 1 7 CYS HA H 0.764 -0.963 -3.575 1.00 . A A . 7 CYS HA 1 1 13 4728 1 1 7 CYS HB3 H 2.088 -2.454 -1.257 1.00 . A A . 7 CYS HB3 1 1 13 4729 1 1 7 CYS N N -0.191 -2.624 -2.689 1.00 . A A . 7 CYS N 1 1 13 4730 1 1 7 CYS O O 1.485 -3.964 -4.136 1.00 . A A . 7 CYS O 1 1 13 4731 1 1 7 CYS SG S 3.160 -0.443 -1.912 1.00 . A A . 7 CYS SG 1 1 13 4732 1 1 8 ALA C C 5.271 -2.561 -4.941 1.00 . A A . 8 ALA C 1 1 13 4733 1 1 8 ALA CA C 3.873 -3.037 -5.336 1.00 . A A . 8 ALA CA 1 1 13 4734 1 1 8 ALA CB C 3.597 -2.967 -6.841 1.00 . A A . 8 ALA CB 1 1 13 4735 1 1 8 ALA H H 3.116 -1.282 -4.429 1.00 . A A . 8 ALA H 1 1 13 4736 1 1 8 ALA HA H 3.809 -4.087 -5.045 1.00 . A A . 8 ALA HA 1 1 13 4737 1 1 8 ALA HB1 H 2.654 -3.465 -7.059 1.00 . A A . 8 ALA HB1 1 1 13 4738 1 1 8 ALA HB2 H 3.531 -1.935 -7.177 1.00 . A A . 8 ALA HB2 1 1 13 4739 1 1 8 ALA HB3 H 4.398 -3.472 -7.384 1.00 . A A . 8 ALA HB3 1 1 13 4740 1 1 8 ALA N N 2.893 -2.257 -4.591 1.00 . A A . 8 ALA N 1 1 13 4741 1 1 8 ALA O O 5.954 -3.274 -4.209 1.00 . A A . 8 ALA O 1 1 13 4742 1 1 9 THR C C 6.340 0.320 -3.723 1.00 . A A . 9 THR C 1 1 13 4743 1 1 9 THR CA C 6.832 -0.685 -4.764 1.00 . A A . 9 THR CA 1 1 13 4744 1 1 9 THR CB C 7.675 -0.003 -5.849 1.00 . A A . 9 THR CB 1 1 13 4745 1 1 9 THR CG2 C 8.170 -1.013 -6.887 1.00 . A A . 9 THR CG2 1 1 13 4746 1 1 9 THR H H 5.092 -0.798 -5.982 1.00 . A A . 9 THR H 1 1 13 4747 1 1 9 THR HA H 7.479 -1.404 -4.258 1.00 . A A . 9 THR HA 1 1 13 4748 1 1 9 THR HB H 8.543 0.459 -5.373 1.00 . A A . 9 THR HB 1 1 13 4749 1 1 9 THR HG1 H 6.127 0.639 -6.876 1.00 . A A . 9 THR HG1 1 1 13 4750 1 1 9 THR HG21 H 7.331 -1.449 -7.430 1.00 . A A . 9 THR HG21 1 1 13 4751 1 1 9 THR HG22 H 8.823 -0.506 -7.598 1.00 . A A . 9 THR HG22 1 1 13 4752 1 1 9 THR HG23 H 8.733 -1.807 -6.393 1.00 . A A . 9 THR HG23 1 1 13 4753 1 1 9 THR N N 5.674 -1.355 -5.350 1.00 . A A . 9 THR N 1 1 13 4754 1 1 9 THR O O 5.215 0.806 -3.823 1.00 . A A . 9 THR O 1 1 13 4755 1 1 9 THR OG1 O 6.945 1.011 -6.505 1.00 . A A . 9 THR OG1 1 1 13 4756 1 1 10 ASP C C 6.403 2.971 -2.522 1.00 . A A . 10 ASP C 1 1 13 4757 1 1 10 ASP CA C 6.942 1.738 -1.787 1.00 . A A . 10 ASP CA 1 1 13 4758 1 1 10 ASP CB C 8.264 2.037 -1.064 1.00 . A A . 10 ASP CB 1 1 13 4759 1 1 10 ASP CG C 9.416 2.022 -2.057 1.00 . A A . 10 ASP CG 1 1 13 4760 1 1 10 ASP H H 8.108 0.248 -2.721 1.00 . A A . 10 ASP H 1 1 13 4761 1 1 10 ASP HA H 6.197 1.427 -1.052 1.00 . A A . 10 ASP HA 1 1 13 4762 1 1 10 ASP HB3 H 8.451 1.268 -0.315 1.00 . A A . 10 ASP HB3 1 1 13 4763 1 1 10 ASP N N 7.166 0.641 -2.727 1.00 . A A . 10 ASP N 1 1 13 4764 1 1 10 ASP O O 5.311 3.454 -2.211 1.00 . A A . 10 ASP O 1 1 13 4765 1 1 10 ASP OD1 O 9.672 3.092 -2.646 1.00 . A A . 10 ASP OD1 1 1 13 4766 1 1 10 ASP OD2 O 9.876 0.894 -2.341 1.00 . A A . 10 ASP OD2 1 1 13 4767 1 1 11 ALA C C 5.254 4.357 -4.872 1.00 . A A . 11 ALA C 1 1 13 4768 1 1 11 ALA CA C 6.736 4.446 -4.494 1.00 . A A . 11 ALA CA 1 1 13 4769 1 1 11 ALA CB C 7.629 4.377 -5.734 1.00 . A A . 11 ALA CB 1 1 13 4770 1 1 11 ALA H H 8.116 3.128 -3.561 1.00 . A A . 11 ALA H 1 1 13 4771 1 1 11 ALA HA H 6.917 5.419 -4.038 1.00 . A A . 11 ALA HA 1 1 13 4772 1 1 11 ALA HB1 H 7.375 5.191 -6.413 1.00 . A A . 11 ALA HB1 1 1 13 4773 1 1 11 ALA HB2 H 8.676 4.471 -5.444 1.00 . A A . 11 ALA HB2 1 1 13 4774 1 1 11 ALA HB3 H 7.488 3.431 -6.254 1.00 . A A . 11 ALA HB3 1 1 13 4775 1 1 11 ALA N N 7.143 3.432 -3.536 1.00 . A A . 11 ALA N 1 1 13 4776 1 1 11 ALA O O 4.583 5.382 -4.880 1.00 . A A . 11 ALA O 1 1 13 4777 1 1 12 ASP C C 2.363 3.437 -4.463 1.00 . A A . 12 ASP C 1 1 13 4778 1 1 12 ASP CA C 3.320 3.028 -5.574 1.00 . A A . 12 ASP CA 1 1 13 4779 1 1 12 ASP CB C 2.991 1.607 -6.037 1.00 . A A . 12 ASP CB 1 1 13 4780 1 1 12 ASP CG C 3.745 1.255 -7.298 1.00 . A A . 12 ASP CG 1 1 13 4781 1 1 12 ASP H H 5.274 2.324 -5.067 1.00 . A A . 12 ASP H 1 1 13 4782 1 1 12 ASP HA H 3.156 3.698 -6.414 1.00 . A A . 12 ASP HA 1 1 13 4783 1 1 12 ASP HB3 H 1.926 1.548 -6.267 1.00 . A A . 12 ASP HB3 1 1 13 4784 1 1 12 ASP N N 4.718 3.167 -5.170 1.00 . A A . 12 ASP N 1 1 13 4785 1 1 12 ASP O O 1.313 4.026 -4.728 1.00 . A A . 12 ASP O 1 1 13 4786 1 1 12 ASP OD1 O 3.530 1.982 -8.296 1.00 . A A . 12 ASP OD1 1 1 13 4787 1 1 12 ASP OD2 O 4.532 0.284 -7.231 1.00 . A A . 12 ASP OD2 1 1 13 4788 1 1 13 CYS C C 2.069 5.081 -1.910 1.00 . A A . 13 CYS C 1 1 13 4789 1 1 13 CYS CA C 1.881 3.578 -2.102 1.00 . A A . 13 CYS CA 1 1 13 4790 1 1 13 CYS CB C 2.199 2.784 -0.845 1.00 . A A . 13 CYS CB 1 1 13 4791 1 1 13 CYS H H 3.617 2.728 -3.034 1.00 . A A . 13 CYS H 1 1 13 4792 1 1 13 CYS HA H 0.836 3.391 -2.348 1.00 . A A . 13 CYS HA 1 1 13 4793 1 1 13 CYS HB3 H 3.251 2.884 -0.582 1.00 . A A . 13 CYS HB3 1 1 13 4794 1 1 13 CYS N N 2.698 3.124 -3.212 1.00 . A A . 13 CYS N 1 1 13 4795 1 1 13 CYS O O 1.089 5.827 -1.839 1.00 . A A . 13 CYS O 1 1 13 4796 1 1 13 CYS SG S 1.186 3.237 0.565 1.00 . A A . 13 CYS SG 1 1 13 4797 1 1 14 SER C C 3.442 7.600 -3.302 1.00 . A A . 14 SER C 1 1 13 4798 1 1 14 SER CA C 3.751 6.927 -1.950 1.00 . A A . 14 SER CA 1 1 13 4799 1 1 14 SER CB C 5.252 6.962 -1.618 1.00 . A A . 14 SER CB 1 1 13 4800 1 1 14 SER H H 4.054 4.820 -2.025 1.00 . A A . 14 SER H 1 1 13 4801 1 1 14 SER HA H 3.211 7.466 -1.172 1.00 . A A . 14 SER HA 1 1 13 4802 1 1 14 SER HB3 H 5.788 6.353 -2.344 1.00 . A A . 14 SER HB3 1 1 13 4803 1 1 14 SER HG H 5.592 8.602 -2.573 1.00 . A A . 14 SER HG 1 1 13 4804 1 1 14 SER N N 3.328 5.528 -1.943 1.00 . A A . 14 SER N 1 1 13 4805 1 1 14 SER O O 4.312 8.222 -3.912 1.00 . A A . 14 SER O 1 1 13 4806 1 1 14 SER OG O 5.769 8.278 -1.674 1.00 . A A . 14 SER OG 1 1 13 4807 1 1 15 ARG C C 0.178 7.600 -4.996 1.00 . A A . 15 ARG C 1 1 13 4808 1 1 15 ARG CA C 1.686 7.824 -5.074 1.00 . A A . 15 ARG CA 1 1 13 4809 1 1 15 ARG CB C 2.365 6.922 -6.122 1.00 . A A . 15 ARG CB 1 1 13 4810 1 1 15 ARG CD C 2.280 5.645 -8.264 1.00 . A A . 15 ARG CD 1 1 13 4811 1 1 15 ARG CG C 1.776 6.908 -7.539 1.00 . A A . 15 ARG CG 1 1 13 4812 1 1 15 ARG CZ C 2.270 4.705 -10.587 1.00 . A A . 15 ARG CZ 1 1 13 4813 1 1 15 ARG H H 1.542 7.053 -3.106 1.00 . A A . 15 ARG H 1 1 13 4814 1 1 15 ARG HA H 1.890 8.870 -5.301 1.00 . A A . 15 ARG HA 1 1 13 4815 1 1 15 ARG HB3 H 2.322 5.908 -5.750 1.00 . A A . 15 ARG HB3 1 1 13 4816 1 1 15 ARG HD3 H 1.795 4.774 -7.819 1.00 . A A . 15 ARG HD3 1 1 13 4817 1 1 15 ARG HE H 1.529 6.517 -10.031 1.00 . A A . 15 ARG HE 1 1 13 4818 1 1 15 ARG HG3 H 2.099 7.812 -8.060 1.00 . A A . 15 ARG HG3 1 1 13 4819 1 1 15 ARG HH11 H 3.038 3.274 -9.246 1.00 . A A . 15 ARG HH11 1 1 13 4820 1 1 15 ARG HH12 H 3.072 2.832 -10.884 1.00 . A A . 15 ARG HH12 1 1 13 4821 1 1 15 ARG HH21 H 1.567 5.766 -12.189 1.00 . A A . 15 ARG HH21 1 1 13 4822 1 1 15 ARG HH22 H 2.198 4.195 -12.568 1.00 . A A . 15 ARG HH22 1 1 13 4823 1 1 15 ARG N N 2.191 7.491 -3.747 1.00 . A A . 15 ARG N 1 1 13 4824 1 1 15 ARG NE N 1.975 5.673 -9.700 1.00 . A A . 15 ARG NE 1 1 13 4825 1 1 15 ARG NH1 N 2.836 3.548 -10.219 1.00 . A A . 15 ARG NH1 1 1 13 4826 1 1 15 ARG NH2 N 1.989 4.903 -11.879 1.00 . A A . 15 ARG NH2 1 1 13 4827 1 1 15 ARG O O -0.605 8.507 -5.268 1.00 . A A . 15 ARG O 1 1 13 4828 1 1 16 LYS C C -2.129 7.081 -3.139 1.00 . A A . 16 LYS C 1 1 13 4829 1 1 16 LYS CA C -1.616 6.117 -4.218 1.00 . A A . 16 LYS CA 1 1 13 4830 1 1 16 LYS CB C -1.750 4.639 -3.808 1.00 . A A . 16 LYS CB 1 1 13 4831 1 1 16 LYS CD C -3.795 4.420 -2.284 1.00 . A A . 16 LYS CD 1 1 13 4832 1 1 16 LYS CE C -5.280 4.813 -2.307 1.00 . A A . 16 LYS CE 1 1 13 4833 1 1 16 LYS CG C -3.203 4.156 -3.681 1.00 . A A . 16 LYS CG 1 1 13 4834 1 1 16 LYS H H 0.453 5.666 -4.416 1.00 . A A . 16 LYS H 1 1 13 4835 1 1 16 LYS HA H -2.208 6.275 -5.122 1.00 . A A . 16 LYS HA 1 1 13 4836 1 1 16 LYS HB3 H -1.209 4.452 -2.880 1.00 . A A . 16 LYS HB3 1 1 13 4837 1 1 16 LYS HD3 H -3.230 5.189 -1.761 1.00 . A A . 16 LYS HD3 1 1 13 4838 1 1 16 LYS HE3 H -5.606 4.951 -1.273 1.00 . A A . 16 LYS HE3 1 1 13 4839 1 1 16 LYS HG3 H -3.211 3.076 -3.844 1.00 . A A . 16 LYS HG3 1 1 13 4840 1 1 16 LYS HZ1 H -4.816 6.762 -2.822 1.00 . A A . 16 LYS HZ1 1 1 13 4841 1 1 16 LYS HZ2 H -5.464 5.910 -4.044 1.00 . A A . 16 LYS HZ2 1 1 13 4842 1 1 16 LYS HZ3 H -6.439 6.444 -2.833 1.00 . A A . 16 LYS HZ3 1 1 13 4843 1 1 16 LYS N N -0.232 6.405 -4.555 1.00 . A A . 16 LYS N 1 1 13 4844 1 1 16 LYS NZ N -5.526 6.068 -3.050 1.00 . A A . 16 LYS NZ 1 1 13 4845 1 1 16 LYS O O -3.299 7.467 -3.178 1.00 . A A . 16 LYS O 1 1 13 4846 1 1 17 CYS C C -0.426 9.047 -0.530 1.00 . A A . 17 CYS C 1 1 13 4847 1 1 17 CYS CA C -1.677 8.324 -1.053 1.00 . A A . 17 CYS CA 1 1 13 4848 1 1 17 CYS CB C -2.417 7.542 0.043 1.00 . A A . 17 CYS CB 1 1 13 4849 1 1 17 CYS H H -0.372 7.015 -2.095 1.00 . A A . 17 CYS H 1 1 13 4850 1 1 17 CYS HA H -2.364 9.064 -1.461 1.00 . A A . 17 CYS HA 1 1 13 4851 1 1 17 CYS HB3 H -3.367 7.209 -0.370 1.00 . A A . 17 CYS HB3 1 1 13 4852 1 1 17 CYS N N -1.303 7.425 -2.145 1.00 . A A . 17 CYS N 1 1 13 4853 1 1 17 CYS O O 0.669 8.492 -0.609 1.00 . A A . 17 CYS O 1 1 13 4854 1 1 17 CYS SG S -1.554 6.069 0.636 1.00 . A A . 17 CYS SG 1 1 13 4855 1 1 18 PRO C C 1.139 10.824 1.657 1.00 . A A . 18 PRO C 1 1 13 4856 1 1 18 PRO CA C 0.574 11.160 0.272 1.00 . A A . 18 PRO CA 1 1 13 4857 1 1 18 PRO CB C 0.014 12.587 0.231 1.00 . A A . 18 PRO CB 1 1 13 4858 1 1 18 PRO CD C -1.800 11.062 0.011 1.00 . A A . 18 PRO CD 1 1 13 4859 1 1 18 PRO CG C -1.432 12.386 0.680 1.00 . A A . 18 PRO CG 1 1 13 4860 1 1 18 PRO HA H 1.369 11.058 -0.469 1.00 . A A . 18 PRO HA 1 1 13 4861 1 1 18 PRO HB3 H 0.023 12.949 -0.799 1.00 . A A . 18 PRO HB3 1 1 13 4862 1 1 18 PRO HD3 H -2.173 11.270 -0.993 1.00 . A A . 18 PRO HD3 1 1 13 4863 1 1 18 PRO HG3 H -2.083 13.205 0.367 1.00 . A A . 18 PRO HG3 1 1 13 4864 1 1 18 PRO N N -0.557 10.307 -0.075 1.00 . A A . 18 PRO N 1 1 13 4865 1 1 18 PRO O O 0.595 9.986 2.372 1.00 . A A . 18 PRO O 1 1 13 4866 1 1 19 GLY C C 3.986 10.238 3.250 1.00 . A A . 19 GLY C 1 1 13 4867 1 1 19 GLY CA C 2.915 11.330 3.313 1.00 . A A . 19 GLY CA 1 1 13 4868 1 1 19 GLY H H 2.591 12.210 1.409 1.00 . A A . 19 GLY H 1 1 13 4869 1 1 19 GLY HA2 H 3.402 12.270 3.575 1.00 . A A . 19 GLY HA2 1 1 13 4870 1 1 19 GLY HA3 H 2.199 11.085 4.098 1.00 . A A . 19 GLY HA3 1 1 13 4871 1 1 19 GLY N N 2.228 11.507 2.034 1.00 . A A . 19 GLY N 1 1 13 4872 1 1 19 GLY O O 4.402 9.708 4.276 1.00 . A A . 19 GLY O 1 1 13 4873 1 1 20 ASN C C 5.124 7.498 2.498 1.00 . A A . 20 ASN C 1 1 13 4874 1 1 20 ASN CA C 5.358 8.812 1.730 1.00 . A A . 20 ASN CA 1 1 13 4875 1 1 20 ASN CB C 6.805 9.311 1.874 1.00 . A A . 20 ASN CB 1 1 13 4876 1 1 20 ASN CG C 7.095 10.537 1.013 1.00 . A A . 20 ASN CG 1 1 13 4877 1 1 20 ASN H H 4.014 10.365 1.244 1.00 . A A . 20 ASN H 1 1 13 4878 1 1 20 ASN HA H 5.198 8.567 0.685 1.00 . A A . 20 ASN HA 1 1 13 4879 1 1 20 ASN HB3 H 7.494 8.521 1.570 1.00 . A A . 20 ASN HB3 1 1 13 4880 1 1 20 ASN HD21 H 6.648 9.541 -0.720 1.00 . A A . 20 ASN HD21 1 1 13 4881 1 1 20 ASN HD22 H 7.158 11.216 -0.884 1.00 . A A . 20 ASN HD22 1 1 13 4882 1 1 20 ASN N N 4.414 9.884 2.034 1.00 . A A . 20 ASN N 1 1 13 4883 1 1 20 ASN ND2 N 6.956 10.419 -0.304 1.00 . A A . 20 ASN ND2 1 1 13 4884 1 1 20 ASN O O 6.076 6.922 3.021 1.00 . A A . 20 ASN O 1 1 13 4885 1 1 20 ASN OD1 O 7.433 11.598 1.526 1.00 . A A . 20 ASN OD1 1 1 13 4886 1 1 21 PRO C C 4.226 4.550 2.241 1.00 . A A . 21 PRO C 1 1 13 4887 1 1 21 PRO CA C 3.619 5.664 3.115 1.00 . A A . 21 PRO CA 1 1 13 4888 1 1 21 PRO CB C 2.093 5.561 3.163 1.00 . A A . 21 PRO CB 1 1 13 4889 1 1 21 PRO CD C 2.668 7.575 2.049 1.00 . A A . 21 PRO CD 1 1 13 4890 1 1 21 PRO CG C 1.632 6.467 2.022 1.00 . A A . 21 PRO CG 1 1 13 4891 1 1 21 PRO HA H 4.004 5.644 4.134 1.00 . A A . 21 PRO HA 1 1 13 4892 1 1 21 PRO HB3 H 1.737 5.974 4.108 1.00 . A A . 21 PRO HB3 1 1 13 4893 1 1 21 PRO HD3 H 2.333 8.299 2.785 1.00 . A A . 21 PRO HD3 1 1 13 4894 1 1 21 PRO HG3 H 0.635 6.870 2.187 1.00 . A A . 21 PRO HG3 1 1 13 4895 1 1 21 PRO N N 3.892 6.967 2.533 1.00 . A A . 21 PRO N 1 1 13 4896 1 1 21 PRO O O 4.126 4.630 1.017 1.00 . A A . 21 PRO O 1 1 13 4897 1 1 22 PRO C C 4.464 1.250 1.905 1.00 . A A . 22 PRO C 1 1 13 4898 1 1 22 PRO CA C 5.452 2.409 2.106 1.00 . A A . 22 PRO CA 1 1 13 4899 1 1 22 PRO CB C 6.616 1.974 3.005 1.00 . A A . 22 PRO CB 1 1 13 4900 1 1 22 PRO CD C 5.214 3.454 4.243 1.00 . A A . 22 PRO CD 1 1 13 4901 1 1 22 PRO CG C 6.037 2.173 4.404 1.00 . A A . 22 PRO CG 1 1 13 4902 1 1 22 PRO HA H 5.838 2.730 1.137 1.00 . A A . 22 PRO HA 1 1 13 4903 1 1 22 PRO HB3 H 7.454 2.657 2.861 1.00 . A A . 22 PRO HB3 1 1 13 4904 1 1 22 PRO HD3 H 5.846 4.309 4.491 1.00 . A A . 22 PRO HD3 1 1 13 4905 1 1 22 PRO HG3 H 6.811 2.273 5.164 1.00 . A A . 22 PRO HG3 1 1 13 4906 1 1 22 PRO N N 4.850 3.520 2.837 1.00 . A A . 22 PRO N 1 1 13 4907 1 1 22 PRO O O 3.310 1.293 2.345 1.00 . A A . 22 PRO O 1 1 13 4908 1 1 23 CYS C C 4.396 -1.793 2.627 1.00 . A A . 23 CYS C 1 1 13 4909 1 1 23 CYS CA C 4.235 -1.104 1.266 1.00 . A A . 23 CYS CA 1 1 13 4910 1 1 23 CYS CB C 4.766 -2.073 0.193 1.00 . A A . 23 CYS CB 1 1 13 4911 1 1 23 CYS H H 5.896 0.178 0.937 1.00 . A A . 23 CYS H 1 1 13 4912 1 1 23 CYS HA H 3.182 -0.922 1.057 1.00 . A A . 23 CYS HA 1 1 13 4913 1 1 23 CYS HB3 H 4.110 -2.938 0.240 1.00 . A A . 23 CYS HB3 1 1 13 4914 1 1 23 CYS N N 4.948 0.165 1.284 1.00 . A A . 23 CYS N 1 1 13 4915 1 1 23 CYS O O 5.444 -2.375 2.903 1.00 . A A . 23 CYS O 1 1 13 4916 1 1 23 CYS SG S 4.820 -1.631 -1.559 1.00 . A A . 23 CYS SG 1 1 13 4917 1 1 24 ARG C C 3.087 -4.203 3.766 1.00 . A A . 24 ARG C 1 1 13 4918 1 1 24 ARG CA C 3.260 -2.861 4.480 1.00 . A A . 24 ARG CA 1 1 13 4919 1 1 24 ARG CB C 2.095 -2.593 5.449 1.00 . A A . 24 ARG CB 1 1 13 4920 1 1 24 ARG CD C 0.796 -3.531 7.428 1.00 . A A . 24 ARG CD 1 1 13 4921 1 1 24 ARG CG C 1.983 -3.725 6.481 1.00 . A A . 24 ARG CG 1 1 13 4922 1 1 24 ARG CZ C -0.347 -4.936 9.154 1.00 . A A . 24 ARG CZ 1 1 13 4923 1 1 24 ARG H H 2.481 -1.411 3.138 1.00 . A A . 24 ARG H 1 1 13 4924 1 1 24 ARG HA H 4.181 -2.873 5.068 1.00 . A A . 24 ARG HA 1 1 13 4925 1 1 24 ARG HB3 H 1.163 -2.509 4.887 1.00 . A A . 24 ARG HB3 1 1 13 4926 1 1 24 ARG HD3 H -0.107 -3.435 6.821 1.00 . A A . 24 ARG HD3 1 1 13 4927 1 1 24 ARG HE H 1.436 -5.366 8.265 1.00 . A A . 24 ARG HE 1 1 13 4928 1 1 24 ARG HG3 H 2.908 -3.775 7.059 1.00 . A A . 24 ARG HG3 1 1 13 4929 1 1 24 ARG HH11 H -1.310 -3.208 8.699 1.00 . A A . 24 ARG HH11 1 1 13 4930 1 1 24 ARG HH12 H -2.139 -4.205 9.855 1.00 . A A . 24 ARG HH12 1 1 13 4931 1 1 24 ARG HH21 H 0.389 -6.726 9.813 1.00 . A A . 24 ARG HH21 1 1 13 4932 1 1 24 ARG HH22 H -1.126 -6.262 10.515 1.00 . A A . 24 ARG HH22 1 1 13 4933 1 1 24 ARG N N 3.347 -1.835 3.452 1.00 . A A . 24 ARG N 1 1 13 4934 1 1 24 ARG NE N 0.681 -4.695 8.323 1.00 . A A . 24 ARG NE 1 1 13 4935 1 1 24 ARG NH1 N -1.348 -4.056 9.247 1.00 . A A . 24 ARG NH1 1 1 13 4936 1 1 24 ARG NH2 N -0.365 -6.056 9.883 1.00 . A A . 24 ARG NH2 1 1 13 4937 1 1 24 ARG O O 1.971 -4.574 3.407 1.00 . A A . 24 ARG O 1 1 13 4938 1 1 25 ASN C C 3.355 -6.463 1.805 1.00 . A A . 25 ASN C 1 1 13 4939 1 1 25 ASN CA C 4.163 -6.318 3.098 1.00 . A A . 25 ASN CA 1 1 13 4940 1 1 25 ASN CB C 3.607 -7.239 4.201 1.00 . A A . 25 ASN CB 1 1 13 4941 1 1 25 ASN CG C 4.300 -7.043 5.546 1.00 . A A . 25 ASN CG 1 1 13 4942 1 1 25 ASN H H 5.077 -4.494 3.760 1.00 . A A . 25 ASN H 1 1 13 4943 1 1 25 ASN HA H 5.190 -6.616 2.886 1.00 . A A . 25 ASN HA 1 1 13 4944 1 1 25 ASN HB3 H 3.727 -8.279 3.894 1.00 . A A . 25 ASN HB3 1 1 13 4945 1 1 25 ASN HD21 H 6.032 -7.889 4.878 1.00 . A A . 25 ASN HD21 1 1 13 4946 1 1 25 ASN HD22 H 6.035 -7.326 6.538 1.00 . A A . 25 ASN HD22 1 1 13 4947 1 1 25 ASN N N 4.185 -4.929 3.553 1.00 . A A . 25 ASN N 1 1 13 4948 1 1 25 ASN ND2 N 5.562 -7.450 5.655 1.00 . A A . 25 ASN ND2 1 1 13 4949 1 1 25 ASN O O 2.565 -7.390 1.651 1.00 . A A . 25 ASN O 1 1 13 4950 1 1 25 ASN OD1 O 3.706 -6.520 6.485 1.00 . A A . 25 ASN OD1 1 1 13 4951 1 1 26 GLY C C 1.460 -4.892 -0.354 1.00 . A A . 26 GLY C 1 1 13 4952 1 1 26 GLY CA C 2.859 -5.517 -0.408 1.00 . A A . 26 GLY CA 1 1 13 4953 1 1 26 GLY H H 4.230 -4.806 1.064 1.00 . A A . 26 GLY H 1 1 13 4954 1 1 26 GLY HA2 H 3.458 -4.944 -1.116 1.00 . A A . 26 GLY HA2 1 1 13 4955 1 1 26 GLY HA3 H 2.775 -6.536 -0.789 1.00 . A A . 26 GLY HA3 1 1 13 4956 1 1 26 GLY N N 3.549 -5.527 0.873 1.00 . A A . 26 GLY N 1 1 13 4957 1 1 26 GLY O O 0.737 -4.974 -1.351 1.00 . A A . 26 GLY O 1 1 13 4958 1 1 27 PHE C C 0.113 -2.073 1.342 1.00 . A A . 27 PHE C 1 1 13 4959 1 1 27 PHE CA C -0.175 -3.506 0.893 1.00 . A A . 27 PHE CA 1 1 13 4960 1 1 27 PHE CB C -1.074 -4.234 1.892 1.00 . A A . 27 PHE CB 1 1 13 4961 1 1 27 PHE CD1 C -2.384 -5.906 0.525 1.00 . A A . 27 PHE CD1 1 1 13 4962 1 1 27 PHE CD2 C -0.601 -6.723 1.964 1.00 . A A . 27 PHE CD2 1 1 13 4963 1 1 27 PHE CE1 C -2.676 -7.225 0.134 1.00 . A A . 27 PHE CE1 1 1 13 4964 1 1 27 PHE CE2 C -0.847 -8.035 1.521 1.00 . A A . 27 PHE CE2 1 1 13 4965 1 1 27 PHE CG C -1.383 -5.658 1.480 1.00 . A A . 27 PHE CG 1 1 13 4966 1 1 27 PHE CZ C -1.900 -8.289 0.626 1.00 . A A . 27 PHE CZ 1 1 13 4967 1 1 27 PHE H H 1.683 -4.241 1.567 1.00 . A A . 27 PHE H 1 1 13 4968 1 1 27 PHE HA H -0.696 -3.467 -0.062 1.00 . A A . 27 PHE HA 1 1 13 4969 1 1 27 PHE HB3 H -2.011 -3.681 1.983 1.00 . A A . 27 PHE HB3 1 1 13 4970 1 1 27 PHE HD1 H -2.932 -5.084 0.095 1.00 . A A . 27 PHE HD1 1 1 13 4971 1 1 27 PHE HD2 H 0.219 -6.535 2.641 1.00 . A A . 27 PHE HD2 1 1 13 4972 1 1 27 PHE HE1 H -3.500 -7.416 -0.538 1.00 . A A . 27 PHE HE1 1 1 13 4973 1 1 27 PHE HE2 H -0.224 -8.844 1.875 1.00 . A A . 27 PHE HE2 1 1 13 4974 1 1 27 PHE HZ H -2.114 -9.304 0.320 1.00 . A A . 27 PHE HZ 1 1 13 4975 1 1 27 PHE N N 1.086 -4.230 0.748 1.00 . A A . 27 PHE N 1 1 13 4976 1 1 27 PHE O O 1.031 -1.844 2.120 1.00 . A A . 27 PHE O 1 1 13 4977 1 1 28 CYS C C -0.583 0.903 2.282 1.00 . A A . 28 CYS C 1 1 13 4978 1 1 28 CYS CA C -0.248 0.311 0.913 1.00 . A A . 28 CYS CA 1 1 13 4979 1 1 28 CYS CB C -0.909 1.090 -0.221 1.00 . A A . 28 CYS CB 1 1 13 4980 1 1 28 CYS H H -1.417 -1.342 0.236 1.00 . A A . 28 CYS H 1 1 13 4981 1 1 28 CYS HA H 0.830 0.385 0.767 1.00 . A A . 28 CYS HA 1 1 13 4982 1 1 28 CYS HB3 H -1.973 0.856 -0.266 1.00 . A A . 28 CYS HB3 1 1 13 4983 1 1 28 CYS N N -0.625 -1.094 0.819 1.00 . A A . 28 CYS N 1 1 13 4984 1 1 28 CYS O O -1.751 1.064 2.634 1.00 . A A . 28 CYS O 1 1 13 4985 1 1 28 CYS SG S -0.761 2.881 -0.074 1.00 . A A . 28 CYS SG 1 1 13 4986 1 1 29 ALA C C -0.102 3.124 4.584 1.00 . A A . 29 ALA C 1 1 13 4987 1 1 29 ALA CA C 0.283 1.646 4.455 1.00 . A A . 29 ALA CA 1 1 13 4988 1 1 29 ALA CB C 1.588 1.346 5.198 1.00 . A A . 29 ALA CB 1 1 13 4989 1 1 29 ALA H H 1.395 1.174 2.704 1.00 . A A . 29 ALA H 1 1 13 4990 1 1 29 ALA HA H -0.504 1.046 4.916 1.00 . A A . 29 ALA HA 1 1 13 4991 1 1 29 ALA HB1 H 1.460 1.523 6.267 1.00 . A A . 29 ALA HB1 1 1 13 4992 1 1 29 ALA HB2 H 1.866 0.307 5.037 1.00 . A A . 29 ALA HB2 1 1 13 4993 1 1 29 ALA HB3 H 2.387 1.983 4.821 1.00 . A A . 29 ALA HB3 1 1 13 4994 1 1 29 ALA N N 0.445 1.239 3.068 1.00 . A A . 29 ALA N 1 1 13 4995 1 1 29 ALA O O 0.577 3.864 5.292 1.00 . A A . 29 ALA O 1 1 13 4996 1 1 30 CYS C C -1.686 5.521 5.388 1.00 . A A . 30 CYS C 1 1 13 4997 1 1 30 CYS CA C -1.603 4.975 3.963 1.00 . A A . 30 CYS CA 1 1 13 4998 1 1 30 CYS CB C -2.956 5.211 3.274 1.00 . A A . 30 CYS CB 1 1 13 4999 1 1 30 CYS H H -1.694 2.903 3.351 1.00 . A A . 30 CYS H 1 1 13 5000 1 1 30 CYS HA H -0.848 5.556 3.435 1.00 . A A . 30 CYS HA 1 1 13 5001 1 1 30 CYS HB3 H -3.220 6.260 3.405 1.00 . A A . 30 CYS HB3 1 1 13 5002 1 1 30 CYS N N -1.192 3.564 3.938 1.00 . A A . 30 CYS N 1 1 13 5003 1 1 30 CYS O O -1.304 6.661 5.641 1.00 . A A . 30 CYS O 1 1 13 5004 1 1 30 CYS SG S -3.040 4.888 1.501 1.00 . A A . 30 CYS SG 1 1 13 5005 1 1 31 THR C C -1.964 3.863 8.571 1.00 . A A . 31 THR C 1 1 13 5006 1 1 31 THR CA C -2.357 5.066 7.715 1.00 . A A . 31 THR CA 1 1 13 5007 1 1 31 THR CB C -3.777 5.608 7.983 1.00 . A A . 31 THR CB 1 1 13 5008 1 1 31 THR CG2 C -4.892 4.741 7.383 1.00 . A A . 31 THR CG2 1 1 13 5009 1 1 31 THR H H -2.525 3.801 6.014 1.00 . A A . 31 THR H 1 1 13 5010 1 1 31 THR HA H -1.650 5.856 7.976 1.00 . A A . 31 THR HA 1 1 13 5011 1 1 31 THR HB H -3.851 6.601 7.535 1.00 . A A . 31 THR HB 1 1 13 5012 1 1 31 THR HG1 H -3.898 4.867 9.772 1.00 . A A . 31 THR HG1 1 1 13 5013 1 1 31 THR HG21 H -5.859 5.159 7.665 1.00 . A A . 31 THR HG21 1 1 13 5014 1 1 31 THR HG22 H -4.829 4.735 6.294 1.00 . A A . 31 THR HG22 1 1 13 5015 1 1 31 THR HG23 H -4.832 3.717 7.753 1.00 . A A . 31 THR HG23 1 1 13 5016 1 1 31 THR N N -2.219 4.715 6.308 1.00 . A A . 31 THR N 1 1 13 5017 1 1 31 THR O O -2.782 3.317 9.314 1.00 . A A . 31 THR O 1 1 13 5018 1 1 31 THR OG1 O -4.005 5.740 9.370 1.00 . A A . 31 THR OG1 1 1 14 5019 1 1 1 THR C C -12.283 -7.353 1.915 1.00 . A A . 1 THR C 1 1 14 5020 1 1 1 THR CA C -13.573 -7.765 2.647 1.00 . A A . 1 THR CA 1 1 14 5021 1 1 1 THR CB C -13.318 -8.612 3.910 1.00 . A A . 1 THR CB 1 1 14 5022 1 1 1 THR CG2 C -12.818 -7.792 5.102 1.00 . A A . 1 THR CG2 1 1 14 5023 1 1 1 THR H1 H -14.986 -9.234 2.307 1.00 . A A . 1 THR H1 1 1 14 5024 1 1 1 THR HA H -14.122 -6.869 2.934 1.00 . A A . 1 THR HA 1 1 14 5025 1 1 1 THR HB H -12.590 -9.395 3.679 1.00 . A A . 1 THR HB 1 1 14 5026 1 1 1 THR HG1 H -14.378 -9.814 5.028 1.00 . A A . 1 THR HG1 1 1 14 5027 1 1 1 THR HG21 H -12.756 -8.430 5.985 1.00 . A A . 1 THR HG21 1 1 14 5028 1 1 1 THR HG22 H -11.821 -7.402 4.900 1.00 . A A . 1 THR HG22 1 1 14 5029 1 1 1 THR HG23 H -13.502 -6.969 5.307 1.00 . A A . 1 THR HG23 1 1 14 5030 1 1 1 THR N N -14.432 -8.559 1.789 1.00 . A A . 1 THR N 1 1 14 5031 1 1 1 THR O O -11.188 -7.668 2.379 1.00 . A A . 1 THR O 1 1 14 5032 1 1 1 THR OG1 O -14.536 -9.240 4.274 1.00 . A A . 1 THR OG1 1 1 14 5033 1 1 2 PRO C C -10.340 -5.224 0.438 1.00 . A A . 2 PRO C 1 1 14 5034 1 1 2 PRO CA C -11.230 -6.364 -0.087 1.00 . A A . 2 PRO CA 1 1 14 5035 1 1 2 PRO CB C -11.862 -6.032 -1.445 1.00 . A A . 2 PRO CB 1 1 14 5036 1 1 2 PRO CD C -13.597 -6.136 0.174 1.00 . A A . 2 PRO CD 1 1 14 5037 1 1 2 PRO CG C -13.152 -5.321 -1.040 1.00 . A A . 2 PRO CG 1 1 14 5038 1 1 2 PRO HA H -10.614 -7.258 -0.192 1.00 . A A . 2 PRO HA 1 1 14 5039 1 1 2 PRO HB3 H -12.117 -6.962 -1.956 1.00 . A A . 2 PRO HB3 1 1 14 5040 1 1 2 PRO HD3 H -14.199 -6.974 -0.180 1.00 . A A . 2 PRO HD3 1 1 14 5041 1 1 2 PRO HG3 H -13.898 -5.324 -1.838 1.00 . A A . 2 PRO HG3 1 1 14 5042 1 1 2 PRO N N -12.370 -6.629 0.785 1.00 . A A . 2 PRO N 1 1 14 5043 1 1 2 PRO O O -9.893 -4.373 -0.330 1.00 . A A . 2 PRO O 1 1 14 5044 1 1 3 PHE C C -7.672 -4.649 2.034 1.00 . A A . 3 PHE C 1 1 14 5045 1 1 3 PHE CA C -9.115 -4.242 2.332 1.00 . A A . 3 PHE CA 1 1 14 5046 1 1 3 PHE CB C -9.389 -4.122 3.837 1.00 . A A . 3 PHE CB 1 1 14 5047 1 1 3 PHE CD1 C -11.902 -4.284 4.148 1.00 . A A . 3 PHE CD1 1 1 14 5048 1 1 3 PHE CD2 C -10.826 -2.124 4.461 1.00 . A A . 3 PHE CD2 1 1 14 5049 1 1 3 PHE CE1 C -13.152 -3.704 4.424 1.00 . A A . 3 PHE CE1 1 1 14 5050 1 1 3 PHE CE2 C -12.076 -1.545 4.745 1.00 . A A . 3 PHE CE2 1 1 14 5051 1 1 3 PHE CG C -10.734 -3.499 4.169 1.00 . A A . 3 PHE CG 1 1 14 5052 1 1 3 PHE CZ C -13.238 -2.335 4.727 1.00 . A A . 3 PHE CZ 1 1 14 5053 1 1 3 PHE H H -10.309 -6.015 2.296 1.00 . A A . 3 PHE H 1 1 14 5054 1 1 3 PHE HA H -9.289 -3.261 1.888 1.00 . A A . 3 PHE HA 1 1 14 5055 1 1 3 PHE HB3 H -8.607 -3.505 4.281 1.00 . A A . 3 PHE HB3 1 1 14 5056 1 1 3 PHE HD1 H -11.840 -5.331 3.915 1.00 . A A . 3 PHE HD1 1 1 14 5057 1 1 3 PHE HD2 H -9.941 -1.506 4.474 1.00 . A A . 3 PHE HD2 1 1 14 5058 1 1 3 PHE HE1 H -14.047 -4.309 4.410 1.00 . A A . 3 PHE HE1 1 1 14 5059 1 1 3 PHE HE2 H -12.143 -0.492 4.980 1.00 . A A . 3 PHE HE2 1 1 14 5060 1 1 3 PHE HZ H -14.199 -1.888 4.946 1.00 . A A . 3 PHE HZ 1 1 14 5061 1 1 3 PHE N N -10.012 -5.227 1.733 1.00 . A A . 3 PHE N 1 1 14 5062 1 1 3 PHE O O -6.885 -4.903 2.942 1.00 . A A . 3 PHE O 1 1 14 5063 1 1 4 ALA C C -5.619 -4.466 -0.949 1.00 . A A . 4 ALA C 1 1 14 5064 1 1 4 ALA CA C -6.102 -5.299 0.237 1.00 . A A . 4 ALA CA 1 1 14 5065 1 1 4 ALA CB C -6.341 -6.766 -0.134 1.00 . A A . 4 ALA CB 1 1 14 5066 1 1 4 ALA H H -8.066 -4.490 0.072 1.00 . A A . 4 ALA H 1 1 14 5067 1 1 4 ALA HA H -5.327 -5.264 1.005 1.00 . A A . 4 ALA HA 1 1 14 5068 1 1 4 ALA HB1 H -6.659 -7.319 0.751 1.00 . A A . 4 ALA HB1 1 1 14 5069 1 1 4 ALA HB2 H -7.119 -6.839 -0.896 1.00 . A A . 4 ALA HB2 1 1 14 5070 1 1 4 ALA HB3 H -5.423 -7.211 -0.510 1.00 . A A . 4 ALA HB3 1 1 14 5071 1 1 4 ALA N N -7.344 -4.736 0.742 1.00 . A A . 4 ALA N 1 1 14 5072 1 1 4 ALA O O -5.401 -4.994 -2.045 1.00 . A A . 4 ALA O 1 1 14 5073 1 1 5 ILE C C -3.355 -2.638 -1.740 1.00 . A A . 5 ILE C 1 1 14 5074 1 1 5 ILE CA C -4.824 -2.232 -1.642 1.00 . A A . 5 ILE CA 1 1 14 5075 1 1 5 ILE CB C -4.982 -0.782 -1.141 1.00 . A A . 5 ILE CB 1 1 14 5076 1 1 5 ILE CD1 C -6.671 0.974 -0.355 1.00 . A A . 5 ILE CD1 1 1 14 5077 1 1 5 ILE CG1 C -6.469 -0.431 -0.931 1.00 . A A . 5 ILE CG1 1 1 14 5078 1 1 5 ILE CG2 C -4.338 0.196 -2.140 1.00 . A A . 5 ILE CG2 1 1 14 5079 1 1 5 ILE H H -5.642 -2.830 0.221 1.00 . A A . 5 ILE H 1 1 14 5080 1 1 5 ILE HA H -5.309 -2.322 -2.616 1.00 . A A . 5 ILE HA 1 1 14 5081 1 1 5 ILE HB H -4.467 -0.684 -0.183 1.00 . A A . 5 ILE HB 1 1 14 5082 1 1 5 ILE HD11 H -7.716 1.097 -0.072 1.00 . A A . 5 ILE HD11 1 1 14 5083 1 1 5 ILE HD12 H -6.046 1.107 0.528 1.00 . A A . 5 ILE HD12 1 1 14 5084 1 1 5 ILE HD13 H -6.425 1.732 -1.097 1.00 . A A . 5 ILE HD13 1 1 14 5085 1 1 5 ILE HG13 H -6.914 -1.130 -0.221 1.00 . A A . 5 ILE HG13 1 1 14 5086 1 1 5 ILE HG21 H -3.302 -0.080 -2.343 1.00 . A A . 5 ILE HG21 1 1 14 5087 1 1 5 ILE HG22 H -4.892 0.189 -3.078 1.00 . A A . 5 ILE HG22 1 1 14 5088 1 1 5 ILE HG23 H -4.333 1.206 -1.732 1.00 . A A . 5 ILE HG23 1 1 14 5089 1 1 5 ILE N N -5.448 -3.162 -0.711 1.00 . A A . 5 ILE N 1 1 14 5090 1 1 5 ILE O O -2.639 -2.575 -0.743 1.00 . A A . 5 ILE O 1 1 14 5091 1 1 6 LYS C C -0.518 -2.701 -3.216 1.00 . A A . 6 LYS C 1 1 14 5092 1 1 6 LYS CA C -1.624 -3.746 -3.083 1.00 . A A . 6 LYS CA 1 1 14 5093 1 1 6 LYS CB C -1.684 -4.716 -4.269 1.00 . A A . 6 LYS CB 1 1 14 5094 1 1 6 LYS CD C -3.203 -6.623 -5.039 1.00 . A A . 6 LYS CD 1 1 14 5095 1 1 6 LYS CE C -4.328 -7.553 -4.562 1.00 . A A . 6 LYS CE 1 1 14 5096 1 1 6 LYS CG C -2.538 -5.923 -3.848 1.00 . A A . 6 LYS CG 1 1 14 5097 1 1 6 LYS H H -3.540 -3.079 -3.707 1.00 . A A . 6 LYS H 1 1 14 5098 1 1 6 LYS HA H -1.412 -4.339 -2.195 1.00 . A A . 6 LYS HA 1 1 14 5099 1 1 6 LYS HB3 H -0.682 -5.061 -4.531 1.00 . A A . 6 LYS HB3 1 1 14 5100 1 1 6 LYS HD3 H -2.441 -7.205 -5.562 1.00 . A A . 6 LYS HD3 1 1 14 5101 1 1 6 LYS HE3 H -3.943 -8.218 -3.785 1.00 . A A . 6 LYS HE3 1 1 14 5102 1 1 6 LYS HG3 H -3.302 -5.581 -3.161 1.00 . A A . 6 LYS HG3 1 1 14 5103 1 1 6 LYS HZ1 H -6.211 -7.463 -3.733 1.00 . A A . 6 LYS HZ1 1 1 14 5104 1 1 6 LYS HZ2 H -5.270 -6.204 -3.262 1.00 . A A . 6 LYS HZ2 1 1 14 5105 1 1 6 LYS HZ3 H -5.900 -6.234 -4.774 1.00 . A A . 6 LYS HZ3 1 1 14 5106 1 1 6 LYS N N -2.928 -3.118 -2.909 1.00 . A A . 6 LYS N 1 1 14 5107 1 1 6 LYS NZ N -5.504 -6.812 -4.047 1.00 . A A . 6 LYS NZ 1 1 14 5108 1 1 6 LYS O O -0.789 -1.546 -3.544 1.00 . A A . 6 LYS O 1 1 14 5109 1 1 7 CYS C C 3.147 -3.050 -2.855 1.00 . A A . 7 CYS C 1 1 14 5110 1 1 7 CYS CA C 1.866 -2.225 -2.800 1.00 . A A . 7 CYS CA 1 1 14 5111 1 1 7 CYS CB C 1.777 -1.487 -1.467 1.00 . A A . 7 CYS CB 1 1 14 5112 1 1 7 CYS H H 0.847 -4.069 -2.607 1.00 . A A . 7 CYS H 1 1 14 5113 1 1 7 CYS HA H 1.856 -1.495 -3.611 1.00 . A A . 7 CYS HA 1 1 14 5114 1 1 7 CYS HB3 H 1.832 -2.203 -0.654 1.00 . A A . 7 CYS HB3 1 1 14 5115 1 1 7 CYS N N 0.717 -3.109 -2.912 1.00 . A A . 7 CYS N 1 1 14 5116 1 1 7 CYS O O 3.420 -3.815 -1.928 1.00 . A A . 7 CYS O 1 1 14 5117 1 1 7 CYS SG S 3.020 -0.225 -1.152 1.00 . A A . 7 CYS SG 1 1 14 5118 1 1 8 ALA C C 6.256 -2.662 -3.293 1.00 . A A . 8 ALA C 1 1 14 5119 1 1 8 ALA CA C 5.236 -3.503 -4.061 1.00 . A A . 8 ALA CA 1 1 14 5120 1 1 8 ALA CB C 5.614 -3.617 -5.541 1.00 . A A . 8 ALA CB 1 1 14 5121 1 1 8 ALA H H 3.607 -2.298 -4.693 1.00 . A A . 8 ALA H 1 1 14 5122 1 1 8 ALA HA H 5.224 -4.511 -3.641 1.00 . A A . 8 ALA HA 1 1 14 5123 1 1 8 ALA HB1 H 5.656 -2.630 -6.003 1.00 . A A . 8 ALA HB1 1 1 14 5124 1 1 8 ALA HB2 H 6.592 -4.093 -5.631 1.00 . A A . 8 ALA HB2 1 1 14 5125 1 1 8 ALA HB3 H 4.875 -4.224 -6.063 1.00 . A A . 8 ALA HB3 1 1 14 5126 1 1 8 ALA N N 3.914 -2.913 -3.938 1.00 . A A . 8 ALA N 1 1 14 5127 1 1 8 ALA O O 7.007 -3.200 -2.484 1.00 . A A . 8 ALA O 1 1 14 5128 1 1 9 THR C C 6.664 0.858 -2.502 1.00 . A A . 9 THR C 1 1 14 5129 1 1 9 THR CA C 7.299 -0.439 -3.018 1.00 . A A . 9 THR CA 1 1 14 5130 1 1 9 THR CB C 8.345 -0.151 -4.110 1.00 . A A . 9 THR CB 1 1 14 5131 1 1 9 THR CG2 C 9.094 -1.421 -4.522 1.00 . A A . 9 THR CG2 1 1 14 5132 1 1 9 THR H H 5.657 -0.949 -4.240 1.00 . A A . 9 THR H 1 1 14 5133 1 1 9 THR HA H 7.806 -0.897 -2.171 1.00 . A A . 9 THR HA 1 1 14 5134 1 1 9 THR HB H 9.083 0.555 -3.723 1.00 . A A . 9 THR HB 1 1 14 5135 1 1 9 THR HG1 H 6.820 0.155 -5.340 1.00 . A A . 9 THR HG1 1 1 14 5136 1 1 9 THR HG21 H 9.516 -1.907 -3.642 1.00 . A A . 9 THR HG21 1 1 14 5137 1 1 9 THR HG22 H 8.427 -2.114 -5.032 1.00 . A A . 9 THR HG22 1 1 14 5138 1 1 9 THR HG23 H 9.904 -1.153 -5.202 1.00 . A A . 9 THR HG23 1 1 14 5139 1 1 9 THR N N 6.299 -1.351 -3.557 1.00 . A A . 9 THR N 1 1 14 5140 1 1 9 THR O O 5.489 1.145 -2.736 1.00 . A A . 9 THR O 1 1 14 5141 1 1 9 THR OG1 O 7.758 0.409 -5.267 1.00 . A A . 9 THR OG1 1 1 14 5142 1 1 10 ASP C C 6.565 3.770 -2.696 1.00 . A A . 10 ASP C 1 1 14 5143 1 1 10 ASP CA C 7.233 3.066 -1.509 1.00 . A A . 10 ASP CA 1 1 14 5144 1 1 10 ASP CB C 8.580 3.719 -1.164 1.00 . A A . 10 ASP CB 1 1 14 5145 1 1 10 ASP CG C 9.654 3.257 -2.137 1.00 . A A . 10 ASP CG 1 1 14 5146 1 1 10 ASP H H 8.442 1.363 -1.680 1.00 . A A . 10 ASP H 1 1 14 5147 1 1 10 ASP HA H 6.570 3.144 -0.646 1.00 . A A . 10 ASP HA 1 1 14 5148 1 1 10 ASP HB3 H 8.878 3.419 -0.159 1.00 . A A . 10 ASP HB3 1 1 14 5149 1 1 10 ASP N N 7.473 1.658 -1.802 1.00 . A A . 10 ASP N 1 1 14 5150 1 1 10 ASP O O 5.503 4.372 -2.530 1.00 . A A . 10 ASP O 1 1 14 5151 1 1 10 ASP OD1 O 10.171 2.147 -1.881 1.00 . A A . 10 ASP OD1 1 1 14 5152 1 1 10 ASP OD2 O 9.792 3.907 -3.193 1.00 . A A . 10 ASP OD2 1 1 14 5153 1 1 11 ALA C C 5.117 3.995 -5.244 1.00 . A A . 11 ALA C 1 1 14 5154 1 1 11 ALA CA C 6.629 4.219 -5.135 1.00 . A A . 11 ALA CA 1 1 14 5155 1 1 11 ALA CB C 7.370 3.615 -6.330 1.00 . A A . 11 ALA CB 1 1 14 5156 1 1 11 ALA H H 8.150 3.405 -3.882 1.00 . A A . 11 ALA H 1 1 14 5157 1 1 11 ALA HA H 6.823 5.292 -5.150 1.00 . A A . 11 ALA HA 1 1 14 5158 1 1 11 ALA HB1 H 8.444 3.757 -6.212 1.00 . A A . 11 ALA HB1 1 1 14 5159 1 1 11 ALA HB2 H 7.155 2.551 -6.415 1.00 . A A . 11 ALA HB2 1 1 14 5160 1 1 11 ALA HB3 H 7.044 4.110 -7.245 1.00 . A A . 11 ALA HB3 1 1 14 5161 1 1 11 ALA N N 7.172 3.698 -3.887 1.00 . A A . 11 ALA N 1 1 14 5162 1 1 11 ALA O O 4.371 4.963 -5.384 1.00 . A A . 11 ALA O 1 1 14 5163 1 1 12 ASP C C 2.416 3.281 -4.314 1.00 . A A . 12 ASP C 1 1 14 5164 1 1 12 ASP CA C 3.241 2.400 -5.252 1.00 . A A . 12 ASP CA 1 1 14 5165 1 1 12 ASP CB C 2.997 0.927 -4.878 1.00 . A A . 12 ASP CB 1 1 14 5166 1 1 12 ASP CG C 3.902 -0.096 -5.541 1.00 . A A . 12 ASP CG 1 1 14 5167 1 1 12 ASP H H 5.290 1.954 -5.047 1.00 . A A . 12 ASP H 1 1 14 5168 1 1 12 ASP HA H 2.917 2.560 -6.281 1.00 . A A . 12 ASP HA 1 1 14 5169 1 1 12 ASP HB3 H 1.960 0.680 -5.114 1.00 . A A . 12 ASP HB3 1 1 14 5170 1 1 12 ASP N N 4.653 2.743 -5.155 1.00 . A A . 12 ASP N 1 1 14 5171 1 1 12 ASP O O 1.517 4.011 -4.744 1.00 . A A . 12 ASP O 1 1 14 5172 1 1 12 ASP OD1 O 5.138 0.106 -5.516 1.00 . A A . 12 ASP OD1 1 1 14 5173 1 1 12 ASP OD2 O 3.361 -1.151 -5.929 1.00 . A A . 12 ASP OD2 1 1 14 5174 1 1 13 CYS C C 1.929 5.318 -2.071 1.00 . A A . 13 CYS C 1 1 14 5175 1 1 13 CYS CA C 1.830 3.801 -2.019 1.00 . A A . 13 CYS CA 1 1 14 5176 1 1 13 CYS CB C 2.041 3.256 -0.602 1.00 . A A . 13 CYS CB 1 1 14 5177 1 1 13 CYS H H 3.492 2.620 -2.729 1.00 . A A . 13 CYS H 1 1 14 5178 1 1 13 CYS HA H 0.819 3.544 -2.320 1.00 . A A . 13 CYS HA 1 1 14 5179 1 1 13 CYS HB3 H 2.829 3.812 -0.107 1.00 . A A . 13 CYS HB3 1 1 14 5180 1 1 13 CYS N N 2.699 3.186 -3.010 1.00 . A A . 13 CYS N 1 1 14 5181 1 1 13 CYS O O 0.907 5.988 -2.010 1.00 . A A . 13 CYS O 1 1 14 5182 1 1 13 CYS SG S 0.528 3.309 0.393 1.00 . A A . 13 CYS SG 1 1 14 5183 1 1 14 SER C C 2.549 7.823 -3.588 1.00 . A A . 14 SER C 1 1 14 5184 1 1 14 SER CA C 3.366 7.285 -2.409 1.00 . A A . 14 SER CA 1 1 14 5185 1 1 14 SER CB C 4.863 7.583 -2.550 1.00 . A A . 14 SER CB 1 1 14 5186 1 1 14 SER H H 3.935 5.227 -2.293 1.00 . A A . 14 SER H 1 1 14 5187 1 1 14 SER HA H 3.027 7.793 -1.512 1.00 . A A . 14 SER HA 1 1 14 5188 1 1 14 SER HB3 H 5.390 7.253 -1.655 1.00 . A A . 14 SER HB3 1 1 14 5189 1 1 14 SER HG H 5.378 5.958 -3.494 1.00 . A A . 14 SER HG 1 1 14 5190 1 1 14 SER N N 3.141 5.856 -2.233 1.00 . A A . 14 SER N 1 1 14 5191 1 1 14 SER O O 1.829 8.810 -3.447 1.00 . A A . 14 SER O 1 1 14 5192 1 1 14 SER OG O 5.417 6.910 -3.656 1.00 . A A . 14 SER OG 1 1 14 5193 1 1 15 ARG C C 0.353 7.485 -5.574 1.00 . A A . 15 ARG C 1 1 14 5194 1 1 15 ARG CA C 1.849 7.517 -5.923 1.00 . A A . 15 ARG CA 1 1 14 5195 1 1 15 ARG CB C 2.206 6.564 -7.081 1.00 . A A . 15 ARG CB 1 1 14 5196 1 1 15 ARG CD C 0.434 7.514 -8.673 1.00 . A A . 15 ARG CD 1 1 14 5197 1 1 15 ARG CG C 1.890 7.079 -8.494 1.00 . A A . 15 ARG CG 1 1 14 5198 1 1 15 ARG CZ C -1.120 8.126 -10.505 1.00 . A A . 15 ARG CZ 1 1 14 5199 1 1 15 ARG H H 3.279 6.375 -4.809 1.00 . A A . 15 ARG H 1 1 14 5200 1 1 15 ARG HA H 2.127 8.531 -6.211 1.00 . A A . 15 ARG HA 1 1 14 5201 1 1 15 ARG HB3 H 1.720 5.600 -6.927 1.00 . A A . 15 ARG HB3 1 1 14 5202 1 1 15 ARG HD3 H 0.316 8.481 -8.186 1.00 . A A . 15 ARG HD3 1 1 14 5203 1 1 15 ARG HE H 0.766 7.388 -10.768 1.00 . A A . 15 ARG HE 1 1 14 5204 1 1 15 ARG HG3 H 2.119 6.271 -9.191 1.00 . A A . 15 ARG HG3 1 1 14 5205 1 1 15 ARG HH11 H -1.809 8.443 -8.617 1.00 . A A . 15 ARG HH11 1 1 14 5206 1 1 15 ARG HH12 H -2.941 8.855 -9.868 1.00 . A A . 15 ARG HH12 1 1 14 5207 1 1 15 ARG HH21 H -0.703 7.926 -12.496 1.00 . A A . 15 ARG HH21 1 1 14 5208 1 1 15 ARG HH22 H -2.279 8.555 -12.144 1.00 . A A . 15 ARG HH22 1 1 14 5209 1 1 15 ARG N N 2.630 7.158 -4.746 1.00 . A A . 15 ARG N 1 1 14 5210 1 1 15 ARG NE N 0.070 7.664 -10.089 1.00 . A A . 15 ARG NE 1 1 14 5211 1 1 15 ARG NH1 N -2.035 8.499 -9.602 1.00 . A A . 15 ARG NH1 1 1 14 5212 1 1 15 ARG NH2 N -1.389 8.210 -11.813 1.00 . A A . 15 ARG NH2 1 1 14 5213 1 1 15 ARG O O -0.386 8.418 -5.890 1.00 . A A . 15 ARG O 1 1 14 5214 1 1 16 LYS C C -1.945 7.286 -3.498 1.00 . A A . 16 LYS C 1 1 14 5215 1 1 16 LYS CA C -1.511 6.260 -4.561 1.00 . A A . 16 LYS CA 1 1 14 5216 1 1 16 LYS CB C -1.769 4.798 -4.155 1.00 . A A . 16 LYS CB 1 1 14 5217 1 1 16 LYS CD C -3.143 4.572 -2.062 1.00 . A A . 16 LYS CD 1 1 14 5218 1 1 16 LYS CE C -4.517 4.837 -1.431 1.00 . A A . 16 LYS CE 1 1 14 5219 1 1 16 LYS CG C -3.178 4.539 -3.596 1.00 . A A . 16 LYS CG 1 1 14 5220 1 1 16 LYS H H 0.535 5.648 -4.727 1.00 . A A . 16 LYS H 1 1 14 5221 1 1 16 LYS HA H -2.117 6.453 -5.448 1.00 . A A . 16 LYS HA 1 1 14 5222 1 1 16 LYS HB3 H -1.024 4.479 -3.425 1.00 . A A . 16 LYS HB3 1 1 14 5223 1 1 16 LYS HD3 H -2.437 5.330 -1.733 1.00 . A A . 16 LYS HD3 1 1 14 5224 1 1 16 LYS HE3 H -5.191 4.028 -1.714 1.00 . A A . 16 LYS HE3 1 1 14 5225 1 1 16 LYS HG3 H -3.508 3.547 -3.912 1.00 . A A . 16 LYS HG3 1 1 14 5226 1 1 16 LYS HZ1 H -3.970 5.732 0.382 1.00 . A A . 16 LYS HZ1 1 1 14 5227 1 1 16 LYS HZ2 H -5.338 4.818 0.492 1.00 . A A . 16 LYS HZ2 1 1 14 5228 1 1 16 LYS HZ3 H -3.896 4.112 0.413 1.00 . A A . 16 LYS HZ3 1 1 14 5229 1 1 16 LYS N N -0.110 6.405 -4.940 1.00 . A A . 16 LYS N 1 1 14 5230 1 1 16 LYS NZ N -4.427 4.896 0.042 1.00 . A A . 16 LYS NZ 1 1 14 5231 1 1 16 LYS O O -3.123 7.632 -3.433 1.00 . A A . 16 LYS O 1 1 14 5232 1 1 17 CYS C C -0.074 9.251 -0.979 1.00 . A A . 17 CYS C 1 1 14 5233 1 1 17 CYS CA C -1.345 8.533 -1.449 1.00 . A A . 17 CYS CA 1 1 14 5234 1 1 17 CYS CB C -1.867 7.599 -0.358 1.00 . A A . 17 CYS CB 1 1 14 5235 1 1 17 CYS H H -0.085 7.378 -2.691 1.00 . A A . 17 CYS H 1 1 14 5236 1 1 17 CYS HA H -2.135 9.241 -1.688 1.00 . A A . 17 CYS HA 1 1 14 5237 1 1 17 CYS HB3 H -1.210 6.733 -0.281 1.00 . A A . 17 CYS HB3 1 1 14 5238 1 1 17 CYS N N -1.037 7.734 -2.628 1.00 . A A . 17 CYS N 1 1 14 5239 1 1 17 CYS O O 0.872 8.578 -0.583 1.00 . A A . 17 CYS O 1 1 14 5240 1 1 17 CYS SG S -2.003 8.294 1.298 1.00 . A A . 17 CYS SG 1 1 14 5241 1 1 18 PRO C C 1.666 11.315 0.637 1.00 . A A . 18 PRO C 1 1 14 5242 1 1 18 PRO CA C 1.222 11.334 -0.830 1.00 . A A . 18 PRO CA 1 1 14 5243 1 1 18 PRO CB C 0.926 12.753 -1.331 1.00 . A A . 18 PRO CB 1 1 14 5244 1 1 18 PRO CD C -1.098 11.494 -1.394 1.00 . A A . 18 PRO CD 1 1 14 5245 1 1 18 PRO CG C -0.577 12.898 -1.095 1.00 . A A . 18 PRO CG 1 1 14 5246 1 1 18 PRO HA H 2.017 10.899 -1.438 1.00 . A A . 18 PRO HA 1 1 14 5247 1 1 18 PRO HB3 H 1.121 12.800 -2.404 1.00 . A A . 18 PRO HB3 1 1 14 5248 1 1 18 PRO HD3 H -1.317 11.400 -2.458 1.00 . A A . 18 PRO HD3 1 1 14 5249 1 1 18 PRO HG3 H -1.027 13.657 -1.735 1.00 . A A . 18 PRO HG3 1 1 14 5250 1 1 18 PRO N N -0.014 10.593 -1.042 1.00 . A A . 18 PRO N 1 1 14 5251 1 1 18 PRO O O 0.985 10.778 1.507 1.00 . A A . 18 PRO O 1 1 14 5252 1 1 19 GLY C C 4.201 10.576 2.454 1.00 . A A . 19 GLY C 1 1 14 5253 1 1 19 GLY CA C 3.466 11.896 2.216 1.00 . A A . 19 GLY CA 1 1 14 5254 1 1 19 GLY H H 3.327 12.363 0.147 1.00 . A A . 19 GLY H 1 1 14 5255 1 1 19 GLY HA2 H 4.190 12.709 2.266 1.00 . A A . 19 GLY HA2 1 1 14 5256 1 1 19 GLY HA3 H 2.722 12.048 3.000 1.00 . A A . 19 GLY HA3 1 1 14 5257 1 1 19 GLY N N 2.832 11.912 0.902 1.00 . A A . 19 GLY N 1 1 14 5258 1 1 19 GLY O O 4.284 10.108 3.587 1.00 . A A . 19 GLY O 1 1 14 5259 1 1 20 ASN C C 5.150 7.718 2.403 1.00 . A A . 20 ASN C 1 1 14 5260 1 1 20 ASN CA C 5.466 8.733 1.297 1.00 . A A . 20 ASN CA 1 1 14 5261 1 1 20 ASN CB C 6.972 9.006 1.151 1.00 . A A . 20 ASN CB 1 1 14 5262 1 1 20 ASN CG C 7.308 9.721 -0.157 1.00 . A A . 20 ASN CG 1 1 14 5263 1 1 20 ASN H H 4.644 10.485 0.494 1.00 . A A . 20 ASN H 1 1 14 5264 1 1 20 ASN HA H 5.166 8.246 0.370 1.00 . A A . 20 ASN HA 1 1 14 5265 1 1 20 ASN HB3 H 7.505 8.053 1.152 1.00 . A A . 20 ASN HB3 1 1 14 5266 1 1 20 ASN HD21 H 9.295 9.330 0.051 1.00 . A A . 20 ASN HD21 1 1 14 5267 1 1 20 ASN HD22 H 8.825 10.216 -1.389 1.00 . A A . 20 ASN HD22 1 1 14 5268 1 1 20 ASN N N 4.730 9.992 1.373 1.00 . A A . 20 ASN N 1 1 14 5269 1 1 20 ASN ND2 N 8.586 9.763 -0.520 1.00 . A A . 20 ASN ND2 1 1 14 5270 1 1 20 ASN O O 6.051 7.301 3.130 1.00 . A A . 20 ASN O 1 1 14 5271 1 1 20 ASN OD1 O 6.427 10.230 -0.848 1.00 . A A . 20 ASN OD1 1 1 14 5272 1 1 21 PRO C C 4.294 4.858 2.661 1.00 . A A . 21 PRO C 1 1 14 5273 1 1 21 PRO CA C 3.571 6.068 3.274 1.00 . A A . 21 PRO CA 1 1 14 5274 1 1 21 PRO CB C 2.050 5.921 3.156 1.00 . A A . 21 PRO CB 1 1 14 5275 1 1 21 PRO CD C 2.736 7.717 1.761 1.00 . A A . 21 PRO CD 1 1 14 5276 1 1 21 PRO CG C 1.739 6.568 1.805 1.00 . A A . 21 PRO CG 1 1 14 5277 1 1 21 PRO HA H 3.850 6.229 4.313 1.00 . A A . 21 PRO HA 1 1 14 5278 1 1 21 PRO HB3 H 1.573 6.498 3.950 1.00 . A A . 21 PRO HB3 1 1 14 5279 1 1 21 PRO HD3 H 2.303 8.577 2.270 1.00 . A A . 21 PRO HD3 1 1 14 5280 1 1 21 PRO HG3 H 0.717 6.931 1.719 1.00 . A A . 21 PRO HG3 1 1 14 5281 1 1 21 PRO N N 3.895 7.254 2.502 1.00 . A A . 21 PRO N 1 1 14 5282 1 1 21 PRO O O 4.430 4.793 1.440 1.00 . A A . 21 PRO O 1 1 14 5283 1 1 22 PRO C C 4.360 1.643 2.563 1.00 . A A . 22 PRO C 1 1 14 5284 1 1 22 PRO CA C 5.402 2.693 2.974 1.00 . A A . 22 PRO CA 1 1 14 5285 1 1 22 PRO CB C 6.251 2.205 4.155 1.00 . A A . 22 PRO CB 1 1 14 5286 1 1 22 PRO CD C 4.809 3.950 4.924 1.00 . A A . 22 PRO CD 1 1 14 5287 1 1 22 PRO CG C 5.412 2.615 5.366 1.00 . A A . 22 PRO CG 1 1 14 5288 1 1 22 PRO HA H 6.050 2.909 2.124 1.00 . A A . 22 PRO HA 1 1 14 5289 1 1 22 PRO HB3 H 7.191 2.760 4.170 1.00 . A A . 22 PRO HB3 1 1 14 5290 1 1 22 PRO HD3 H 5.471 4.761 5.232 1.00 . A A . 22 PRO HD3 1 1 14 5291 1 1 22 PRO HG3 H 6.012 2.712 6.272 1.00 . A A . 22 PRO HG3 1 1 14 5292 1 1 22 PRO N N 4.761 3.898 3.472 1.00 . A A . 22 PRO N 1 1 14 5293 1 1 22 PRO O O 3.148 1.852 2.677 1.00 . A A . 22 PRO O 1 1 14 5294 1 1 23 CYS C C 4.089 -1.413 3.432 1.00 . A A . 23 CYS C 1 1 14 5295 1 1 23 CYS CA C 4.029 -0.727 2.073 1.00 . A A . 23 CYS CA 1 1 14 5296 1 1 23 CYS CB C 4.554 -1.735 1.041 1.00 . A A . 23 CYS CB 1 1 14 5297 1 1 23 CYS H H 5.845 0.358 2.055 1.00 . A A . 23 CYS H 1 1 14 5298 1 1 23 CYS HA H 3.000 -0.472 1.817 1.00 . A A . 23 CYS HA 1 1 14 5299 1 1 23 CYS HB3 H 3.844 -2.561 1.002 1.00 . A A . 23 CYS HB3 1 1 14 5300 1 1 23 CYS N N 4.844 0.472 2.138 1.00 . A A . 23 CYS N 1 1 14 5301 1 1 23 CYS O O 5.179 -1.661 3.948 1.00 . A A . 23 CYS O 1 1 14 5302 1 1 23 CYS SG S 4.789 -1.185 -0.657 1.00 . A A . 23 CYS SG 1 1 14 5303 1 1 24 ARG C C 3.225 -4.232 3.737 1.00 . A A . 24 ARG C 1 1 14 5304 1 1 24 ARG CA C 2.936 -3.093 4.726 1.00 . A A . 24 ARG CA 1 1 14 5305 1 1 24 ARG CB C 1.588 -3.241 5.449 1.00 . A A . 24 ARG CB 1 1 14 5306 1 1 24 ARG CD C 0.298 -4.541 7.193 1.00 . A A . 24 ARG CD 1 1 14 5307 1 1 24 ARG CG C 1.599 -4.455 6.386 1.00 . A A . 24 ARG CG 1 1 14 5308 1 1 24 ARG CZ C -0.643 -6.019 8.976 1.00 . A A . 24 ARG CZ 1 1 14 5309 1 1 24 ARG H H 2.103 -1.672 3.426 1.00 . A A . 24 ARG H 1 1 14 5310 1 1 24 ARG HA H 3.722 -3.058 5.484 1.00 . A A . 24 ARG HA 1 1 14 5311 1 1 24 ARG HB3 H 0.782 -3.340 4.718 1.00 . A A . 24 ARG HB3 1 1 14 5312 1 1 24 ARG HD3 H -0.539 -4.621 6.495 1.00 . A A . 24 ARG HD3 1 1 14 5313 1 1 24 ARG HE H 1.120 -6.319 8.003 1.00 . A A . 24 ARG HE 1 1 14 5314 1 1 24 ARG HG3 H 2.441 -4.365 7.076 1.00 . A A . 24 ARG HG3 1 1 14 5315 1 1 24 ARG HH11 H -1.802 -4.425 8.494 1.00 . A A . 24 ARG HH11 1 1 14 5316 1 1 24 ARG HH12 H -2.457 -5.431 9.750 1.00 . A A . 24 ARG HH12 1 1 14 5317 1 1 24 ARG HH21 H 0.297 -7.700 9.668 1.00 . A A . 24 ARG HH21 1 1 14 5318 1 1 24 ARG HH22 H -1.222 -7.352 10.425 1.00 . A A . 24 ARG HH22 1 1 14 5319 1 1 24 ARG N N 2.949 -1.866 3.949 1.00 . A A . 24 ARG N 1 1 14 5320 1 1 24 ARG NE N 0.314 -5.713 8.084 1.00 . A A . 24 ARG NE 1 1 14 5321 1 1 24 ARG NH1 N -1.720 -5.235 9.089 1.00 . A A . 24 ARG NH1 1 1 14 5322 1 1 24 ARG NH2 N -0.515 -7.105 9.749 1.00 . A A . 24 ARG NH2 1 1 14 5323 1 1 24 ARG O O 2.301 -4.923 3.305 1.00 . A A . 24 ARG O 1 1 14 5324 1 1 25 ASN C C 4.080 -6.171 1.669 1.00 . A A . 25 ASN C 1 1 14 5325 1 1 25 ASN CA C 5.101 -5.306 2.413 1.00 . A A . 25 ASN CA 1 1 14 5326 1 1 25 ASN CB C 6.118 -6.187 3.151 1.00 . A A . 25 ASN CB 1 1 14 5327 1 1 25 ASN CG C 6.788 -7.188 2.210 1.00 . A A . 25 ASN CG 1 1 14 5328 1 1 25 ASN H H 5.132 -3.651 3.737 1.00 . A A . 25 ASN H 1 1 14 5329 1 1 25 ASN HA H 5.651 -4.722 1.674 1.00 . A A . 25 ASN HA 1 1 14 5330 1 1 25 ASN HB3 H 5.608 -6.727 3.948 1.00 . A A . 25 ASN HB3 1 1 14 5331 1 1 25 ASN HD21 H 7.217 -8.465 3.739 1.00 . A A . 25 ASN HD21 1 1 14 5332 1 1 25 ASN HD22 H 7.731 -8.962 2.136 1.00 . A A . 25 ASN HD22 1 1 14 5333 1 1 25 ASN N N 4.507 -4.357 3.360 1.00 . A A . 25 ASN N 1 1 14 5334 1 1 25 ASN ND2 N 7.292 -8.294 2.749 1.00 . A A . 25 ASN ND2 1 1 14 5335 1 1 25 ASN O O 3.728 -7.246 2.148 1.00 . A A . 25 ASN O 1 1 14 5336 1 1 25 ASN OD1 O 6.862 -6.970 1.005 1.00 . A A . 25 ASN OD1 1 1 14 5337 1 1 26 GLY C C 1.324 -5.462 -0.337 1.00 . A A . 26 GLY C 1 1 14 5338 1 1 26 GLY CA C 2.553 -6.357 -0.246 1.00 . A A . 26 GLY CA 1 1 14 5339 1 1 26 GLY H H 3.948 -4.824 0.132 1.00 . A A . 26 GLY H 1 1 14 5340 1 1 26 GLY HA2 H 2.927 -6.553 -1.253 1.00 . A A . 26 GLY HA2 1 1 14 5341 1 1 26 GLY HA3 H 2.253 -7.305 0.200 1.00 . A A . 26 GLY HA3 1 1 14 5342 1 1 26 GLY N N 3.603 -5.696 0.514 1.00 . A A . 26 GLY N 1 1 14 5343 1 1 26 GLY O O 0.675 -5.429 -1.382 1.00 . A A . 26 GLY O 1 1 14 5344 1 1 27 PHE C C 0.174 -2.488 1.300 1.00 . A A . 27 PHE C 1 1 14 5345 1 1 27 PHE CA C -0.184 -3.896 0.837 1.00 . A A . 27 PHE CA 1 1 14 5346 1 1 27 PHE CB C -1.202 -4.547 1.776 1.00 . A A . 27 PHE CB 1 1 14 5347 1 1 27 PHE CD1 C -2.352 -6.200 0.250 1.00 . A A . 27 PHE CD1 1 1 14 5348 1 1 27 PHE CD2 C -0.901 -7.049 2.010 1.00 . A A . 27 PHE CD2 1 1 14 5349 1 1 27 PHE CE1 C -2.526 -7.508 -0.236 1.00 . A A . 27 PHE CE1 1 1 14 5350 1 1 27 PHE CE2 C -1.085 -8.357 1.533 1.00 . A A . 27 PHE CE2 1 1 14 5351 1 1 27 PHE CG C -1.547 -5.969 1.380 1.00 . A A . 27 PHE CG 1 1 14 5352 1 1 27 PHE CZ C -1.902 -8.587 0.412 1.00 . A A . 27 PHE CZ 1 1 14 5353 1 1 27 PHE H H 1.587 -4.805 1.573 1.00 . A A . 27 PHE H 1 1 14 5354 1 1 27 PHE HA H -0.630 -3.811 -0.147 1.00 . A A . 27 PHE HA 1 1 14 5355 1 1 27 PHE HB3 H -2.113 -3.946 1.775 1.00 . A A . 27 PHE HB3 1 1 14 5356 1 1 27 PHE HD1 H -2.777 -5.365 -0.287 1.00 . A A . 27 PHE HD1 1 1 14 5357 1 1 27 PHE HD2 H -0.206 -6.872 2.819 1.00 . A A . 27 PHE HD2 1 1 14 5358 1 1 27 PHE HE1 H -3.111 -7.684 -1.124 1.00 . A A . 27 PHE HE1 1 1 14 5359 1 1 27 PHE HE2 H -0.567 -9.181 2.003 1.00 . A A . 27 PHE HE2 1 1 14 5360 1 1 27 PHE HZ H -2.022 -9.593 0.033 1.00 . A A . 27 PHE HZ 1 1 14 5361 1 1 27 PHE N N 1.006 -4.736 0.744 1.00 . A A . 27 PHE N 1 1 14 5362 1 1 27 PHE O O 1.136 -2.300 2.035 1.00 . A A . 27 PHE O 1 1 14 5363 1 1 28 CYS C C -0.452 0.173 2.637 1.00 . A A . 28 CYS C 1 1 14 5364 1 1 28 CYS CA C -0.324 -0.077 1.136 1.00 . A A . 28 CYS CA 1 1 14 5365 1 1 28 CYS CB C -1.364 0.786 0.403 1.00 . A A . 28 CYS CB 1 1 14 5366 1 1 28 CYS H H -1.365 -1.729 0.252 1.00 . A A . 28 CYS H 1 1 14 5367 1 1 28 CYS HA H 0.679 0.186 0.798 1.00 . A A . 28 CYS HA 1 1 14 5368 1 1 28 CYS HB3 H -2.008 1.275 1.131 1.00 . A A . 28 CYS HB3 1 1 14 5369 1 1 28 CYS N N -0.578 -1.487 0.844 1.00 . A A . 28 CYS N 1 1 14 5370 1 1 28 CYS O O -1.413 -0.305 3.240 1.00 . A A . 28 CYS O 1 1 14 5371 1 1 28 CYS SG S -0.752 2.078 -0.699 1.00 . A A . 28 CYS SG 1 1 14 5372 1 1 29 ALA C C -0.991 2.393 4.593 1.00 . A A . 29 ALA C 1 1 14 5373 1 1 29 ALA CA C 0.198 1.426 4.605 1.00 . A A . 29 ALA CA 1 1 14 5374 1 1 29 ALA CB C 1.454 2.072 5.195 1.00 . A A . 29 ALA CB 1 1 14 5375 1 1 29 ALA H H 1.267 1.305 2.754 1.00 . A A . 29 ALA H 1 1 14 5376 1 1 29 ALA HA H -0.055 0.573 5.237 1.00 . A A . 29 ALA HA 1 1 14 5377 1 1 29 ALA HB1 H 1.758 2.932 4.600 1.00 . A A . 29 ALA HB1 1 1 14 5378 1 1 29 ALA HB2 H 1.250 2.398 6.215 1.00 . A A . 29 ALA HB2 1 1 14 5379 1 1 29 ALA HB3 H 2.261 1.339 5.213 1.00 . A A . 29 ALA HB3 1 1 14 5380 1 1 29 ALA N N 0.447 0.956 3.247 1.00 . A A . 29 ALA N 1 1 14 5381 1 1 29 ALA O O -2.002 2.155 5.253 1.00 . A A . 29 ALA O 1 1 14 5382 1 1 30 CYS C C -3.160 3.721 3.010 1.00 . A A . 30 CYS C 1 1 14 5383 1 1 30 CYS CA C -1.970 4.436 3.639 1.00 . A A . 30 CYS CA 1 1 14 5384 1 1 30 CYS CB C -1.546 5.625 2.775 1.00 . A A . 30 CYS CB 1 1 14 5385 1 1 30 CYS H H -0.039 3.591 3.269 1.00 . A A . 30 CYS H 1 1 14 5386 1 1 30 CYS HA H -2.258 4.828 4.615 1.00 . A A . 30 CYS HA 1 1 14 5387 1 1 30 CYS HB3 H -1.095 5.273 1.850 1.00 . A A . 30 CYS HB3 1 1 14 5388 1 1 30 CYS N N -0.880 3.480 3.815 1.00 . A A . 30 CYS N 1 1 14 5389 1 1 30 CYS O O -3.164 3.454 1.808 1.00 . A A . 30 CYS O 1 1 14 5390 1 1 30 CYS SG S -2.916 6.729 2.334 1.00 . A A . 30 CYS SG 1 1 14 5391 1 1 31 THR C C -6.347 3.154 2.729 1.00 . A A . 31 THR C 1 1 14 5392 1 1 31 THR CA C -5.217 2.461 3.496 1.00 . A A . 31 THR CA 1 1 14 5393 1 1 31 THR CB C -5.710 1.830 4.809 1.00 . A A . 31 THR CB 1 1 14 5394 1 1 31 THR CG2 C -6.098 0.362 4.620 1.00 . A A . 31 THR CG2 1 1 14 5395 1 1 31 THR H H -4.031 3.551 4.825 1.00 . A A . 31 THR H 1 1 14 5396 1 1 31 THR HA H -4.799 1.674 2.863 1.00 . A A . 31 THR HA 1 1 14 5397 1 1 31 THR HB H -6.582 2.378 5.173 1.00 . A A . 31 THR HB 1 1 14 5398 1 1 31 THR HG1 H -3.845 1.661 5.469 1.00 . A A . 31 THR HG1 1 1 14 5399 1 1 31 THR HG21 H -5.230 -0.219 4.305 1.00 . A A . 31 THR HG21 1 1 14 5400 1 1 31 THR HG22 H -6.466 -0.038 5.565 1.00 . A A . 31 THR HG22 1 1 14 5401 1 1 31 THR HG23 H -6.883 0.275 3.868 1.00 . A A . 31 THR HG23 1 1 14 5402 1 1 31 THR N N -4.152 3.390 3.830 1.00 . A A . 31 THR N 1 1 14 5403 1 1 31 THR O O -6.103 3.944 1.809 1.00 . A A . 31 THR O 1 1 14 5404 1 1 31 THR OG1 O -4.711 1.927 5.814 1.00 . A A . 31 THR OG1 1 1 15 5405 1 1 1 THR C C -9.830 -3.743 7.701 1.00 . A A . 1 THR C 1 1 15 5406 1 1 1 THR CA C -10.189 -2.548 8.598 1.00 . A A . 1 THR CA 1 1 15 5407 1 1 1 THR CB C -10.917 -1.451 7.805 1.00 . A A . 1 THR CB 1 1 15 5408 1 1 1 THR CG2 C -11.594 -0.460 8.756 1.00 . A A . 1 THR CG2 1 1 15 5409 1 1 1 THR H1 H -8.496 -1.358 8.523 1.00 . A A . 1 THR H1 1 1 15 5410 1 1 1 THR HA H -10.812 -2.889 9.425 1.00 . A A . 1 THR HA 1 1 15 5411 1 1 1 THR HB H -11.679 -1.895 7.162 1.00 . A A . 1 THR HB 1 1 15 5412 1 1 1 THR HG1 H -10.449 -0.047 6.534 1.00 . A A . 1 THR HG1 1 1 15 5413 1 1 1 THR HG21 H -10.852 0.018 9.395 1.00 . A A . 1 THR HG21 1 1 15 5414 1 1 1 THR HG22 H -12.117 0.308 8.183 1.00 . A A . 1 THR HG22 1 1 15 5415 1 1 1 THR HG23 H -12.320 -0.982 9.382 1.00 . A A . 1 THR HG23 1 1 15 5416 1 1 1 THR N N -8.987 -1.964 9.166 1.00 . A A . 1 THR N 1 1 15 5417 1 1 1 THR O O -8.712 -3.819 7.186 1.00 . A A . 1 THR O 1 1 15 5418 1 1 1 THR OG1 O -9.987 -0.744 7.007 1.00 . A A . 1 THR OG1 1 1 15 5419 1 1 2 PRO C C -10.569 -5.402 5.152 1.00 . A A . 2 PRO C 1 1 15 5420 1 1 2 PRO CA C -10.538 -5.838 6.622 1.00 . A A . 2 PRO CA 1 1 15 5421 1 1 2 PRO CB C -11.652 -6.828 6.982 1.00 . A A . 2 PRO CB 1 1 15 5422 1 1 2 PRO CD C -12.072 -4.768 8.115 1.00 . A A . 2 PRO CD 1 1 15 5423 1 1 2 PRO CG C -12.800 -5.911 7.407 1.00 . A A . 2 PRO CG 1 1 15 5424 1 1 2 PRO HA H -9.572 -6.303 6.829 1.00 . A A . 2 PRO HA 1 1 15 5425 1 1 2 PRO HB3 H -11.336 -7.421 7.843 1.00 . A A . 2 PRO HB3 1 1 15 5426 1 1 2 PRO HD3 H -11.951 -5.018 9.169 1.00 . A A . 2 PRO HD3 1 1 15 5427 1 1 2 PRO HG3 H -13.515 -6.416 8.057 1.00 . A A . 2 PRO HG3 1 1 15 5428 1 1 2 PRO N N -10.761 -4.691 7.490 1.00 . A A . 2 PRO N 1 1 15 5429 1 1 2 PRO O O -11.504 -5.711 4.416 1.00 . A A . 2 PRO O 1 1 15 5430 1 1 3 PHE C C -7.859 -3.990 3.137 1.00 . A A . 3 PHE C 1 1 15 5431 1 1 3 PHE CA C -9.354 -4.230 3.348 1.00 . A A . 3 PHE CA 1 1 15 5432 1 1 3 PHE CB C -10.178 -2.964 3.092 1.00 . A A . 3 PHE CB 1 1 15 5433 1 1 3 PHE CD1 C -10.656 -3.241 0.624 1.00 . A A . 3 PHE CD1 1 1 15 5434 1 1 3 PHE CD2 C -9.446 -1.259 1.358 1.00 . A A . 3 PHE CD2 1 1 15 5435 1 1 3 PHE CE1 C -10.544 -2.817 -0.711 1.00 . A A . 3 PHE CE1 1 1 15 5436 1 1 3 PHE CE2 C -9.364 -0.820 0.025 1.00 . A A . 3 PHE CE2 1 1 15 5437 1 1 3 PHE CG C -10.107 -2.462 1.661 1.00 . A A . 3 PHE CG 1 1 15 5438 1 1 3 PHE CZ C -9.899 -1.605 -1.009 1.00 . A A . 3 PHE CZ 1 1 15 5439 1 1 3 PHE H H -8.802 -4.419 5.376 1.00 . A A . 3 PHE H 1 1 15 5440 1 1 3 PHE HA H -9.677 -5.024 2.674 1.00 . A A . 3 PHE HA 1 1 15 5441 1 1 3 PHE HB3 H -9.839 -2.184 3.777 1.00 . A A . 3 PHE HB3 1 1 15 5442 1 1 3 PHE HD1 H -11.191 -4.153 0.852 1.00 . A A . 3 PHE HD1 1 1 15 5443 1 1 3 PHE HD2 H -9.027 -0.648 2.145 1.00 . A A . 3 PHE HD2 1 1 15 5444 1 1 3 PHE HE1 H -10.995 -3.401 -1.501 1.00 . A A . 3 PHE HE1 1 1 15 5445 1 1 3 PHE HE2 H -8.925 0.142 -0.199 1.00 . A A . 3 PHE HE2 1 1 15 5446 1 1 3 PHE HZ H -9.857 -1.255 -2.032 1.00 . A A . 3 PHE HZ 1 1 15 5447 1 1 3 PHE N N -9.541 -4.671 4.718 1.00 . A A . 3 PHE N 1 1 15 5448 1 1 3 PHE O O -7.114 -3.894 4.110 1.00 . A A . 3 PHE O 1 1 15 5449 1 1 4 ALA C C -5.787 -3.312 0.141 1.00 . A A . 4 ALA C 1 1 15 5450 1 1 4 ALA CA C -5.994 -3.836 1.563 1.00 . A A . 4 ALA CA 1 1 15 5451 1 1 4 ALA CB C -5.346 -5.213 1.737 1.00 . A A . 4 ALA CB 1 1 15 5452 1 1 4 ALA H H -8.075 -3.949 1.119 1.00 . A A . 4 ALA H 1 1 15 5453 1 1 4 ALA HA H -5.510 -3.151 2.263 1.00 . A A . 4 ALA HA 1 1 15 5454 1 1 4 ALA HB1 H -5.804 -5.940 1.066 1.00 . A A . 4 ALA HB1 1 1 15 5455 1 1 4 ALA HB2 H -4.283 -5.136 1.516 1.00 . A A . 4 ALA HB2 1 1 15 5456 1 1 4 ALA HB3 H -5.459 -5.559 2.765 1.00 . A A . 4 ALA HB3 1 1 15 5457 1 1 4 ALA N N -7.410 -3.924 1.879 1.00 . A A . 4 ALA N 1 1 15 5458 1 1 4 ALA O O -6.015 -4.038 -0.829 1.00 . A A . 4 ALA O 1 1 15 5459 1 1 5 ILE C C -3.385 -2.151 -1.413 1.00 . A A . 5 ILE C 1 1 15 5460 1 1 5 ILE CA C -4.766 -1.514 -1.213 1.00 . A A . 5 ILE CA 1 1 15 5461 1 1 5 ILE CB C -4.686 0.022 -1.084 1.00 . A A . 5 ILE CB 1 1 15 5462 1 1 5 ILE CD1 C -6.076 2.117 -0.572 1.00 . A A . 5 ILE CD1 1 1 15 5463 1 1 5 ILE CG1 C -6.090 0.611 -0.847 1.00 . A A . 5 ILE CG1 1 1 15 5464 1 1 5 ILE CG2 C -4.034 0.653 -2.323 1.00 . A A . 5 ILE CG2 1 1 15 5465 1 1 5 ILE H H -5.139 -1.547 0.867 1.00 . A A . 5 ILE H 1 1 15 5466 1 1 5 ILE HA H -5.417 -1.770 -2.050 1.00 . A A . 5 ILE HA 1 1 15 5467 1 1 5 ILE HB H -4.073 0.257 -0.213 1.00 . A A . 5 ILE HB 1 1 15 5468 1 1 5 ILE HD11 H -5.375 2.341 0.233 1.00 . A A . 5 ILE HD11 1 1 15 5469 1 1 5 ILE HD12 H -5.798 2.675 -1.466 1.00 . A A . 5 ILE HD12 1 1 15 5470 1 1 5 ILE HD13 H -7.074 2.433 -0.267 1.00 . A A . 5 ILE HD13 1 1 15 5471 1 1 5 ILE HG13 H -6.532 0.142 0.032 1.00 . A A . 5 ILE HG13 1 1 15 5472 1 1 5 ILE HG21 H -4.649 0.471 -3.205 1.00 . A A . 5 ILE HG21 1 1 15 5473 1 1 5 ILE HG22 H -3.918 1.725 -2.177 1.00 . A A . 5 ILE HG22 1 1 15 5474 1 1 5 ILE HG23 H -3.040 0.245 -2.489 1.00 . A A . 5 ILE HG23 1 1 15 5475 1 1 5 ILE N N -5.313 -2.070 0.020 1.00 . A A . 5 ILE N 1 1 15 5476 1 1 5 ILE O O -2.672 -2.346 -0.431 1.00 . A A . 5 ILE O 1 1 15 5477 1 1 6 LYS C C -0.580 -2.279 -2.950 1.00 . A A . 6 LYS C 1 1 15 5478 1 1 6 LYS CA C -1.777 -3.242 -2.934 1.00 . A A . 6 LYS CA 1 1 15 5479 1 1 6 LYS CB C -1.891 -4.023 -4.264 1.00 . A A . 6 LYS CB 1 1 15 5480 1 1 6 LYS CD C -3.570 -6.013 -4.055 1.00 . A A . 6 LYS CD 1 1 15 5481 1 1 6 LYS CE C -4.382 -5.283 -2.980 1.00 . A A . 6 LYS CE 1 1 15 5482 1 1 6 LYS CG C -2.106 -5.540 -4.099 1.00 . A A . 6 LYS CG 1 1 15 5483 1 1 6 LYS H H -3.588 -2.239 -3.428 1.00 . A A . 6 LYS H 1 1 15 5484 1 1 6 LYS HA H -1.606 -3.955 -2.132 1.00 . A A . 6 LYS HA 1 1 15 5485 1 1 6 LYS HB3 H -0.940 -3.915 -4.788 1.00 . A A . 6 LYS HB3 1 1 15 5486 1 1 6 LYS HD3 H -3.555 -7.086 -3.857 1.00 . A A . 6 LYS HD3 1 1 15 5487 1 1 6 LYS HE3 H -4.635 -4.290 -3.350 1.00 . A A . 6 LYS HE3 1 1 15 5488 1 1 6 LYS HG3 H -1.564 -5.898 -3.221 1.00 . A A . 6 LYS HG3 1 1 15 5489 1 1 6 LYS HZ1 H -6.089 -5.371 -1.916 1.00 . A A . 6 LYS HZ1 1 1 15 5490 1 1 6 LYS HZ2 H -6.264 -6.010 -3.431 1.00 . A A . 6 LYS HZ2 1 1 15 5491 1 1 6 LYS HZ3 H -5.486 -6.870 -2.250 1.00 . A A . 6 LYS HZ3 1 1 15 5492 1 1 6 LYS N N -3.018 -2.520 -2.645 1.00 . A A . 6 LYS N 1 1 15 5493 1 1 6 LYS NZ N -5.650 -5.951 -2.632 1.00 . A A . 6 LYS NZ 1 1 15 5494 1 1 6 LYS O O -0.761 -1.074 -3.109 1.00 . A A . 6 LYS O 1 1 15 5495 1 1 7 CYS C C 3.062 -3.026 -2.962 1.00 . A A . 7 CYS C 1 1 15 5496 1 1 7 CYS CA C 1.887 -2.068 -2.792 1.00 . A A . 7 CYS CA 1 1 15 5497 1 1 7 CYS CB C 2.031 -1.325 -1.467 1.00 . A A . 7 CYS CB 1 1 15 5498 1 1 7 CYS H H 0.702 -3.811 -2.580 1.00 . A A . 7 CYS H 1 1 15 5499 1 1 7 CYS HA H 1.874 -1.345 -3.610 1.00 . A A . 7 CYS HA 1 1 15 5500 1 1 7 CYS HB3 H 2.090 -2.035 -0.647 1.00 . A A . 7 CYS HB3 1 1 15 5501 1 1 7 CYS N N 0.635 -2.819 -2.787 1.00 . A A . 7 CYS N 1 1 15 5502 1 1 7 CYS O O 3.238 -3.904 -2.119 1.00 . A A . 7 CYS O 1 1 15 5503 1 1 7 CYS SG S 3.436 -0.205 -1.320 1.00 . A A . 7 CYS SG 1 1 15 5504 1 1 8 ALA C C 6.280 -2.825 -3.786 1.00 . A A . 8 ALA C 1 1 15 5505 1 1 8 ALA CA C 5.073 -3.654 -4.227 1.00 . A A . 8 ALA CA 1 1 15 5506 1 1 8 ALA CB C 5.191 -4.053 -5.700 1.00 . A A . 8 ALA CB 1 1 15 5507 1 1 8 ALA H H 3.714 -2.094 -4.674 1.00 . A A . 8 ALA H 1 1 15 5508 1 1 8 ALA HA H 5.052 -4.574 -3.637 1.00 . A A . 8 ALA HA 1 1 15 5509 1 1 8 ALA HB1 H 6.100 -4.640 -5.846 1.00 . A A . 8 ALA HB1 1 1 15 5510 1 1 8 ALA HB2 H 4.330 -4.654 -5.990 1.00 . A A . 8 ALA HB2 1 1 15 5511 1 1 8 ALA HB3 H 5.239 -3.165 -6.333 1.00 . A A . 8 ALA HB3 1 1 15 5512 1 1 8 ALA N N 3.854 -2.876 -4.029 1.00 . A A . 8 ALA N 1 1 15 5513 1 1 8 ALA O O 7.218 -3.342 -3.185 1.00 . A A . 8 ALA O 1 1 15 5514 1 1 9 THR C C 6.644 0.615 -3.092 1.00 . A A . 9 THR C 1 1 15 5515 1 1 9 THR CA C 7.269 -0.544 -3.866 1.00 . A A . 9 THR CA 1 1 15 5516 1 1 9 THR CB C 7.785 -0.055 -5.226 1.00 . A A . 9 THR CB 1 1 15 5517 1 1 9 THR CG2 C 8.508 -1.177 -5.979 1.00 . A A . 9 THR CG2 1 1 15 5518 1 1 9 THR H H 5.408 -1.187 -4.578 1.00 . A A . 9 THR H 1 1 15 5519 1 1 9 THR HA H 8.091 -0.965 -3.285 1.00 . A A . 9 THR HA 1 1 15 5520 1 1 9 THR HB H 8.498 0.756 -5.057 1.00 . A A . 9 THR HB 1 1 15 5521 1 1 9 THR HG1 H 5.948 -0.154 -5.985 1.00 . A A . 9 THR HG1 1 1 15 5522 1 1 9 THR HG21 H 9.314 -1.575 -5.364 1.00 . A A . 9 THR HG21 1 1 15 5523 1 1 9 THR HG22 H 7.813 -1.978 -6.229 1.00 . A A . 9 THR HG22 1 1 15 5524 1 1 9 THR HG23 H 8.929 -0.776 -6.902 1.00 . A A . 9 THR HG23 1 1 15 5525 1 1 9 THR N N 6.239 -1.533 -4.103 1.00 . A A . 9 THR N 1 1 15 5526 1 1 9 THR O O 5.479 0.935 -3.316 1.00 . A A . 9 THR O 1 1 15 5527 1 1 9 THR OG1 O 6.726 0.431 -6.035 1.00 . A A . 9 THR OG1 1 1 15 5528 1 1 10 ASP C C 6.310 3.430 -2.564 1.00 . A A . 10 ASP C 1 1 15 5529 1 1 10 ASP CA C 7.073 2.533 -1.581 1.00 . A A . 10 ASP CA 1 1 15 5530 1 1 10 ASP CB C 8.369 3.196 -1.093 1.00 . A A . 10 ASP CB 1 1 15 5531 1 1 10 ASP CG C 9.464 3.054 -2.139 1.00 . A A . 10 ASP CG 1 1 15 5532 1 1 10 ASP H H 8.392 0.986 -2.129 1.00 . A A . 10 ASP H 1 1 15 5533 1 1 10 ASP HA H 6.428 2.345 -0.723 1.00 . A A . 10 ASP HA 1 1 15 5534 1 1 10 ASP HB3 H 8.705 2.702 -0.182 1.00 . A A . 10 ASP HB3 1 1 15 5535 1 1 10 ASP N N 7.412 1.256 -2.209 1.00 . A A . 10 ASP N 1 1 15 5536 1 1 10 ASP O O 5.167 3.800 -2.300 1.00 . A A . 10 ASP O 1 1 15 5537 1 1 10 ASP OD1 O 9.523 3.935 -3.023 1.00 . A A . 10 ASP OD1 1 1 15 5538 1 1 10 ASP OD2 O 10.089 1.971 -2.137 1.00 . A A . 10 ASP OD2 1 1 15 5539 1 1 11 ALA C C 4.852 4.091 -5.096 1.00 . A A . 11 ALA C 1 1 15 5540 1 1 11 ALA CA C 6.341 4.385 -4.871 1.00 . A A . 11 ALA CA 1 1 15 5541 1 1 11 ALA CB C 7.156 4.037 -6.118 1.00 . A A . 11 ALA CB 1 1 15 5542 1 1 11 ALA H H 7.931 3.562 -3.735 1.00 . A A . 11 ALA H 1 1 15 5543 1 1 11 ALA HA H 6.450 5.459 -4.712 1.00 . A A . 11 ALA HA 1 1 15 5544 1 1 11 ALA HB1 H 6.771 4.591 -6.974 1.00 . A A . 11 ALA HB1 1 1 15 5545 1 1 11 ALA HB2 H 8.204 4.304 -5.963 1.00 . A A . 11 ALA HB2 1 1 15 5546 1 1 11 ALA HB3 H 7.089 2.971 -6.326 1.00 . A A . 11 ALA HB3 1 1 15 5547 1 1 11 ALA N N 6.923 3.719 -3.715 1.00 . A A . 11 ALA N 1 1 15 5548 1 1 11 ALA O O 4.097 5.034 -5.309 1.00 . A A . 11 ALA O 1 1 15 5549 1 1 12 ASP C C 2.100 3.193 -4.349 1.00 . A A . 12 ASP C 1 1 15 5550 1 1 12 ASP CA C 3.014 2.473 -5.338 1.00 . A A . 12 ASP CA 1 1 15 5551 1 1 12 ASP CB C 2.784 0.959 -5.186 1.00 . A A . 12 ASP CB 1 1 15 5552 1 1 12 ASP CG C 3.517 0.114 -6.209 1.00 . A A . 12 ASP CG 1 1 15 5553 1 1 12 ASP H H 5.052 2.083 -4.805 1.00 . A A . 12 ASP H 1 1 15 5554 1 1 12 ASP HA H 2.752 2.774 -6.354 1.00 . A A . 12 ASP HA 1 1 15 5555 1 1 12 ASP HB3 H 1.720 0.757 -5.304 1.00 . A A . 12 ASP HB3 1 1 15 5556 1 1 12 ASP N N 4.414 2.826 -5.076 1.00 . A A . 12 ASP N 1 1 15 5557 1 1 12 ASP O O 1.140 3.875 -4.715 1.00 . A A . 12 ASP O 1 1 15 5558 1 1 12 ASP OD1 O 3.275 0.331 -7.413 1.00 . A A . 12 ASP OD1 1 1 15 5559 1 1 12 ASP OD2 O 4.292 -0.764 -5.759 1.00 . A A . 12 ASP OD2 1 1 15 5560 1 1 13 CYS C C 1.755 5.084 -1.992 1.00 . A A . 13 CYS C 1 1 15 5561 1 1 13 CYS CA C 1.609 3.570 -1.986 1.00 . A A . 13 CYS CA 1 1 15 5562 1 1 13 CYS CB C 2.051 2.944 -0.666 1.00 . A A . 13 CYS CB 1 1 15 5563 1 1 13 CYS H H 3.252 2.503 -2.852 1.00 . A A . 13 CYS H 1 1 15 5564 1 1 13 CYS HA H 0.562 3.319 -2.158 1.00 . A A . 13 CYS HA 1 1 15 5565 1 1 13 CYS HB3 H 3.099 3.167 -0.475 1.00 . A A . 13 CYS HB3 1 1 15 5566 1 1 13 CYS N N 2.396 3.004 -3.066 1.00 . A A . 13 CYS N 1 1 15 5567 1 1 13 CYS O O 0.757 5.799 -1.971 1.00 . A A . 13 CYS O 1 1 15 5568 1 1 13 CYS SG S 1.096 3.382 0.793 1.00 . A A . 13 CYS SG 1 1 15 5569 1 1 14 SER C C 3.037 7.564 -3.590 1.00 . A A . 14 SER C 1 1 15 5570 1 1 14 SER CA C 3.412 6.953 -2.232 1.00 . A A . 14 SER CA 1 1 15 5571 1 1 14 SER CB C 4.931 7.004 -2.029 1.00 . A A . 14 SER CB 1 1 15 5572 1 1 14 SER H H 3.733 4.862 -2.180 1.00 . A A . 14 SER H 1 1 15 5573 1 1 14 SER HA H 2.934 7.526 -1.437 1.00 . A A . 14 SER HA 1 1 15 5574 1 1 14 SER HB3 H 5.425 6.508 -2.865 1.00 . A A . 14 SER HB3 1 1 15 5575 1 1 14 SER HG H 5.164 8.745 -2.828 1.00 . A A . 14 SER HG 1 1 15 5576 1 1 14 SER N N 2.998 5.558 -2.122 1.00 . A A . 14 SER N 1 1 15 5577 1 1 14 SER O O 3.867 8.205 -4.237 1.00 . A A . 14 SER O 1 1 15 5578 1 1 14 SER OG O 5.373 8.347 -1.971 1.00 . A A . 14 SER OG 1 1 15 5579 1 1 15 ARG C C -0.225 7.452 -5.280 1.00 . A A . 15 ARG C 1 1 15 5580 1 1 15 ARG CA C 1.278 7.688 -5.339 1.00 . A A . 15 ARG CA 1 1 15 5581 1 1 15 ARG CB C 1.961 6.793 -6.382 1.00 . A A . 15 ARG CB 1 1 15 5582 1 1 15 ARG CD C 2.054 5.779 -8.632 1.00 . A A . 15 ARG CD 1 1 15 5583 1 1 15 ARG CG C 1.460 6.943 -7.821 1.00 . A A . 15 ARG CG 1 1 15 5584 1 1 15 ARG CZ C 2.611 6.645 -10.906 1.00 . A A . 15 ARG CZ 1 1 15 5585 1 1 15 ARG H H 1.166 6.930 -3.356 1.00 . A A . 15 ARG H 1 1 15 5586 1 1 15 ARG HA H 1.474 8.736 -5.570 1.00 . A A . 15 ARG HA 1 1 15 5587 1 1 15 ARG HB3 H 1.820 5.757 -6.087 1.00 . A A . 15 ARG HB3 1 1 15 5588 1 1 15 ARG HD3 H 1.570 4.856 -8.307 1.00 . A A . 15 ARG HD3 1 1 15 5589 1 1 15 ARG HE H 1.063 5.393 -10.462 1.00 . A A . 15 ARG HE 1 1 15 5590 1 1 15 ARG HG3 H 1.779 7.910 -8.210 1.00 . A A . 15 ARG HG3 1 1 15 5591 1 1 15 ARG HH11 H 3.748 7.397 -9.408 1.00 . A A . 15 ARG HH11 1 1 15 5592 1 1 15 ARG HH12 H 4.234 7.913 -10.996 1.00 . A A . 15 ARG HH12 1 1 15 5593 1 1 15 ARG HH21 H 1.637 6.059 -12.607 1.00 . A A . 15 ARG HH21 1 1 15 5594 1 1 15 ARG HH22 H 2.964 7.146 -12.865 1.00 . A A . 15 ARG HH22 1 1 15 5595 1 1 15 ARG N N 1.791 7.372 -4.016 1.00 . A A . 15 ARG N 1 1 15 5596 1 1 15 ARG NE N 1.830 5.930 -10.078 1.00 . A A . 15 ARG NE 1 1 15 5597 1 1 15 ARG NH1 N 3.612 7.377 -10.408 1.00 . A A . 15 ARG NH1 1 1 15 5598 1 1 15 ARG NH2 N 2.385 6.621 -12.225 1.00 . A A . 15 ARG NH2 1 1 15 5599 1 1 15 ARG O O -1.007 8.344 -5.594 1.00 . A A . 15 ARG O 1 1 15 5600 1 1 16 LYS C C -2.479 6.984 -3.377 1.00 . A A . 16 LYS C 1 1 15 5601 1 1 16 LYS CA C -2.032 6.020 -4.491 1.00 . A A . 16 LYS CA 1 1 15 5602 1 1 16 LYS CB C -2.236 4.544 -4.101 1.00 . A A . 16 LYS CB 1 1 15 5603 1 1 16 LYS CD C -4.788 4.743 -4.111 1.00 . A A . 16 LYS CD 1 1 15 5604 1 1 16 LYS CE C -6.097 4.020 -4.459 1.00 . A A . 16 LYS CE 1 1 15 5605 1 1 16 LYS CG C -3.566 3.959 -4.604 1.00 . A A . 16 LYS CG 1 1 15 5606 1 1 16 LYS H H 0.048 5.529 -4.637 1.00 . A A . 16 LYS H 1 1 15 5607 1 1 16 LYS HA H -2.611 6.230 -5.392 1.00 . A A . 16 LYS HA 1 1 15 5608 1 1 16 LYS HB3 H -2.161 4.433 -3.018 1.00 . A A . 16 LYS HB3 1 1 15 5609 1 1 16 LYS HD3 H -4.797 5.717 -4.603 1.00 . A A . 16 LYS HD3 1 1 15 5610 1 1 16 LYS HE3 H -6.124 3.055 -3.950 1.00 . A A . 16 LYS HE3 1 1 15 5611 1 1 16 LYS HG3 H -3.621 2.926 -4.259 1.00 . A A . 16 LYS HG3 1 1 15 5612 1 1 16 LYS HZ1 H -7.268 5.710 -4.538 1.00 . A A . 16 LYS HZ1 1 1 15 5613 1 1 16 LYS HZ2 H -8.125 4.327 -4.306 1.00 . A A . 16 LYS HZ2 1 1 15 5614 1 1 16 LYS HZ3 H -7.269 4.981 -3.063 1.00 . A A . 16 LYS HZ3 1 1 15 5615 1 1 16 LYS N N -0.635 6.260 -4.822 1.00 . A A . 16 LYS N 1 1 15 5616 1 1 16 LYS NZ N -7.276 4.818 -4.061 1.00 . A A . 16 LYS NZ 1 1 15 5617 1 1 16 LYS O O -3.619 7.446 -3.375 1.00 . A A . 16 LYS O 1 1 15 5618 1 1 17 CYS C C -0.554 9.006 -1.045 1.00 . A A . 17 CYS C 1 1 15 5619 1 1 17 CYS CA C -1.817 8.161 -1.291 1.00 . A A . 17 CYS CA 1 1 15 5620 1 1 17 CYS CB C -2.195 7.304 -0.078 1.00 . A A . 17 CYS CB 1 1 15 5621 1 1 17 CYS H H -0.674 6.829 -2.448 1.00 . A A . 17 CYS H 1 1 15 5622 1 1 17 CYS HA H -2.652 8.820 -1.519 1.00 . A A . 17 CYS HA 1 1 15 5623 1 1 17 CYS HB3 H -1.684 6.343 -0.135 1.00 . A A . 17 CYS HB3 1 1 15 5624 1 1 17 CYS N N -1.588 7.271 -2.423 1.00 . A A . 17 CYS N 1 1 15 5625 1 1 17 CYS O O 0.551 8.514 -1.260 1.00 . A A . 17 CYS O 1 1 15 5626 1 1 17 CYS SG S -1.785 7.993 1.536 1.00 . A A . 17 CYS SG 1 1 15 5627 1 1 18 PRO C C 1.192 10.934 0.817 1.00 . A A . 18 PRO C 1 1 15 5628 1 1 18 PRO CA C 0.450 11.188 -0.503 1.00 . A A . 18 PRO CA 1 1 15 5629 1 1 18 PRO CB C -0.161 12.595 -0.535 1.00 . A A . 18 PRO CB 1 1 15 5630 1 1 18 PRO CD C -1.936 11.007 -0.462 1.00 . A A . 18 PRO CD 1 1 15 5631 1 1 18 PRO CG C -1.539 12.375 0.090 1.00 . A A . 18 PRO CG 1 1 15 5632 1 1 18 PRO HA H 1.152 11.078 -1.333 1.00 . A A . 18 PRO HA 1 1 15 5633 1 1 18 PRO HB3 H -0.285 12.910 -1.572 1.00 . A A . 18 PRO HB3 1 1 15 5634 1 1 18 PRO HD3 H -2.435 11.142 -1.422 1.00 . A A . 18 PRO HD3 1 1 15 5635 1 1 18 PRO HG3 H -2.250 13.157 -0.184 1.00 . A A . 18 PRO HG3 1 1 15 5636 1 1 18 PRO N N -0.686 10.291 -0.666 1.00 . A A . 18 PRO N 1 1 15 5637 1 1 18 PRO O O 0.764 10.132 1.640 1.00 . A A . 18 PRO O 1 1 15 5638 1 1 19 GLY C C 3.978 10.464 2.457 1.00 . A A . 19 GLY C 1 1 15 5639 1 1 19 GLY CA C 3.038 11.661 2.289 1.00 . A A . 19 GLY CA 1 1 15 5640 1 1 19 GLY H H 2.600 12.300 0.309 1.00 . A A . 19 GLY H 1 1 15 5641 1 1 19 GLY HA2 H 3.637 12.570 2.329 1.00 . A A . 19 GLY HA2 1 1 15 5642 1 1 19 GLY HA3 H 2.336 11.679 3.123 1.00 . A A . 19 GLY HA3 1 1 15 5643 1 1 19 GLY N N 2.301 11.654 1.026 1.00 . A A . 19 GLY N 1 1 15 5644 1 1 19 GLY O O 4.478 10.229 3.553 1.00 . A A . 19 GLY O 1 1 15 5645 1 1 20 ASN C C 4.949 7.585 2.542 1.00 . A A . 20 ASN C 1 1 15 5646 1 1 20 ASN CA C 5.063 8.524 1.329 1.00 . A A . 20 ASN CA 1 1 15 5647 1 1 20 ASN CB C 6.517 8.919 1.028 1.00 . A A . 20 ASN CB 1 1 15 5648 1 1 20 ASN CG C 7.400 7.724 0.654 1.00 . A A . 20 ASN CG 1 1 15 5649 1 1 20 ASN H H 3.757 9.972 0.519 1.00 . A A . 20 ASN H 1 1 15 5650 1 1 20 ASN HA H 4.696 7.952 0.481 1.00 . A A . 20 ASN HA 1 1 15 5651 1 1 20 ASN HB3 H 6.941 9.419 1.899 1.00 . A A . 20 ASN HB3 1 1 15 5652 1 1 20 ASN HD21 H 9.048 8.909 0.478 1.00 . A A . 20 ASN HD21 1 1 15 5653 1 1 20 ASN HD22 H 9.272 7.199 0.142 1.00 . A A . 20 ASN HD22 1 1 15 5654 1 1 20 ASN N N 4.219 9.716 1.378 1.00 . A A . 20 ASN N 1 1 15 5655 1 1 20 ASN ND2 N 8.683 7.973 0.413 1.00 . A A . 20 ASN ND2 1 1 15 5656 1 1 20 ASN O O 5.956 7.266 3.173 1.00 . A A . 20 ASN O 1 1 15 5657 1 1 20 ASN OD1 O 6.947 6.587 0.563 1.00 . A A . 20 ASN OD1 1 1 15 5658 1 1 21 PRO C C 4.161 4.676 2.817 1.00 . A A . 21 PRO C 1 1 15 5659 1 1 21 PRO CA C 3.624 5.860 3.642 1.00 . A A . 21 PRO CA 1 1 15 5660 1 1 21 PRO CB C 2.130 5.720 3.942 1.00 . A A . 21 PRO CB 1 1 15 5661 1 1 21 PRO CD C 2.453 7.548 2.401 1.00 . A A . 21 PRO CD 1 1 15 5662 1 1 21 PRO CG C 1.447 6.476 2.802 1.00 . A A . 21 PRO CG 1 1 15 5663 1 1 21 PRO HA H 4.165 5.987 4.578 1.00 . A A . 21 PRO HA 1 1 15 5664 1 1 21 PRO HB3 H 1.906 6.219 4.886 1.00 . A A . 21 PRO HB3 1 1 15 5665 1 1 21 PRO HD3 H 2.210 8.463 2.941 1.00 . A A . 21 PRO HD3 1 1 15 5666 1 1 21 PRO HG3 H 0.501 6.915 3.115 1.00 . A A . 21 PRO HG3 1 1 15 5667 1 1 21 PRO N N 3.749 7.071 2.850 1.00 . A A . 21 PRO N 1 1 15 5668 1 1 21 PRO O O 3.924 4.624 1.611 1.00 . A A . 21 PRO O 1 1 15 5669 1 1 22 PRO C C 4.585 1.479 2.449 1.00 . A A . 22 PRO C 1 1 15 5670 1 1 22 PRO CA C 5.550 2.642 2.720 1.00 . A A . 22 PRO CA 1 1 15 5671 1 1 22 PRO CB C 6.686 2.211 3.659 1.00 . A A . 22 PRO CB 1 1 15 5672 1 1 22 PRO CD C 5.281 3.732 4.832 1.00 . A A . 22 PRO CD 1 1 15 5673 1 1 22 PRO CG C 6.079 2.445 5.041 1.00 . A A . 22 PRO CG 1 1 15 5674 1 1 22 PRO HA H 5.970 2.987 1.773 1.00 . A A . 22 PRO HA 1 1 15 5675 1 1 22 PRO HB3 H 7.534 2.884 3.523 1.00 . A A . 22 PRO HB3 1 1 15 5676 1 1 22 PRO HD3 H 5.931 4.588 5.031 1.00 . A A . 22 PRO HD3 1 1 15 5677 1 1 22 PRO HG3 H 6.838 2.547 5.817 1.00 . A A . 22 PRO HG3 1 1 15 5678 1 1 22 PRO N N 4.899 3.735 3.429 1.00 . A A . 22 PRO N 1 1 15 5679 1 1 22 PRO O O 3.398 1.532 2.784 1.00 . A A . 22 PRO O 1 1 15 5680 1 1 23 CYS C C 4.394 -1.539 3.193 1.00 . A A . 23 CYS C 1 1 15 5681 1 1 23 CYS CA C 4.371 -0.864 1.822 1.00 . A A . 23 CYS CA 1 1 15 5682 1 1 23 CYS CB C 4.947 -1.857 0.801 1.00 . A A . 23 CYS CB 1 1 15 5683 1 1 23 CYS H H 6.082 0.381 1.613 1.00 . A A . 23 CYS H 1 1 15 5684 1 1 23 CYS HA H 3.345 -0.648 1.530 1.00 . A A . 23 CYS HA 1 1 15 5685 1 1 23 CYS HB3 H 4.273 -2.713 0.792 1.00 . A A . 23 CYS HB3 1 1 15 5686 1 1 23 CYS N N 5.112 0.386 1.886 1.00 . A A . 23 CYS N 1 1 15 5687 1 1 23 CYS O O 5.456 -1.922 3.681 1.00 . A A . 23 CYS O 1 1 15 5688 1 1 23 CYS SG S 5.119 -1.351 -0.922 1.00 . A A . 23 CYS SG 1 1 15 5689 1 1 24 ARG C C 3.207 -4.214 3.672 1.00 . A A . 24 ARG C 1 1 15 5690 1 1 24 ARG CA C 3.029 -2.996 4.589 1.00 . A A . 24 ARG CA 1 1 15 5691 1 1 24 ARG CB C 1.630 -2.932 5.227 1.00 . A A . 24 ARG CB 1 1 15 5692 1 1 24 ARG CD C -0.103 -4.028 6.671 1.00 . A A . 24 ARG CD 1 1 15 5693 1 1 24 ARG CG C 1.361 -4.080 6.210 1.00 . A A . 24 ARG CG 1 1 15 5694 1 1 24 ARG CZ C -0.186 -5.039 8.961 1.00 . A A . 24 ARG CZ 1 1 15 5695 1 1 24 ARG H H 2.398 -1.497 3.260 1.00 . A A . 24 ARG H 1 1 15 5696 1 1 24 ARG HA H 3.777 -3.015 5.384 1.00 . A A . 24 ARG HA 1 1 15 5697 1 1 24 ARG HB3 H 0.876 -2.946 4.438 1.00 . A A . 24 ARG HB3 1 1 15 5698 1 1 24 ARG HD3 H -0.739 -4.177 5.796 1.00 . A A . 24 ARG HD3 1 1 15 5699 1 1 24 ARG HE H -0.867 -5.913 7.253 1.00 . A A . 24 ARG HE 1 1 15 5700 1 1 24 ARG HG3 H 2.040 -3.987 7.057 1.00 . A A . 24 ARG HG3 1 1 15 5701 1 1 24 ARG HH11 H 0.754 -3.244 8.872 1.00 . A A . 24 ARG HH11 1 1 15 5702 1 1 24 ARG HH12 H 0.616 -3.895 10.475 1.00 . A A . 24 ARG HH12 1 1 15 5703 1 1 24 ARG HH21 H -1.054 -6.848 9.363 1.00 . A A . 24 ARG HH21 1 1 15 5704 1 1 24 ARG HH22 H -0.420 -6.022 10.747 1.00 . A A . 24 ARG HH22 1 1 15 5705 1 1 24 ARG N N 3.220 -1.822 3.754 1.00 . A A . 24 ARG N 1 1 15 5706 1 1 24 ARG NE N -0.414 -5.095 7.639 1.00 . A A . 24 ARG NE 1 1 15 5707 1 1 24 ARG NH1 N 0.439 -3.980 9.486 1.00 . A A . 24 ARG NH1 1 1 15 5708 1 1 24 ARG NH2 N -0.580 -6.044 9.752 1.00 . A A . 24 ARG NH2 1 1 15 5709 1 1 24 ARG O O 2.220 -4.822 3.260 1.00 . A A . 24 ARG O 1 1 15 5710 1 1 25 ASN C C 3.852 -6.291 1.658 1.00 . A A . 25 ASN C 1 1 15 5711 1 1 25 ASN CA C 4.956 -5.560 2.429 1.00 . A A . 25 ASN CA 1 1 15 5712 1 1 25 ASN CB C 5.809 -6.552 3.232 1.00 . A A . 25 ASN CB 1 1 15 5713 1 1 25 ASN CG C 6.403 -7.641 2.338 1.00 . A A . 25 ASN CG 1 1 15 5714 1 1 25 ASN H H 5.168 -3.851 3.664 1.00 . A A . 25 ASN H 1 1 15 5715 1 1 25 ASN HA H 5.613 -5.081 1.704 1.00 . A A . 25 ASN HA 1 1 15 5716 1 1 25 ASN HB3 H 5.191 -7.014 4.004 1.00 . A A . 25 ASN HB3 1 1 15 5717 1 1 25 ASN HD21 H 6.685 -8.899 3.915 1.00 . A A . 25 ASN HD21 1 1 15 5718 1 1 25 ASN HD22 H 7.187 -9.493 2.341 1.00 . A A . 25 ASN HD22 1 1 15 5719 1 1 25 ASN N N 4.468 -4.503 3.323 1.00 . A A . 25 ASN N 1 1 15 5720 1 1 25 ASN ND2 N 6.794 -8.770 2.923 1.00 . A A . 25 ASN ND2 1 1 15 5721 1 1 25 ASN O O 3.360 -7.319 2.117 1.00 . A A . 25 ASN O 1 1 15 5722 1 1 25 ASN OD1 O 6.524 -7.470 1.130 1.00 . A A . 25 ASN OD1 1 1 15 5723 1 1 26 GLY C C 1.221 -5.259 -0.376 1.00 . A A . 26 GLY C 1 1 15 5724 1 1 26 GLY CA C 2.363 -6.267 -0.302 1.00 . A A . 26 GLY CA 1 1 15 5725 1 1 26 GLY H H 3.920 -4.917 0.150 1.00 . A A . 26 GLY H 1 1 15 5726 1 1 26 GLY HA2 H 2.732 -6.463 -1.309 1.00 . A A . 26 GLY HA2 1 1 15 5727 1 1 26 GLY HA3 H 1.969 -7.199 0.102 1.00 . A A . 26 GLY HA3 1 1 15 5728 1 1 26 GLY N N 3.462 -5.749 0.499 1.00 . A A . 26 GLY N 1 1 15 5729 1 1 26 GLY O O 0.514 -5.212 -1.385 1.00 . A A . 26 GLY O 1 1 15 5730 1 1 27 PHE C C 0.277 -2.185 1.257 1.00 . A A . 27 PHE C 1 1 15 5731 1 1 27 PHE CA C -0.134 -3.600 0.850 1.00 . A A . 27 PHE CA 1 1 15 5732 1 1 27 PHE CB C -1.076 -4.227 1.882 1.00 . A A . 27 PHE CB 1 1 15 5733 1 1 27 PHE CD1 C -2.004 -6.112 0.482 1.00 . A A . 27 PHE CD1 1 1 15 5734 1 1 27 PHE CD2 C -0.632 -6.664 2.411 1.00 . A A . 27 PHE CD2 1 1 15 5735 1 1 27 PHE CE1 C -2.048 -7.469 0.121 1.00 . A A . 27 PHE CE1 1 1 15 5736 1 1 27 PHE CE2 C -0.670 -8.022 2.049 1.00 . A A . 27 PHE CE2 1 1 15 5737 1 1 27 PHE CG C -1.318 -5.707 1.640 1.00 . A A . 27 PHE CG 1 1 15 5738 1 1 27 PHE CZ C -1.388 -8.426 0.911 1.00 . A A . 27 PHE CZ 1 1 15 5739 1 1 27 PHE H H 1.629 -4.576 1.496 1.00 . A A . 27 PHE H 1 1 15 5740 1 1 27 PHE HA H -0.647 -3.536 -0.104 1.00 . A A . 27 PHE HA 1 1 15 5741 1 1 27 PHE HB3 H -2.028 -3.696 1.861 1.00 . A A . 27 PHE HB3 1 1 15 5742 1 1 27 PHE HD1 H -2.425 -5.364 -0.172 1.00 . A A . 27 PHE HD1 1 1 15 5743 1 1 27 PHE HD2 H 0.007 -6.355 3.227 1.00 . A A . 27 PHE HD2 1 1 15 5744 1 1 27 PHE HE1 H -2.537 -7.775 -0.790 1.00 . A A . 27 PHE HE1 1 1 15 5745 1 1 27 PHE HE2 H -0.102 -8.746 2.616 1.00 . A A . 27 PHE HE2 1 1 15 5746 1 1 27 PHE HZ H -1.389 -9.466 0.616 1.00 . A A . 27 PHE HZ 1 1 15 5747 1 1 27 PHE N N 1.029 -4.462 0.686 1.00 . A A . 27 PHE N 1 1 15 5748 1 1 27 PHE O O 1.262 -2.014 1.964 1.00 . A A . 27 PHE O 1 1 15 5749 1 1 28 CYS C C -0.408 0.681 2.437 1.00 . A A . 28 CYS C 1 1 15 5750 1 1 28 CYS CA C -0.086 0.241 1.010 1.00 . A A . 28 CYS CA 1 1 15 5751 1 1 28 CYS CB C -0.835 1.106 -0.006 1.00 . A A . 28 CYS CB 1 1 15 5752 1 1 28 CYS H H -1.276 -1.376 0.262 1.00 . A A . 28 CYS H 1 1 15 5753 1 1 28 CYS HA H 0.985 0.367 0.845 1.00 . A A . 28 CYS HA 1 1 15 5754 1 1 28 CYS HB3 H -1.874 0.789 -0.052 1.00 . A A . 28 CYS HB3 1 1 15 5755 1 1 28 CYS N N -0.444 -1.161 0.801 1.00 . A A . 28 CYS N 1 1 15 5756 1 1 28 CYS O O -1.579 0.730 2.808 1.00 . A A . 28 CYS O 1 1 15 5757 1 1 28 CYS SG S -0.864 2.886 0.317 1.00 . A A . 28 CYS SG 1 1 15 5758 1 1 29 ALA C C -0.125 2.793 4.852 1.00 . A A . 29 ALA C 1 1 15 5759 1 1 29 ALA CA C 0.398 1.365 4.653 1.00 . A A . 29 ALA CA 1 1 15 5760 1 1 29 ALA CB C 1.711 1.158 5.417 1.00 . A A . 29 ALA CB 1 1 15 5761 1 1 29 ALA H H 1.549 1.098 2.878 1.00 . A A . 29 ALA H 1 1 15 5762 1 1 29 ALA HA H -0.336 0.676 5.073 1.00 . A A . 29 ALA HA 1 1 15 5763 1 1 29 ALA HB1 H 2.437 1.921 5.131 1.00 . A A . 29 ALA HB1 1 1 15 5764 1 1 29 ALA HB2 H 1.529 1.231 6.489 1.00 . A A . 29 ALA HB2 1 1 15 5765 1 1 29 ALA HB3 H 2.126 0.177 5.197 1.00 . A A . 29 ALA HB3 1 1 15 5766 1 1 29 ALA N N 0.600 1.037 3.243 1.00 . A A . 29 ALA N 1 1 15 5767 1 1 29 ALA O O 0.290 3.469 5.792 1.00 . A A . 29 ALA O 1 1 15 5768 1 1 30 CYS C C -2.841 4.545 5.022 1.00 . A A . 30 CYS C 1 1 15 5769 1 1 30 CYS CA C -1.615 4.595 4.119 1.00 . A A . 30 CYS CA 1 1 15 5770 1 1 30 CYS CB C -1.966 5.170 2.748 1.00 . A A . 30 CYS CB 1 1 15 5771 1 1 30 CYS H H -1.383 2.633 3.280 1.00 . A A . 30 CYS H 1 1 15 5772 1 1 30 CYS HA H -0.894 5.281 4.572 1.00 . A A . 30 CYS HA 1 1 15 5773 1 1 30 CYS HB3 H -2.609 4.481 2.201 1.00 . A A . 30 CYS HB3 1 1 15 5774 1 1 30 CYS N N -1.030 3.265 3.990 1.00 . A A . 30 CYS N 1 1 15 5775 1 1 30 CYS O O -2.935 5.284 5.997 1.00 . A A . 30 CYS O 1 1 15 5776 1 1 30 CYS SG S -2.827 6.757 2.848 1.00 . A A . 30 CYS SG 1 1 15 5777 1 1 31 THR C C -5.341 1.930 5.370 1.00 . A A . 31 THR C 1 1 15 5778 1 1 31 THR CA C -4.993 3.414 5.472 1.00 . A A . 31 THR CA 1 1 15 5779 1 1 31 THR CB C -6.151 4.284 4.953 1.00 . A A . 31 THR CB 1 1 15 5780 1 1 31 THR CG2 C -5.939 5.771 5.248 1.00 . A A . 31 THR CG2 1 1 15 5781 1 1 31 THR H H -3.636 3.031 3.919 1.00 . A A . 31 THR H 1 1 15 5782 1 1 31 THR HA H -4.819 3.633 6.526 1.00 . A A . 31 THR HA 1 1 15 5783 1 1 31 THR HB H -7.070 3.972 5.451 1.00 . A A . 31 THR HB 1 1 15 5784 1 1 31 THR HG1 H -6.974 4.707 3.239 1.00 . A A . 31 THR HG1 1 1 15 5785 1 1 31 THR HG21 H -6.838 6.331 4.987 1.00 . A A . 31 THR HG21 1 1 15 5786 1 1 31 THR HG22 H -5.731 5.917 6.308 1.00 . A A . 31 THR HG22 1 1 15 5787 1 1 31 THR HG23 H -5.106 6.164 4.665 1.00 . A A . 31 THR HG23 1 1 15 5788 1 1 31 THR N N -3.784 3.657 4.699 1.00 . A A . 31 THR N 1 1 15 5789 1 1 31 THR O O -4.696 1.189 4.625 1.00 . A A . 31 THR O 1 1 15 5790 1 1 31 THR OG1 O -6.293 4.108 3.557 1.00 . A A . 31 THR OG1 1 1 stop_ save_
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