NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
651795 | 7jvf | 30713 | cing | 4-filtered-FRED | STAR | entry | full | 127 |
data_FRED_restraints_with_modified_coordinates_PDB_code_7jvf # This FRED archive file contains, for PDB entry <7jvf>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396. save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.PDB_coordinate_file_version . _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_7jvf _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 7jvf _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all other bound" _Assembly.Molecular_mass 2022.44 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 $Prochlorosin_2_10 A . 1 1 stop_ save_ save_Prochlorosin_2_10 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Prochlorosin 2 10" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code AGGXIPXLMXGCGWLXGLCVR _Entity.Number_of_monomers 21 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 ALA . 1 1 2 GLY . 1 1 3 GLY . 1 1 4 . $. 1 1 5 ILE . 1 1 6 PRO . 1 1 7 DAL $DAL 1 1 8 LEU . 1 1 9 MET . 1 1 10 . $. 1 1 11 GLY . 1 1 12 CYS . 1 1 13 GLY . 1 1 14 TRP . 1 1 15 LEU . 1 1 16 . $. 1 1 17 GLY . 1 1 18 LEU . 1 1 19 CYS . 1 1 20 VAL . 1 1 21 ARG . 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 ALA 1 1 1 1 GLY 2 2 1 1 GLY 3 3 1 1 . 4 4 1 1 ILE 5 5 1 1 PRO 6 6 1 1 DAL 7 7 1 1 LEU 8 8 1 1 MET 9 9 1 1 . 10 10 1 1 GLY 11 11 1 1 CYS 12 12 1 1 GLY 13 13 1 1 TRP 14 14 1 1 LEU 15 15 1 1 . 16 16 1 1 GLY 17 17 1 1 LEU 18 18 1 1 CYS 19 19 1 1 VAL 20 20 1 1 ARG 21 21 1 1 stop_ save_ save_DAL _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID DAL _Chem_comp.Type non-polymer save_ save_. _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID . _Chem_comp.Type non-polymer save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 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 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 5 ILE H . 5 . HN 1 1 1 1 2 1 1 9 MET HB2 . 9 . HB2 1 1 2 1 1 1 1 5 ILE H . 5 . HN 1 1 2 1 2 1 1 9 MET HB3 . 9 . HB1 1 1 3 1 1 1 1 5 ILE H . 5 . HN 1 1 3 1 2 1 1 9 MET HG2 . 9 . HG2 1 1 4 1 1 1 1 5 ILE H . 5 . HN 1 1 4 1 2 1 1 9 MET HG3 . 9 . HG1 1 1 5 1 1 1 1 5 ILE HA . 5 . HA 1 1 5 1 2 1 1 6 PRO HG3 . 6 . HG1 1 1 6 1 1 1 1 5 ILE HA . 5 . HA 1 1 6 1 2 1 1 8 LEU QB . 8 . HB# 1 1 7 1 1 1 1 5 ILE HA . 5 . HA 1 1 7 1 2 1 1 8 LEU HG . 8 . HG 1 1 8 1 1 1 1 5 ILE HB . 5 . HB 1 1 8 1 2 1 1 6 PRO HD2 . 6 . HD2 1 1 9 1 1 1 1 5 ILE HB . 5 . HB 1 1 9 1 2 1 1 6 PRO HD3 . 6 . HD1 1 1 10 1 1 1 1 5 ILE HB . 5 . HB 1 1 10 1 2 1 1 8 LEU H . 8 . HN 1 1 11 1 1 1 1 5 ILE HB . 5 . HB 1 1 11 1 2 1 1 8 LEU MD1 . 8 . HD1# 1 1 12 1 1 1 1 5 ILE MD . 5 . HD1# 1 1 12 1 2 1 1 6 PRO HD3 . 6 . HD1 1 1 13 1 1 1 1 5 ILE MD . 5 . HD1# 1 1 13 1 2 1 1 9 MET HB3 . 9 . HB1 1 1 14 1 1 1 1 5 ILE MD . 5 . HD1# 1 1 14 1 2 1 1 9 MET HG2 . 9 . HG2 1 1 15 1 1 1 1 5 ILE MD . 5 . HD1# 1 1 15 1 2 1 1 9 MET HG3 . 9 . HG1 1 1 16 1 1 1 1 5 ILE HG12 . 5 . HG12 1 1 16 1 2 1 1 6 PRO HD2 . 6 . HD2 1 1 17 1 1 1 1 5 ILE HG12 . 5 . HG12 1 1 17 1 2 1 1 6 PRO HD3 . 6 . HD1 1 1 18 1 1 1 1 5 ILE HG13 . 5 . HG11 1 1 18 1 2 1 1 6 PRO HD2 . 6 . HD2 1 1 19 1 1 1 1 5 ILE HG13 . 5 . HG11 1 1 19 1 2 1 1 6 PRO HD3 . 6 . HD1 1 1 20 1 1 1 1 5 ILE MG . 5 . HG2# 1 1 20 1 2 1 1 6 PRO HB3 . 6 . HB1 1 1 21 1 1 1 1 5 ILE MG . 5 . HG2# 1 1 21 1 2 1 1 6 PRO HD2 . 6 . HD2 1 1 22 1 1 1 1 5 ILE MG . 5 . HG2# 1 1 22 1 2 1 1 6 PRO HD3 . 6 . HD1 1 1 23 1 1 1 1 5 ILE MG . 5 . HG2# 1 1 23 1 2 1 1 8 LEU QB . 8 . HB# 1 1 24 1 1 1 1 5 ILE MG . 5 . HG2# 1 1 24 1 2 1 1 8 LEU HG . 8 . HG 1 1 25 1 1 1 1 5 ILE MG . 5 . HG2# 1 1 25 1 2 1 1 9 MET HB3 . 9 . HB1 1 1 26 1 1 1 1 5 ILE MG . 5 . HG2# 1 1 26 1 2 1 1 9 MET HG2 . 9 . HG2 1 1 27 1 1 1 1 5 ILE MG . 5 . HG2# 1 1 27 1 2 1 1 9 MET HG3 . 9 . HG1 1 1 28 1 1 1 1 6 PRO HA . 6 . HA 1 1 28 1 2 1 1 8 LEU H . 8 . HN 1 1 29 1 1 1 1 6 PRO HA . 6 . HA 1 1 29 1 2 1 1 9 MET QG . 9 . HG# 1 1 30 1 1 1 1 6 PRO HB2 . 6 . HB2 1 1 30 1 2 1 1 12 CYS HB2 . 12 . HB2 1 1 31 1 1 1 1 6 PRO HB2 . 6 . HB2 1 1 31 1 2 1 1 12 CYS HB3 . 12 . HB1 1 1 32 1 1 1 1 6 PRO HB2 . 6 . HB2 1 1 32 1 2 1 1 14 TRP HD1 . 14 . HD1 1 1 33 1 1 1 1 6 PRO HB3 . 6 . HB1 1 1 33 1 2 1 1 8 LEU H . 8 . HN 1 1 34 1 1 1 1 6 PRO HB3 . 6 . HB1 1 1 34 1 2 1 1 8 LEU MD2 . 8 . HD2# 1 1 35 1 1 1 1 6 PRO HB3 . 6 . HB1 1 1 35 1 2 1 1 12 CYS HB2 . 12 . HB2 1 1 36 1 1 1 1 6 PRO HB3 . 6 . HB1 1 1 36 1 2 1 1 12 CYS HB3 . 12 . HB1 1 1 37 1 1 1 1 6 PRO HB3 . 6 . HB1 1 1 37 1 2 1 1 14 TRP HD1 . 14 . HD1 1 1 38 1 1 1 1 6 PRO HD2 . 6 . HD2 1 1 38 1 2 1 1 15 LEU MD2 . 15 . HD2# 1 1 39 1 1 1 1 6 PRO HD3 . 6 . HD1 1 1 39 1 2 1 1 15 LEU MD2 . 15 . HD2# 1 1 40 1 1 1 1 7 DAL HA . 7 . HA 1 1 40 1 2 1 1 12 CYS HB2 . 12 . HB2 1 1 41 1 1 1 1 7 DAL HA . 7 . HA 1 1 41 1 2 1 1 12 CYS HB3 . 12 . HB1 1 1 42 1 1 1 1 7 DAL HB1 . 7 . HB2 1 1 42 1 2 1 1 8 LEU MD2 . 8 . HD2# 1 1 43 1 1 1 1 7 DAL HB1 . 7 . HB3 1 1 43 1 2 1 1 9 MET H . 9 . HN 1 1 44 1 1 1 1 7 DAL HB1 . 7 . HB3 1 1 44 1 2 1 1 11 GLY H . 11 . HN 1 1 45 1 1 1 1 7 DAL HB1 . 7 . HB2 1 1 45 1 2 1 1 11 GLY HA3 . 11 . HA1 1 1 46 1 1 1 1 7 DAL HB1 . 7 . HB2 1 1 46 1 2 1 1 12 CYS H . 12 . HN 1 1 47 1 1 1 1 7 DAL HB1 . 7 . HB3 1 1 47 1 2 1 1 12 CYS HA . 12 . HA 1 1 48 1 1 1 1 7 DAL HB1 . 7 . HB3 1 1 48 1 2 1 1 13 GLY H . 13 . HN 1 1 49 1 1 1 1 7 DAL HB1 . 7 . HB3 1 1 49 1 2 1 1 14 TRP HD1 . 14 . HD1 1 1 50 1 1 1 1 7 DAL HB1 . 7 . HB3 1 1 50 1 2 1 1 14 TRP HE3 . 14 . HE3 1 1 51 1 1 1 1 7 DAL HB1 . 7 . HB2 1 1 51 1 2 1 1 15 LEU MD2 . 15 . HD2# 1 1 52 1 1 1 1 8 LEU H . 8 . HN 1 1 52 1 2 1 1 8 LEU MD2 . 8 . HD2# 1 1 53 1 1 1 1 8 LEU H . 8 . HN 1 1 53 1 2 1 1 9 MET H . 9 . HN 1 1 54 1 1 1 1 8 LEU H . 8 . HN 1 1 54 1 2 1 1 9 MET HB2 . 9 . HB2 1 1 55 1 1 1 1 8 LEU H . 8 . HN 1 1 55 1 2 1 1 9 MET HB3 . 9 . HB1 1 1 56 1 1 1 1 8 LEU H . 8 . HN 1 1 56 1 2 1 1 9 MET HG2 . 9 . HG2 1 1 57 1 1 1 1 8 LEU HA . 8 . HA 1 1 57 1 2 1 1 14 TRP HZ2 . 14 . HZ2 1 1 58 1 1 1 1 8 LEU HA . 8 . HA 1 1 58 1 2 1 1 14 TRP HZ3 . 14 . HZ3 1 1 59 1 1 1 1 8 LEU HA . 8 . HA 1 1 59 1 2 1 1 21 ARG HB3 . 21 . HB1 1 1 60 1 1 1 1 8 LEU QB . 8 . HB# 1 1 60 1 2 1 1 9 MET HA . 9 . HA 1 1 61 1 1 1 1 8 LEU QB . 8 . HB# 1 1 61 1 2 1 1 9 MET HB3 . 9 . HB1 1 1 62 1 1 1 1 8 LEU QB . 8 . HB# 1 1 62 1 2 1 1 9 MET HG2 . 9 . HG2 1 1 63 1 1 1 1 8 LEU QB . 8 . HB# 1 1 63 1 2 1 1 9 MET HG3 . 9 . HG1 1 1 64 1 1 1 1 8 LEU QB . 8 . HB# 1 1 64 1 2 1 1 14 TRP HE3 . 14 . HE3 1 1 65 1 1 1 1 8 LEU QB . 8 . HB# 1 1 65 1 2 1 1 14 TRP HH2 . 14 . HH2 1 1 66 1 1 1 1 8 LEU QD . 8 . HD# 1 1 66 1 2 1 1 9 MET QG . 9 . HG# 1 1 67 1 1 1 1 8 LEU HG . 8 . HG 1 1 67 1 2 1 1 9 MET HG2 . 9 . HG2 1 1 68 1 1 1 1 9 MET H . 9 . HN 1 1 68 1 2 1 1 9 MET QG . 9 . HG# 1 1 69 1 1 1 1 9 MET HB2 . 9 . HB2 1 1 69 1 2 1 1 11 GLY H . 11 . HN 1 1 70 1 1 1 1 9 MET QG . 9 . HG# 1 1 70 1 2 1 1 11 GLY H . 11 . HN 1 1 71 1 1 1 1 11 GLY H . 11 . HN 1 1 71 1 2 1 1 12 CYS H . 12 . HN 1 1 72 1 1 1 1 11 GLY H . 11 . HN 1 1 72 1 2 1 1 19 CYS HB2 . 19 . HB2 1 1 73 1 1 1 1 11 GLY H . 11 . HN 1 1 73 1 2 1 1 19 CYS HB3 . 19 . HB1 1 1 74 1 1 1 1 11 GLY HA2 . 11 . HA2 1 1 74 1 2 1 1 12 CYS H . 12 . HN 1 1 75 1 1 1 1 11 GLY HA2 . 11 . HA2 1 1 75 1 2 1 1 19 CYS HB2 . 19 . HB2 1 1 76 1 1 1 1 11 GLY HA2 . 11 . HA2 1 1 76 1 2 1 1 19 CYS HB3 . 19 . HB1 1 1 77 1 1 1 1 11 GLY HA3 . 11 . HA1 1 1 77 1 2 1 1 19 CYS HB2 . 19 . HB2 1 1 78 1 1 1 1 11 GLY HA3 . 11 . HA1 1 1 78 1 2 1 1 19 CYS HB3 . 19 . HB1 1 1 79 1 1 1 1 12 CYS H . 12 . HN 1 1 79 1 2 1 1 12 CYS HB2 . 12 . HB2 1 1 80 1 1 1 1 12 CYS H . 12 . HN 1 1 80 1 2 1 1 13 GLY H . 13 . HN 1 1 81 1 1 1 1 12 CYS HB2 . 12 . HB2 1 1 81 1 2 1 1 13 GLY H . 13 . HN 1 1 82 1 1 1 1 12 CYS HB2 . 12 . HB2 1 1 82 1 2 1 1 14 TRP H . 14 . HN 1 1 83 1 1 1 1 12 CYS HB2 . 12 . HB2 1 1 83 1 2 1 1 14 TRP HD1 . 14 . HD1 1 1 84 1 1 1 1 12 CYS HB2 . 12 . HB2 1 1 84 1 2 1 1 15 LEU MD2 . 15 . HD2# 1 1 85 1 1 1 1 12 CYS HB2 . 12 . HB2 1 1 85 1 2 1 1 17 GLY H . 17 . HN 1 1 86 1 1 1 1 12 CYS HB2 . 12 . HB2 1 1 86 1 2 1 1 17 GLY HA2 . 17 . HA2 1 1 87 1 1 1 1 12 CYS HB3 . 12 . HB1 1 1 87 1 2 1 1 13 GLY H . 13 . HN 1 1 88 1 1 1 1 12 CYS HB3 . 12 . HB1 1 1 88 1 2 1 1 14 TRP H . 14 . HN 1 1 89 1 1 1 1 12 CYS HB3 . 12 . HB1 1 1 89 1 2 1 1 14 TRP HD1 . 14 . HD1 1 1 90 1 1 1 1 12 CYS HB3 . 12 . HB1 1 1 90 1 2 1 1 15 LEU MD2 . 15 . HD2# 1 1 91 1 1 1 1 12 CYS HB3 . 12 . HB1 1 1 91 1 2 1 1 17 GLY H . 17 . HN 1 1 92 1 1 1 1 13 GLY H . 13 . HN 1 1 92 1 2 1 1 14 TRP HD1 . 14 . HD1 1 1 93 1 1 1 1 13 GLY HA3 . 13 . HA1 1 1 93 1 2 1 1 15 LEU MD2 . 15 . HD2# 1 1 94 1 1 1 1 13 GLY HA3 . 13 . HA1 1 1 94 1 2 1 1 17 GLY H . 17 . HN 1 1 95 1 1 1 1 14 TRP HB2 . 14 . HB2 1 1 95 1 2 1 1 15 LEU MD1 . 15 . HD1# 1 1 96 1 1 1 1 14 TRP HB2 . 14 . HB2 1 1 96 1 2 1 1 15 LEU MD2 . 15 . HD2# 1 1 97 1 1 1 1 14 TRP HB2 . 14 . HB2 1 1 97 1 2 1 1 17 GLY H . 17 . HN 1 1 98 1 1 1 1 14 TRP HB3 . 14 . HB1 1 1 98 1 2 1 1 15 LEU MD1 . 15 . HD1# 1 1 99 1 1 1 1 14 TRP HB3 . 14 . HB1 1 1 99 1 2 1 1 15 LEU MD2 . 15 . HD2# 1 1 100 1 1 1 1 14 TRP HB3 . 14 . HB1 1 1 100 1 2 1 1 17 GLY H . 17 . HN 1 1 101 1 1 1 1 14 TRP HD1 . 14 . HD1 1 1 101 1 2 1 1 15 LEU MD1 . 15 . HD1# 1 1 102 1 1 1 1 14 TRP HD1 . 14 . HD1 1 1 102 1 2 1 1 15 LEU MD2 . 15 . HD2# 1 1 103 1 1 1 1 14 TRP HD1 . 14 . HD1 1 1 103 1 2 1 1 18 LEU HA . 18 . HA 1 1 104 1 1 1 1 14 TRP HE3 . 14 . HE3 1 1 104 1 2 1 1 15 LEU MD2 . 15 . HD2# 1 1 105 1 1 1 1 14 TRP HE3 . 14 . HE3 1 1 105 1 2 1 1 15 LEU HG . 15 . HG 1 1 106 1 1 1 1 14 TRP HH2 . 14 . HH2 1 1 106 1 2 1 1 15 LEU MD1 . 15 . HD1# 1 1 107 1 1 1 1 14 TRP HH2 . 14 . HH2 1 1 107 1 2 1 1 15 LEU MD2 . 15 . HD2# 1 1 108 1 1 1 1 14 TRP HZ2 . 14 . HZ2 1 1 108 1 2 1 1 15 LEU MD2 . 15 . HD2# 1 1 109 1 1 1 1 14 TRP HZ3 . 14 . HZ3 1 1 109 1 2 1 1 15 LEU MD1 . 15 . HD1# 1 1 110 1 1 1 1 14 TRP HZ3 . 14 . HZ3 1 1 110 1 2 1 1 15 LEU MD2 . 15 . HD2# 1 1 111 1 1 1 1 15 LEU MD2 . 15 . HD2# 1 1 111 1 2 1 1 17 GLY H . 17 . HN 1 1 112 1 1 1 1 15 LEU MD2 . 15 . HD2# 1 1 112 1 2 1 1 17 GLY HA2 . 17 . HA2 1 1 113 1 1 1 1 17 GLY H . 17 . HN 1 1 113 1 2 1 1 18 LEU H . 18 . HN 1 1 114 1 1 1 1 17 GLY H . 17 . HN 1 1 114 1 2 1 1 20 VAL MG2 . 20 . HG2# 1 1 115 1 1 1 1 17 GLY HA2 . 17 . HA2 1 1 115 1 2 1 1 18 LEU H . 18 . HN 1 1 116 1 1 1 1 17 GLY HA3 . 17 . HA1 1 1 116 1 2 1 1 18 LEU H . 18 . HN 1 1 117 1 1 1 1 20 VAL H . 20 . HN 1 1 117 1 2 1 1 21 ARG H . 21 . HN 1 1 118 1 1 1 1 20 VAL HA . 20 . HA 1 1 118 1 2 1 1 20 VAL MG1 . 20 . HG1# 1 1 119 1 1 1 1 20 VAL HA . 20 . HA 1 1 119 1 2 1 1 20 VAL MG2 . 20 . HG2# 1 1 120 1 1 1 1 20 VAL HA . 20 . HA 1 1 120 1 2 1 1 21 ARG H . 21 . HN 1 1 121 1 1 1 1 20 VAL HB . 20 . HB 1 1 121 1 2 1 1 21 ARG H . 21 . HN 1 1 122 1 1 1 1 20 VAL MG2 . 20 . HG2# 1 1 122 1 2 1 1 21 ARG H . 21 . HN 1 1 123 1 1 1 1 21 ARG H . 21 . HN 1 1 123 1 2 1 1 21 ARG HB3 . 21 . HB1 1 1 124 1 1 1 1 21 ARG HA . 21 . HA 1 1 124 1 2 1 1 21 ARG HE . 21 . HE 1 1 125 1 1 1 1 21 ARG HB2 . 21 . HB2 1 1 125 1 2 1 1 21 ARG QD . 21 . HD# 1 1 126 1 1 1 1 21 ARG HB3 . 21 . HB1 1 1 126 1 2 1 1 21 ARG QD . 21 . HD# 1 1 127 1 1 1 1 21 ARG HE . 21 . HE 1 1 127 1 2 1 1 21 ARG QG . 21 . HG# 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 . . . . . 5.5 1.8 6.5 1 1 2 1 . . . . . 5.5 1.8 6.5 1 1 3 1 . . . . . 5.5 1.8 6.5 1 1 4 1 . . . . . 5.5 1.8 6.5 1 1 5 1 . . . . . 4.5 1.8 5.5 1 1 6 1 . . . . . 5.5 1.8 6.5 1 1 7 1 . . . . . 5.5 1.8 6.5 1 1 8 1 . . . . . 4.5 1.8 5.5 1 1 9 1 . . . . . 3.5 1.8 4.5 1 1 10 1 . . . . . 4.5 1.8 5.5 1 1 11 1 . . . . . 5.5 1.8 6.5 1 1 12 1 . . . . . 3.5 1.8 4.5 1 1 13 1 . . . . . 4.5 1.8 5.5 1 1 14 1 . . . . . 4.5 1.8 5.5 1 1 15 1 . . . . . 3.5 1.8 4.5 1 1 16 1 . . . . . 4.5 1.8 5.5 1 1 17 1 . . . . . 4.5 1.8 5.5 1 1 18 1 . . . . . 4.5 1.8 5.5 1 1 19 1 . . . . . 4.5 1.8 5.5 1 1 20 1 . . . . . 4.5 1.8 5.5 1 1 21 1 . . . . . 3.5 1.8 4.5 1 1 22 1 . . . . . 3.5 1.8 4.5 1 1 23 1 . . . . . 5.5 1.8 6.5 1 1 24 1 . . . . . 5.5 1.8 6.5 1 1 25 1 . . . . . 4.5 1.8 5.5 1 1 26 1 . . . . . 4.5 1.8 5.5 1 1 27 1 . . . . . 4.5 1.8 5.5 1 1 28 1 . . . . . 4.5 1.8 5.5 1 1 29 1 . . . . . 4.5 1.8 5.5 1 1 30 1 . . . . . 5.5 1.8 6.5 1 1 31 1 . . . . . 5.5 1.8 6.5 1 1 32 1 . . . . . 5.0 1.8 6.0 1 1 33 1 . . . . . 5.5 1.8 6.5 1 1 34 1 . . . . . 4.5 1.8 5.5 1 1 35 1 . . . . . 5.5 1.8 6.5 1 1 36 1 . . . . . 5.5 1.8 6.5 1 1 37 1 . . . . . 6.0 1.8 7.0 1 1 38 1 . . . . . 5.5 1.8 6.5 1 1 39 1 . . . . . 5.5 1.8 6.5 1 1 40 1 . . . . . 4.5 1.8 5.5 1 1 41 1 . . . . . 4.5 1.8 5.5 1 1 42 1 . . . . . 4.5 1.8 5.5 1 1 43 1 . . . . . 4.5 1.8 5.5 1 1 44 1 . . . . . 5.0 1.8 5.5 1 1 45 1 . . . . . 4.5 1.8 5.5 1 1 46 1 . . . . . 4.5 1.8 5.5 1 1 47 1 . . . . . 4.5 1.8 5.5 1 1 48 1 . . . . . 4.5 1.8 5.5 1 1 49 1 . . . . . 5.0 1.8 6.0 1 1 50 1 . . . . . 6.0 1.8 7.0 1 1 51 1 . . . . . 5.5 2.8 6.5 1 1 52 1 . . . . . 5.5 1.8 6.5 1 1 53 1 . . . . . 3.5 1.8 4.5 1 1 54 1 . . . . . 4.5 1.8 5.5 1 1 55 1 . . . . . 5.5 1.8 6.5 1 1 56 1 . . . . . 4.5 1.8 5.5 1 1 57 1 . . . . . 4.5 1.8 5.5 1 1 58 1 . . . . . 4.5 1.8 5.5 1 1 59 1 . . . . . 4.5 1.8 5.5 1 1 60 1 . . . . . 4.5 1.8 5.5 1 1 61 1 . . . . . 4.5 1.8 5.5 1 1 62 1 . . . . . 4.5 1.8 4.5 1 1 63 1 . . . . . 4.5 1.8 5.5 1 1 64 1 . . . . . 4.5 1.8 5.5 1 1 65 1 . . . . . 4.5 1.8 5.5 1 1 66 1 . . . . . 4.5 1.8 5.5 1 1 67 1 . . . . . 4.5 1.8 5.5 1 1 68 1 . . . . . 4.5 1.8 5.5 1 1 69 1 . . . . . 5.5 1.8 6.5 1 1 70 1 . . . . . 4.5 1.8 5.5 1 1 71 1 . . . . . 3.5 1.8 4.5 1 1 72 1 . . . . . 5.5 1.8 6.5 1 1 73 1 . . . . . 5.5 1.8 6.5 1 1 74 1 . . . . . 3.5 1.8 4.5 1 1 75 1 . . . . . 5.5 1.8 6.5 1 1 76 1 . . . . . 5.5 1.8 6.5 1 1 77 1 . . . . . 5.5 1.8 6.5 1 1 78 1 . . . . . 5.5 2.0 5.7 1 1 79 1 . . . . . 3.5 1.8 4.5 1 1 80 1 . . . . . 3.5 1.8 4.5 1 1 81 1 . . . . . 4.5 1.8 5.5 1 1 82 1 . . . . . 4.5 1.8 5.5 1 1 83 1 . . . . . 4.5 1.8 5.5 1 1 84 1 . . . . . 5.5 1.8 6.5 1 1 85 1 . . . . . 5.5 1.8 6.5 1 1 86 1 . . . . . 5.5 1.8 6.5 1 1 87 1 . . . . . 4.5 1.8 5.5 1 1 88 1 . . . . . 4.5 1.8 5.5 1 1 89 1 . . . . . 4.5 1.8 5.5 1 1 90 1 . . . . . 5.5 1.8 6.5 1 1 91 1 . . . . . 5.5 1.8 6.5 1 1 92 1 . . . . . 4.5 1.8 5.5 1 1 93 1 . . . . . 5.5 1.8 6.5 1 1 94 1 . . . . . 5.5 1.8 6.5 1 1 95 1 . . . . . 5.5 1.8 6.5 1 1 96 1 . . . . . 5.5 1.8 6.5 1 1 97 1 . . . . . 5.5 1.8 6.5 1 1 98 1 . . . . . 5.5 1.8 6.5 1 1 99 1 . . . . . 5.5 1.8 6.5 1 1 100 1 . . . . . 5.5 1.8 6.5 1 1 101 1 . . . . . 4.5 1.8 5.5 1 1 102 1 . . . . . 4.5 1.8 5.5 1 1 103 1 . . . . . 5.5 1.8 6.5 1 1 104 1 . . . . . 4.5 1.8 5.5 1 1 105 1 . . . . . 4.5 1.8 5.5 1 1 106 1 . . . . . 4.5 1.8 5.5 1 1 107 1 . . . . . 4.5 1.8 5.5 1 1 108 1 . . . . . 4.5 1.8 5.5 1 1 109 1 . . . . . 6.0 1.8 7.0 1 1 110 1 . . . . . 4.5 1.8 5.5 1 1 111 1 . . . . . 5.5 1.8 6.5 1 1 112 1 . . . . . 5.5 1.8 6.5 1 1 113 1 . . . . . 3.5 1.8 4.5 1 1 114 1 . . . . . 3.5 1.8 4.5 1 1 115 1 . . . . . 3.5 1.8 4.5 1 1 116 1 . . . . . 3.5 1.8 4.5 1 1 117 1 . . . . . 3.5 1.8 4.5 1 1 118 1 . . . . . 3.5 1.8 4.5 1 1 119 1 . . . . . 3.5 1.8 4.5 1 1 120 1 . . . . . 3.5 1.8 4.5 1 1 121 1 . . . . . 4.5 1.8 5.5 1 1 122 1 . . . . . 4.5 1.8 5.5 1 1 123 1 . . . . . 3.5 1.8 4.5 1 1 124 1 . . . . . 4.5 1.8 5.5 1 1 125 1 . . . . . 3.5 1.8 4.5 1 1 126 1 . . . . . 3.5 1.8 4.5 1 1 127 1 . . . . . 3.5 1.8 4.5 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 ALA C C 10.739 7.360 -9.339 1.00 . A A . 1 ALA C 1 1 1 2 1 1 1 ALA CA C 9.406 8.088 -9.195 1.00 . A A . 1 ALA CA 1 1 1 3 1 1 1 ALA CB C 9.150 8.962 -10.424 1.00 . A A . 1 ALA CB 1 1 1 4 1 1 1 ALA H1 H 9.615 9.936 -8.256 1.00 . A A . 1 ALA H1 1 1 1 5 1 1 1 ALA H2 H 10.209 8.625 -7.350 1.00 . A A . 1 ALA H2 1 1 1 6 1 1 1 ALA H3 H 8.535 8.884 -7.479 1.00 . A A . 1 ALA H3 1 1 1 7 1 1 1 ALA HA H 8.611 7.365 -9.097 1.00 . A A . 1 ALA HA 1 1 1 8 1 1 1 ALA HB1 H 8.228 8.656 -10.898 1.00 . A A . 1 ALA HB1 1 1 1 9 1 1 1 ALA HB2 H 9.968 8.849 -11.123 1.00 . A A . 1 ALA HB2 1 1 1 10 1 1 1 ALA HB3 H 9.075 9.995 -10.123 1.00 . A A . 1 ALA HB3 1 1 1 11 1 1 1 ALA N N 9.444 8.948 -7.978 1.00 . A A . 1 ALA N 1 1 1 12 1 1 1 ALA O O 10.810 6.292 -9.948 1.00 . A A . 1 ALA O 1 1 1 13 1 1 2 GLY C C 13.143 5.999 -8.118 1.00 . A A . 2 GLY C 1 1 1 14 1 1 2 GLY CA C 13.117 7.339 -8.845 1.00 . A A . 2 GLY CA 1 1 1 15 1 1 2 GLY H H 11.674 8.793 -8.300 1.00 . A A . 2 GLY H 1 1 1 16 1 1 2 GLY HA2 H 13.382 7.189 -9.882 1.00 . A A . 2 GLY HA2 1 1 1 17 1 1 2 GLY HA3 H 13.835 8.003 -8.388 1.00 . A A . 2 GLY HA3 1 1 1 18 1 1 2 GLY N N 11.791 7.944 -8.775 1.00 . A A . 2 GLY N 1 1 1 19 1 1 2 GLY O O 13.808 5.059 -8.552 1.00 . A A . 2 GLY O 1 1 1 20 1 1 3 GLY C C 13.477 4.654 -5.188 1.00 . A A . 3 GLY C 1 1 1 21 1 1 3 GLY CA C 12.358 4.694 -6.224 1.00 . A A . 3 GLY CA 1 1 1 22 1 1 3 GLY H H 11.905 6.706 -6.713 1.00 . A A . 3 GLY H 1 1 1 23 1 1 3 GLY HA2 H 11.403 4.636 -5.722 1.00 . A A . 3 GLY HA2 1 1 1 24 1 1 3 GLY HA3 H 12.463 3.846 -6.885 1.00 . A A . 3 GLY HA3 1 1 1 25 1 1 3 GLY N N 12.414 5.922 -7.008 1.00 . A A . 3 GLY N 1 1 1 26 1 1 3 GLY O O 13.619 3.677 -4.454 1.00 . A A . 3 GLY O 1 1 1 27 1 1 4 . C C 14.937 6.601 -3.002 1.00 . A A . 4 DBU C 1 1 1 28 1 1 4 . CA C 15.336 5.818 -4.222 1.00 . A A . 4 DBU CA 1 1 1 29 1 1 4 . CB C 16.639 5.317 -4.293 1.00 . A A . 4 DBU CB 1 1 1 30 1 1 4 . CG C 17.156 4.518 -5.462 1.00 . A A . 4 DBU CG 1 1 1 31 1 1 4 . H H 14.109 6.477 -5.739 1.00 . A A . 4 DBU H 1 1 1 32 1 1 4 . HB H 17.316 5.509 -3.472 1.00 . A A . 4 DBU HB 1 1 1 33 1 1 4 . HG1 H 17.977 3.892 -5.144 1.00 . A A . 4 DBU HG1 1 1 1 34 1 1 4 . HG2 H 17.492 5.187 -6.240 1.00 . A A . 4 DBU HG2 1 1 1 35 1 1 4 . HG3 H 16.357 3.899 -5.840 1.00 . A A . 4 DBU HG3 1 1 1 36 1 1 4 . N N 14.265 5.722 -5.134 1.00 . A A . 4 DBU N 1 1 1 37 1 1 4 . O O 14.986 7.828 -3.021 1.00 . A A . 4 DBU O 1 1 1 38 1 1 5 ILE C C 13.068 5.708 0.016 1.00 . A A . 5 ILE C 1 1 1 39 1 1 5 ILE CA C 14.143 6.531 -0.692 1.00 . A A . 5 ILE CA 1 1 1 40 1 1 5 ILE CB C 13.606 7.935 -0.968 1.00 . A A . 5 ILE CB 1 1 1 41 1 1 5 ILE CD1 C 14.926 9.398 0.614 1.00 . A A . 5 ILE CD1 1 1 1 42 1 1 5 ILE CG1 C 14.748 8.956 -0.846 1.00 . A A . 5 ILE CG1 1 1 1 43 1 1 5 ILE CG2 C 12.496 8.278 0.036 1.00 . A A . 5 ILE CG2 1 1 1 44 1 1 5 ILE H H 14.541 4.913 -1.999 1.00 . A A . 5 ILE H 1 1 1 45 1 1 5 ILE HA H 14.999 6.610 -0.048 1.00 . A A . 5 ILE HA 1 1 1 46 1 1 5 ILE HB H 13.206 7.960 -1.971 1.00 . A A . 5 ILE HB 1 1 1 47 1 1 5 ILE HD11 H 14.736 8.564 1.271 1.00 . A A . 5 ILE HD11 1 1 1 48 1 1 5 ILE HD12 H 14.232 10.195 0.834 1.00 . A A . 5 ILE HD12 1 1 1 49 1 1 5 ILE HD13 H 15.937 9.751 0.763 1.00 . A A . 5 ILE HD13 1 1 1 50 1 1 5 ILE HG12 H 15.666 8.508 -1.197 1.00 . A A . 5 ILE HG12 1 1 1 51 1 1 5 ILE HG13 H 14.516 9.814 -1.454 1.00 . A A . 5 ILE HG13 1 1 1 52 1 1 5 ILE HG21 H 12.251 9.326 -0.039 1.00 . A A . 5 ILE HG21 1 1 1 53 1 1 5 ILE HG22 H 12.841 8.057 1.037 1.00 . A A . 5 ILE HG22 1 1 1 54 1 1 5 ILE HG23 H 11.621 7.686 -0.182 1.00 . A A . 5 ILE HG23 1 1 1 55 1 1 5 ILE N N 14.550 5.890 -1.941 1.00 . A A . 5 ILE N 1 1 1 56 1 1 5 ILE O O 13.100 5.543 1.235 1.00 . A A . 5 ILE O 1 1 1 57 1 1 6 PRO C C 11.495 3.138 0.493 1.00 . A A . 6 PRO C 1 1 1 58 1 1 6 PRO CA C 10.994 4.409 -0.162 1.00 . A A . 6 PRO CA 1 1 1 59 1 1 6 PRO CB C 10.115 4.088 -1.377 1.00 . A A . 6 PRO CB 1 1 1 60 1 1 6 PRO CD C 12.000 5.353 -2.178 1.00 . A A . 6 PRO CD 1 1 1 61 1 1 6 PRO CG C 10.529 5.055 -2.433 1.00 . A A . 6 PRO CG 1 1 1 62 1 1 6 PRO HA H 10.429 4.997 0.545 1.00 . A A . 6 PRO HA 1 1 1 63 1 1 6 PRO HB2 H 10.290 3.073 -1.705 1.00 . A A . 6 PRO HB2 1 1 1 64 1 1 6 PRO HB3 H 9.073 4.230 -1.133 1.00 . A A . 6 PRO HB3 1 1 1 65 1 1 6 PRO HD2 H 12.629 4.638 -2.685 1.00 . A A . 6 PRO HD2 1 1 1 66 1 1 6 PRO HD3 H 12.244 6.351 -2.478 1.00 . A A . 6 PRO HD3 1 1 1 67 1 1 6 PRO HG2 H 10.397 4.614 -3.411 1.00 . A A . 6 PRO HG2 1 1 1 68 1 1 6 PRO HG3 H 9.956 5.965 -2.350 1.00 . A A . 6 PRO HG3 1 1 1 69 1 1 6 PRO N N 12.115 5.213 -0.724 1.00 . A A . 6 PRO N 1 1 1 70 1 1 6 PRO O O 10.709 2.335 0.982 1.00 . A A . 6 PRO O 1 1 1 71 1 1 7 DAL C C 14.832 1.581 0.498 1.00 . A A . 7 DAL C 1 1 1 72 1 1 7 DAL CA C 13.438 1.798 1.084 1.00 . A A . 7 DAL CA 1 1 1 73 1 1 7 DAL CB C 13.563 1.980 2.596 1.00 . A A . 7 DAL CB 1 1 1 74 1 1 7 DAL H H 13.375 3.657 0.084 1.00 . A A . 7 DAL H 1 1 1 75 1 1 7 DAL HA H 12.825 0.935 0.887 1.00 . A A . 7 DAL HA 1 1 1 76 1 1 7 DAL HB1 H 14.603 2.066 2.854 1.00 . A A . 7 DAL HB1 1 1 1 77 1 1 7 DAL HB2 H 13.136 1.124 3.095 1.00 . A A . 7 DAL HB2 1 1 1 78 1 1 7 DAL N N 12.812 2.972 0.492 1.00 . A A . 7 DAL N 1 1 1 79 1 1 7 DAL O O 15.587 0.727 0.951 1.00 . A A . 7 DAL O 1 1 1 80 1 1 8 LEU C C 17.545 2.645 -0.068 1.00 . A A . 8 LEU C 1 1 1 81 1 1 8 LEU CA C 16.490 2.259 -1.101 1.00 . A A . 8 LEU CA 1 1 1 82 1 1 8 LEU CB C 16.562 3.178 -2.322 1.00 . A A . 8 LEU CB 1 1 1 83 1 1 8 LEU CD1 C 16.818 1.482 -4.128 1.00 . A A . 8 LEU CD1 1 1 1 84 1 1 8 LEU CD2 C 14.595 1.789 -3.044 1.00 . A A . 8 LEU CD2 1 1 1 85 1 1 8 LEU CG C 15.871 2.501 -3.510 1.00 . A A . 8 LEU CG 1 1 1 86 1 1 8 LEU H H 14.553 3.044 -0.826 1.00 . A A . 8 LEU H 1 1 1 87 1 1 8 LEU HA H 16.655 1.236 -1.412 1.00 . A A . 8 LEU HA 1 1 1 88 1 1 8 LEU HB2 H 16.067 4.112 -2.099 1.00 . A A . 8 LEU HB2 1 1 1 89 1 1 8 LEU HB3 H 17.594 3.364 -2.568 1.00 . A A . 8 LEU HB3 1 1 1 90 1 1 8 LEU HD11 H 16.825 1.603 -5.200 1.00 . A A . 8 LEU HD11 1 1 1 91 1 1 8 LEU HD12 H 16.485 0.486 -3.877 1.00 . A A . 8 LEU HD12 1 1 1 92 1 1 8 LEU HD13 H 17.812 1.640 -3.740 1.00 . A A . 8 LEU HD13 1 1 1 93 1 1 8 LEU HD21 H 14.128 1.299 -3.887 1.00 . A A . 8 LEU HD21 1 1 1 94 1 1 8 LEU HD22 H 13.912 2.511 -2.623 1.00 . A A . 8 LEU HD22 1 1 1 95 1 1 8 LEU HD23 H 14.847 1.053 -2.296 1.00 . A A . 8 LEU HD23 1 1 1 96 1 1 8 LEU HG H 15.615 3.245 -4.247 1.00 . A A . 8 LEU HG 1 1 1 97 1 1 8 LEU N N 15.178 2.368 -0.499 1.00 . A A . 8 LEU N 1 1 1 98 1 1 8 LEU O O 18.615 2.042 0.007 1.00 . A A . 8 LEU O 1 1 1 99 1 1 9 MET C C 18.364 3.077 2.828 1.00 . A A . 9 MET C 1 1 1 100 1 1 9 MET CA C 18.117 4.152 1.767 1.00 . A A . 9 MET CA 1 1 1 101 1 1 9 MET CB C 17.477 5.369 2.437 1.00 . A A . 9 MET CB 1 1 1 102 1 1 9 MET CE C 17.215 8.300 3.242 1.00 . A A . 9 MET CE 1 1 1 103 1 1 9 MET CG C 16.993 6.342 1.367 1.00 . A A . 9 MET CG 1 1 1 104 1 1 9 MET H H 16.346 4.094 0.610 1.00 . A A . 9 MET H 1 1 1 105 1 1 9 MET HA H 19.055 4.443 1.324 1.00 . A A . 9 MET HA 1 1 1 106 1 1 9 MET HB2 H 16.638 5.049 3.034 1.00 . A A . 9 MET HB2 1 1 1 107 1 1 9 MET HB3 H 18.199 5.863 3.065 1.00 . A A . 9 MET HB3 1 1 1 108 1 1 9 MET HE1 H 16.566 7.500 3.569 1.00 . A A . 9 MET HE1 1 1 1 109 1 1 9 MET HE2 H 16.663 9.226 3.236 1.00 . A A . 9 MET HE2 1 1 1 110 1 1 9 MET HE3 H 18.057 8.388 3.914 1.00 . A A . 9 MET HE3 1 1 1 111 1 1 9 MET HG2 H 17.213 5.943 0.386 1.00 . A A . 9 MET HG2 1 1 1 112 1 1 9 MET HG3 H 15.927 6.469 1.473 1.00 . A A . 9 MET HG3 1 1 1 113 1 1 9 MET N N 17.218 3.661 0.728 1.00 . A A . 9 MET N 1 1 1 114 1 1 9 MET O O 19.494 2.884 3.276 1.00 . A A . 9 MET O 1 1 1 115 1 1 9 MET SD S 17.816 7.942 1.573 1.00 . A A . 9 MET SD 1 1 1 116 1 1 10 . C C 16.567 1.615 5.446 1.00 . A A . 10 DBB C 1 1 1 117 1 1 10 . CA C 17.422 1.319 4.226 1.00 . A A . 10 DBB CA 1 1 1 118 1 1 10 . CB C 16.996 -0.021 3.625 1.00 . A A . 10 DBB CB 1 1 1 119 1 1 10 . CG C 15.464 -0.119 3.605 1.00 . A A . 10 DBB CG 1 1 1 120 1 1 10 . H H 16.424 2.566 2.828 1.00 . A A . 10 DBB H 1 1 1 121 1 1 10 . HA H 18.454 1.245 4.533 1.00 . A A . 10 DBB HA 1 1 1 122 1 1 10 . HB2 H 17.339 -0.062 2.612 1.00 . A A . 10 DBB HB2 1 1 1 123 1 1 10 . HG1 H 15.171 -1.151 3.665 1.00 . A A . 10 DBB HG1 1 1 1 124 1 1 10 . HG2 H 15.088 0.297 2.692 1.00 . A A . 10 DBB HG2 1 1 1 125 1 1 10 . HG3 H 15.047 0.415 4.439 1.00 . A A . 10 DBB HG3 1 1 1 126 1 1 10 . N N 17.301 2.373 3.222 1.00 . A A . 10 DBB N 1 1 1 127 1 1 10 . O O 16.897 1.208 6.559 1.00 . A A . 10 DBB O 1 1 1 128 1 1 11 GLY C C 13.172 2.986 5.788 1.00 . A A . 11 GLY C 1 1 1 129 1 1 11 GLY CA C 14.565 2.636 6.310 1.00 . A A . 11 GLY CA 1 1 1 130 1 1 11 GLY H H 15.251 2.600 4.320 1.00 . A A . 11 GLY H 1 1 1 131 1 1 11 GLY HA2 H 14.493 1.789 6.980 1.00 . A A . 11 GLY HA2 1 1 1 132 1 1 11 GLY HA3 H 14.970 3.472 6.838 1.00 . A A . 11 GLY HA3 1 1 1 133 1 1 11 GLY N N 15.464 2.310 5.226 1.00 . A A . 11 GLY N 1 1 1 134 1 1 11 GLY O O 12.795 4.157 5.733 1.00 . A A . 11 GLY O 1 1 1 135 1 1 12 CYS C C 10.241 0.893 4.903 1.00 . A A . 12 CYS C 1 1 1 136 1 1 12 CYS CA C 11.058 2.179 4.885 1.00 . A A . 12 CYS CA 1 1 1 137 1 1 12 CYS CB C 11.113 2.656 3.441 1.00 . A A . 12 CYS CB 1 1 1 138 1 1 12 CYS H H 12.759 1.048 5.466 1.00 . A A . 12 CYS H 1 1 1 139 1 1 12 CYS HA H 10.560 2.925 5.481 1.00 . A A . 12 CYS HA 1 1 1 140 1 1 12 CYS HB2 H 11.023 1.796 2.797 1.00 . A A . 12 CYS HB2 1 1 1 141 1 1 12 CYS HB3 H 10.300 3.334 3.246 1.00 . A A . 12 CYS HB3 1 1 1 142 1 1 12 CYS N N 12.409 1.962 5.404 1.00 . A A . 12 CYS N 1 1 1 143 1 1 12 CYS O O 10.511 -0.033 5.670 1.00 . A A . 12 CYS O 1 1 1 144 1 1 12 CYS SG S 12.688 3.473 3.117 1.00 . A A . 12 CYS SG 1 1 1 145 1 1 13 GLY C C 8.211 -0.677 2.420 1.00 . A A . 13 GLY C 1 1 1 146 1 1 13 GLY CA C 8.373 -0.301 3.887 1.00 . A A . 13 GLY CA 1 1 1 147 1 1 13 GLY H H 9.105 1.629 3.438 1.00 . A A . 13 GLY H 1 1 1 148 1 1 13 GLY HA2 H 8.796 -1.133 4.426 1.00 . A A . 13 GLY HA2 1 1 1 149 1 1 13 GLY HA3 H 7.405 -0.067 4.292 1.00 . A A . 13 GLY HA3 1 1 1 150 1 1 13 GLY N N 9.246 0.857 4.021 1.00 . A A . 13 GLY N 1 1 1 151 1 1 13 GLY O O 7.280 -1.392 2.049 1.00 . A A . 13 GLY O 1 1 1 152 1 1 14 TRP C C 8.695 -1.893 -0.123 1.00 . A A . 14 TRP C 1 1 1 153 1 1 14 TRP CA C 9.090 -0.441 0.163 1.00 . A A . 14 TRP CA 1 1 1 154 1 1 14 TRP CB C 10.464 -0.130 -0.446 1.00 . A A . 14 TRP CB 1 1 1 155 1 1 14 TRP CD1 C 11.375 -1.558 1.438 1.00 . A A . 14 TRP CD1 1 1 1 156 1 1 14 TRP CD2 C 12.920 -1.123 -0.141 1.00 . A A . 14 TRP CD2 1 1 1 157 1 1 14 TRP CE2 C 13.556 -1.919 0.840 1.00 . A A . 14 TRP CE2 1 1 1 158 1 1 14 TRP CE3 C 13.678 -0.709 -1.251 1.00 . A A . 14 TRP CE3 1 1 1 159 1 1 14 TRP CG C 11.535 -0.901 0.265 1.00 . A A . 14 TRP CG 1 1 1 160 1 1 14 TRP CH2 C 15.633 -1.876 -0.386 1.00 . A A . 14 TRP CH2 1 1 1 161 1 1 14 TRP CZ2 C 14.894 -2.294 0.724 1.00 . A A . 14 TRP CZ2 1 1 1 162 1 1 14 TRP CZ3 C 15.026 -1.085 -1.371 1.00 . A A . 14 TRP CZ3 1 1 1 163 1 1 14 TRP H H 9.833 0.392 1.958 1.00 . A A . 14 TRP H 1 1 1 164 1 1 14 TRP HA H 8.360 0.211 -0.289 1.00 . A A . 14 TRP HA 1 1 1 165 1 1 14 TRP HB2 H 10.459 -0.396 -1.482 1.00 . A A . 14 TRP HB2 1 1 1 166 1 1 14 TRP HB3 H 10.665 0.924 -0.359 1.00 . A A . 14 TRP HB3 1 1 1 167 1 1 14 TRP HD1 H 10.465 -1.607 2.011 1.00 . A A . 14 TRP HD1 1 1 1 168 1 1 14 TRP HE1 H 12.728 -2.693 2.587 1.00 . A A . 14 TRP HE1 1 1 1 169 1 1 14 TRP HE3 H 13.220 -0.099 -2.016 1.00 . A A . 14 TRP HE3 1 1 1 170 1 1 14 TRP HH2 H 16.670 -2.161 -0.485 1.00 . A A . 14 TRP HH2 1 1 1 171 1 1 14 TRP HZ2 H 15.357 -2.903 1.486 1.00 . A A . 14 TRP HZ2 1 1 1 172 1 1 14 TRP HZ3 H 15.599 -0.764 -2.229 1.00 . A A . 14 TRP HZ3 1 1 1 173 1 1 14 TRP N N 9.123 -0.176 1.595 1.00 . A A . 14 TRP N 1 1 1 174 1 1 14 TRP NE1 N 12.573 -2.160 1.780 1.00 . A A . 14 TRP NE1 1 1 1 175 1 1 14 TRP O O 7.539 -2.275 0.057 1.00 . A A . 14 TRP O 1 1 1 176 1 1 15 LEU C C 9.930 -4.988 0.197 1.00 . A A . 15 LEU C 1 1 1 177 1 1 15 LEU CA C 9.386 -4.080 -0.903 1.00 . A A . 15 LEU CA 1 1 1 178 1 1 15 LEU CB C 10.049 -4.427 -2.235 1.00 . A A . 15 LEU CB 1 1 1 179 1 1 15 LEU CD1 C 12.209 -4.229 -3.468 1.00 . A A . 15 LEU CD1 1 1 1 180 1 1 15 LEU CD2 C 10.950 -2.156 -2.860 1.00 . A A . 15 LEU CD2 1 1 1 181 1 1 15 LEU CG C 11.317 -3.579 -2.412 1.00 . A A . 15 LEU CG 1 1 1 182 1 1 15 LEU H H 10.541 -2.338 -0.727 1.00 . A A . 15 LEU H 1 1 1 183 1 1 15 LEU HA H 8.321 -4.230 -0.991 1.00 . A A . 15 LEU HA 1 1 1 184 1 1 15 LEU HB2 H 10.311 -5.476 -2.246 1.00 . A A . 15 LEU HB2 1 1 1 185 1 1 15 LEU HB3 H 9.365 -4.218 -3.043 1.00 . A A . 15 LEU HB3 1 1 1 186 1 1 15 LEU HD11 H 13.096 -4.625 -2.995 1.00 . A A . 15 LEU HD11 1 1 1 187 1 1 15 LEU HD12 H 12.493 -3.490 -4.203 1.00 . A A . 15 LEU HD12 1 1 1 188 1 1 15 LEU HD13 H 11.669 -5.030 -3.951 1.00 . A A . 15 LEU HD13 1 1 1 189 1 1 15 LEU HD21 H 9.942 -1.921 -2.543 1.00 . A A . 15 LEU HD21 1 1 1 190 1 1 15 LEU HD22 H 11.010 -2.088 -3.935 1.00 . A A . 15 LEU HD22 1 1 1 191 1 1 15 LEU HD23 H 11.639 -1.447 -2.417 1.00 . A A . 15 LEU HD23 1 1 1 192 1 1 15 LEU HG H 11.851 -3.537 -1.472 1.00 . A A . 15 LEU HG 1 1 1 193 1 1 15 LEU N N 9.649 -2.690 -0.585 1.00 . A A . 15 LEU N 1 1 1 194 1 1 15 LEU O O 9.415 -6.083 0.425 1.00 . A A . 15 LEU O 1 1 1 195 1 1 16 . C C 10.791 -5.096 3.197 1.00 . A A . 16 DBU C 1 1 1 196 1 1 16 . CA C 11.582 -5.251 1.920 1.00 . A A . 16 DBU CA 1 1 1 197 1 1 16 . CB C 12.740 -6.034 1.893 1.00 . A A . 16 DBU CB 1 1 1 198 1 1 16 . CG C 13.599 -6.252 0.671 1.00 . A A . 16 DBU CG 1 1 1 199 1 1 16 . H H 11.351 -3.643 0.661 1.00 . A A . 16 DBU H 1 1 1 200 1 1 16 . HB H 13.062 -6.526 2.799 1.00 . A A . 16 DBU HB 1 1 1 201 1 1 16 . HG1 H 13.652 -5.335 0.102 1.00 . A A . 16 DBU HG1 1 1 1 202 1 1 16 . HG2 H 13.166 -7.030 0.062 1.00 . A A . 16 DBU HG2 1 1 1 203 1 1 16 . HG3 H 14.593 -6.545 0.976 1.00 . A A . 16 DBU HG3 1 1 1 204 1 1 16 . N N 10.975 -4.522 0.877 1.00 . A A . 16 DBU N 1 1 1 205 1 1 16 . O O 10.177 -6.043 3.687 1.00 . A A . 16 DBU O 1 1 1 206 1 1 17 GLY C C 11.021 -3.190 6.092 1.00 . A A . 17 GLY C 1 1 1 207 1 1 17 GLY CA C 10.074 -3.609 4.974 1.00 . A A . 17 GLY CA 1 1 1 208 1 1 17 GLY H H 11.306 -3.162 3.308 1.00 . A A . 17 GLY H 1 1 1 209 1 1 17 GLY HA2 H 9.362 -2.820 4.794 1.00 . A A . 17 GLY HA2 1 1 1 210 1 1 17 GLY HA3 H 9.544 -4.500 5.277 1.00 . A A . 17 GLY HA3 1 1 1 211 1 1 17 GLY N N 10.802 -3.884 3.741 1.00 . A A . 17 GLY N 1 1 1 212 1 1 17 GLY O O 10.933 -2.076 6.608 1.00 . A A . 17 GLY O 1 1 1 213 1 1 18 LEU C C 14.298 -3.688 6.955 1.00 . A A . 18 LEU C 1 1 1 214 1 1 18 LEU CA C 12.888 -3.808 7.521 1.00 . A A . 18 LEU CA 1 1 1 215 1 1 18 LEU CB C 12.851 -4.921 8.570 1.00 . A A . 18 LEU CB 1 1 1 216 1 1 18 LEU CD1 C 11.384 -6.130 10.188 1.00 . A A . 18 LEU CD1 1 1 1 217 1 1 18 LEU CD2 C 11.462 -3.633 10.199 1.00 . A A . 18 LEU CD2 1 1 1 218 1 1 18 LEU CG C 11.516 -4.881 9.314 1.00 . A A . 18 LEU CG 1 1 1 219 1 1 18 LEU H H 11.946 -4.961 6.011 1.00 . A A . 18 LEU H 1 1 1 220 1 1 18 LEU HA H 12.622 -2.875 7.996 1.00 . A A . 18 LEU HA 1 1 1 221 1 1 18 LEU HB2 H 12.962 -5.878 8.080 1.00 . A A . 18 LEU HB2 1 1 1 222 1 1 18 LEU HB3 H 13.657 -4.779 9.272 1.00 . A A . 18 LEU HB3 1 1 1 223 1 1 18 LEU HD11 H 11.978 -6.928 9.766 1.00 . A A . 18 LEU HD11 1 1 1 224 1 1 18 LEU HD12 H 10.349 -6.434 10.227 1.00 . A A . 18 LEU HD12 1 1 1 225 1 1 18 LEU HD13 H 11.732 -5.909 11.186 1.00 . A A . 18 LEU HD13 1 1 1 226 1 1 18 LEU HD21 H 10.616 -3.701 10.866 1.00 . A A . 18 LEU HD21 1 1 1 227 1 1 18 LEU HD22 H 11.361 -2.755 9.578 1.00 . A A . 18 LEU HD22 1 1 1 228 1 1 18 LEU HD23 H 12.373 -3.563 10.776 1.00 . A A . 18 LEU HD23 1 1 1 229 1 1 18 LEU HG H 10.706 -4.854 8.600 1.00 . A A . 18 LEU HG 1 1 1 230 1 1 18 LEU N N 11.926 -4.090 6.460 1.00 . A A . 18 LEU N 1 1 1 231 1 1 18 LEU O O 15.272 -4.077 7.601 1.00 . A A . 18 LEU O 1 1 1 232 1 1 19 CYS C C 16.556 -4.235 5.309 1.00 . A A . 19 CYS C 1 1 1 233 1 1 19 CYS CA C 15.695 -2.996 5.095 1.00 . A A . 19 CYS CA 1 1 1 234 1 1 19 CYS CB C 16.416 -1.764 5.650 1.00 . A A . 19 CYS CB 1 1 1 235 1 1 19 CYS H H 13.588 -2.866 5.275 1.00 . A A . 19 CYS H 1 1 1 236 1 1 19 CYS HA H 15.542 -2.864 4.036 1.00 . A A . 19 CYS HA 1 1 1 237 1 1 19 CYS HB2 H 15.730 -0.934 5.704 1.00 . A A . 19 CYS HB2 1 1 1 238 1 1 19 CYS HB3 H 16.789 -1.980 6.641 1.00 . A A . 19 CYS HB3 1 1 1 239 1 1 19 CYS N N 14.399 -3.154 5.744 1.00 . A A . 19 CYS N 1 1 1 240 1 1 19 CYS O O 17.359 -4.298 6.240 1.00 . A A . 19 CYS O 1 1 1 241 1 1 19 CYS SG S 17.804 -1.342 4.564 1.00 . A A . 19 CYS SG 1 1 1 242 1 1 20 VAL C C 18.146 -6.537 3.367 1.00 . A A . 20 VAL C 1 1 1 243 1 1 20 VAL CA C 17.144 -6.454 4.515 1.00 . A A . 20 VAL CA 1 1 1 244 1 1 20 VAL CB C 16.195 -7.654 4.467 1.00 . A A . 20 VAL CB 1 1 1 245 1 1 20 VAL CG1 C 15.373 -7.706 5.756 1.00 . A A . 20 VAL CG1 1 1 1 246 1 1 20 VAL CG2 C 15.252 -7.513 3.270 1.00 . A A . 20 VAL CG2 1 1 1 247 1 1 20 VAL H H 15.729 -5.102 3.709 1.00 . A A . 20 VAL H 1 1 1 248 1 1 20 VAL HA H 17.681 -6.472 5.452 1.00 . A A . 20 VAL HA 1 1 1 249 1 1 20 VAL HB H 16.772 -8.563 4.371 1.00 . A A . 20 VAL HB 1 1 1 250 1 1 20 VAL HG11 H 14.631 -6.920 5.740 1.00 . A A . 20 VAL HG11 1 1 1 251 1 1 20 VAL HG12 H 16.025 -7.567 6.605 1.00 . A A . 20 VAL HG12 1 1 1 252 1 1 20 VAL HG13 H 14.881 -8.664 5.831 1.00 . A A . 20 VAL HG13 1 1 1 253 1 1 20 VAL HG21 H 15.818 -7.587 2.354 1.00 . A A . 20 VAL HG21 1 1 1 254 1 1 20 VAL HG22 H 14.757 -6.553 3.311 1.00 . A A . 20 VAL HG22 1 1 1 255 1 1 20 VAL HG23 H 14.513 -8.301 3.300 1.00 . A A . 20 VAL HG23 1 1 1 256 1 1 20 VAL N N 16.382 -5.216 4.431 1.00 . A A . 20 VAL N 1 1 1 257 1 1 20 VAL O O 18.927 -7.485 3.279 1.00 . A A . 20 VAL O 1 1 1 258 1 1 21 ARG C C 20.462 -5.272 1.825 1.00 . A A . 21 ARG C 1 1 1 259 1 1 21 ARG CA C 19.030 -5.504 1.353 1.00 . A A . 21 ARG CA 1 1 1 260 1 1 21 ARG CB C 18.627 -4.394 0.380 1.00 . A A . 21 ARG CB 1 1 1 261 1 1 21 ARG CD C 19.159 -3.320 -1.811 1.00 . A A . 21 ARG CD 1 1 1 262 1 1 21 ARG CG C 19.530 -4.451 -0.853 1.00 . A A . 21 ARG CG 1 1 1 263 1 1 21 ARG CZ C 19.171 -0.893 -1.827 1.00 . A A . 21 ARG CZ 1 1 1 264 1 1 21 ARG H H 17.475 -4.808 2.613 1.00 . A A . 21 ARG H 1 1 1 265 1 1 21 ARG HA H 18.982 -6.453 0.839 1.00 . A A . 21 ARG HA 1 1 1 266 1 1 21 ARG HB2 H 17.597 -4.534 0.080 1.00 . A A . 21 ARG HB2 1 1 1 267 1 1 21 ARG HB3 H 18.734 -3.430 0.858 1.00 . A A . 21 ARG HB3 1 1 1 268 1 1 21 ARG HD2 H 19.709 -3.436 -2.734 1.00 . A A . 21 ARG HD2 1 1 1 269 1 1 21 ARG HD3 H 18.099 -3.362 -2.021 1.00 . A A . 21 ARG HD3 1 1 1 270 1 1 21 ARG HE H 19.944 -2.001 -0.351 1.00 . A A . 21 ARG HE 1 1 1 271 1 1 21 ARG HG2 H 20.560 -4.342 -0.549 1.00 . A A . 21 ARG HG2 1 1 1 272 1 1 21 ARG HG3 H 19.399 -5.400 -1.351 1.00 . A A . 21 ARG HG3 1 1 1 273 1 1 21 ARG HH11 H 18.331 -1.793 -3.405 1.00 . A A . 21 ARG HH11 1 1 1 274 1 1 21 ARG HH12 H 18.326 -0.062 -3.441 1.00 . A A . 21 ARG HH12 1 1 1 275 1 1 21 ARG HH21 H 19.942 0.267 -0.390 1.00 . A A . 21 ARG HH21 1 1 1 276 1 1 21 ARG HH22 H 19.237 1.106 -1.731 1.00 . A A . 21 ARG HH22 1 1 1 277 1 1 21 ARG N N 18.118 -5.536 2.490 1.00 . A A . 21 ARG N 1 1 1 278 1 1 21 ARG NE N 19.485 -2.030 -1.216 1.00 . A A . 21 ARG NE 1 1 1 279 1 1 21 ARG NH1 N 18.561 -0.918 -2.981 1.00 . A A . 21 ARG NH1 1 1 1 280 1 1 21 ARG NH2 N 19.473 0.249 -1.272 1.00 . A A . 21 ARG NH2 1 1 1 281 1 1 21 ARG O O 21.138 -6.247 2.108 1.00 . A A . 21 ARG O 1 1 1 282 1 1 21 ARG OXT O 20.860 -4.121 1.899 1.00 . A A . 21 ARG OXT 1 1 2 283 1 1 1 ALA C C 9.377 7.861 -8.046 1.00 . A A . 1 ALA C 1 1 2 284 1 1 1 ALA CA C 7.923 7.835 -7.587 1.00 . A A . 1 ALA CA 1 1 2 285 1 1 1 ALA CB C 7.067 7.083 -8.607 1.00 . A A . 1 ALA CB 1 1 2 286 1 1 1 ALA H1 H 7.137 9.587 -8.391 1.00 . A A . 1 ALA H1 1 1 2 287 1 1 1 ALA H2 H 8.176 9.836 -7.070 1.00 . A A . 1 ALA H2 1 1 2 288 1 1 1 ALA H3 H 6.602 9.249 -6.817 1.00 . A A . 1 ALA H3 1 1 2 289 1 1 1 ALA HA H 7.857 7.340 -6.629 1.00 . A A . 1 ALA HA 1 1 2 290 1 1 1 ALA HB1 H 7.320 6.032 -8.585 1.00 . A A . 1 ALA HB1 1 1 2 291 1 1 1 ALA HB2 H 7.255 7.477 -9.595 1.00 . A A . 1 ALA HB2 1 1 2 292 1 1 1 ALA HB3 H 6.023 7.207 -8.363 1.00 . A A . 1 ALA HB3 1 1 2 293 1 1 1 ALA N N 7.422 9.232 -7.457 1.00 . A A . 1 ALA N 1 1 2 294 1 1 1 ALA O O 9.693 7.445 -9.160 1.00 . A A . 1 ALA O 1 1 2 295 1 1 2 GLY C C 12.264 7.034 -7.711 1.00 . A A . 2 GLY C 1 1 2 296 1 1 2 GLY CA C 11.677 8.426 -7.507 1.00 . A A . 2 GLY CA 1 1 2 297 1 1 2 GLY H H 9.947 8.668 -6.305 1.00 . A A . 2 GLY H 1 1 2 298 1 1 2 GLY HA2 H 11.802 9.003 -8.411 1.00 . A A . 2 GLY HA2 1 1 2 299 1 1 2 GLY HA3 H 12.202 8.915 -6.699 1.00 . A A . 2 GLY HA3 1 1 2 300 1 1 2 GLY N N 10.258 8.351 -7.179 1.00 . A A . 2 GLY N 1 1 2 301 1 1 2 GLY O O 13.106 6.828 -8.585 1.00 . A A . 2 GLY O 1 1 2 302 1 1 3 GLY C C 13.478 4.480 -6.059 1.00 . A A . 3 GLY C 1 1 2 303 1 1 3 GLY CA C 12.302 4.711 -7.002 1.00 . A A . 3 GLY CA 1 1 2 304 1 1 3 GLY H H 11.142 6.304 -6.223 1.00 . A A . 3 GLY H 1 1 2 305 1 1 3 GLY HA2 H 11.502 4.029 -6.746 1.00 . A A . 3 GLY HA2 1 1 2 306 1 1 3 GLY HA3 H 12.621 4.520 -8.015 1.00 . A A . 3 GLY HA3 1 1 2 307 1 1 3 GLY N N 11.814 6.082 -6.901 1.00 . A A . 3 GLY N 1 1 2 308 1 1 3 GLY O O 14.015 3.376 -5.978 1.00 . A A . 3 GLY O 1 1 2 309 1 1 4 . C C 14.678 6.350 -3.244 1.00 . A A . 4 DBU C 1 1 2 310 1 1 4 . CA C 14.945 5.461 -4.434 1.00 . A A . 4 DBU CA 1 1 2 311 1 1 4 . CB C 16.137 4.726 -4.498 1.00 . A A . 4 DBU CB 1 1 2 312 1 1 4 . CG C 16.527 3.804 -5.628 1.00 . A A . 4 DBU CG 1 1 2 313 1 1 4 . H H 13.411 6.390 -5.444 1.00 . A A . 4 DBU H 1 1 2 314 1 1 4 . HB H 16.840 4.814 -3.683 1.00 . A A . 4 DBU HB 1 1 2 315 1 1 4 . HG1 H 15.940 4.042 -6.502 1.00 . A A . 4 DBU HG1 1 1 2 316 1 1 4 . HG2 H 16.345 2.780 -5.340 1.00 . A A . 4 DBU HG2 1 1 2 317 1 1 4 . HG3 H 17.575 3.933 -5.853 1.00 . A A . 4 DBU HG3 1 1 2 318 1 1 4 . N N 13.871 5.531 -5.347 1.00 . A A . 4 DBU N 1 1 2 319 1 1 4 . O O 14.765 7.569 -3.368 1.00 . A A . 4 DBU O 1 1 2 320 1 1 5 ILE C C 13.001 5.785 -0.043 1.00 . A A . 5 ILE C 1 1 2 321 1 1 5 ILE CA C 14.077 6.488 -0.870 1.00 . A A . 5 ILE CA 1 1 2 322 1 1 5 ILE CB C 13.624 7.913 -1.191 1.00 . A A . 5 ILE CB 1 1 2 323 1 1 5 ILE CD1 C 15.112 9.524 0.078 1.00 . A A . 5 ILE CD1 1 1 2 324 1 1 5 ILE CG1 C 14.855 8.837 -1.269 1.00 . A A . 5 ILE CG1 1 1 2 325 1 1 5 ILE CG2 C 12.665 8.408 -0.101 1.00 . A A . 5 ILE CG2 1 1 2 326 1 1 5 ILE H H 14.310 4.761 -2.082 1.00 . A A . 5 ILE H 1 1 2 327 1 1 5 ILE HA H 14.980 6.536 -0.287 1.00 . A A . 5 ILE HA 1 1 2 328 1 1 5 ILE HB H 13.115 7.911 -2.144 1.00 . A A . 5 ILE HB 1 1 2 329 1 1 5 ILE HD11 H 14.463 10.382 0.174 1.00 . A A . 5 ILE HD11 1 1 2 330 1 1 5 ILE HD12 H 16.143 9.845 0.127 1.00 . A A . 5 ILE HD12 1 1 2 331 1 1 5 ILE HD13 H 14.913 8.830 0.880 1.00 . A A . 5 ILE HD13 1 1 2 332 1 1 5 ILE HG12 H 15.722 8.252 -1.540 1.00 . A A . 5 ILE HG12 1 1 2 333 1 1 5 ILE HG13 H 14.685 9.588 -2.025 1.00 . A A . 5 ILE HG13 1 1 2 334 1 1 5 ILE HG21 H 11.748 7.841 -0.143 1.00 . A A . 5 ILE HG21 1 1 2 335 1 1 5 ILE HG22 H 12.452 9.454 -0.256 1.00 . A A . 5 ILE HG22 1 1 2 336 1 1 5 ILE HG23 H 13.130 8.272 0.867 1.00 . A A . 5 ILE HG23 1 1 2 337 1 1 5 ILE N N 14.357 5.740 -2.100 1.00 . A A . 5 ILE N 1 1 2 338 1 1 5 ILE O O 13.102 5.706 1.181 1.00 . A A . 5 ILE O 1 1 2 339 1 1 6 PRO C C 11.338 3.328 0.747 1.00 . A A . 6 PRO C 1 1 2 340 1 1 6 PRO CA C 10.857 4.568 0.003 1.00 . A A . 6 PRO CA 1 1 2 341 1 1 6 PRO CB C 9.903 4.184 -1.131 1.00 . A A . 6 PRO CB 1 1 2 342 1 1 6 PRO CD C 11.777 5.332 -2.136 1.00 . A A . 6 PRO CD 1 1 2 343 1 1 6 PRO CG C 10.287 5.050 -2.287 1.00 . A A . 6 PRO CG 1 1 2 344 1 1 6 PRO HA H 10.354 5.237 0.684 1.00 . A A . 6 PRO HA 1 1 2 345 1 1 6 PRO HB2 H 10.029 3.139 -1.382 1.00 . A A . 6 PRO HB2 1 1 2 346 1 1 6 PRO HB3 H 8.882 4.380 -0.844 1.00 . A A . 6 PRO HB3 1 1 2 347 1 1 6 PRO HD2 H 12.361 4.573 -2.635 1.00 . A A . 6 PRO HD2 1 1 2 348 1 1 6 PRO HD3 H 12.020 6.311 -2.511 1.00 . A A . 6 PRO HD3 1 1 2 349 1 1 6 PRO HG2 H 10.094 4.533 -3.217 1.00 . A A . 6 PRO HG2 1 1 2 350 1 1 6 PRO HG3 H 9.741 5.977 -2.254 1.00 . A A . 6 PRO HG3 1 1 2 351 1 1 6 PRO N N 11.979 5.280 -0.686 1.00 . A A . 6 PRO N 1 1 2 352 1 1 6 PRO O O 10.537 2.511 1.201 1.00 . A A . 6 PRO O 1 1 2 353 1 1 7 DAL C C 14.479 1.597 0.816 1.00 . A A . 7 DAL C 1 1 2 354 1 1 7 DAL CA C 13.255 2.089 1.569 1.00 . A A . 7 DAL CA 1 1 2 355 1 1 7 DAL CB C 13.690 2.543 2.954 1.00 . A A . 7 DAL CB 1 1 2 356 1 1 7 DAL H H 13.229 3.896 0.500 1.00 . A A . 7 DAL H 1 1 2 357 1 1 7 DAL HA H 12.539 1.289 1.665 1.00 . A A . 7 DAL HA 1 1 2 358 1 1 7 DAL HB1 H 14.693 2.929 2.903 1.00 . A A . 7 DAL HB1 1 1 2 359 1 1 7 DAL HB2 H 13.656 1.708 3.633 1.00 . A A . 7 DAL HB2 1 1 2 360 1 1 7 DAL N N 12.651 3.208 0.874 1.00 . A A . 7 DAL N 1 1 2 361 1 1 7 DAL O O 15.095 0.609 1.198 1.00 . A A . 7 DAL O 1 1 2 362 1 1 8 LEU C C 17.248 2.320 -0.213 1.00 . A A . 8 LEU C 1 1 2 363 1 1 8 LEU CA C 16.011 1.963 -1.023 1.00 . A A . 8 LEU CA 1 1 2 364 1 1 8 LEU CB C 16.015 2.723 -2.350 1.00 . A A . 8 LEU CB 1 1 2 365 1 1 8 LEU CD1 C 15.211 0.771 -3.683 1.00 . A A . 8 LEU CD1 1 1 2 366 1 1 8 LEU CD2 C 13.562 2.213 -2.495 1.00 . A A . 8 LEU CD2 1 1 2 367 1 1 8 LEU CG C 14.892 2.199 -3.253 1.00 . A A . 8 LEU CG 1 1 2 368 1 1 8 LEU H H 14.317 3.098 -0.491 1.00 . A A . 8 LEU H 1 1 2 369 1 1 8 LEU HA H 16.009 0.903 -1.220 1.00 . A A . 8 LEU HA 1 1 2 370 1 1 8 LEU HB2 H 15.863 3.775 -2.161 1.00 . A A . 8 LEU HB2 1 1 2 371 1 1 8 LEU HB3 H 16.963 2.576 -2.841 1.00 . A A . 8 LEU HB3 1 1 2 372 1 1 8 LEU HD11 H 14.439 0.108 -3.325 1.00 . A A . 8 LEU HD11 1 1 2 373 1 1 8 LEU HD12 H 16.162 0.475 -3.265 1.00 . A A . 8 LEU HD12 1 1 2 374 1 1 8 LEU HD13 H 15.259 0.722 -4.760 1.00 . A A . 8 LEU HD13 1 1 2 375 1 1 8 LEU HD21 H 13.426 3.176 -2.028 1.00 . A A . 8 LEU HD21 1 1 2 376 1 1 8 LEU HD22 H 13.573 1.445 -1.736 1.00 . A A . 8 LEU HD22 1 1 2 377 1 1 8 LEU HD23 H 12.752 2.029 -3.183 1.00 . A A . 8 LEU HD23 1 1 2 378 1 1 8 LEU HG H 14.813 2.826 -4.127 1.00 . A A . 8 LEU HG 1 1 2 379 1 1 8 LEU N N 14.836 2.309 -0.244 1.00 . A A . 8 LEU N 1 1 2 380 1 1 8 LEU O O 18.247 1.599 -0.214 1.00 . A A . 8 LEU O 1 1 2 381 1 1 9 MET C C 18.520 2.961 2.453 1.00 . A A . 9 MET C 1 1 2 382 1 1 9 MET CA C 18.244 3.938 1.314 1.00 . A A . 9 MET CA 1 1 2 383 1 1 9 MET CB C 17.880 5.314 1.882 1.00 . A A . 9 MET CB 1 1 2 384 1 1 9 MET CE C 16.413 7.829 2.896 1.00 . A A . 9 MET CE 1 1 2 385 1 1 9 MET CG C 16.936 6.036 0.920 1.00 . A A . 9 MET CG 1 1 2 386 1 1 9 MET H H 16.322 3.969 0.433 1.00 . A A . 9 MET H 1 1 2 387 1 1 9 MET HA H 19.133 4.034 0.709 1.00 . A A . 9 MET HA 1 1 2 388 1 1 9 MET HB2 H 17.392 5.190 2.836 1.00 . A A . 9 MET HB2 1 1 2 389 1 1 9 MET HB3 H 18.771 5.905 2.009 1.00 . A A . 9 MET HB3 1 1 2 390 1 1 9 MET HE1 H 15.567 7.157 2.964 1.00 . A A . 9 MET HE1 1 1 2 391 1 1 9 MET HE2 H 16.098 8.826 3.157 1.00 . A A . 9 MET HE2 1 1 2 392 1 1 9 MET HE3 H 17.190 7.508 3.576 1.00 . A A . 9 MET HE3 1 1 2 393 1 1 9 MET HG2 H 17.215 5.810 -0.100 1.00 . A A . 9 MET HG2 1 1 2 394 1 1 9 MET HG3 H 15.923 5.709 1.098 1.00 . A A . 9 MET HG3 1 1 2 395 1 1 9 MET N N 17.153 3.452 0.481 1.00 . A A . 9 MET N 1 1 2 396 1 1 9 MET O O 19.674 2.650 2.751 1.00 . A A . 9 MET O 1 1 2 397 1 1 9 MET SD S 17.054 7.819 1.203 1.00 . A A . 9 MET SD 1 1 2 398 1 1 10 . C C 16.903 1.986 5.435 1.00 . A A . 10 DBB C 1 1 2 399 1 1 10 . CA C 17.594 1.500 4.160 1.00 . A A . 10 DBB CA 1 1 2 400 1 1 10 . CB C 17.011 0.145 3.726 1.00 . A A . 10 DBB CB 1 1 2 401 1 1 10 . CG C 17.236 -0.034 2.230 1.00 . A A . 10 DBB CG 1 1 2 402 1 1 10 . H H 16.556 2.735 2.782 1.00 . A A . 10 DBB H 1 1 2 403 1 1 10 . HA H 18.645 1.367 4.369 1.00 . A A . 10 DBB HA 1 1 2 404 1 1 10 . HB2 H 17.514 -0.651 4.239 1.00 . A A . 10 DBB HB2 1 1 2 405 1 1 10 . HG1 H 18.262 -0.314 2.050 1.00 . A A . 10 DBB HG1 1 1 2 406 1 1 10 . HG2 H 17.018 0.890 1.718 1.00 . A A . 10 DBB HG2 1 1 2 407 1 1 10 . HG3 H 16.581 -0.811 1.864 1.00 . A A . 10 DBB HG3 1 1 2 408 1 1 10 . N N 17.452 2.462 3.072 1.00 . A A . 10 DBB N 1 1 2 409 1 1 10 . O O 17.503 1.996 6.510 1.00 . A A . 10 DBB O 1 1 2 410 1 1 11 GLY C C 13.408 3.038 6.119 1.00 . A A . 11 GLY C 1 1 2 411 1 1 11 GLY CA C 14.886 2.860 6.463 1.00 . A A . 11 GLY CA 1 1 2 412 1 1 11 GLY H H 15.215 2.350 4.442 1.00 . A A . 11 GLY H 1 1 2 413 1 1 11 GLY HA2 H 14.981 2.147 7.270 1.00 . A A . 11 GLY HA2 1 1 2 414 1 1 11 GLY HA3 H 15.291 3.807 6.780 1.00 . A A . 11 GLY HA3 1 1 2 415 1 1 11 GLY N N 15.642 2.384 5.314 1.00 . A A . 11 GLY N 1 1 2 416 1 1 11 GLY O O 12.833 4.103 6.345 1.00 . A A . 11 GLY O 1 1 2 417 1 1 12 CYS C C 10.789 0.654 5.091 1.00 . A A . 12 CYS C 1 1 2 418 1 1 12 CYS CA C 11.381 2.045 5.204 1.00 . A A . 12 CYS CA 1 1 2 419 1 1 12 CYS CB C 11.195 2.733 3.851 1.00 . A A . 12 CYS CB 1 1 2 420 1 1 12 CYS H H 13.301 1.165 5.414 1.00 . A A . 12 CYS H 1 1 2 421 1 1 12 CYS HA H 10.845 2.598 5.953 1.00 . A A . 12 CYS HA 1 1 2 422 1 1 12 CYS HB2 H 11.159 1.983 3.075 1.00 . A A . 12 CYS HB2 1 1 2 423 1 1 12 CYS HB3 H 10.273 3.288 3.844 1.00 . A A . 12 CYS HB3 1 1 2 424 1 1 12 CYS N N 12.795 1.989 5.572 1.00 . A A . 12 CYS N 1 1 2 425 1 1 12 CYS O O 11.296 -0.314 5.657 1.00 . A A . 12 CYS O 1 1 2 426 1 1 12 CYS SG S 12.579 3.839 3.539 1.00 . A A . 12 CYS SG 1 1 2 427 1 1 13 GLY C C 8.970 -0.916 2.568 1.00 . A A . 13 GLY C 1 1 2 428 1 1 13 GLY CA C 9.035 -0.678 4.066 1.00 . A A . 13 GLY CA 1 1 2 429 1 1 13 GLY H H 9.390 1.393 3.881 1.00 . A A . 13 GLY H 1 1 2 430 1 1 13 GLY HA2 H 9.579 -1.480 4.536 1.00 . A A . 13 GLY HA2 1 1 2 431 1 1 13 GLY HA3 H 8.035 -0.633 4.462 1.00 . A A . 13 GLY HA3 1 1 2 432 1 1 13 GLY N N 9.718 0.578 4.316 1.00 . A A . 13 GLY N 1 1 2 433 1 1 13 GLY O O 8.268 -1.810 2.095 1.00 . A A . 13 GLY O 1 1 2 434 1 1 14 TRP C C 9.225 -1.528 -0.104 1.00 . A A . 14 TRP C 1 1 2 435 1 1 14 TRP CA C 9.770 -0.182 0.385 1.00 . A A . 14 TRP CA 1 1 2 436 1 1 14 TRP CB C 11.218 0.036 -0.089 1.00 . A A . 14 TRP CB 1 1 2 437 1 1 14 TRP CD1 C 11.854 -1.637 1.713 1.00 . A A . 14 TRP CD1 1 1 2 438 1 1 14 TRP CD2 C 13.535 -1.247 0.272 1.00 . A A . 14 TRP CD2 1 1 2 439 1 1 14 TRP CE2 C 14.018 -2.187 1.213 1.00 . A A . 14 TRP CE2 1 1 2 440 1 1 14 TRP CE3 C 14.406 -0.832 -0.748 1.00 . A A . 14 TRP CE3 1 1 2 441 1 1 14 TRP CG C 12.156 -0.909 0.614 1.00 . A A . 14 TRP CG 1 1 2 442 1 1 14 TRP CH2 C 16.165 -2.269 0.112 1.00 . A A . 14 TRP CH2 1 1 2 443 1 1 14 TRP CZ2 C 15.317 -2.696 1.138 1.00 . A A . 14 TRP CZ2 1 1 2 444 1 1 14 TRP CZ3 C 15.711 -1.340 -0.826 1.00 . A A . 14 TRP CZ3 1 1 2 445 1 1 14 TRP H H 10.249 0.596 2.288 1.00 . A A . 14 TRP H 1 1 2 446 1 1 14 TRP HA H 9.155 0.605 -0.029 1.00 . A A . 14 TRP HA 1 1 2 447 1 1 14 TRP HB2 H 11.271 -0.126 -1.151 1.00 . A A . 14 TRP HB2 1 1 2 448 1 1 14 TRP HB3 H 11.509 1.053 0.127 1.00 . A A . 14 TRP HB3 1 1 2 449 1 1 14 TRP HD1 H 10.910 -1.631 2.227 1.00 . A A . 14 TRP HD1 1 1 2 450 1 1 14 TRP HE1 H 12.999 -3.006 2.834 1.00 . A A . 14 TRP HE1 1 1 2 451 1 1 14 TRP HE3 H 14.071 -0.117 -1.475 1.00 . A A . 14 TRP HE3 1 1 2 452 1 1 14 TRP HH2 H 17.172 -2.651 0.046 1.00 . A A . 14 TRP HH2 1 1 2 453 1 1 14 TRP HZ2 H 15.664 -3.414 1.866 1.00 . A A . 14 TRP HZ2 1 1 2 454 1 1 14 TRP HZ3 H 16.369 -1.013 -1.618 1.00 . A A . 14 TRP HZ3 1 1 2 455 1 1 14 TRP N N 9.717 -0.093 1.836 1.00 . A A . 14 TRP N 1 1 2 456 1 1 14 TRP NE1 N 12.957 -2.394 2.070 1.00 . A A . 14 TRP NE1 1 1 2 457 1 1 14 TRP O O 8.014 -1.744 -0.110 1.00 . A A . 14 TRP O 1 1 2 458 1 1 15 LEU C C 10.020 -4.796 0.051 1.00 . A A . 15 LEU C 1 1 2 459 1 1 15 LEU CA C 9.698 -3.732 -0.992 1.00 . A A . 15 LEU CA 1 1 2 460 1 1 15 LEU CB C 10.425 -4.050 -2.298 1.00 . A A . 15 LEU CB 1 1 2 461 1 1 15 LEU CD1 C 12.698 -4.110 -3.323 1.00 . A A . 15 LEU CD1 1 1 2 462 1 1 15 LEU CD2 C 11.762 -1.939 -2.515 1.00 . A A . 15 LEU CD2 1 1 2 463 1 1 15 LEU CG C 11.832 -3.448 -2.254 1.00 . A A . 15 LEU CG 1 1 2 464 1 1 15 LEU H H 11.060 -2.211 -0.492 1.00 . A A . 15 LEU H 1 1 2 465 1 1 15 LEU HA H 8.634 -3.723 -1.174 1.00 . A A . 15 LEU HA 1 1 2 466 1 1 15 LEU HB2 H 10.493 -5.122 -2.420 1.00 . A A . 15 LEU HB2 1 1 2 467 1 1 15 LEU HB3 H 9.880 -3.626 -3.128 1.00 . A A . 15 LEU HB3 1 1 2 468 1 1 15 LEU HD11 H 13.310 -4.875 -2.867 1.00 . A A . 15 LEU HD11 1 1 2 469 1 1 15 LEU HD12 H 13.333 -3.368 -3.781 1.00 . A A . 15 LEU HD12 1 1 2 470 1 1 15 LEU HD13 H 12.064 -4.557 -4.074 1.00 . A A . 15 LEU HD13 1 1 2 471 1 1 15 LEU HD21 H 10.744 -1.596 -2.396 1.00 . A A . 15 LEU HD21 1 1 2 472 1 1 15 LEU HD22 H 12.097 -1.729 -3.519 1.00 . A A . 15 LEU HD22 1 1 2 473 1 1 15 LEU HD23 H 12.399 -1.423 -1.808 1.00 . A A . 15 LEU HD23 1 1 2 474 1 1 15 LEU HG H 12.266 -3.627 -1.281 1.00 . A A . 15 LEU HG 1 1 2 475 1 1 15 LEU N N 10.113 -2.425 -0.512 1.00 . A A . 15 LEU N 1 1 2 476 1 1 15 LEU O O 9.364 -5.836 0.120 1.00 . A A . 15 LEU O 1 1 2 477 1 1 16 . C C 10.616 -5.263 3.112 1.00 . A A . 16 DBU C 1 1 2 478 1 1 16 . CA C 11.500 -5.367 1.891 1.00 . A A . 16 DBU CA 1 1 2 479 1 1 16 . CB C 12.613 -6.218 1.880 1.00 . A A . 16 DBU CB 1 1 2 480 1 1 16 . CG C 13.564 -6.400 0.721 1.00 . A A . 16 DBU CG 1 1 2 481 1 1 16 . H H 11.528 -3.677 0.763 1.00 . A A . 16 DBU H 1 1 2 482 1 1 16 . HB H 12.834 -6.803 2.759 1.00 . A A . 16 DBU HB 1 1 2 483 1 1 16 . HG1 H 13.027 -6.281 -0.209 1.00 . A A . 16 DBU HG1 1 1 2 484 1 1 16 . HG2 H 13.995 -7.389 0.763 1.00 . A A . 16 DBU HG2 1 1 2 485 1 1 16 . HG3 H 14.349 -5.662 0.782 1.00 . A A . 16 DBU HG3 1 1 2 486 1 1 16 . N N 11.038 -4.521 0.861 1.00 . A A . 16 DBU N 1 1 2 487 1 1 16 . O O 10.198 -6.269 3.685 1.00 . A A . 16 DBU O 1 1 2 488 1 1 17 GLY C C 10.310 -3.237 5.843 1.00 . A A . 17 GLY C 1 1 2 489 1 1 17 GLY CA C 9.485 -3.800 4.691 1.00 . A A . 17 GLY CA 1 1 2 490 1 1 17 GLY H H 10.690 -3.261 3.030 1.00 . A A . 17 GLY H 1 1 2 491 1 1 17 GLY HA2 H 8.702 -3.099 4.434 1.00 . A A . 17 GLY HA2 1 1 2 492 1 1 17 GLY HA3 H 9.040 -4.734 4.999 1.00 . A A . 17 GLY HA3 1 1 2 493 1 1 17 GLY N N 10.327 -4.030 3.520 1.00 . A A . 17 GLY N 1 1 2 494 1 1 17 GLY O O 10.009 -2.171 6.379 1.00 . A A . 17 GLY O 1 1 2 495 1 1 18 LEU C C 13.556 -3.029 6.731 1.00 . A A . 18 LEU C 1 1 2 496 1 1 18 LEU CA C 12.229 -3.524 7.296 1.00 . A A . 18 LEU CA 1 1 2 497 1 1 18 LEU CB C 12.470 -4.677 8.270 1.00 . A A . 18 LEU CB 1 1 2 498 1 1 18 LEU CD1 C 11.328 -6.326 9.760 1.00 . A A . 18 LEU CD1 1 1 2 499 1 1 18 LEU CD2 C 10.741 -3.900 9.897 1.00 . A A . 18 LEU CD2 1 1 2 500 1 1 18 LEU CG C 11.152 -5.037 8.957 1.00 . A A . 18 LEU CG 1 1 2 501 1 1 18 LEU H H 11.551 -4.800 5.749 1.00 . A A . 18 LEU H 1 1 2 502 1 1 18 LEU HA H 11.750 -2.713 7.826 1.00 . A A . 18 LEU HA 1 1 2 503 1 1 18 LEU HB2 H 12.842 -5.535 7.728 1.00 . A A . 18 LEU HB2 1 1 2 504 1 1 18 LEU HB3 H 13.191 -4.376 9.014 1.00 . A A . 18 LEU HB3 1 1 2 505 1 1 18 LEU HD11 H 10.767 -6.256 10.680 1.00 . A A . 18 LEU HD11 1 1 2 506 1 1 18 LEU HD12 H 12.375 -6.469 9.986 1.00 . A A . 18 LEU HD12 1 1 2 507 1 1 18 LEU HD13 H 10.967 -7.163 9.181 1.00 . A A . 18 LEU HD13 1 1 2 508 1 1 18 LEU HD21 H 11.387 -3.050 9.737 1.00 . A A . 18 LEU HD21 1 1 2 509 1 1 18 LEU HD22 H 10.828 -4.232 10.921 1.00 . A A . 18 LEU HD22 1 1 2 510 1 1 18 LEU HD23 H 9.718 -3.618 9.695 1.00 . A A . 18 LEU HD23 1 1 2 511 1 1 18 LEU HG H 10.385 -5.182 8.208 1.00 . A A . 18 LEU HG 1 1 2 512 1 1 18 LEU N N 11.357 -3.961 6.214 1.00 . A A . 18 LEU N 1 1 2 513 1 1 18 LEU O O 14.474 -2.690 7.476 1.00 . A A . 18 LEU O 1 1 2 514 1 1 19 CYS C C 15.931 -3.634 4.826 1.00 . A A . 19 CYS C 1 1 2 515 1 1 19 CYS CA C 14.860 -2.558 4.733 1.00 . A A . 19 CYS CA 1 1 2 516 1 1 19 CYS CB C 15.367 -1.259 5.359 1.00 . A A . 19 CYS CB 1 1 2 517 1 1 19 CYS H H 12.879 -3.289 4.866 1.00 . A A . 19 CYS H 1 1 2 518 1 1 19 CYS HA H 14.635 -2.378 3.692 1.00 . A A . 19 CYS HA 1 1 2 519 1 1 19 CYS HB2 H 14.764 -1.012 6.220 1.00 . A A . 19 CYS HB2 1 1 2 520 1 1 19 CYS HB3 H 16.396 -1.383 5.662 1.00 . A A . 19 CYS HB3 1 1 2 521 1 1 19 CYS N N 13.645 -3.000 5.404 1.00 . A A . 19 CYS N 1 1 2 522 1 1 19 CYS O O 17.005 -3.417 5.389 1.00 . A A . 19 CYS O 1 1 2 523 1 1 19 CYS SG S 15.255 0.072 4.138 1.00 . A A . 19 CYS SG 1 1 2 524 1 1 20 VAL C C 17.824 -5.582 3.531 1.00 . A A . 20 VAL C 1 1 2 525 1 1 20 VAL CA C 16.547 -5.924 4.293 1.00 . A A . 20 VAL CA 1 1 2 526 1 1 20 VAL CB C 15.877 -7.140 3.654 1.00 . A A . 20 VAL CB 1 1 2 527 1 1 20 VAL CG1 C 16.836 -8.331 3.686 1.00 . A A . 20 VAL CG1 1 1 2 528 1 1 20 VAL CG2 C 14.599 -7.481 4.426 1.00 . A A . 20 VAL CG2 1 1 2 529 1 1 20 VAL H H 14.746 -4.908 3.846 1.00 . A A . 20 VAL H 1 1 2 530 1 1 20 VAL HA H 16.797 -6.158 5.316 1.00 . A A . 20 VAL HA 1 1 2 531 1 1 20 VAL HB H 15.628 -6.911 2.628 1.00 . A A . 20 VAL HB 1 1 2 532 1 1 20 VAL HG11 H 16.530 -9.020 4.460 1.00 . A A . 20 VAL HG11 1 1 2 533 1 1 20 VAL HG12 H 17.838 -7.982 3.891 1.00 . A A . 20 VAL HG12 1 1 2 534 1 1 20 VAL HG13 H 16.819 -8.832 2.730 1.00 . A A . 20 VAL HG13 1 1 2 535 1 1 20 VAL HG21 H 14.814 -7.509 5.484 1.00 . A A . 20 VAL HG21 1 1 2 536 1 1 20 VAL HG22 H 14.232 -8.444 4.106 1.00 . A A . 20 VAL HG22 1 1 2 537 1 1 20 VAL HG23 H 13.849 -6.726 4.230 1.00 . A A . 20 VAL HG23 1 1 2 538 1 1 20 VAL N N 15.622 -4.800 4.273 1.00 . A A . 20 VAL N 1 1 2 539 1 1 20 VAL O O 18.929 -5.848 4.004 1.00 . A A . 20 VAL O 1 1 2 540 1 1 21 ARG C C 19.147 -3.142 1.720 1.00 . A A . 21 ARG C 1 1 2 541 1 1 21 ARG CA C 18.808 -4.617 1.529 1.00 . A A . 21 ARG CA 1 1 2 542 1 1 21 ARG CB C 18.504 -4.887 0.054 1.00 . A A . 21 ARG CB 1 1 2 543 1 1 21 ARG CD C 19.441 -4.863 -2.262 1.00 . A A . 21 ARG CD 1 1 2 544 1 1 21 ARG CG C 19.741 -4.576 -0.790 1.00 . A A . 21 ARG CG 1 1 2 545 1 1 21 ARG CZ C 17.516 -4.364 -3.662 1.00 . A A . 21 ARG CZ 1 1 2 546 1 1 21 ARG H H 16.757 -4.805 2.027 1.00 . A A . 21 ARG H 1 1 2 547 1 1 21 ARG HA H 19.660 -5.213 1.822 1.00 . A A . 21 ARG HA 1 1 2 548 1 1 21 ARG HB2 H 18.233 -5.925 -0.073 1.00 . A A . 21 ARG HB2 1 1 2 549 1 1 21 ARG HB3 H 17.687 -4.259 -0.266 1.00 . A A . 21 ARG HB3 1 1 2 550 1 1 21 ARG HD2 H 20.337 -4.718 -2.846 1.00 . A A . 21 ARG HD2 1 1 2 551 1 1 21 ARG HD3 H 19.112 -5.887 -2.364 1.00 . A A . 21 ARG HD3 1 1 2 552 1 1 21 ARG HE H 18.345 -3.054 -2.396 1.00 . A A . 21 ARG HE 1 1 2 553 1 1 21 ARG HG2 H 20.006 -3.534 -0.673 1.00 . A A . 21 ARG HG2 1 1 2 554 1 1 21 ARG HG3 H 20.565 -5.195 -0.466 1.00 . A A . 21 ARG HG3 1 1 2 555 1 1 21 ARG HH11 H 18.279 -6.208 -3.828 1.00 . A A . 21 ARG HH11 1 1 2 556 1 1 21 ARG HH12 H 16.908 -5.872 -4.830 1.00 . A A . 21 ARG HH12 1 1 2 557 1 1 21 ARG HH21 H 16.550 -2.612 -3.709 1.00 . A A . 21 ARG HH21 1 1 2 558 1 1 21 ARG HH22 H 15.930 -3.838 -4.764 1.00 . A A . 21 ARG HH22 1 1 2 559 1 1 21 ARG N N 17.663 -4.993 2.351 1.00 . A A . 21 ARG N 1 1 2 560 1 1 21 ARG NE N 18.398 -3.966 -2.749 1.00 . A A . 21 ARG NE 1 1 2 561 1 1 21 ARG NH1 N 17.574 -5.575 -4.144 1.00 . A A . 21 ARG NH1 1 1 2 562 1 1 21 ARG NH2 N 16.593 -3.540 -4.078 1.00 . A A . 21 ARG NH2 1 1 2 563 1 1 21 ARG O O 20.320 -2.812 1.669 1.00 . A A . 21 ARG O 1 1 2 564 1 1 21 ARG OXT O 18.226 -2.365 1.916 1.00 . A A . 21 ARG OXT 1 1 3 565 1 1 1 ALA C C 11.758 2.246 -8.617 1.00 . A A . 1 ALA C 1 1 3 566 1 1 1 ALA CA C 10.990 1.067 -8.027 1.00 . A A . 1 ALA CA 1 1 3 567 1 1 1 ALA CB C 10.585 0.099 -9.140 1.00 . A A . 1 ALA CB 1 1 3 568 1 1 1 ALA H1 H 9.862 2.586 -7.160 1.00 . A A . 1 ALA H1 1 1 3 569 1 1 1 ALA H2 H 9.650 1.065 -6.435 1.00 . A A . 1 ALA H2 1 1 3 570 1 1 1 ALA H3 H 8.937 1.399 -7.940 1.00 . A A . 1 ALA H3 1 1 3 571 1 1 1 ALA HA H 11.618 0.553 -7.315 1.00 . A A . 1 ALA HA 1 1 3 572 1 1 1 ALA HB1 H 9.640 0.411 -9.564 1.00 . A A . 1 ALA HB1 1 1 3 573 1 1 1 ALA HB2 H 10.485 -0.896 -8.734 1.00 . A A . 1 ALA HB2 1 1 3 574 1 1 1 ALA HB3 H 11.341 0.099 -9.911 1.00 . A A . 1 ALA HB3 1 1 3 575 1 1 1 ALA N N 9.767 1.568 -7.338 1.00 . A A . 1 ALA N 1 1 3 576 1 1 1 ALA O O 11.236 2.983 -9.454 1.00 . A A . 1 ALA O 1 1 3 577 1 1 2 GLY C C 13.480 4.818 -7.965 1.00 . A A . 2 GLY C 1 1 3 578 1 1 2 GLY CA C 13.829 3.511 -8.667 1.00 . A A . 2 GLY CA 1 1 3 579 1 1 2 GLY H H 13.363 1.800 -7.508 1.00 . A A . 2 GLY H 1 1 3 580 1 1 2 GLY HA2 H 14.869 3.277 -8.487 1.00 . A A . 2 GLY HA2 1 1 3 581 1 1 2 GLY HA3 H 13.671 3.629 -9.729 1.00 . A A . 2 GLY HA3 1 1 3 582 1 1 2 GLY N N 12.999 2.419 -8.176 1.00 . A A . 2 GLY N 1 1 3 583 1 1 2 GLY O O 13.854 5.899 -8.422 1.00 . A A . 2 GLY O 1 1 3 584 1 1 3 GLY C C 13.480 6.340 -5.157 1.00 . A A . 3 GLY C 1 1 3 585 1 1 3 GLY CA C 12.366 5.895 -6.098 1.00 . A A . 3 GLY CA 1 1 3 586 1 1 3 GLY H H 12.490 3.826 -6.538 1.00 . A A . 3 GLY H 1 1 3 587 1 1 3 GLY HA2 H 12.140 6.697 -6.786 1.00 . A A . 3 GLY HA2 1 1 3 588 1 1 3 GLY HA3 H 11.485 5.666 -5.517 1.00 . A A . 3 GLY HA3 1 1 3 589 1 1 3 GLY N N 12.760 4.713 -6.854 1.00 . A A . 3 GLY N 1 1 3 590 1 1 3 GLY O O 13.392 7.400 -4.538 1.00 . A A . 3 GLY O 1 1 3 591 1 1 4 . C C 15.143 6.658 -3.038 1.00 . A A . 4 DBU C 1 1 3 592 1 1 4 . CA C 15.613 5.832 -4.208 1.00 . A A . 4 DBU CA 1 1 3 593 1 1 4 . CB C 16.968 5.495 -4.313 1.00 . A A . 4 DBU CB 1 1 3 594 1 1 4 . CG C 17.589 4.681 -5.419 1.00 . A A . 4 DBU CG 1 1 3 595 1 1 4 . H H 14.549 4.685 -5.564 1.00 . A A . 4 DBU H 1 1 3 596 1 1 4 . HB H 17.642 5.842 -3.543 1.00 . A A . 4 DBU HB 1 1 3 597 1 1 4 . HG1 H 16.892 4.604 -6.242 1.00 . A A . 4 DBU HG1 1 1 3 598 1 1 4 . HG2 H 17.821 3.695 -5.049 1.00 . A A . 4 DBU HG2 1 1 3 599 1 1 4 . HG3 H 18.494 5.162 -5.757 1.00 . A A . 4 DBU HG3 1 1 3 600 1 1 4 . N N 14.524 5.522 -5.052 1.00 . A A . 4 DBU N 1 1 3 601 1 1 4 . O O 15.197 7.883 -3.097 1.00 . A A . 4 DBU O 1 1 3 602 1 1 5 ILE C C 13.076 5.864 -0.117 1.00 . A A . 5 ILE C 1 1 3 603 1 1 5 ILE CA C 14.193 6.670 -0.783 1.00 . A A . 5 ILE CA 1 1 3 604 1 1 5 ILE CB C 13.676 8.073 -1.127 1.00 . A A . 5 ILE CB 1 1 3 605 1 1 5 ILE CD1 C 14.913 9.611 0.445 1.00 . A A . 5 ILE CD1 1 1 3 606 1 1 5 ILE CG1 C 14.823 9.089 -0.993 1.00 . A A . 5 ILE CG1 1 1 3 607 1 1 5 ILE CG2 C 12.536 8.453 -0.178 1.00 . A A . 5 ILE CG2 1 1 3 608 1 1 5 ILE H H 14.668 5.008 -2.011 1.00 . A A . 5 ILE H 1 1 3 609 1 1 5 ILE HA H 15.008 6.764 -0.088 1.00 . A A . 5 ILE HA 1 1 3 610 1 1 5 ILE HB H 13.310 8.078 -2.145 1.00 . A A . 5 ILE HB 1 1 3 611 1 1 5 ILE HD11 H 15.869 10.091 0.595 1.00 . A A . 5 ILE HD11 1 1 3 612 1 1 5 ILE HD12 H 14.810 8.786 1.133 1.00 . A A . 5 ILE HD12 1 1 3 613 1 1 5 ILE HD13 H 14.121 10.325 0.618 1.00 . A A . 5 ILE HD13 1 1 3 614 1 1 5 ILE HG12 H 15.755 8.612 -1.258 1.00 . A A . 5 ILE HG12 1 1 3 615 1 1 5 ILE HG13 H 14.644 9.915 -1.664 1.00 . A A . 5 ILE HG13 1 1 3 616 1 1 5 ILE HG21 H 12.816 8.199 0.835 1.00 . A A . 5 ILE HG21 1 1 3 617 1 1 5 ILE HG22 H 11.643 7.911 -0.451 1.00 . A A . 5 ILE HG22 1 1 3 618 1 1 5 ILE HG23 H 12.348 9.514 -0.245 1.00 . A A . 5 ILE HG23 1 1 3 619 1 1 5 ILE N N 14.682 5.988 -1.982 1.00 . A A . 5 ILE N 1 1 3 620 1 1 5 ILE O O 13.015 5.767 1.109 1.00 . A A . 5 ILE O 1 1 3 621 1 1 6 PRO C C 11.521 3.337 0.471 1.00 . A A . 6 PRO C 1 1 3 622 1 1 6 PRO CA C 11.048 4.501 -0.383 1.00 . A A . 6 PRO CA 1 1 3 623 1 1 6 PRO CB C 10.344 3.996 -1.645 1.00 . A A . 6 PRO CB 1 1 3 624 1 1 6 PRO CD C 12.196 5.366 -2.365 1.00 . A A . 6 PRO CD 1 1 3 625 1 1 6 PRO CG C 10.794 4.903 -2.741 1.00 . A A . 6 PRO CG 1 1 3 626 1 1 6 PRO HA H 10.375 5.129 0.179 1.00 . A A . 6 PRO HA 1 1 3 627 1 1 6 PRO HB2 H 10.640 2.975 -1.852 1.00 . A A . 6 PRO HB2 1 1 3 628 1 1 6 PRO HB3 H 9.274 4.060 -1.530 1.00 . A A . 6 PRO HB3 1 1 3 629 1 1 6 PRO HD2 H 12.941 4.703 -2.778 1.00 . A A . 6 PRO HD2 1 1 3 630 1 1 6 PRO HD3 H 12.363 6.375 -2.694 1.00 . A A . 6 PRO HD3 1 1 3 631 1 1 6 PRO HG2 H 10.814 4.371 -3.682 1.00 . A A . 6 PRO HG2 1 1 3 632 1 1 6 PRO HG3 H 10.142 5.756 -2.806 1.00 . A A . 6 PRO HG3 1 1 3 633 1 1 6 PRO N N 12.195 5.303 -0.899 1.00 . A A . 6 PRO N 1 1 3 634 1 1 6 PRO O O 10.719 2.640 1.089 1.00 . A A . 6 PRO O 1 1 3 635 1 1 7 DAL C C 14.698 1.537 0.579 1.00 . A A . 7 DAL C 1 1 3 636 1 1 7 DAL CA C 13.431 2.051 1.258 1.00 . A A . 7 DAL CA 1 1 3 637 1 1 7 DAL CB C 13.795 2.530 2.664 1.00 . A A . 7 DAL CB 1 1 3 638 1 1 7 DAL H H 13.409 3.732 -0.031 1.00 . A A . 7 DAL H 1 1 3 639 1 1 7 DAL HA H 12.721 1.243 1.338 1.00 . A A . 7 DAL HA 1 1 3 640 1 1 7 DAL HB1 H 14.823 2.852 2.674 1.00 . A A . 7 DAL HB1 1 1 3 641 1 1 7 DAL HB2 H 13.668 1.715 3.357 1.00 . A A . 7 DAL HB2 1 1 3 642 1 1 7 DAL N N 12.833 3.136 0.487 1.00 . A A . 7 DAL N 1 1 3 643 1 1 7 DAL O O 15.275 0.536 1.005 1.00 . A A . 7 DAL O 1 1 3 644 1 1 8 LEU C C 17.559 2.366 -0.400 1.00 . A A . 8 LEU C 1 1 3 645 1 1 8 LEU CA C 16.353 1.839 -1.163 1.00 . A A . 8 LEU CA 1 1 3 646 1 1 8 LEU CB C 16.342 2.419 -2.581 1.00 . A A . 8 LEU CB 1 1 3 647 1 1 8 LEU CD1 C 14.970 2.730 -4.649 1.00 . A A . 8 LEU CD1 1 1 3 648 1 1 8 LEU CD2 C 14.728 0.646 -3.301 1.00 . A A . 8 LEU CD2 1 1 3 649 1 1 8 LEU CG C 14.983 2.152 -3.234 1.00 . A A . 8 LEU CG 1 1 3 650 1 1 8 LEU H H 14.660 3.030 -0.753 1.00 . A A . 8 LEU H 1 1 3 651 1 1 8 LEU HA H 16.405 0.764 -1.215 1.00 . A A . 8 LEU HA 1 1 3 652 1 1 8 LEU HB2 H 16.520 3.484 -2.536 1.00 . A A . 8 LEU HB2 1 1 3 653 1 1 8 LEU HB3 H 17.119 1.950 -3.167 1.00 . A A . 8 LEU HB3 1 1 3 654 1 1 8 LEU HD11 H 13.990 3.129 -4.866 1.00 . A A . 8 LEU HD11 1 1 3 655 1 1 8 LEU HD12 H 15.209 1.952 -5.359 1.00 . A A . 8 LEU HD12 1 1 3 656 1 1 8 LEU HD13 H 15.703 3.520 -4.722 1.00 . A A . 8 LEU HD13 1 1 3 657 1 1 8 LEU HD21 H 13.680 0.453 -3.134 1.00 . A A . 8 LEU HD21 1 1 3 658 1 1 8 LEU HD22 H 15.311 0.150 -2.542 1.00 . A A . 8 LEU HD22 1 1 3 659 1 1 8 LEU HD23 H 15.012 0.275 -4.273 1.00 . A A . 8 LEU HD23 1 1 3 660 1 1 8 LEU HG H 14.207 2.624 -2.648 1.00 . A A . 8 LEU HG 1 1 3 661 1 1 8 LEU N N 15.142 2.233 -0.461 1.00 . A A . 8 LEU N 1 1 3 662 1 1 8 LEU O O 18.706 2.072 -0.734 1.00 . A A . 8 LEU O 1 1 3 663 1 1 9 MET C C 18.548 2.889 2.716 1.00 . A A . 9 MET C 1 1 3 664 1 1 9 MET CA C 18.321 3.735 1.463 1.00 . A A . 9 MET CA 1 1 3 665 1 1 9 MET CB C 17.945 5.163 1.884 1.00 . A A . 9 MET CB 1 1 3 666 1 1 9 MET CE C 17.140 8.070 1.192 1.00 . A A . 9 MET CE 1 1 3 667 1 1 9 MET CG C 16.484 5.460 1.536 1.00 . A A . 9 MET CG 1 1 3 668 1 1 9 MET H H 16.336 3.345 0.843 1.00 . A A . 9 MET H 1 1 3 669 1 1 9 MET HA H 19.238 3.771 0.896 1.00 . A A . 9 MET HA 1 1 3 670 1 1 9 MET HB2 H 18.085 5.271 2.948 1.00 . A A . 9 MET HB2 1 1 3 671 1 1 9 MET HB3 H 18.576 5.868 1.368 1.00 . A A . 9 MET HB3 1 1 3 672 1 1 9 MET HE1 H 17.124 9.095 1.538 1.00 . A A . 9 MET HE1 1 1 3 673 1 1 9 MET HE2 H 16.813 8.036 0.165 1.00 . A A . 9 MET HE2 1 1 3 674 1 1 9 MET HE3 H 18.145 7.676 1.261 1.00 . A A . 9 MET HE3 1 1 3 675 1 1 9 MET HG2 H 16.362 5.474 0.462 1.00 . A A . 9 MET HG2 1 1 3 676 1 1 9 MET HG3 H 15.848 4.698 1.962 1.00 . A A . 9 MET HG3 1 1 3 677 1 1 9 MET N N 17.274 3.153 0.633 1.00 . A A . 9 MET N 1 1 3 678 1 1 9 MET O O 19.686 2.674 3.132 1.00 . A A . 9 MET O 1 1 3 679 1 1 9 MET SD S 16.031 7.074 2.217 1.00 . A A . 9 MET SD 1 1 3 680 1 1 10 . C C 16.789 2.279 5.672 1.00 . A A . 10 DBB C 1 1 3 681 1 1 10 . CA C 17.553 1.621 4.539 1.00 . A A . 10 DBB CA 1 1 3 682 1 1 10 . CB C 16.986 0.220 4.308 1.00 . A A . 10 DBB CB 1 1 3 683 1 1 10 . CG C 15.551 0.359 3.798 1.00 . A A . 10 DBB CG 1 1 3 684 1 1 10 . H H 16.574 2.638 2.955 1.00 . A A . 10 DBB H 1 1 3 685 1 1 10 . HA H 18.592 1.537 4.818 1.00 . A A . 10 DBB HA 1 1 3 686 1 1 10 . HB2 H 17.556 -0.236 3.527 1.00 . A A . 10 DBB HB2 1 1 3 687 1 1 10 . HG1 H 15.188 -0.606 3.476 1.00 . A A . 10 DBB HG1 1 1 3 688 1 1 10 . HG2 H 15.537 1.041 2.963 1.00 . A A . 10 DBB HG2 1 1 3 689 1 1 10 . HG3 H 14.917 0.738 4.581 1.00 . A A . 10 DBB HG3 1 1 3 690 1 1 10 . N N 17.456 2.427 3.323 1.00 . A A . 10 DBB N 1 1 3 691 1 1 10 . O O 17.328 2.494 6.759 1.00 . A A . 10 DBB O 1 1 3 692 1 1 11 GLY C C 13.290 3.478 5.886 1.00 . A A . 11 GLY C 1 1 3 693 1 1 11 GLY CA C 14.700 3.231 6.414 1.00 . A A . 11 GLY CA 1 1 3 694 1 1 11 GLY H H 15.156 2.406 4.526 1.00 . A A . 11 GLY H 1 1 3 695 1 1 11 GLY HA2 H 14.650 2.595 7.286 1.00 . A A . 11 GLY HA2 1 1 3 696 1 1 11 GLY HA3 H 15.148 4.167 6.680 1.00 . A A . 11 GLY HA3 1 1 3 697 1 1 11 GLY N N 15.530 2.597 5.411 1.00 . A A . 11 GLY N 1 1 3 698 1 1 11 GLY O O 12.831 4.618 5.824 1.00 . A A . 11 GLY O 1 1 3 699 1 1 12 CYS C C 10.515 1.183 5.080 1.00 . A A . 12 CYS C 1 1 3 700 1 1 12 CYS CA C 11.249 2.510 4.983 1.00 . A A . 12 CYS CA 1 1 3 701 1 1 12 CYS CB C 11.273 2.913 3.512 1.00 . A A . 12 CYS CB 1 1 3 702 1 1 12 CYS H H 13.026 1.515 5.580 1.00 . A A . 12 CYS H 1 1 3 703 1 1 12 CYS HA H 10.709 3.259 5.545 1.00 . A A . 12 CYS HA 1 1 3 704 1 1 12 CYS HB2 H 11.301 2.018 2.908 1.00 . A A . 12 CYS HB2 1 1 3 705 1 1 12 CYS HB3 H 10.383 3.472 3.275 1.00 . A A . 12 CYS HB3 1 1 3 706 1 1 12 CYS N N 12.608 2.399 5.507 1.00 . A A . 12 CYS N 1 1 3 707 1 1 12 CYS O O 10.791 0.351 5.946 1.00 . A A . 12 CYS O 1 1 3 708 1 1 12 CYS SG S 12.733 3.908 3.154 1.00 . A A . 12 CYS SG 1 1 3 709 1 1 13 GLY C C 8.750 -0.683 2.617 1.00 . A A . 13 GLY C 1 1 3 710 1 1 13 GLY CA C 8.802 -0.222 4.063 1.00 . A A . 13 GLY CA 1 1 3 711 1 1 13 GLY H H 9.442 1.702 3.482 1.00 . A A . 13 GLY H 1 1 3 712 1 1 13 GLY HA2 H 9.256 -0.985 4.675 1.00 . A A . 13 GLY HA2 1 1 3 713 1 1 13 GLY HA3 H 7.799 -0.030 4.407 1.00 . A A . 13 GLY HA3 1 1 3 714 1 1 13 GLY N N 9.587 0.998 4.148 1.00 . A A . 13 GLY N 1 1 3 715 1 1 13 GLY O O 8.122 -1.688 2.293 1.00 . A A . 13 GLY O 1 1 3 716 1 1 14 TRP C C 9.013 -1.622 0.009 1.00 . A A . 14 TRP C 1 1 3 717 1 1 14 TRP CA C 9.488 -0.203 0.331 1.00 . A A . 14 TRP CA 1 1 3 718 1 1 14 TRP CB C 10.928 0.005 -0.165 1.00 . A A . 14 TRP CB 1 1 3 719 1 1 14 TRP CD1 C 11.591 -1.472 1.784 1.00 . A A . 14 TRP CD1 1 1 3 720 1 1 14 TRP CD2 C 13.268 -1.179 0.319 1.00 . A A . 14 TRP CD2 1 1 3 721 1 1 14 TRP CE2 C 13.768 -2.010 1.349 1.00 . A A . 14 TRP CE2 1 1 3 722 1 1 14 TRP CE3 C 14.133 -0.841 -0.736 1.00 . A A . 14 TRP CE3 1 1 3 723 1 1 14 TRP CG C 11.882 -0.844 0.623 1.00 . A A . 14 TRP CG 1 1 3 724 1 1 14 TRP CH2 C 15.923 -2.145 0.276 1.00 . A A . 14 TRP CH2 1 1 3 725 1 1 14 TRP CZ2 C 15.077 -2.489 1.332 1.00 . A A . 14 TRP CZ2 1 1 3 726 1 1 14 TRP CZ3 C 15.453 -1.323 -0.756 1.00 . A A . 14 TRP CZ3 1 1 3 727 1 1 14 TRP H H 9.901 0.866 2.105 1.00 . A A . 14 TRP H 1 1 3 728 1 1 14 TRP HA H 8.849 0.497 -0.183 1.00 . A A . 14 TRP HA 1 1 3 729 1 1 14 TRP HB2 H 10.986 -0.262 -1.205 1.00 . A A . 14 TRP HB2 1 1 3 730 1 1 14 TRP HB3 H 11.198 1.043 -0.052 1.00 . A A . 14 TRP HB3 1 1 3 731 1 1 14 TRP HD1 H 10.645 -1.441 2.288 1.00 . A A . 14 TRP HD1 1 1 3 732 1 1 14 TRP HE1 H 12.763 -2.692 3.037 1.00 . A A . 14 TRP HE1 1 1 3 733 1 1 14 TRP HE3 H 13.779 -0.209 -1.536 1.00 . A A . 14 TRP HE3 1 1 3 734 1 1 14 TRP HH2 H 16.939 -2.511 0.256 1.00 . A A . 14 TRP HH2 1 1 3 735 1 1 14 TRP HZ2 H 15.434 -3.122 2.129 1.00 . A A . 14 TRP HZ2 1 1 3 736 1 1 14 TRP HZ3 H 16.108 -1.058 -1.573 1.00 . A A . 14 TRP HZ3 1 1 3 737 1 1 14 TRP N N 9.426 0.081 1.761 1.00 . A A . 14 TRP N 1 1 3 738 1 1 14 TRP NE1 N 12.709 -2.159 2.217 1.00 . A A . 14 TRP NE1 1 1 3 739 1 1 14 TRP O O 7.832 -1.940 0.152 1.00 . A A . 14 TRP O 1 1 3 740 1 1 15 LEU C C 10.076 -4.785 0.274 1.00 . A A . 15 LEU C 1 1 3 741 1 1 15 LEU CA C 9.602 -3.828 -0.816 1.00 . A A . 15 LEU CA 1 1 3 742 1 1 15 LEU CB C 10.287 -4.177 -2.139 1.00 . A A . 15 LEU CB 1 1 3 743 1 1 15 LEU CD1 C 12.509 -4.016 -3.271 1.00 . A A . 15 LEU CD1 1 1 3 744 1 1 15 LEU CD2 C 11.212 -1.933 -2.782 1.00 . A A . 15 LEU CD2 1 1 3 745 1 1 15 LEU CG C 11.563 -3.342 -2.282 1.00 . A A . 15 LEU CG 1 1 3 746 1 1 15 LEU H H 10.846 -2.150 -0.576 1.00 . A A . 15 LEU H 1 1 3 747 1 1 15 LEU HA H 8.534 -3.922 -0.935 1.00 . A A . 15 LEU HA 1 1 3 748 1 1 15 LEU HB2 H 10.538 -5.228 -2.149 1.00 . A A . 15 LEU HB2 1 1 3 749 1 1 15 LEU HB3 H 9.620 -3.957 -2.960 1.00 . A A . 15 LEU HB3 1 1 3 750 1 1 15 LEU HD11 H 12.222 -3.753 -4.279 1.00 . A A . 15 LEU HD11 1 1 3 751 1 1 15 LEU HD12 H 12.453 -5.087 -3.148 1.00 . A A . 15 LEU HD12 1 1 3 752 1 1 15 LEU HD13 H 13.519 -3.684 -3.086 1.00 . A A . 15 LEU HD13 1 1 3 753 1 1 15 LEU HD21 H 11.174 -1.934 -3.862 1.00 . A A . 15 LEU HD21 1 1 3 754 1 1 15 LEU HD22 H 11.969 -1.234 -2.449 1.00 . A A . 15 LEU HD22 1 1 3 755 1 1 15 LEU HD23 H 10.253 -1.635 -2.389 1.00 . A A . 15 LEU HD23 1 1 3 756 1 1 15 LEU HG H 12.049 -3.270 -1.319 1.00 . A A . 15 LEU HG 1 1 3 757 1 1 15 LEU N N 9.932 -2.459 -0.454 1.00 . A A . 15 LEU N 1 1 3 758 1 1 15 LEU O O 9.493 -5.849 0.482 1.00 . A A . 15 LEU O 1 1 3 759 1 1 16 . C C 10.822 -5.067 3.232 1.00 . A A . 16 DBU C 1 1 3 760 1 1 16 . CA C 11.700 -5.159 2.009 1.00 . A A . 16 DBU CA 1 1 3 761 1 1 16 . CB C 12.875 -5.921 2.020 1.00 . A A . 16 DBU CB 1 1 3 762 1 1 16 . CG C 13.819 -6.075 0.854 1.00 . A A . 16 DBU CG 1 1 3 763 1 1 16 . H H 11.568 -3.533 0.762 1.00 . A A . 16 DBU H 1 1 3 764 1 1 16 . HB H 13.141 -6.446 2.925 1.00 . A A . 16 DBU HB 1 1 3 765 1 1 16 . HG1 H 14.651 -5.398 0.976 1.00 . A A . 16 DBU HG1 1 1 3 766 1 1 16 . HG2 H 13.298 -5.846 -0.065 1.00 . A A . 16 DBU HG2 1 1 3 767 1 1 16 . HG3 H 14.183 -7.091 0.816 1.00 . A A . 16 DBU HG3 1 1 3 768 1 1 16 . N N 11.141 -4.391 0.967 1.00 . A A . 16 DBU N 1 1 3 769 1 1 16 . O O 10.281 -6.065 3.711 1.00 . A A . 16 DBU O 1 1 3 770 1 1 17 GLY C C 10.690 -3.282 6.141 1.00 . A A . 17 GLY C 1 1 3 771 1 1 17 GLY CA C 9.841 -3.630 4.922 1.00 . A A . 17 GLY CA 1 1 3 772 1 1 17 GLY H H 11.122 -3.087 3.321 1.00 . A A . 17 GLY H 1 1 3 773 1 1 17 GLY HA2 H 9.154 -2.821 4.724 1.00 . A A . 17 GLY HA2 1 1 3 774 1 1 17 GLY HA3 H 9.279 -4.529 5.131 1.00 . A A . 17 GLY HA3 1 1 3 775 1 1 17 GLY N N 10.670 -3.849 3.745 1.00 . A A . 17 GLY N 1 1 3 776 1 1 17 GLY O O 10.503 -2.235 6.760 1.00 . A A . 17 GLY O 1 1 3 777 1 1 18 LEU C C 13.821 -3.345 7.213 1.00 . A A . 18 LEU C 1 1 3 778 1 1 18 LEU CA C 12.485 -3.949 7.638 1.00 . A A . 18 LEU CA 1 1 3 779 1 1 18 LEU CB C 12.726 -5.272 8.368 1.00 . A A . 18 LEU CB 1 1 3 780 1 1 18 LEU CD1 C 10.276 -5.756 8.372 1.00 . A A . 18 LEU CD1 1 1 3 781 1 1 18 LEU CD2 C 11.777 -6.893 10.014 1.00 . A A . 18 LEU CD2 1 1 3 782 1 1 18 LEU CG C 11.519 -5.594 9.249 1.00 . A A . 18 LEU CG 1 1 3 783 1 1 18 LEU H H 11.718 -4.989 5.956 1.00 . A A . 18 LEU H 1 1 3 784 1 1 18 LEU HA H 11.995 -3.266 8.314 1.00 . A A . 18 LEU HA 1 1 3 785 1 1 18 LEU HB2 H 12.868 -6.062 7.645 1.00 . A A . 18 LEU HB2 1 1 3 786 1 1 18 LEU HB3 H 13.608 -5.186 8.986 1.00 . A A . 18 LEU HB3 1 1 3 787 1 1 18 LEU HD11 H 10.548 -6.242 7.448 1.00 . A A . 18 LEU HD11 1 1 3 788 1 1 18 LEU HD12 H 9.856 -4.784 8.158 1.00 . A A . 18 LEU HD12 1 1 3 789 1 1 18 LEU HD13 H 9.544 -6.356 8.893 1.00 . A A . 18 LEU HD13 1 1 3 790 1 1 18 LEU HD21 H 12.841 -7.032 10.138 1.00 . A A . 18 LEU HD21 1 1 3 791 1 1 18 LEU HD22 H 11.369 -7.726 9.458 1.00 . A A . 18 LEU HD22 1 1 3 792 1 1 18 LEU HD23 H 11.305 -6.842 10.983 1.00 . A A . 18 LEU HD23 1 1 3 793 1 1 18 LEU HG H 11.360 -4.787 9.949 1.00 . A A . 18 LEU HG 1 1 3 794 1 1 18 LEU N N 11.618 -4.170 6.484 1.00 . A A . 18 LEU N 1 1 3 795 1 1 18 LEU O O 14.709 -3.145 8.042 1.00 . A A . 18 LEU O 1 1 3 796 1 1 19 CYS C C 16.336 -3.490 5.498 1.00 . A A . 19 CYS C 1 1 3 797 1 1 19 CYS CA C 15.197 -2.482 5.405 1.00 . A A . 19 CYS CA 1 1 3 798 1 1 19 CYS CB C 15.559 -1.224 6.195 1.00 . A A . 19 CYS CB 1 1 3 799 1 1 19 CYS H H 13.222 -3.243 5.306 1.00 . A A . 19 CYS H 1 1 3 800 1 1 19 CYS HA H 15.051 -2.216 4.369 1.00 . A A . 19 CYS HA 1 1 3 801 1 1 19 CYS HB2 H 14.887 -0.427 5.933 1.00 . A A . 19 CYS HB2 1 1 3 802 1 1 19 CYS HB3 H 15.470 -1.430 7.251 1.00 . A A . 19 CYS HB3 1 1 3 803 1 1 19 CYS N N 13.961 -3.061 5.922 1.00 . A A . 19 CYS N 1 1 3 804 1 1 19 CYS O O 17.301 -3.284 6.234 1.00 . A A . 19 CYS O 1 1 3 805 1 1 19 CYS SG S 17.267 -0.742 5.824 1.00 . A A . 19 CYS SG 1 1 3 806 1 1 20 VAL C C 18.560 -5.069 4.203 1.00 . A A . 20 VAL C 1 1 3 807 1 1 20 VAL CA C 17.242 -5.612 4.749 1.00 . A A . 20 VAL CA 1 1 3 808 1 1 20 VAL CB C 16.782 -6.800 3.902 1.00 . A A . 20 VAL CB 1 1 3 809 1 1 20 VAL CG1 C 15.867 -7.697 4.737 1.00 . A A . 20 VAL CG1 1 1 3 810 1 1 20 VAL CG2 C 16.012 -6.285 2.682 1.00 . A A . 20 VAL CG2 1 1 3 811 1 1 20 VAL H H 15.425 -4.685 4.179 1.00 . A A . 20 VAL H 1 1 3 812 1 1 20 VAL HA H 17.396 -5.948 5.762 1.00 . A A . 20 VAL HA 1 1 3 813 1 1 20 VAL HB H 17.643 -7.365 3.576 1.00 . A A . 20 VAL HB 1 1 3 814 1 1 20 VAL HG11 H 14.871 -7.279 4.755 1.00 . A A . 20 VAL HG11 1 1 3 815 1 1 20 VAL HG12 H 16.246 -7.761 5.746 1.00 . A A . 20 VAL HG12 1 1 3 816 1 1 20 VAL HG13 H 15.835 -8.685 4.301 1.00 . A A . 20 VAL HG13 1 1 3 817 1 1 20 VAL HG21 H 15.048 -5.910 2.997 1.00 . A A . 20 VAL HG21 1 1 3 818 1 1 20 VAL HG22 H 15.872 -7.092 1.979 1.00 . A A . 20 VAL HG22 1 1 3 819 1 1 20 VAL HG23 H 16.572 -5.490 2.212 1.00 . A A . 20 VAL HG23 1 1 3 820 1 1 20 VAL N N 16.216 -4.577 4.746 1.00 . A A . 20 VAL N 1 1 3 821 1 1 20 VAL O O 19.628 -5.353 4.743 1.00 . A A . 20 VAL O 1 1 3 822 1 1 21 ARG C C 20.244 -2.610 3.423 1.00 . A A . 21 ARG C 1 1 3 823 1 1 21 ARG CA C 19.674 -3.707 2.531 1.00 . A A . 21 ARG CA 1 1 3 824 1 1 21 ARG CB C 19.345 -3.127 1.152 1.00 . A A . 21 ARG CB 1 1 3 825 1 1 21 ARG CD C 18.704 -3.681 -1.198 1.00 . A A . 21 ARG CD 1 1 3 826 1 1 21 ARG CG C 19.058 -4.265 0.171 1.00 . A A . 21 ARG CG 1 1 3 827 1 1 21 ARG CZ C 17.243 -5.285 -2.290 1.00 . A A . 21 ARG CZ 1 1 3 828 1 1 21 ARG H H 17.599 -4.090 2.744 1.00 . A A . 21 ARG H 1 1 3 829 1 1 21 ARG HA H 20.416 -4.484 2.413 1.00 . A A . 21 ARG HA 1 1 3 830 1 1 21 ARG HB2 H 18.477 -2.490 1.230 1.00 . A A . 21 ARG HB2 1 1 3 831 1 1 21 ARG HB3 H 20.185 -2.550 0.797 1.00 . A A . 21 ARG HB3 1 1 3 832 1 1 21 ARG HD2 H 17.819 -3.071 -1.110 1.00 . A A . 21 ARG HD2 1 1 3 833 1 1 21 ARG HD3 H 19.524 -3.070 -1.548 1.00 . A A . 21 ARG HD3 1 1 3 834 1 1 21 ARG HE H 19.191 -5.085 -2.710 1.00 . A A . 21 ARG HE 1 1 3 835 1 1 21 ARG HG2 H 19.934 -4.893 0.082 1.00 . A A . 21 ARG HG2 1 1 3 836 1 1 21 ARG HG3 H 18.229 -4.853 0.533 1.00 . A A . 21 ARG HG3 1 1 3 837 1 1 21 ARG HH11 H 16.410 -4.121 -0.890 1.00 . A A . 21 ARG HH11 1 1 3 838 1 1 21 ARG HH12 H 15.345 -5.254 -1.655 1.00 . A A . 21 ARG HH12 1 1 3 839 1 1 21 ARG HH21 H 17.799 -6.569 -3.721 1.00 . A A . 21 ARG HH21 1 1 3 840 1 1 21 ARG HH22 H 16.131 -6.639 -3.258 1.00 . A A . 21 ARG HH22 1 1 3 841 1 1 21 ARG N N 18.477 -4.284 3.133 1.00 . A A . 21 ARG N 1 1 3 842 1 1 21 ARG NE N 18.454 -4.752 -2.155 1.00 . A A . 21 ARG NE 1 1 3 843 1 1 21 ARG NH1 N 16.256 -4.853 -1.554 1.00 . A A . 21 ARG NH1 1 1 3 844 1 1 21 ARG NH2 N 17.043 -6.239 -3.157 1.00 . A A . 21 ARG NH2 1 1 3 845 1 1 21 ARG O O 20.394 -1.499 2.940 1.00 . A A . 21 ARG O 1 1 3 846 1 1 21 ARG OXT O 20.523 -2.896 4.576 1.00 . A A . 21 ARG OXT 1 1 4 847 1 1 1 ALA C C 10.256 2.894 -7.543 1.00 . A A . 1 ALA C 1 1 4 848 1 1 1 ALA CA C 8.981 2.913 -6.706 1.00 . A A . 1 ALA CA 1 1 4 849 1 1 1 ALA CB C 8.765 1.549 -6.049 1.00 . A A . 1 ALA CB 1 1 4 850 1 1 1 ALA H1 H 7.171 3.872 -7.086 1.00 . A A . 1 ALA H1 1 1 4 851 1 1 1 ALA H2 H 7.316 2.349 -7.823 1.00 . A A . 1 ALA H2 1 1 4 852 1 1 1 ALA H3 H 8.154 3.685 -8.454 1.00 . A A . 1 ALA H3 1 1 4 853 1 1 1 ALA HA H 9.067 3.670 -5.940 1.00 . A A . 1 ALA HA 1 1 4 854 1 1 1 ALA HB1 H 9.723 1.090 -5.847 1.00 . A A . 1 ALA HB1 1 1 4 855 1 1 1 ALA HB2 H 8.198 0.915 -6.715 1.00 . A A . 1 ALA HB2 1 1 4 856 1 1 1 ALA HB3 H 8.224 1.675 -5.124 1.00 . A A . 1 ALA HB3 1 1 4 857 1 1 1 ALA N N 7.818 3.228 -7.583 1.00 . A A . 1 ALA N 1 1 4 858 1 1 1 ALA O O 10.204 2.964 -8.771 1.00 . A A . 1 ALA O 1 1 4 859 1 1 2 GLY C C 13.292 4.166 -7.644 1.00 . A A . 2 GLY C 1 1 4 860 1 1 2 GLY CA C 12.681 2.769 -7.563 1.00 . A A . 2 GLY CA 1 1 4 861 1 1 2 GLY H H 11.377 2.745 -5.892 1.00 . A A . 2 GLY H 1 1 4 862 1 1 2 GLY HA2 H 13.357 2.115 -7.030 1.00 . A A . 2 GLY HA2 1 1 4 863 1 1 2 GLY HA3 H 12.536 2.391 -8.563 1.00 . A A . 2 GLY HA3 1 1 4 864 1 1 2 GLY N N 11.398 2.798 -6.871 1.00 . A A . 2 GLY N 1 1 4 865 1 1 2 GLY O O 14.405 4.337 -8.139 1.00 . A A . 2 GLY O 1 1 4 866 1 1 3 GLY C C 14.281 6.695 -6.312 1.00 . A A . 3 GLY C 1 1 4 867 1 1 3 GLY CA C 13.037 6.535 -7.178 1.00 . A A . 3 GLY CA 1 1 4 868 1 1 3 GLY H H 11.675 4.962 -6.772 1.00 . A A . 3 GLY H 1 1 4 869 1 1 3 GLY HA2 H 13.274 6.810 -8.196 1.00 . A A . 3 GLY HA2 1 1 4 870 1 1 3 GLY HA3 H 12.262 7.187 -6.805 1.00 . A A . 3 GLY HA3 1 1 4 871 1 1 3 GLY N N 12.556 5.158 -7.155 1.00 . A A . 3 GLY N 1 1 4 872 1 1 3 GLY O O 15.204 7.425 -6.664 1.00 . A A . 3 GLY O 1 1 4 873 1 1 4 . C C 14.980 6.809 -3.033 1.00 . A A . 4 DBU C 1 1 4 874 1 1 4 . CA C 15.380 6.060 -4.278 1.00 . A A . 4 DBU CA 1 1 4 875 1 1 4 . CB C 16.676 5.548 -4.396 1.00 . A A . 4 DBU CB 1 1 4 876 1 1 4 . CG C 17.178 4.789 -5.598 1.00 . A A . 4 DBU CG 1 1 4 877 1 1 4 . H H 13.532 5.436 -4.936 1.00 . A A . 4 DBU H 1 1 4 878 1 1 4 . HB H 17.370 5.702 -3.581 1.00 . A A . 4 DBU HB 1 1 4 879 1 1 4 . HG1 H 17.992 5.332 -6.052 1.00 . A A . 4 DBU HG1 1 1 4 880 1 1 4 . HG2 H 16.375 4.678 -6.310 1.00 . A A . 4 DBU HG2 1 1 4 881 1 1 4 . HG3 H 17.524 3.812 -5.289 1.00 . A A . 4 DBU HG3 1 1 4 882 1 1 4 . N N 14.294 6.005 -5.175 1.00 . A A . 4 DBU N 1 1 4 883 1 1 4 . O O 15.057 8.034 -2.999 1.00 . A A . 4 DBU O 1 1 4 884 1 1 5 ILE C C 13.031 5.827 -0.085 1.00 . A A . 5 ILE C 1 1 4 885 1 1 5 ILE CA C 14.131 6.660 -0.745 1.00 . A A . 5 ILE CA 1 1 4 886 1 1 5 ILE CB C 13.629 8.094 -0.961 1.00 . A A . 5 ILE CB 1 1 4 887 1 1 5 ILE CD1 C 14.915 9.489 0.699 1.00 . A A . 5 ILE CD1 1 1 4 888 1 1 5 ILE CG1 C 14.800 9.070 -0.772 1.00 . A A . 5 ILE CG1 1 1 4 889 1 1 5 ILE CG2 C 12.513 8.416 0.042 1.00 . A A . 5 ILE CG2 1 1 4 890 1 1 5 ILE H H 14.516 5.090 -2.115 1.00 . A A . 5 ILE H 1 1 4 891 1 1 5 ILE HA H 14.979 6.691 -0.084 1.00 . A A . 5 ILE HA 1 1 4 892 1 1 5 ILE HB H 13.243 8.188 -1.966 1.00 . A A . 5 ILE HB 1 1 4 893 1 1 5 ILE HD11 H 14.432 10.445 0.840 1.00 . A A . 5 ILE HD11 1 1 4 894 1 1 5 ILE HD12 H 15.956 9.569 0.971 1.00 . A A . 5 ILE HD12 1 1 4 895 1 1 5 ILE HD13 H 14.434 8.750 1.322 1.00 . A A . 5 ILE HD13 1 1 4 896 1 1 5 ILE HG12 H 15.717 8.588 -1.078 1.00 . A A . 5 ILE HG12 1 1 4 897 1 1 5 ILE HG13 H 14.634 9.942 -1.381 1.00 . A A . 5 ILE HG13 1 1 4 898 1 1 5 ILE HG21 H 11.668 7.771 -0.139 1.00 . A A . 5 ILE HG21 1 1 4 899 1 1 5 ILE HG22 H 12.214 9.448 -0.071 1.00 . A A . 5 ILE HG22 1 1 4 900 1 1 5 ILE HG23 H 12.881 8.254 1.046 1.00 . A A . 5 ILE HG23 1 1 4 901 1 1 5 ILE N N 14.552 6.064 -2.013 1.00 . A A . 5 ILE N 1 1 4 902 1 1 5 ILE O O 13.012 5.665 1.135 1.00 . A A . 5 ILE O 1 1 4 903 1 1 6 PRO C C 11.488 3.286 0.432 1.00 . A A . 6 PRO C 1 1 4 904 1 1 6 PRO CA C 10.990 4.488 -0.348 1.00 . A A . 6 PRO CA 1 1 4 905 1 1 6 PRO CB C 10.239 4.052 -1.608 1.00 . A A . 6 PRO CB 1 1 4 906 1 1 6 PRO CD C 12.068 5.447 -2.323 1.00 . A A . 6 PRO CD 1 1 4 907 1 1 6 PRO CG C 10.647 5.021 -2.665 1.00 . A A . 6 PRO CG 1 1 4 908 1 1 6 PRO HA H 10.342 5.089 0.268 1.00 . A A . 6 PRO HA 1 1 4 909 1 1 6 PRO HB2 H 10.528 3.047 -1.884 1.00 . A A . 6 PRO HB2 1 1 4 910 1 1 6 PRO HB3 H 9.175 4.107 -1.447 1.00 . A A . 6 PRO HB3 1 1 4 911 1 1 6 PRO HD2 H 12.790 4.797 -2.795 1.00 . A A . 6 PRO HD2 1 1 4 912 1 1 6 PRO HD3 H 12.235 6.466 -2.605 1.00 . A A . 6 PRO HD3 1 1 4 913 1 1 6 PRO HG2 H 10.619 4.548 -3.635 1.00 . A A . 6 PRO HG2 1 1 4 914 1 1 6 PRO HG3 H 10.002 5.883 -2.647 1.00 . A A . 6 PRO HG3 1 1 4 915 1 1 6 PRO N N 12.120 5.311 -0.864 1.00 . A A . 6 PRO N 1 1 4 916 1 1 6 PRO O O 10.700 2.537 1.000 1.00 . A A . 6 PRO O 1 1 4 917 1 1 7 DAL C C 14.697 1.543 0.445 1.00 . A A . 7 DAL C 1 1 4 918 1 1 7 DAL CA C 13.430 2.009 1.154 1.00 . A A . 7 DAL CA 1 1 4 919 1 1 7 DAL CB C 13.802 2.435 2.572 1.00 . A A . 7 DAL CB 1 1 4 920 1 1 7 DAL H H 13.373 3.758 -0.032 1.00 . A A . 7 DAL H 1 1 4 921 1 1 7 DAL HA H 12.732 1.188 1.210 1.00 . A A . 7 DAL HA 1 1 4 922 1 1 7 DAL HB1 H 14.836 2.732 2.593 1.00 . A A . 7 DAL HB1 1 1 4 923 1 1 7 DAL HB2 H 13.655 1.604 3.243 1.00 . A A . 7 DAL HB2 1 1 4 924 1 1 7 DAL N N 12.808 3.118 0.444 1.00 . A A . 7 DAL N 1 1 4 925 1 1 7 DAL O O 15.314 0.556 0.847 1.00 . A A . 7 DAL O 1 1 4 926 1 1 8 LEU C C 17.515 2.433 -0.557 1.00 . A A . 8 LEU C 1 1 4 927 1 1 8 LEU CA C 16.306 1.916 -1.323 1.00 . A A . 8 LEU CA 1 1 4 928 1 1 8 LEU CB C 16.275 2.537 -2.721 1.00 . A A . 8 LEU CB 1 1 4 929 1 1 8 LEU CD1 C 14.875 2.892 -4.762 1.00 . A A . 8 LEU CD1 1 1 4 930 1 1 8 LEU CD2 C 14.646 0.781 -3.454 1.00 . A A . 8 LEU CD2 1 1 4 931 1 1 8 LEU CG C 14.908 2.286 -3.359 1.00 . A A . 8 LEU CG 1 1 4 932 1 1 8 LEU H H 14.584 3.050 -0.867 1.00 . A A . 8 LEU H 1 1 4 933 1 1 8 LEU HA H 16.376 0.844 -1.408 1.00 . A A . 8 LEU HA 1 1 4 934 1 1 8 LEU HB2 H 16.449 3.601 -2.647 1.00 . A A . 8 LEU HB2 1 1 4 935 1 1 8 LEU HB3 H 17.043 2.088 -3.331 1.00 . A A . 8 LEU HB3 1 1 4 936 1 1 8 LEU HD11 H 14.232 2.299 -5.394 1.00 . A A . 8 LEU HD11 1 1 4 937 1 1 8 LEU HD12 H 15.872 2.904 -5.173 1.00 . A A . 8 LEU HD12 1 1 4 938 1 1 8 LEU HD13 H 14.495 3.901 -4.707 1.00 . A A . 8 LEU HD13 1 1 4 939 1 1 8 LEU HD21 H 15.226 0.266 -2.703 1.00 . A A . 8 LEU HD21 1 1 4 940 1 1 8 LEU HD22 H 14.929 0.427 -4.432 1.00 . A A . 8 LEU HD22 1 1 4 941 1 1 8 LEU HD23 H 13.596 0.589 -3.290 1.00 . A A . 8 LEU HD23 1 1 4 942 1 1 8 LEU HG H 14.140 2.747 -2.752 1.00 . A A . 8 LEU HG 1 1 4 943 1 1 8 LEU N N 15.098 2.267 -0.595 1.00 . A A . 8 LEU N 1 1 4 944 1 1 8 LEU O O 18.662 2.159 -0.914 1.00 . A A . 8 LEU O 1 1 4 945 1 1 9 MET C C 18.556 2.828 2.539 1.00 . A A . 9 MET C 1 1 4 946 1 1 9 MET CA C 18.296 3.740 1.340 1.00 . A A . 9 MET CA 1 1 4 947 1 1 9 MET CB C 17.909 5.139 1.845 1.00 . A A . 9 MET CB 1 1 4 948 1 1 9 MET CE C 16.120 6.883 3.712 1.00 . A A . 9 MET CE 1 1 4 949 1 1 9 MET CG C 16.486 5.495 1.408 1.00 . A A . 9 MET CG 1 1 4 950 1 1 9 MET H H 16.304 3.359 0.736 1.00 . A A . 9 MET H 1 1 4 951 1 1 9 MET HA H 19.202 3.817 0.756 1.00 . A A . 9 MET HA 1 1 4 952 1 1 9 MET HB2 H 17.965 5.158 2.922 1.00 . A A . 9 MET HB2 1 1 4 953 1 1 9 MET HB3 H 18.593 5.869 1.440 1.00 . A A . 9 MET HB3 1 1 4 954 1 1 9 MET HE1 H 15.552 7.655 4.212 1.00 . A A . 9 MET HE1 1 1 4 955 1 1 9 MET HE2 H 17.135 6.894 4.077 1.00 . A A . 9 MET HE2 1 1 4 956 1 1 9 MET HE3 H 15.678 5.917 3.913 1.00 . A A . 9 MET HE3 1 1 4 957 1 1 9 MET HG2 H 16.410 5.423 0.333 1.00 . A A . 9 MET HG2 1 1 4 958 1 1 9 MET HG3 H 15.786 4.814 1.868 1.00 . A A . 9 MET HG3 1 1 4 959 1 1 9 MET N N 17.239 3.183 0.505 1.00 . A A . 9 MET N 1 1 4 960 1 1 9 MET O O 19.703 2.600 2.922 1.00 . A A . 9 MET O 1 1 4 961 1 1 9 MET SD S 16.113 7.188 1.929 1.00 . A A . 9 MET SD 1 1 4 962 1 1 10 . C C 16.809 1.975 5.465 1.00 . A A . 10 DBB C 1 1 4 963 1 1 10 . CA C 17.592 1.423 4.286 1.00 . A A . 10 DBB CA 1 1 4 964 1 1 10 . CB C 17.071 0.027 3.940 1.00 . A A . 10 DBB CB 1 1 4 965 1 1 10 . CG C 15.558 0.104 3.718 1.00 . A A . 10 DBB CG 1 1 4 966 1 1 10 . H H 16.587 2.528 2.779 1.00 . A A . 10 DBB H 1 1 4 967 1 1 10 . HA H 18.631 1.345 4.564 1.00 . A A . 10 DBB HA 1 1 4 968 1 1 10 . HB2 H 17.508 -0.263 3.008 1.00 . A A . 10 DBB HB2 1 1 4 969 1 1 10 . HG1 H 15.074 0.490 4.599 1.00 . A A . 10 DBB HG1 1 1 4 970 1 1 10 . HG2 H 15.174 -0.880 3.502 1.00 . A A . 10 DBB HG2 1 1 4 971 1 1 10 . HG3 H 15.355 0.756 2.885 1.00 . A A . 10 DBB HG3 1 1 4 972 1 1 10 . N N 17.477 2.309 3.127 1.00 . A A . 10 DBB N 1 1 4 973 1 1 10 . O O 17.298 1.990 6.594 1.00 . A A . 10 DBB O 1 1 4 974 1 1 11 GLY C C 13.354 3.271 5.759 1.00 . A A . 11 GLY C 1 1 4 975 1 1 11 GLY CA C 14.764 2.971 6.253 1.00 . A A . 11 GLY CA 1 1 4 976 1 1 11 GLY H H 15.252 2.391 4.281 1.00 . A A . 11 GLY H 1 1 4 977 1 1 11 GLY HA2 H 14.716 2.261 7.065 1.00 . A A . 11 GLY HA2 1 1 4 978 1 1 11 GLY HA3 H 15.220 3.876 6.602 1.00 . A A . 11 GLY HA3 1 1 4 979 1 1 11 GLY N N 15.594 2.426 5.199 1.00 . A A . 11 GLY N 1 1 4 980 1 1 11 GLY O O 12.922 4.424 5.743 1.00 . A A . 11 GLY O 1 1 4 981 1 1 12 CYS C C 10.520 1.067 4.913 1.00 . A A . 12 CYS C 1 1 4 982 1 1 12 CYS CA C 11.277 2.384 4.867 1.00 . A A . 12 CYS CA 1 1 4 983 1 1 12 CYS CB C 11.292 2.849 3.417 1.00 . A A . 12 CYS CB 1 1 4 984 1 1 12 CYS H H 13.037 1.329 5.395 1.00 . A A . 12 CYS H 1 1 4 985 1 1 12 CYS HA H 10.761 3.117 5.467 1.00 . A A . 12 CYS HA 1 1 4 986 1 1 12 CYS HB2 H 11.296 1.980 2.778 1.00 . A A . 12 CYS HB2 1 1 4 987 1 1 12 CYS HB3 H 10.413 3.437 3.213 1.00 . A A . 12 CYS HB3 1 1 4 988 1 1 12 CYS N N 12.640 2.224 5.359 1.00 . A A . 12 CYS N 1 1 4 989 1 1 12 CYS O O 10.816 0.183 5.716 1.00 . A A . 12 CYS O 1 1 4 990 1 1 12 CYS SG S 12.773 3.823 3.094 1.00 . A A . 12 CYS SG 1 1 4 991 1 1 13 GLY C C 8.713 -0.700 2.441 1.00 . A A . 13 GLY C 1 1 4 992 1 1 13 GLY CA C 8.753 -0.252 3.893 1.00 . A A . 13 GLY CA 1 1 4 993 1 1 13 GLY H H 9.399 1.696 3.388 1.00 . A A . 13 GLY H 1 1 4 994 1 1 13 GLY HA2 H 9.186 -1.030 4.501 1.00 . A A . 13 GLY HA2 1 1 4 995 1 1 13 GLY HA3 H 7.749 -0.050 4.226 1.00 . A A . 13 GLY HA3 1 1 4 996 1 1 13 GLY N N 9.558 0.952 4.009 1.00 . A A . 13 GLY N 1 1 4 997 1 1 13 GLY O O 8.061 -1.685 2.097 1.00 . A A . 13 GLY O 1 1 4 998 1 1 14 TRP C C 9.032 -1.669 -0.136 1.00 . A A . 14 TRP C 1 1 4 999 1 1 14 TRP CA C 9.488 -0.238 0.171 1.00 . A A . 14 TRP CA 1 1 4 1000 1 1 14 TRP CB C 10.921 -0.011 -0.330 1.00 . A A . 14 TRP CB 1 1 4 1001 1 1 14 TRP CD1 C 11.607 -1.466 1.625 1.00 . A A . 14 TRP CD1 1 1 4 1002 1 1 14 TRP CD2 C 13.280 -1.144 0.161 1.00 . A A . 14 TRP CD2 1 1 4 1003 1 1 14 TRP CE2 C 13.796 -1.963 1.192 1.00 . A A . 14 TRP CE2 1 1 4 1004 1 1 14 TRP CE3 C 14.137 -0.792 -0.897 1.00 . A A . 14 TRP CE3 1 1 4 1005 1 1 14 TRP CG C 11.889 -0.836 0.463 1.00 . A A . 14 TRP CG 1 1 4 1006 1 1 14 TRP CH2 C 15.953 -2.058 0.117 1.00 . A A . 14 TRP CH2 1 1 4 1007 1 1 14 TRP CZ2 C 15.115 -2.418 1.175 1.00 . A A . 14 TRP CZ2 1 1 4 1008 1 1 14 TRP CZ3 C 15.465 -1.247 -0.918 1.00 . A A . 14 TRP CZ3 1 1 4 1009 1 1 14 TRP H H 9.913 0.820 1.951 1.00 . A A . 14 TRP H 1 1 4 1010 1 1 14 TRP HA H 8.834 0.447 -0.346 1.00 . A A . 14 TRP HA 1 1 4 1011 1 1 14 TRP HB2 H 10.982 -0.283 -1.367 1.00 . A A . 14 TRP HB2 1 1 4 1012 1 1 14 TRP HB3 H 11.175 1.033 -0.226 1.00 . A A . 14 TRP HB3 1 1 4 1013 1 1 14 TRP HD1 H 10.657 -1.451 2.130 1.00 . A A . 14 TRP HD1 1 1 4 1014 1 1 14 TRP HE1 H 12.800 -2.663 2.882 1.00 . A A . 14 TRP HE1 1 1 4 1015 1 1 14 TRP HE3 H 13.770 -0.168 -1.697 1.00 . A A . 14 TRP HE3 1 1 4 1016 1 1 14 TRP HH2 H 16.975 -2.405 0.095 1.00 . A A . 14 TRP HH2 1 1 4 1017 1 1 14 TRP HZ2 H 15.485 -3.042 1.974 1.00 . A A . 14 TRP HZ2 1 1 4 1018 1 1 14 TRP HZ3 H 16.115 -0.970 -1.735 1.00 . A A . 14 TRP HZ3 1 1 4 1019 1 1 14 TRP N N 9.422 0.049 1.600 1.00 . A A . 14 TRP N 1 1 4 1020 1 1 14 TRP NE1 N 12.738 -2.131 2.061 1.00 . A A . 14 TRP NE1 1 1 4 1021 1 1 14 TRP O O 7.842 -1.977 -0.061 1.00 . A A . 14 TRP O 1 1 4 1022 1 1 15 LEU C C 10.133 -4.846 0.274 1.00 . A A . 15 LEU C 1 1 4 1023 1 1 15 LEU CA C 9.653 -3.911 -0.835 1.00 . A A . 15 LEU CA 1 1 4 1024 1 1 15 LEU CB C 10.332 -4.282 -2.157 1.00 . A A . 15 LEU CB 1 1 4 1025 1 1 15 LEU CD1 C 12.514 -4.086 -3.360 1.00 . A A . 15 LEU CD1 1 1 4 1026 1 1 15 LEU CD2 C 11.195 -2.021 -2.862 1.00 . A A . 15 LEU CD2 1 1 4 1027 1 1 15 LEU CG C 11.584 -3.417 -2.348 1.00 . A A . 15 LEU CG 1 1 4 1028 1 1 15 LEU H H 10.897 -2.237 -0.572 1.00 . A A . 15 LEU H 1 1 4 1029 1 1 15 LEU HA H 8.584 -4.011 -0.948 1.00 . A A . 15 LEU HA 1 1 4 1030 1 1 15 LEU HB2 H 10.612 -5.327 -2.135 1.00 . A A . 15 LEU HB2 1 1 4 1031 1 1 15 LEU HB3 H 9.648 -4.110 -2.974 1.00 . A A . 15 LEU HB3 1 1 4 1032 1 1 15 LEU HD11 H 12.170 -5.090 -3.553 1.00 . A A . 15 LEU HD11 1 1 4 1033 1 1 15 LEU HD12 H 13.516 -4.119 -2.957 1.00 . A A . 15 LEU HD12 1 1 4 1034 1 1 15 LEU HD13 H 12.513 -3.520 -4.278 1.00 . A A . 15 LEU HD13 1 1 4 1035 1 1 15 LEU HD21 H 11.122 -2.039 -3.938 1.00 . A A . 15 LEU HD21 1 1 4 1036 1 1 15 LEU HD22 H 11.950 -1.303 -2.567 1.00 . A A . 15 LEU HD22 1 1 4 1037 1 1 15 LEU HD23 H 10.243 -1.729 -2.442 1.00 . A A . 15 LEU HD23 1 1 4 1038 1 1 15 LEU HG H 12.099 -3.321 -1.403 1.00 . A A . 15 LEU HG 1 1 4 1039 1 1 15 LEU N N 9.972 -2.532 -0.504 1.00 . A A . 15 LEU N 1 1 4 1040 1 1 15 LEU O O 9.554 -5.908 0.499 1.00 . A A . 15 LEU O 1 1 4 1041 1 1 16 . C C 10.907 -5.050 3.253 1.00 . A A . 16 DBU C 1 1 4 1042 1 1 16 . CA C 11.774 -5.171 2.023 1.00 . A A . 16 DBU CA 1 1 4 1043 1 1 16 . CB C 12.954 -5.924 2.042 1.00 . A A . 16 DBU CB 1 1 4 1044 1 1 16 . CG C 13.886 -6.106 0.869 1.00 . A A . 16 DBU CG 1 1 4 1045 1 1 16 . H H 11.622 -3.582 0.751 1.00 . A A . 16 DBU H 1 1 4 1046 1 1 16 . HB H 13.237 -6.421 2.957 1.00 . A A . 16 DBU HB 1 1 4 1047 1 1 16 . HG1 H 13.668 -5.364 0.117 1.00 . A A . 16 DBU HG1 1 1 4 1048 1 1 16 . HG2 H 13.753 -7.094 0.452 1.00 . A A . 16 DBU HG2 1 1 4 1049 1 1 16 . HG3 H 14.908 -5.992 1.202 1.00 . A A . 16 DBU HG3 1 1 4 1050 1 1 16 . N N 11.196 -4.437 0.965 1.00 . A A . 16 DBU N 1 1 4 1051 1 1 16 . O O 10.345 -6.028 3.742 1.00 . A A . 16 DBU O 1 1 4 1052 1 1 17 GLY C C 10.832 -3.067 6.099 1.00 . A A . 17 GLY C 1 1 4 1053 1 1 17 GLY CA C 9.982 -3.575 4.940 1.00 . A A . 17 GLY CA 1 1 4 1054 1 1 17 GLY H H 11.263 -3.079 3.327 1.00 . A A . 17 GLY H 1 1 4 1055 1 1 17 GLY HA2 H 9.230 -2.840 4.699 1.00 . A A . 17 GLY HA2 1 1 4 1056 1 1 17 GLY HA3 H 9.498 -4.493 5.235 1.00 . A A . 17 GLY HA3 1 1 4 1057 1 1 17 GLY N N 10.795 -3.826 3.758 1.00 . A A . 17 GLY N 1 1 4 1058 1 1 17 GLY O O 10.654 -1.943 6.567 1.00 . A A . 17 GLY O 1 1 4 1059 1 1 18 LEU C C 14.018 -3.184 7.187 1.00 . A A . 18 LEU C 1 1 4 1060 1 1 18 LEU CA C 12.618 -3.545 7.677 1.00 . A A . 18 LEU CA 1 1 4 1061 1 1 18 LEU CB C 12.704 -4.706 8.669 1.00 . A A . 18 LEU CB 1 1 4 1062 1 1 18 LEU CD1 C 10.213 -4.922 8.713 1.00 . A A . 18 LEU CD1 1 1 4 1063 1 1 18 LEU CD2 C 11.578 -5.830 10.596 1.00 . A A . 18 LEU CD2 1 1 4 1064 1 1 18 LEU CG C 11.465 -4.703 9.566 1.00 . A A . 18 LEU CG 1 1 4 1065 1 1 18 LEU H H 11.838 -4.794 6.152 1.00 . A A . 18 LEU H 1 1 4 1066 1 1 18 LEU HA H 12.194 -2.690 8.183 1.00 . A A . 18 LEU HA 1 1 4 1067 1 1 18 LEU HB2 H 12.754 -5.639 8.126 1.00 . A A . 18 LEU HB2 1 1 4 1068 1 1 18 LEU HB3 H 13.587 -4.595 9.279 1.00 . A A . 18 LEU HB3 1 1 4 1069 1 1 18 LEU HD11 H 9.820 -3.966 8.398 1.00 . A A . 18 LEU HD11 1 1 4 1070 1 1 18 LEU HD12 H 9.467 -5.444 9.294 1.00 . A A . 18 LEU HD12 1 1 4 1071 1 1 18 LEU HD13 H 10.469 -5.510 7.844 1.00 . A A . 18 LEU HD13 1 1 4 1072 1 1 18 LEU HD21 H 11.326 -5.450 11.575 1.00 . A A . 18 LEU HD21 1 1 4 1073 1 1 18 LEU HD22 H 12.589 -6.208 10.605 1.00 . A A . 18 LEU HD22 1 1 4 1074 1 1 18 LEU HD23 H 10.898 -6.628 10.335 1.00 . A A . 18 LEU HD23 1 1 4 1075 1 1 18 LEU HG H 11.391 -3.753 10.075 1.00 . A A . 18 LEU HG 1 1 4 1076 1 1 18 LEU N N 11.748 -3.909 6.563 1.00 . A A . 18 LEU N 1 1 4 1077 1 1 18 LEU O O 14.929 -2.989 7.990 1.00 . A A . 18 LEU O 1 1 4 1078 1 1 19 CYS C C 16.442 -3.962 5.434 1.00 . A A . 19 CYS C 1 1 4 1079 1 1 19 CYS CA C 15.488 -2.782 5.291 1.00 . A A . 19 CYS CA 1 1 4 1080 1 1 19 CYS CB C 16.085 -1.549 5.982 1.00 . A A . 19 CYS CB 1 1 4 1081 1 1 19 CYS H H 13.428 -3.281 5.276 1.00 . A A . 19 CYS H 1 1 4 1082 1 1 19 CYS HA H 15.360 -2.565 4.243 1.00 . A A . 19 CYS HA 1 1 4 1083 1 1 19 CYS HB2 H 15.404 -0.721 5.895 1.00 . A A . 19 CYS HB2 1 1 4 1084 1 1 19 CYS HB3 H 16.246 -1.766 7.027 1.00 . A A . 19 CYS HB3 1 1 4 1085 1 1 19 CYS N N 14.187 -3.109 5.870 1.00 . A A . 19 CYS N 1 1 4 1086 1 1 19 CYS O O 17.537 -3.828 5.980 1.00 . A A . 19 CYS O 1 1 4 1087 1 1 19 CYS SG S 17.670 -1.124 5.210 1.00 . A A . 19 CYS SG 1 1 4 1088 1 1 20 VAL C C 18.121 -6.131 4.205 1.00 . A A . 20 VAL C 1 1 4 1089 1 1 20 VAL CA C 16.843 -6.317 5.015 1.00 . A A . 20 VAL CA 1 1 4 1090 1 1 20 VAL CB C 16.064 -7.516 4.475 1.00 . A A . 20 VAL CB 1 1 4 1091 1 1 20 VAL CG1 C 16.797 -8.809 4.839 1.00 . A A . 20 VAL CG1 1 1 4 1092 1 1 20 VAL CG2 C 14.663 -7.530 5.091 1.00 . A A . 20 VAL CG2 1 1 4 1093 1 1 20 VAL H H 15.136 -5.167 4.513 1.00 . A A . 20 VAL H 1 1 4 1094 1 1 20 VAL HA H 17.100 -6.502 6.046 1.00 . A A . 20 VAL HA 1 1 4 1095 1 1 20 VAL HB H 15.986 -7.439 3.401 1.00 . A A . 20 VAL HB 1 1 4 1096 1 1 20 VAL HG11 H 17.014 -9.366 3.939 1.00 . A A . 20 VAL HG11 1 1 4 1097 1 1 20 VAL HG12 H 16.174 -9.405 5.490 1.00 . A A . 20 VAL HG12 1 1 4 1098 1 1 20 VAL HG13 H 17.721 -8.569 5.345 1.00 . A A . 20 VAL HG13 1 1 4 1099 1 1 20 VAL HG21 H 14.196 -8.485 4.903 1.00 . A A . 20 VAL HG21 1 1 4 1100 1 1 20 VAL HG22 H 14.068 -6.744 4.651 1.00 . A A . 20 VAL HG22 1 1 4 1101 1 1 20 VAL HG23 H 14.739 -7.370 6.158 1.00 . A A . 20 VAL HG23 1 1 4 1102 1 1 20 VAL N N 16.018 -5.120 4.938 1.00 . A A . 20 VAL N 1 1 4 1103 1 1 20 VAL O O 19.212 -6.481 4.659 1.00 . A A . 20 VAL O 1 1 4 1104 1 1 21 ARG C C 20.134 -4.420 2.816 1.00 . A A . 21 ARG C 1 1 4 1105 1 1 21 ARG CA C 19.130 -5.346 2.139 1.00 . A A . 21 ARG CA 1 1 4 1106 1 1 21 ARG CB C 18.675 -4.728 0.814 1.00 . A A . 21 ARG CB 1 1 4 1107 1 1 21 ARG CD C 19.432 -3.939 -1.434 1.00 . A A . 21 ARG CD 1 1 4 1108 1 1 21 ARG CG C 19.879 -4.575 -0.117 1.00 . A A . 21 ARG CG 1 1 4 1109 1 1 21 ARG CZ C 21.385 -2.894 -2.430 1.00 . A A . 21 ARG CZ 1 1 4 1110 1 1 21 ARG H H 17.086 -5.318 2.698 1.00 . A A . 21 ARG H 1 1 4 1111 1 1 21 ARG HA H 19.609 -6.291 1.935 1.00 . A A . 21 ARG HA 1 1 4 1112 1 1 21 ARG HB2 H 17.940 -5.371 0.351 1.00 . A A . 21 ARG HB2 1 1 4 1113 1 1 21 ARG HB3 H 18.238 -3.758 0.999 1.00 . A A . 21 ARG HB3 1 1 4 1114 1 1 21 ARG HD2 H 18.618 -4.513 -1.849 1.00 . A A . 21 ARG HD2 1 1 4 1115 1 1 21 ARG HD3 H 19.098 -2.929 -1.247 1.00 . A A . 21 ARG HD3 1 1 4 1116 1 1 21 ARG HE H 20.657 -4.670 -3.001 1.00 . A A . 21 ARG HE 1 1 4 1117 1 1 21 ARG HG2 H 20.619 -3.944 0.355 1.00 . A A . 21 ARG HG2 1 1 4 1118 1 1 21 ARG HG3 H 20.307 -5.546 -0.314 1.00 . A A . 21 ARG HG3 1 1 4 1119 1 1 21 ARG HH11 H 20.484 -1.882 -0.958 1.00 . A A . 21 ARG HH11 1 1 4 1120 1 1 21 ARG HH12 H 21.875 -1.118 -1.651 1.00 . A A . 21 ARG HH12 1 1 4 1121 1 1 21 ARG HH21 H 22.482 -3.673 -3.914 1.00 . A A . 21 ARG HH21 1 1 4 1122 1 1 21 ARG HH22 H 23.006 -2.130 -3.323 1.00 . A A . 21 ARG HH22 1 1 4 1123 1 1 21 ARG N N 17.979 -5.577 3.005 1.00 . A A . 21 ARG N 1 1 4 1124 1 1 21 ARG NE N 20.537 -3.917 -2.385 1.00 . A A . 21 ARG NE 1 1 4 1125 1 1 21 ARG NH1 N 21.236 -1.886 -1.616 1.00 . A A . 21 ARG NH1 1 1 4 1126 1 1 21 ARG NH2 N 22.368 -2.900 -3.289 1.00 . A A . 21 ARG NH2 1 1 4 1127 1 1 21 ARG O O 21.135 -4.919 3.306 1.00 . A A . 21 ARG O 1 1 4 1128 1 1 21 ARG OXT O 19.889 -3.224 2.836 1.00 . A A . 21 ARG OXT 1 1 5 1129 1 1 1 ALA C C 9.179 1.882 -6.169 1.00 . A A . 1 ALA C 1 1 5 1130 1 1 1 ALA CA C 8.594 0.707 -6.945 1.00 . A A . 1 ALA CA 1 1 5 1131 1 1 1 ALA CB C 8.542 -0.534 -6.049 1.00 . A A . 1 ALA CB 1 1 5 1132 1 1 1 ALA H1 H 8.844 0.182 -8.944 1.00 . A A . 1 ALA H1 1 1 5 1133 1 1 1 ALA H2 H 10.082 -0.374 -7.921 1.00 . A A . 1 ALA H2 1 1 5 1134 1 1 1 ALA H3 H 10.014 1.265 -8.362 1.00 . A A . 1 ALA H3 1 1 5 1135 1 1 1 ALA HA H 7.596 0.955 -7.272 1.00 . A A . 1 ALA HA 1 1 5 1136 1 1 1 ALA HB1 H 9.383 -1.174 -6.272 1.00 . A A . 1 ALA HB1 1 1 5 1137 1 1 1 ALA HB2 H 7.623 -1.071 -6.233 1.00 . A A . 1 ALA HB2 1 1 5 1138 1 1 1 ALA HB3 H 8.582 -0.233 -5.013 1.00 . A A . 1 ALA HB3 1 1 5 1139 1 1 1 ALA N N 9.448 0.424 -8.133 1.00 . A A . 1 ALA N 1 1 5 1140 1 1 1 ALA O O 8.455 2.797 -5.771 1.00 . A A . 1 ALA O 1 1 5 1141 1 1 2 GLY C C 12.293 3.520 -6.065 1.00 . A A . 2 GLY C 1 1 5 1142 1 1 2 GLY CA C 11.163 2.923 -5.232 1.00 . A A . 2 GLY CA 1 1 5 1143 1 1 2 GLY H H 11.016 1.099 -6.301 1.00 . A A . 2 GLY H 1 1 5 1144 1 1 2 GLY HA2 H 10.446 3.697 -4.997 1.00 . A A . 2 GLY HA2 1 1 5 1145 1 1 2 GLY HA3 H 11.573 2.527 -4.315 1.00 . A A . 2 GLY HA3 1 1 5 1146 1 1 2 GLY N N 10.491 1.853 -5.961 1.00 . A A . 2 GLY N 1 1 5 1147 1 1 2 GLY O O 13.126 2.795 -6.609 1.00 . A A . 2 GLY O 1 1 5 1148 1 1 3 GLY C C 14.562 5.840 -6.069 1.00 . A A . 3 GLY C 1 1 5 1149 1 1 3 GLY CA C 13.343 5.532 -6.933 1.00 . A A . 3 GLY CA 1 1 5 1150 1 1 3 GLY H H 11.622 5.373 -5.706 1.00 . A A . 3 GLY H 1 1 5 1151 1 1 3 GLY HA2 H 13.644 4.904 -7.758 1.00 . A A . 3 GLY HA2 1 1 5 1152 1 1 3 GLY HA3 H 12.942 6.458 -7.317 1.00 . A A . 3 GLY HA3 1 1 5 1153 1 1 3 GLY N N 12.312 4.847 -6.160 1.00 . A A . 3 GLY N 1 1 5 1154 1 1 3 GLY O O 15.591 6.292 -6.572 1.00 . A A . 3 GLY O 1 1 5 1155 1 1 4 . C C 15.017 6.652 -2.695 1.00 . A A . 4 DBU C 1 1 5 1156 1 1 4 . CA C 15.496 5.846 -3.872 1.00 . A A . 4 DBU CA 1 1 5 1157 1 1 4 . CB C 16.845 5.472 -3.921 1.00 . A A . 4 DBU CB 1 1 5 1158 1 1 4 . CG C 17.459 4.665 -5.039 1.00 . A A . 4 DBU CG 1 1 5 1159 1 1 4 . H H 13.597 5.240 -4.414 1.00 . A A . 4 DBU H 1 1 5 1160 1 1 4 . HB H 17.488 5.777 -3.107 1.00 . A A . 4 DBU HB 1 1 5 1161 1 1 4 . HG1 H 17.884 5.331 -5.775 1.00 . A A . 4 DBU HG1 1 1 5 1162 1 1 4 . HG2 H 16.695 4.057 -5.501 1.00 . A A . 4 DBU HG2 1 1 5 1163 1 1 4 . HG3 H 18.234 4.027 -4.640 1.00 . A A . 4 DBU HG3 1 1 5 1164 1 1 4 . N N 14.437 5.598 -4.770 1.00 . A A . 4 DBU N 1 1 5 1165 1 1 4 . O O 15.095 7.878 -2.715 1.00 . A A . 4 DBU O 1 1 5 1166 1 1 5 ILE C C 12.951 5.792 0.215 1.00 . A A . 5 ILE C 1 1 5 1167 1 1 5 ILE CA C 14.046 6.617 -0.455 1.00 . A A . 5 ILE CA 1 1 5 1168 1 1 5 ILE CB C 13.513 8.014 -0.780 1.00 . A A . 5 ILE CB 1 1 5 1169 1 1 5 ILE CD1 C 14.709 9.497 0.876 1.00 . A A . 5 ILE CD1 1 1 5 1170 1 1 5 ILE CG1 C 14.640 9.042 -0.589 1.00 . A A . 5 ILE CG1 1 1 5 1171 1 1 5 ILE CG2 C 12.343 8.356 0.154 1.00 . A A . 5 ILE CG2 1 1 5 1172 1 1 5 ILE H H 14.507 4.979 -1.719 1.00 . A A . 5 ILE H 1 1 5 1173 1 1 5 ILE HA H 14.867 6.717 0.226 1.00 . A A . 5 ILE HA 1 1 5 1174 1 1 5 ILE HB H 13.175 8.034 -1.806 1.00 . A A . 5 ILE HB 1 1 5 1175 1 1 5 ILE HD11 H 14.006 10.301 1.037 1.00 . A A . 5 ILE HD11 1 1 5 1176 1 1 5 ILE HD12 H 15.708 9.840 1.099 1.00 . A A . 5 ILE HD12 1 1 5 1177 1 1 5 ILE HD13 H 14.461 8.667 1.522 1.00 . A A . 5 ILE HD13 1 1 5 1178 1 1 5 ILE HG12 H 15.581 8.594 -0.868 1.00 . A A . 5 ILE HG12 1 1 5 1179 1 1 5 ILE HG13 H 14.448 9.894 -1.221 1.00 . A A . 5 ILE HG13 1 1 5 1180 1 1 5 ILE HG21 H 12.117 9.410 0.079 1.00 . A A . 5 ILE HG21 1 1 5 1181 1 1 5 ILE HG22 H 12.621 8.119 1.173 1.00 . A A . 5 ILE HG22 1 1 5 1182 1 1 5 ILE HG23 H 11.475 7.779 -0.127 1.00 . A A . 5 ILE HG23 1 1 5 1183 1 1 5 ILE N N 14.531 5.957 -1.667 1.00 . A A . 5 ILE N 1 1 5 1184 1 1 5 ILE O O 12.938 5.630 1.436 1.00 . A A . 5 ILE O 1 1 5 1185 1 1 6 PRO C C 11.385 3.181 0.587 1.00 . A A . 6 PRO C 1 1 5 1186 1 1 6 PRO CA C 10.896 4.477 -0.034 1.00 . A A . 6 PRO CA 1 1 5 1187 1 1 6 PRO CB C 10.027 4.197 -1.269 1.00 . A A . 6 PRO CB 1 1 5 1188 1 1 6 PRO CD C 11.973 5.422 -2.011 1.00 . A A . 6 PRO CD 1 1 5 1189 1 1 6 PRO CG C 10.512 5.132 -2.327 1.00 . A A . 6 PRO CG 1 1 5 1190 1 1 6 PRO HA H 10.330 5.045 0.686 1.00 . A A . 6 PRO HA 1 1 5 1191 1 1 6 PRO HB2 H 10.152 3.172 -1.586 1.00 . A A . 6 PRO HB2 1 1 5 1192 1 1 6 PRO HB3 H 8.991 4.397 -1.046 1.00 . A A . 6 PRO HB3 1 1 5 1193 1 1 6 PRO HD2 H 12.621 4.703 -2.489 1.00 . A A . 6 PRO HD2 1 1 5 1194 1 1 6 PRO HD3 H 12.234 6.418 -2.302 1.00 . A A . 6 PRO HD3 1 1 5 1195 1 1 6 PRO HG2 H 10.423 4.668 -3.301 1.00 . A A . 6 PRO HG2 1 1 5 1196 1 1 6 PRO HG3 H 9.947 6.050 -2.297 1.00 . A A . 6 PRO HG3 1 1 5 1197 1 1 6 PRO N N 12.031 5.286 -0.556 1.00 . A A . 6 PRO N 1 1 5 1198 1 1 6 PRO O O 10.591 2.367 1.043 1.00 . A A . 6 PRO O 1 1 5 1199 1 1 7 DAL C C 14.728 1.622 0.625 1.00 . A A . 7 DAL C 1 1 5 1200 1 1 7 DAL CA C 13.312 1.812 1.157 1.00 . A A . 7 DAL CA 1 1 5 1201 1 1 7 DAL CB C 13.386 1.926 2.676 1.00 . A A . 7 DAL CB 1 1 5 1202 1 1 7 DAL H H 13.272 3.706 0.214 1.00 . A A . 7 DAL H 1 1 5 1203 1 1 7 DAL HA H 12.717 0.957 0.901 1.00 . A A . 7 DAL HA 1 1 5 1204 1 1 7 DAL HB1 H 14.419 2.000 2.967 1.00 . A A . 7 DAL HB1 1 1 5 1205 1 1 7 DAL HB2 H 12.946 1.048 3.126 1.00 . A A . 7 DAL HB2 1 1 5 1206 1 1 7 DAL N N 12.701 3.010 0.594 1.00 . A A . 7 DAL N 1 1 5 1207 1 1 7 DAL O O 15.478 0.776 1.106 1.00 . A A . 7 DAL O 1 1 5 1208 1 1 8 LEU C C 17.443 2.723 0.188 1.00 . A A . 8 LEU C 1 1 5 1209 1 1 8 LEU CA C 16.444 2.351 -0.899 1.00 . A A . 8 LEU CA 1 1 5 1210 1 1 8 LEU CB C 16.569 3.315 -2.077 1.00 . A A . 8 LEU CB 1 1 5 1211 1 1 8 LEU CD1 C 16.918 1.777 -4.012 1.00 . A A . 8 LEU CD1 1 1 5 1212 1 1 8 LEU CD2 C 14.666 1.907 -2.933 1.00 . A A . 8 LEU CD2 1 1 5 1213 1 1 8 LEU CG C 15.919 2.702 -3.324 1.00 . A A . 8 LEU CG 1 1 5 1214 1 1 8 LEU H H 14.482 3.100 -0.693 1.00 . A A . 8 LEU H 1 1 5 1215 1 1 8 LEU HA H 16.641 1.340 -1.236 1.00 . A A . 8 LEU HA 1 1 5 1216 1 1 8 LEU HB2 H 16.075 4.244 -1.833 1.00 . A A . 8 LEU HB2 1 1 5 1217 1 1 8 LEU HB3 H 17.612 3.505 -2.275 1.00 . A A . 8 LEU HB3 1 1 5 1218 1 1 8 LEU HD11 H 16.393 0.932 -4.432 1.00 . A A . 8 LEU HD11 1 1 5 1219 1 1 8 LEU HD12 H 17.643 1.431 -3.292 1.00 . A A . 8 LEU HD12 1 1 5 1220 1 1 8 LEU HD13 H 17.420 2.318 -4.800 1.00 . A A . 8 LEU HD13 1 1 5 1221 1 1 8 LEU HD21 H 14.253 1.432 -3.809 1.00 . A A . 8 LEU HD21 1 1 5 1222 1 1 8 LEU HD22 H 13.934 2.577 -2.507 1.00 . A A . 8 LEU HD22 1 1 5 1223 1 1 8 LEU HD23 H 14.929 1.154 -2.204 1.00 . A A . 8 LEU HD23 1 1 5 1224 1 1 8 LEU HG H 15.640 3.490 -4.002 1.00 . A A . 8 LEU HG 1 1 5 1225 1 1 8 LEU N N 15.104 2.428 -0.349 1.00 . A A . 8 LEU N 1 1 5 1226 1 1 8 LEU O O 18.530 2.152 0.284 1.00 . A A . 8 LEU O 1 1 5 1227 1 1 9 MET C C 18.142 3.064 3.103 1.00 . A A . 9 MET C 1 1 5 1228 1 1 9 MET CA C 17.895 4.180 2.090 1.00 . A A . 9 MET CA 1 1 5 1229 1 1 9 MET CB C 17.186 5.337 2.787 1.00 . A A . 9 MET CB 1 1 5 1230 1 1 9 MET CE C 18.688 8.022 0.973 1.00 . A A . 9 MET CE 1 1 5 1231 1 1 9 MET CG C 16.707 6.336 1.744 1.00 . A A . 9 MET CG 1 1 5 1232 1 1 9 MET H H 16.176 4.113 0.861 1.00 . A A . 9 MET H 1 1 5 1233 1 1 9 MET HA H 18.837 4.524 1.694 1.00 . A A . 9 MET HA 1 1 5 1234 1 1 9 MET HB2 H 16.340 4.960 3.335 1.00 . A A . 9 MET HB2 1 1 5 1235 1 1 9 MET HB3 H 17.864 5.830 3.463 1.00 . A A . 9 MET HB3 1 1 5 1236 1 1 9 MET HE1 H 18.394 8.586 0.100 1.00 . A A . 9 MET HE1 1 1 5 1237 1 1 9 MET HE2 H 18.937 7.014 0.682 1.00 . A A . 9 MET HE2 1 1 5 1238 1 1 9 MET HE3 H 19.550 8.485 1.434 1.00 . A A . 9 MET HE3 1 1 5 1239 1 1 9 MET HG2 H 17.068 6.046 0.766 1.00 . A A . 9 MET HG2 1 1 5 1240 1 1 9 MET HG3 H 15.630 6.340 1.744 1.00 . A A . 9 MET HG3 1 1 5 1241 1 1 9 MET N N 17.053 3.700 1.001 1.00 . A A . 9 MET N 1 1 5 1242 1 1 9 MET O O 19.258 2.896 3.596 1.00 . A A . 9 MET O 1 1 5 1243 1 1 9 MET SD S 17.319 7.988 2.156 1.00 . A A . 9 MET SD 1 1 5 1244 1 1 10 . C C 16.338 1.412 5.575 1.00 . A A . 10 DBB C 1 1 5 1245 1 1 10 . CA C 17.215 1.195 4.354 1.00 . A A . 10 DBB CA 1 1 5 1246 1 1 10 . CB C 16.828 -0.119 3.674 1.00 . A A . 10 DBB CB 1 1 5 1247 1 1 10 . CG C 15.304 -0.295 3.702 1.00 . A A . 10 DBB CG 1 1 5 1248 1 1 10 . H H 16.230 2.474 2.977 1.00 . A A . 10 DBB H 1 1 5 1249 1 1 10 . HA H 18.243 1.125 4.674 1.00 . A A . 10 DBB HA 1 1 5 1250 1 1 10 . HB2 H 17.127 -0.068 2.646 1.00 . A A . 10 DBB HB2 1 1 5 1251 1 1 10 . HG1 H 14.900 0.102 4.618 1.00 . A A . 10 DBB HG1 1 1 5 1252 1 1 10 . HG2 H 15.064 -1.343 3.633 1.00 . A A . 10 DBB HG2 1 1 5 1253 1 1 10 . HG3 H 14.869 0.220 2.866 1.00 . A A . 10 DBB HG3 1 1 5 1254 1 1 10 . N N 17.094 2.298 3.405 1.00 . A A . 10 DBB N 1 1 5 1255 1 1 10 . O O 16.669 0.973 6.676 1.00 . A A . 10 DBB O 1 1 5 1256 1 1 11 GLY C C 12.936 2.771 5.952 1.00 . A A . 11 GLY C 1 1 5 1257 1 1 11 GLY CA C 14.305 2.333 6.465 1.00 . A A . 11 GLY CA 1 1 5 1258 1 1 11 GLY H H 15.000 2.405 4.480 1.00 . A A . 11 GLY H 1 1 5 1259 1 1 11 GLY HA2 H 14.195 1.431 7.049 1.00 . A A . 11 GLY HA2 1 1 5 1260 1 1 11 GLY HA3 H 14.721 3.103 7.077 1.00 . A A . 11 GLY HA3 1 1 5 1261 1 1 11 GLY N N 15.217 2.081 5.374 1.00 . A A . 11 GLY N 1 1 5 1262 1 1 11 GLY O O 12.602 3.956 5.978 1.00 . A A . 11 GLY O 1 1 5 1263 1 1 12 CYS C C 9.935 0.859 4.972 1.00 . A A . 12 CYS C 1 1 5 1264 1 1 12 CYS CA C 10.819 2.100 4.960 1.00 . A A . 12 CYS CA 1 1 5 1265 1 1 12 CYS CB C 10.917 2.582 3.517 1.00 . A A . 12 CYS CB 1 1 5 1266 1 1 12 CYS H H 12.472 0.881 5.484 1.00 . A A . 12 CYS H 1 1 5 1267 1 1 12 CYS HA H 10.362 2.873 5.557 1.00 . A A . 12 CYS HA 1 1 5 1268 1 1 12 CYS HB2 H 10.840 1.728 2.865 1.00 . A A . 12 CYS HB2 1 1 5 1269 1 1 12 CYS HB3 H 10.112 3.268 3.304 1.00 . A A . 12 CYS HB3 1 1 5 1270 1 1 12 CYS N N 12.150 1.805 5.482 1.00 . A A . 12 CYS N 1 1 5 1271 1 1 12 CYS O O 10.100 -0.038 5.799 1.00 . A A . 12 CYS O 1 1 5 1272 1 1 12 CYS SG S 12.503 3.400 3.237 1.00 . A A . 12 CYS SG 1 1 5 1273 1 1 13 GLY C C 7.988 -0.700 2.415 1.00 . A A . 13 GLY C 1 1 5 1274 1 1 13 GLY CA C 8.090 -0.303 3.878 1.00 . A A . 13 GLY CA 1 1 5 1275 1 1 13 GLY H H 8.947 1.569 3.389 1.00 . A A . 13 GLY H 1 1 5 1276 1 1 13 GLY HA2 H 8.448 -1.139 4.458 1.00 . A A . 13 GLY HA2 1 1 5 1277 1 1 13 GLY HA3 H 7.115 -0.016 4.226 1.00 . A A . 13 GLY HA3 1 1 5 1278 1 1 13 GLY N N 9.008 0.821 4.022 1.00 . A A . 13 GLY N 1 1 5 1279 1 1 13 GLY O O 7.042 -1.371 2.002 1.00 . A A . 13 GLY O 1 1 5 1280 1 1 14 TRP C C 8.695 -2.010 -0.078 1.00 . A A . 14 TRP C 1 1 5 1281 1 1 14 TRP CA C 8.985 -0.535 0.210 1.00 . A A . 14 TRP CA 1 1 5 1282 1 1 14 TRP CB C 10.343 -0.130 -0.379 1.00 . A A . 14 TRP CB 1 1 5 1283 1 1 14 TRP CD1 C 11.374 -1.459 1.514 1.00 . A A . 14 TRP CD1 1 1 5 1284 1 1 14 TRP CD2 C 12.813 -1.089 -0.173 1.00 . A A . 14 TRP CD2 1 1 5 1285 1 1 14 TRP CE2 C 13.517 -1.832 0.802 1.00 . A A . 14 TRP CE2 1 1 5 1286 1 1 14 TRP CE3 C 13.493 -0.723 -1.349 1.00 . A A . 14 TRP CE3 1 1 5 1287 1 1 14 TRP CG C 11.456 -0.862 0.306 1.00 . A A . 14 TRP CG 1 1 5 1288 1 1 14 TRP CH2 C 15.512 -1.829 -0.556 1.00 . A A . 14 TRP CH2 1 1 5 1289 1 1 14 TRP CZ2 C 14.851 -2.201 0.617 1.00 . A A . 14 TRP CZ2 1 1 5 1290 1 1 14 TRP CZ3 C 14.836 -1.090 -1.537 1.00 . A A . 14 TRP CZ3 1 1 5 1291 1 1 14 TRP H H 9.679 0.288 2.028 1.00 . A A . 14 TRP H 1 1 5 1292 1 1 14 TRP HA H 8.219 0.060 -0.264 1.00 . A A . 14 TRP HA 1 1 5 1293 1 1 14 TRP HB2 H 10.358 -0.363 -1.425 1.00 . A A . 14 TRP HB2 1 1 5 1294 1 1 14 TRP HB3 H 10.483 0.929 -0.258 1.00 . A A . 14 TRP HB3 1 1 5 1295 1 1 14 TRP HD1 H 10.500 -1.484 2.143 1.00 . A A . 14 TRP HD1 1 1 5 1296 1 1 14 TRP HE1 H 12.805 -2.526 2.633 1.00 . A A . 14 TRP HE1 1 1 5 1297 1 1 14 TRP HE3 H 12.981 -0.156 -2.111 1.00 . A A . 14 TRP HE3 1 1 5 1298 1 1 14 TRP HH2 H 16.544 -2.109 -0.707 1.00 . A A . 14 TRP HH2 1 1 5 1299 1 1 14 TRP HZ2 H 15.368 -2.769 1.377 1.00 . A A . 14 TRP HZ2 1 1 5 1300 1 1 14 TRP HZ3 H 15.348 -0.805 -2.443 1.00 . A A . 14 TRP HZ3 1 1 5 1301 1 1 14 TRP N N 8.965 -0.255 1.636 1.00 . A A . 14 TRP N 1 1 5 1302 1 1 14 TRP NE1 N 12.597 -2.034 1.813 1.00 . A A . 14 TRP NE1 1 1 5 1303 1 1 14 TRP O O 7.588 -2.491 0.158 1.00 . A A . 14 TRP O 1 1 5 1304 1 1 15 LEU C C 10.084 -5.005 0.155 1.00 . A A . 15 LEU C 1 1 5 1305 1 1 15 LEU CA C 9.536 -4.115 -0.959 1.00 . A A . 15 LEU CA 1 1 5 1306 1 1 15 LEU CB C 10.290 -4.392 -2.264 1.00 . A A . 15 LEU CB 1 1 5 1307 1 1 15 LEU CD1 C 12.469 -3.925 -3.410 1.00 . A A . 15 LEU CD1 1 1 5 1308 1 1 15 LEU CD2 C 10.911 -2.031 -2.909 1.00 . A A . 15 LEU CD2 1 1 5 1309 1 1 15 LEU CG C 11.444 -3.387 -2.413 1.00 . A A . 15 LEU CG 1 1 5 1310 1 1 15 LEU H H 10.534 -2.273 -0.795 1.00 . A A . 15 LEU H 1 1 5 1311 1 1 15 LEU HA H 8.489 -4.335 -1.105 1.00 . A A . 15 LEU HA 1 1 5 1312 1 1 15 LEU HB2 H 10.685 -5.398 -2.244 1.00 . A A . 15 LEU HB2 1 1 5 1313 1 1 15 LEU HB3 H 9.615 -4.289 -3.100 1.00 . A A . 15 LEU HB3 1 1 5 1314 1 1 15 LEU HD11 H 13.395 -4.133 -2.895 1.00 . A A . 15 LEU HD11 1 1 5 1315 1 1 15 LEU HD12 H 12.642 -3.188 -4.181 1.00 . A A . 15 LEU HD12 1 1 5 1316 1 1 15 LEU HD13 H 12.094 -4.834 -3.859 1.00 . A A . 15 LEU HD13 1 1 5 1317 1 1 15 LEU HD21 H 11.547 -1.235 -2.538 1.00 . A A . 15 LEU HD21 1 1 5 1318 1 1 15 LEU HD22 H 9.903 -1.879 -2.547 1.00 . A A . 15 LEU HD22 1 1 5 1319 1 1 15 LEU HD23 H 10.911 -2.013 -3.988 1.00 . A A . 15 LEU HD23 1 1 5 1320 1 1 15 LEU HG H 11.922 -3.254 -1.454 1.00 . A A . 15 LEU HG 1 1 5 1321 1 1 15 LEU N N 9.687 -2.711 -0.612 1.00 . A A . 15 LEU N 1 1 5 1322 1 1 15 LEU O O 9.652 -6.147 0.320 1.00 . A A . 15 LEU O 1 1 5 1323 1 1 16 . C C 10.834 -4.964 3.241 1.00 . A A . 16 DBU C 1 1 5 1324 1 1 16 . CA C 11.642 -5.164 1.984 1.00 . A A . 16 DBU CA 1 1 5 1325 1 1 16 . CB C 12.809 -5.938 1.990 1.00 . A A . 16 DBU CB 1 1 5 1326 1 1 16 . CG C 13.681 -6.192 0.784 1.00 . A A . 16 DBU CG 1 1 5 1327 1 1 16 . H H 11.345 -3.560 0.747 1.00 . A A . 16 DBU H 1 1 5 1328 1 1 16 . HB H 13.125 -6.396 2.916 1.00 . A A . 16 DBU HB 1 1 5 1329 1 1 16 . HG1 H 13.810 -5.268 0.239 1.00 . A A . 16 DBU HG1 1 1 5 1330 1 1 16 . HG2 H 13.213 -6.926 0.145 1.00 . A A . 16 DBU HG2 1 1 5 1331 1 1 16 . HG3 H 14.645 -6.556 1.108 1.00 . A A . 16 DBU HG3 1 1 5 1332 1 1 16 . N N 11.036 -4.473 0.916 1.00 . A A . 16 DBU N 1 1 5 1333 1 1 16 . O O 10.140 -5.857 3.728 1.00 . A A . 16 DBU O 1 1 5 1334 1 1 17 GLY C C 11.162 -2.989 6.102 1.00 . A A . 17 GLY C 1 1 5 1335 1 1 17 GLY CA C 10.203 -3.403 4.990 1.00 . A A . 17 GLY CA 1 1 5 1336 1 1 17 GLY H H 11.495 -3.079 3.345 1.00 . A A . 17 GLY H 1 1 5 1337 1 1 17 GLY HA2 H 9.532 -2.585 4.777 1.00 . A A . 17 GLY HA2 1 1 5 1338 1 1 17 GLY HA3 H 9.629 -4.256 5.319 1.00 . A A . 17 GLY HA3 1 1 5 1339 1 1 17 GLY N N 10.929 -3.750 3.776 1.00 . A A . 17 GLY N 1 1 5 1340 1 1 17 GLY O O 11.126 -1.855 6.577 1.00 . A A . 17 GLY O 1 1 5 1341 1 1 18 LEU C C 14.365 -3.378 6.996 1.00 . A A . 18 LEU C 1 1 5 1342 1 1 18 LEU CA C 12.978 -3.642 7.575 1.00 . A A . 18 LEU CA 1 1 5 1343 1 1 18 LEU CB C 13.040 -4.825 8.541 1.00 . A A . 18 LEU CB 1 1 5 1344 1 1 18 LEU CD1 C 11.698 -6.243 10.101 1.00 . A A . 18 LEU CD1 1 1 5 1345 1 1 18 LEU CD2 C 11.476 -3.754 10.161 1.00 . A A . 18 LEU CD2 1 1 5 1346 1 1 18 LEU CG C 11.697 -4.968 9.256 1.00 . A A . 18 LEU CG 1 1 5 1347 1 1 18 LEU H H 11.996 -4.807 6.100 1.00 . A A . 18 LEU H 1 1 5 1348 1 1 18 LEU HA H 12.655 -2.768 8.120 1.00 . A A . 18 LEU HA 1 1 5 1349 1 1 18 LEU HB2 H 13.253 -5.730 7.988 1.00 . A A . 18 LEU HB2 1 1 5 1350 1 1 18 LEU HB3 H 13.819 -4.656 9.270 1.00 . A A . 18 LEU HB3 1 1 5 1351 1 1 18 LEU HD11 H 11.602 -7.103 9.454 1.00 . A A . 18 LEU HD11 1 1 5 1352 1 1 18 LEU HD12 H 10.869 -6.217 10.793 1.00 . A A . 18 LEU HD12 1 1 5 1353 1 1 18 LEU HD13 H 12.624 -6.308 10.651 1.00 . A A . 18 LEU HD13 1 1 5 1354 1 1 18 LEU HD21 H 11.072 -4.081 11.108 1.00 . A A . 18 LEU HD21 1 1 5 1355 1 1 18 LEU HD22 H 10.784 -3.073 9.688 1.00 . A A . 18 LEU HD22 1 1 5 1356 1 1 18 LEU HD23 H 12.419 -3.254 10.327 1.00 . A A . 18 LEU HD23 1 1 5 1357 1 1 18 LEU HG H 10.904 -5.022 8.524 1.00 . A A . 18 LEU HG 1 1 5 1358 1 1 18 LEU N N 12.014 -3.919 6.514 1.00 . A A . 18 LEU N 1 1 5 1359 1 1 18 LEU O O 15.314 -3.108 7.733 1.00 . A A . 18 LEU O 1 1 5 1360 1 1 19 CYS C C 16.655 -4.445 5.135 1.00 . A A . 19 CYS C 1 1 5 1361 1 1 19 CYS CA C 15.749 -3.227 5.007 1.00 . A A . 19 CYS CA 1 1 5 1362 1 1 19 CYS CB C 16.447 -2.003 5.603 1.00 . A A . 19 CYS CB 1 1 5 1363 1 1 19 CYS H H 13.685 -3.676 5.139 1.00 . A A . 19 CYS H 1 1 5 1364 1 1 19 CYS HA H 15.565 -3.047 3.959 1.00 . A A . 19 CYS HA 1 1 5 1365 1 1 19 CYS HB2 H 15.731 -1.211 5.748 1.00 . A A . 19 CYS HB2 1 1 5 1366 1 1 19 CYS HB3 H 16.886 -2.265 6.555 1.00 . A A . 19 CYS HB3 1 1 5 1367 1 1 19 CYS N N 14.475 -3.458 5.675 1.00 . A A . 19 CYS N 1 1 5 1368 1 1 19 CYS O O 17.439 -4.554 6.078 1.00 . A A . 19 CYS O 1 1 5 1369 1 1 19 CYS SG S 17.750 -1.456 4.471 1.00 . A A . 19 CYS SG 1 1 5 1370 1 1 20 VAL C C 18.454 -6.467 3.133 1.00 . A A . 20 VAL C 1 1 5 1371 1 1 20 VAL CA C 17.352 -6.564 4.183 1.00 . A A . 20 VAL CA 1 1 5 1372 1 1 20 VAL CB C 16.471 -7.778 3.890 1.00 . A A . 20 VAL CB 1 1 5 1373 1 1 20 VAL CG1 C 17.066 -9.018 4.561 1.00 . A A . 20 VAL CG1 1 1 5 1374 1 1 20 VAL CG2 C 15.065 -7.526 4.440 1.00 . A A . 20 VAL CG2 1 1 5 1375 1 1 20 VAL H H 15.898 -5.211 3.452 1.00 . A A . 20 VAL H 1 1 5 1376 1 1 20 VAL HA H 17.801 -6.684 5.157 1.00 . A A . 20 VAL HA 1 1 5 1377 1 1 20 VAL HB H 16.419 -7.936 2.822 1.00 . A A . 20 VAL HB 1 1 5 1378 1 1 20 VAL HG11 H 18.056 -8.789 4.928 1.00 . A A . 20 VAL HG11 1 1 5 1379 1 1 20 VAL HG12 H 17.126 -9.822 3.841 1.00 . A A . 20 VAL HG12 1 1 5 1380 1 1 20 VAL HG13 H 16.437 -9.320 5.385 1.00 . A A . 20 VAL HG13 1 1 5 1381 1 1 20 VAL HG21 H 14.689 -6.592 4.048 1.00 . A A . 20 VAL HG21 1 1 5 1382 1 1 20 VAL HG22 H 15.105 -7.472 5.518 1.00 . A A . 20 VAL HG22 1 1 5 1383 1 1 20 VAL HG23 H 14.412 -8.331 4.143 1.00 . A A . 20 VAL HG23 1 1 5 1384 1 1 20 VAL N N 16.539 -5.355 4.178 1.00 . A A . 20 VAL N 1 1 5 1385 1 1 20 VAL O O 19.407 -7.245 3.147 1.00 . A A . 20 VAL O 1 1 5 1386 1 1 21 ARG C C 20.702 -5.191 1.757 1.00 . A A . 21 ARG C 1 1 5 1387 1 1 21 ARG CA C 19.303 -5.324 1.164 1.00 . A A . 21 ARG CA 1 1 5 1388 1 1 21 ARG CB C 18.977 -4.078 0.337 1.00 . A A . 21 ARG CB 1 1 5 1389 1 1 21 ARG CD C 19.690 -2.704 -1.628 1.00 . A A . 21 ARG CD 1 1 5 1390 1 1 21 ARG CG C 19.960 -3.980 -0.832 1.00 . A A . 21 ARG CG 1 1 5 1391 1 1 21 ARG CZ C 19.854 -0.303 -1.305 1.00 . A A . 21 ARG CZ 1 1 5 1392 1 1 21 ARG H H 17.532 -4.918 2.256 1.00 . A A . 21 ARG H 1 1 5 1393 1 1 21 ARG HA H 19.283 -6.186 0.516 1.00 . A A . 21 ARG HA 1 1 5 1394 1 1 21 ARG HB2 H 17.970 -4.154 -0.046 1.00 . A A . 21 ARG HB2 1 1 5 1395 1 1 21 ARG HB3 H 19.064 -3.194 0.953 1.00 . A A . 21 ARG HB3 1 1 5 1396 1 1 21 ARG HD2 H 20.277 -2.713 -2.533 1.00 . A A . 21 ARG HD2 1 1 5 1397 1 1 21 ARG HD3 H 18.640 -2.660 -1.883 1.00 . A A . 21 ARG HD3 1 1 5 1398 1 1 21 ARG HE H 20.431 -1.652 0.056 1.00 . A A . 21 ARG HE 1 1 5 1399 1 1 21 ARG HG2 H 20.972 -3.958 -0.451 1.00 . A A . 21 ARG HG2 1 1 5 1400 1 1 21 ARG HG3 H 19.838 -4.837 -1.477 1.00 . A A . 21 ARG HG3 1 1 5 1401 1 1 21 ARG HH11 H 19.085 -0.925 -3.047 1.00 . A A . 21 ARG HH11 1 1 5 1402 1 1 21 ARG HH12 H 19.196 0.793 -2.845 1.00 . A A . 21 ARG HH12 1 1 5 1403 1 1 21 ARG HH21 H 20.589 0.598 0.323 1.00 . A A . 21 ARG HH21 1 1 5 1404 1 1 21 ARG HH22 H 20.046 1.654 -0.936 1.00 . A A . 21 ARG HH22 1 1 5 1405 1 1 21 ARG N N 18.314 -5.508 2.220 1.00 . A A . 21 ARG N 1 1 5 1406 1 1 21 ARG NE N 20.045 -1.532 -0.836 1.00 . A A . 21 ARG NE 1 1 5 1407 1 1 21 ARG NH1 N 19.338 -0.131 -2.492 1.00 . A A . 21 ARG NH1 1 1 5 1408 1 1 21 ARG NH2 N 20.189 0.730 -0.584 1.00 . A A . 21 ARG NH2 1 1 5 1409 1 1 21 ARG O O 20.880 -4.349 2.624 1.00 . A A . 21 ARG O 1 1 5 1410 1 1 21 ARG OXT O 21.576 -5.931 1.336 1.00 . A A . 21 ARG OXT 1 1 6 1411 1 1 1 ALA C C 10.565 3.595 -7.960 1.00 . A A . 1 ALA C 1 1 6 1412 1 1 1 ALA CA C 10.186 2.123 -8.090 1.00 . A A . 1 ALA CA 1 1 6 1413 1 1 1 ALA CB C 8.869 1.987 -8.855 1.00 . A A . 1 ALA CB 1 1 6 1414 1 1 1 ALA H1 H 10.844 1.803 -6.140 1.00 . A A . 1 ALA H1 1 1 6 1415 1 1 1 ALA H2 H 9.990 0.495 -6.808 1.00 . A A . 1 ALA H2 1 1 6 1416 1 1 1 ALA H3 H 9.156 1.885 -6.295 1.00 . A A . 1 ALA H3 1 1 6 1417 1 1 1 ALA HA H 10.966 1.598 -8.622 1.00 . A A . 1 ALA HA 1 1 6 1418 1 1 1 ALA HB1 H 8.849 2.697 -9.669 1.00 . A A . 1 ALA HB1 1 1 6 1419 1 1 1 ALA HB2 H 8.043 2.185 -8.187 1.00 . A A . 1 ALA HB2 1 1 6 1420 1 1 1 ALA HB3 H 8.782 0.985 -9.247 1.00 . A A . 1 ALA HB3 1 1 6 1421 1 1 1 ALA N N 10.032 1.532 -6.731 1.00 . A A . 1 ALA N 1 1 6 1422 1 1 1 ALA O O 10.655 4.315 -8.953 1.00 . A A . 1 ALA O 1 1 6 1423 1 1 2 GLY C C 12.510 5.742 -7.105 1.00 . A A . 2 GLY C 1 1 6 1424 1 1 2 GLY CA C 11.162 5.418 -6.470 1.00 . A A . 2 GLY CA 1 1 6 1425 1 1 2 GLY H H 10.704 3.411 -5.972 1.00 . A A . 2 GLY H 1 1 6 1426 1 1 2 GLY HA2 H 10.408 6.071 -6.882 1.00 . A A . 2 GLY HA2 1 1 6 1427 1 1 2 GLY HA3 H 11.228 5.577 -5.404 1.00 . A A . 2 GLY HA3 1 1 6 1428 1 1 2 GLY N N 10.789 4.032 -6.725 1.00 . A A . 2 GLY N 1 1 6 1429 1 1 2 GLY O O 12.746 6.866 -7.546 1.00 . A A . 2 GLY O 1 1 6 1430 1 1 3 GLY C C 15.710 5.386 -6.658 1.00 . A A . 3 GLY C 1 1 6 1431 1 1 3 GLY CA C 14.715 4.936 -7.722 1.00 . A A . 3 GLY CA 1 1 6 1432 1 1 3 GLY H H 13.148 3.874 -6.772 1.00 . A A . 3 GLY H 1 1 6 1433 1 1 3 GLY HA2 H 15.051 4.004 -8.152 1.00 . A A . 3 GLY HA2 1 1 6 1434 1 1 3 GLY HA3 H 14.662 5.688 -8.495 1.00 . A A . 3 GLY HA3 1 1 6 1435 1 1 3 GLY N N 13.392 4.748 -7.143 1.00 . A A . 3 GLY N 1 1 6 1436 1 1 3 GLY O O 16.846 5.744 -6.968 1.00 . A A . 3 GLY O 1 1 6 1437 1 1 4 . C C 15.390 6.625 -3.341 1.00 . A A . 4 DBU C 1 1 6 1438 1 1 4 . CA C 16.114 5.758 -4.342 1.00 . A A . 4 DBU CA 1 1 6 1439 1 1 4 . CB C 17.464 5.464 -4.116 1.00 . A A . 4 DBU CB 1 1 6 1440 1 1 4 . CG C 18.358 4.623 -4.994 1.00 . A A . 4 DBU CG 1 1 6 1441 1 1 4 . H H 14.361 5.069 -5.204 1.00 . A A . 4 DBU H 1 1 6 1442 1 1 4 . HB H 17.926 5.873 -3.229 1.00 . A A . 4 DBU HB 1 1 6 1443 1 1 4 . HG1 H 19.144 5.241 -5.401 1.00 . A A . 4 DBU HG1 1 1 6 1444 1 1 4 . HG2 H 17.782 4.197 -5.800 1.00 . A A . 4 DBU HG2 1 1 6 1445 1 1 4 . HG3 H 18.792 3.829 -4.402 1.00 . A A . 4 DBU HG3 1 1 6 1446 1 1 4 . N N 15.275 5.364 -5.403 1.00 . A A . 4 DBU N 1 1 6 1447 1 1 4 . O O 15.316 7.838 -3.518 1.00 . A A . 4 DBU O 1 1 6 1448 1 1 5 ILE C C 13.071 5.850 -0.610 1.00 . A A . 5 ILE C 1 1 6 1449 1 1 5 ILE CA C 14.156 6.726 -1.230 1.00 . A A . 5 ILE CA 1 1 6 1450 1 1 5 ILE CB C 13.534 8.016 -1.776 1.00 . A A . 5 ILE CB 1 1 6 1451 1 1 5 ILE CD1 C 14.406 9.776 -0.188 1.00 . A A . 5 ILE CD1 1 1 6 1452 1 1 5 ILE CG1 C 14.528 9.178 -1.595 1.00 . A A . 5 ILE CG1 1 1 6 1453 1 1 5 ILE CG2 C 12.237 8.329 -1.018 1.00 . A A . 5 ILE CG2 1 1 6 1454 1 1 5 ILE H H 14.977 5.030 -2.204 1.00 . A A . 5 ILE H 1 1 6 1455 1 1 5 ILE HA H 14.858 6.987 -0.462 1.00 . A A . 5 ILE HA 1 1 6 1456 1 1 5 ILE HB H 13.313 7.890 -2.825 1.00 . A A . 5 ILE HB 1 1 6 1457 1 1 5 ILE HD11 H 13.770 10.648 -0.222 1.00 . A A . 5 ILE HD11 1 1 6 1458 1 1 5 ILE HD12 H 15.384 10.058 0.171 1.00 . A A . 5 ILE HD12 1 1 6 1459 1 1 5 ILE HD13 H 13.975 9.044 0.478 1.00 . A A . 5 ILE HD13 1 1 6 1460 1 1 5 ILE HG12 H 15.535 8.809 -1.736 1.00 . A A . 5 ILE HG12 1 1 6 1461 1 1 5 ILE HG13 H 14.322 9.940 -2.327 1.00 . A A . 5 ILE HG13 1 1 6 1462 1 1 5 ILE HG21 H 12.033 9.388 -1.075 1.00 . A A . 5 ILE HG21 1 1 6 1463 1 1 5 ILE HG22 H 12.355 8.041 0.019 1.00 . A A . 5 ILE HG22 1 1 6 1464 1 1 5 ILE HG23 H 11.421 7.777 -1.456 1.00 . A A . 5 ILE HG23 1 1 6 1465 1 1 5 ILE N N 14.869 6.000 -2.283 1.00 . A A . 5 ILE N 1 1 6 1466 1 1 5 ILE O O 12.918 5.807 0.610 1.00 . A A . 5 ILE O 1 1 6 1467 1 1 6 PRO C C 11.719 3.245 0.022 1.00 . A A . 6 PRO C 1 1 6 1468 1 1 6 PRO CA C 11.212 4.294 -0.945 1.00 . A A . 6 PRO CA 1 1 6 1469 1 1 6 PRO CB C 10.683 3.623 -2.210 1.00 . A A . 6 PRO CB 1 1 6 1470 1 1 6 PRO CD C 12.431 5.154 -2.886 1.00 . A A . 6 PRO CD 1 1 6 1471 1 1 6 PRO CG C 11.132 4.494 -3.338 1.00 . A A . 6 PRO CG 1 1 6 1472 1 1 6 PRO HA H 10.431 4.881 -0.491 1.00 . A A . 6 PRO HA 1 1 6 1473 1 1 6 PRO HB2 H 11.098 2.623 -2.300 1.00 . A A . 6 PRO HB2 1 1 6 1474 1 1 6 PRO HB3 H 9.606 3.577 -2.186 1.00 . A A . 6 PRO HB3 1 1 6 1475 1 1 6 PRO HD2 H 13.283 4.567 -3.197 1.00 . A A . 6 PRO HD2 1 1 6 1476 1 1 6 PRO HD3 H 12.497 6.156 -3.266 1.00 . A A . 6 PRO HD3 1 1 6 1477 1 1 6 PRO HG2 H 11.301 3.901 -4.225 1.00 . A A . 6 PRO HG2 1 1 6 1478 1 1 6 PRO HG3 H 10.396 5.256 -3.531 1.00 . A A . 6 PRO HG3 1 1 6 1479 1 1 6 PRO N N 12.315 5.169 -1.424 1.00 . A A . 6 PRO N 1 1 6 1480 1 1 6 PRO O O 11.023 2.866 0.961 1.00 . A A . 6 PRO O 1 1 6 1481 1 1 7 DAL C C 14.997 1.504 0.302 1.00 . A A . 7 DAL C 1 1 6 1482 1 1 7 DAL CA C 13.519 1.740 0.603 1.00 . A A . 7 DAL CA 1 1 6 1483 1 1 7 DAL CB C 13.341 2.097 2.066 1.00 . A A . 7 DAL CB 1 1 6 1484 1 1 7 DAL H H 13.422 3.098 -1.004 1.00 . A A . 7 DAL H 1 1 6 1485 1 1 7 DAL HA H 12.990 0.833 0.419 1.00 . A A . 7 DAL HA 1 1 6 1486 1 1 7 DAL HB1 H 13.208 3.165 2.168 1.00 . A A . 7 DAL HB1 1 1 6 1487 1 1 7 DAL HB2 H 14.206 1.788 2.625 1.00 . A A . 7 DAL HB2 1 1 6 1488 1 1 7 DAL N N 12.932 2.767 -0.234 1.00 . A A . 7 DAL N 1 1 6 1489 1 1 7 DAL O O 15.637 0.680 0.953 1.00 . A A . 7 DAL O 1 1 6 1490 1 1 8 LEU C C 17.799 2.748 0.027 1.00 . A A . 8 LEU C 1 1 6 1491 1 1 8 LEU CA C 16.951 2.029 -1.007 1.00 . A A . 8 LEU CA 1 1 6 1492 1 1 8 LEU CB C 17.242 2.610 -2.389 1.00 . A A . 8 LEU CB 1 1 6 1493 1 1 8 LEU CD1 C 16.565 2.460 -4.791 1.00 . A A . 8 LEU CD1 1 1 6 1494 1 1 8 LEU CD2 C 15.719 0.773 -3.153 1.00 . A A . 8 LEU CD2 1 1 6 1495 1 1 8 LEU CG C 16.109 2.241 -3.347 1.00 . A A . 8 LEU CG 1 1 6 1496 1 1 8 LEU H H 15.009 2.859 -1.177 1.00 . A A . 8 LEU H 1 1 6 1497 1 1 8 LEU HA H 17.189 0.972 -0.999 1.00 . A A . 8 LEU HA 1 1 6 1498 1 1 8 LEU HB2 H 17.321 3.685 -2.315 1.00 . A A . 8 LEU HB2 1 1 6 1499 1 1 8 LEU HB3 H 18.172 2.204 -2.759 1.00 . A A . 8 LEU HB3 1 1 6 1500 1 1 8 LEU HD11 H 17.643 2.416 -4.838 1.00 . A A . 8 LEU HD11 1 1 6 1501 1 1 8 LEU HD12 H 16.226 3.427 -5.131 1.00 . A A . 8 LEU HD12 1 1 6 1502 1 1 8 LEU HD13 H 16.144 1.690 -5.421 1.00 . A A . 8 LEU HD13 1 1 6 1503 1 1 8 LEU HD21 H 16.562 0.226 -2.756 1.00 . A A . 8 LEU HD21 1 1 6 1504 1 1 8 LEU HD22 H 15.432 0.349 -4.103 1.00 . A A . 8 LEU HD22 1 1 6 1505 1 1 8 LEU HD23 H 14.891 0.709 -2.464 1.00 . A A . 8 LEU HD23 1 1 6 1506 1 1 8 LEU HG H 15.256 2.872 -3.141 1.00 . A A . 8 LEU HG 1 1 6 1507 1 1 8 LEU N N 15.546 2.212 -0.676 1.00 . A A . 8 LEU N 1 1 6 1508 1 1 8 LEU O O 19.001 2.511 0.148 1.00 . A A . 8 LEU O 1 1 6 1509 1 1 9 MET C C 18.303 3.482 2.901 1.00 . A A . 9 MET C 1 1 6 1510 1 1 9 MET CA C 17.820 4.409 1.794 1.00 . A A . 9 MET CA 1 1 6 1511 1 1 9 MET CB C 16.849 5.442 2.358 1.00 . A A . 9 MET CB 1 1 6 1512 1 1 9 MET CE C 16.492 8.597 2.515 1.00 . A A . 9 MET CE 1 1 6 1513 1 1 9 MET CG C 16.244 6.237 1.203 1.00 . A A . 9 MET CG 1 1 6 1514 1 1 9 MET H H 16.190 3.776 0.613 1.00 . A A . 9 MET H 1 1 6 1515 1 1 9 MET HA H 18.666 4.918 1.362 1.00 . A A . 9 MET HA 1 1 6 1516 1 1 9 MET HB2 H 16.063 4.942 2.907 1.00 . A A . 9 MET HB2 1 1 6 1517 1 1 9 MET HB3 H 17.374 6.115 3.012 1.00 . A A . 9 MET HB3 1 1 6 1518 1 1 9 MET HE1 H 17.246 8.743 1.755 1.00 . A A . 9 MET HE1 1 1 6 1519 1 1 9 MET HE2 H 16.940 8.126 3.376 1.00 . A A . 9 MET HE2 1 1 6 1520 1 1 9 MET HE3 H 16.075 9.552 2.806 1.00 . A A . 9 MET HE3 1 1 6 1521 1 1 9 MET HG2 H 17.033 6.675 0.611 1.00 . A A . 9 MET HG2 1 1 6 1522 1 1 9 MET HG3 H 15.658 5.574 0.583 1.00 . A A . 9 MET HG3 1 1 6 1523 1 1 9 MET N N 17.147 3.636 0.766 1.00 . A A . 9 MET N 1 1 6 1524 1 1 9 MET O O 19.402 3.647 3.431 1.00 . A A . 9 MET O 1 1 6 1525 1 1 9 MET SD S 15.176 7.539 1.862 1.00 . A A . 9 MET SD 1 1 6 1526 1 1 10 . C C 17.075 1.798 5.557 1.00 . A A . 10 DBB C 1 1 6 1527 1 1 10 . CA C 17.830 1.532 4.266 1.00 . A A . 10 DBB CA 1 1 6 1528 1 1 10 . CB C 17.539 0.113 3.776 1.00 . A A . 10 DBB CB 1 1 6 1529 1 1 10 . CG C 16.059 0.023 3.405 1.00 . A A . 10 DBB CG 1 1 6 1530 1 1 10 . H H 16.619 2.409 2.766 1.00 . A A . 10 DBB H 1 1 6 1531 1 1 10 . HA H 18.889 1.614 4.464 1.00 . A A . 10 DBB HA 1 1 6 1532 1 1 10 . HB2 H 18.103 -0.047 2.878 1.00 . A A . 10 DBB HB2 1 1 6 1533 1 1 10 . HG1 H 15.753 0.946 2.947 1.00 . A A . 10 DBB HG1 1 1 6 1534 1 1 10 . HG2 H 15.466 -0.149 4.290 1.00 . A A . 10 DBB HG2 1 1 6 1535 1 1 10 . HG3 H 15.909 -0.788 2.706 1.00 . A A . 10 DBB HG3 1 1 6 1536 1 1 10 . N N 17.476 2.495 3.234 1.00 . A A . 10 DBB N 1 1 6 1537 1 1 10 . O O 17.687 2.003 6.606 1.00 . A A . 10 DBB O 1 1 6 1538 1 1 11 GLY C C 13.533 2.450 6.382 1.00 . A A . 11 GLY C 1 1 6 1539 1 1 11 GLY CA C 14.967 2.038 6.694 1.00 . A A . 11 GLY CA 1 1 6 1540 1 1 11 GLY H H 15.294 1.629 4.642 1.00 . A A . 11 GLY H 1 1 6 1541 1 1 11 GLY HA2 H 14.956 1.140 7.296 1.00 . A A . 11 GLY HA2 1 1 6 1542 1 1 11 GLY HA3 H 15.446 2.823 7.247 1.00 . A A . 11 GLY HA3 1 1 6 1543 1 1 11 GLY N N 15.748 1.794 5.495 1.00 . A A . 11 GLY N 1 1 6 1544 1 1 11 GLY O O 13.067 3.496 6.833 1.00 . A A . 11 GLY O 1 1 6 1545 1 1 12 CYS C C 10.626 0.638 5.236 1.00 . A A . 12 CYS C 1 1 6 1546 1 1 12 CYS CA C 11.452 1.913 5.254 1.00 . A A . 12 CYS CA 1 1 6 1547 1 1 12 CYS CB C 11.409 2.518 3.862 1.00 . A A . 12 CYS CB 1 1 6 1548 1 1 12 CYS H H 13.257 0.805 5.279 1.00 . A A . 12 CYS H 1 1 6 1549 1 1 12 CYS HA H 11.031 2.611 5.961 1.00 . A A . 12 CYS HA 1 1 6 1550 1 1 12 CYS HB2 H 10.413 2.869 3.641 1.00 . A A . 12 CYS HB2 1 1 6 1551 1 1 12 CYS HB3 H 12.105 3.333 3.796 1.00 . A A . 12 CYS HB3 1 1 6 1552 1 1 12 CYS N N 12.835 1.623 5.614 1.00 . A A . 12 CYS N 1 1 6 1553 1 1 12 CYS O O 10.943 -0.340 5.916 1.00 . A A . 12 CYS O 1 1 6 1554 1 1 12 CYS SG S 11.882 1.242 2.688 1.00 . A A . 12 CYS SG 1 1 6 1555 1 1 13 GLY C C 8.586 -0.850 2.797 1.00 . A A . 13 GLY C 1 1 6 1556 1 1 13 GLY CA C 8.709 -0.498 4.272 1.00 . A A . 13 GLY CA 1 1 6 1557 1 1 13 GLY H H 9.396 1.460 3.895 1.00 . A A . 13 GLY H 1 1 6 1558 1 1 13 GLY HA2 H 9.129 -1.331 4.811 1.00 . A A . 13 GLY HA2 1 1 6 1559 1 1 13 GLY HA3 H 7.732 -0.269 4.665 1.00 . A A . 13 GLY HA3 1 1 6 1560 1 1 13 GLY N N 9.577 0.656 4.424 1.00 . A A . 13 GLY N 1 1 6 1561 1 1 13 GLY O O 7.911 -1.809 2.428 1.00 . A A . 13 GLY O 1 1 6 1562 1 1 14 TRP C C 8.691 -1.613 0.140 1.00 . A A . 14 TRP C 1 1 6 1563 1 1 14 TRP CA C 9.236 -0.232 0.518 1.00 . A A . 14 TRP CA 1 1 6 1564 1 1 14 TRP CB C 10.657 -0.028 -0.046 1.00 . A A . 14 TRP CB 1 1 6 1565 1 1 14 TRP CD1 C 11.398 -1.649 1.741 1.00 . A A . 14 TRP CD1 1 1 6 1566 1 1 14 TRP CD2 C 12.966 -1.354 0.159 1.00 . A A . 14 TRP CD2 1 1 6 1567 1 1 14 TRP CE2 C 13.505 -2.269 1.090 1.00 . A A . 14 TRP CE2 1 1 6 1568 1 1 14 TRP CE3 C 13.760 -0.989 -0.944 1.00 . A A . 14 TRP CE3 1 1 6 1569 1 1 14 TRP CG C 11.627 -0.971 0.602 1.00 . A A . 14 TRP CG 1 1 6 1570 1 1 14 TRP CH2 C 15.555 -2.435 -0.173 1.00 . A A . 14 TRP CH2 1 1 6 1571 1 1 14 TRP CZ2 C 14.783 -2.808 0.931 1.00 . A A . 14 TRP CZ2 1 1 6 1572 1 1 14 TRP CZ3 C 15.043 -1.528 -1.108 1.00 . A A . 14 TRP CZ3 1 1 6 1573 1 1 14 TRP H H 9.760 0.702 2.341 1.00 . A A . 14 TRP H 1 1 6 1574 1 1 14 TRP HA H 8.590 0.516 0.086 1.00 . A A . 14 TRP HA 1 1 6 1575 1 1 14 TRP HB2 H 10.647 -0.198 -1.108 1.00 . A A . 14 TRP HB2 1 1 6 1576 1 1 14 TRP HB3 H 10.970 0.988 0.144 1.00 . A A . 14 TRP HB3 1 1 6 1577 1 1 14 TRP HD1 H 10.497 -1.594 2.321 1.00 . A A . 14 TRP HD1 1 1 6 1578 1 1 14 TRP HE1 H 12.597 -3.009 2.818 1.00 . A A . 14 TRP HE1 1 1 6 1579 1 1 14 TRP HE3 H 13.376 -0.288 -1.670 1.00 . A A . 14 TRP HE3 1 1 6 1580 1 1 14 TRP HH2 H 16.544 -2.846 -0.304 1.00 . A A . 14 TRP HH2 1 1 6 1581 1 1 14 TRP HZ2 H 15.174 -3.506 1.654 1.00 . A A . 14 TRP HZ2 1 1 6 1582 1 1 14 TRP HZ3 H 15.643 -1.240 -1.961 1.00 . A A . 14 TRP HZ3 1 1 6 1583 1 1 14 TRP N N 9.251 -0.045 1.966 1.00 . A A . 14 TRP N 1 1 6 1584 1 1 14 TRP NE1 N 12.509 -2.422 2.037 1.00 . A A . 14 TRP NE1 1 1 6 1585 1 1 14 TRP O O 7.494 -1.867 0.268 1.00 . A A . 14 TRP O 1 1 6 1586 1 1 15 LEU C C 9.552 -4.836 0.348 1.00 . A A . 15 LEU C 1 1 6 1587 1 1 15 LEU CA C 9.151 -3.828 -0.726 1.00 . A A . 15 LEU CA 1 1 6 1588 1 1 15 LEU CB C 9.816 -4.193 -2.053 1.00 . A A . 15 LEU CB 1 1 6 1589 1 1 15 LEU CD1 C 12.033 -4.213 -3.203 1.00 . A A . 15 LEU CD1 1 1 6 1590 1 1 15 LEU CD2 C 11.016 -2.033 -2.513 1.00 . A A . 15 LEU CD2 1 1 6 1591 1 1 15 LEU CG C 11.186 -3.513 -2.140 1.00 . A A . 15 LEU CG 1 1 6 1592 1 1 15 LEU H H 10.496 -2.245 -0.428 1.00 . A A . 15 LEU H 1 1 6 1593 1 1 15 LEU HA H 8.080 -3.848 -0.851 1.00 . A A . 15 LEU HA 1 1 6 1594 1 1 15 LEU HB2 H 9.942 -5.266 -2.110 1.00 . A A . 15 LEU HB2 1 1 6 1595 1 1 15 LEU HB3 H 9.197 -3.858 -2.872 1.00 . A A . 15 LEU HB3 1 1 6 1596 1 1 15 LEU HD11 H 11.753 -3.853 -4.180 1.00 . A A . 15 LEU HD11 1 1 6 1597 1 1 15 LEU HD12 H 11.866 -5.278 -3.149 1.00 . A A . 15 LEU HD12 1 1 6 1598 1 1 15 LEU HD13 H 13.077 -4.003 -3.025 1.00 . A A . 15 LEU HD13 1 1 6 1599 1 1 15 LEU HD21 H 11.204 -1.900 -3.567 1.00 . A A . 15 LEU HD21 1 1 6 1600 1 1 15 LEU HD22 H 11.718 -1.436 -1.945 1.00 . A A . 15 LEU HD22 1 1 6 1601 1 1 15 LEU HD23 H 10.010 -1.713 -2.284 1.00 . A A . 15 LEU HD23 1 1 6 1602 1 1 15 LEU HG H 11.683 -3.589 -1.183 1.00 . A A . 15 LEU HG 1 1 6 1603 1 1 15 LEU N N 9.563 -2.494 -0.333 1.00 . A A . 15 LEU N 1 1 6 1604 1 1 15 LEU O O 8.924 -5.883 0.501 1.00 . A A . 15 LEU O 1 1 6 1605 1 1 16 . C C 10.303 -5.158 3.395 1.00 . A A . 16 DBU C 1 1 6 1606 1 1 16 . CA C 11.123 -5.300 2.133 1.00 . A A . 16 DBU CA 1 1 6 1607 1 1 16 . CB C 12.238 -6.147 2.112 1.00 . A A . 16 DBU CB 1 1 6 1608 1 1 16 . CG C 13.144 -6.384 0.929 1.00 . A A . 16 DBU CG 1 1 6 1609 1 1 16 . H H 11.067 -3.655 0.928 1.00 . A A . 16 DBU H 1 1 6 1610 1 1 16 . HB H 12.491 -6.686 3.012 1.00 . A A . 16 DBU HB 1 1 6 1611 1 1 16 . HG1 H 12.550 -6.620 0.059 1.00 . A A . 16 DBU HG1 1 1 6 1612 1 1 16 . HG2 H 13.807 -7.208 1.146 1.00 . A A . 16 DBU HG2 1 1 6 1613 1 1 16 . HG3 H 13.725 -5.494 0.737 1.00 . A A . 16 DBU HG3 1 1 6 1614 1 1 16 . N N 10.604 -4.502 1.091 1.00 . A A . 16 DBU N 1 1 6 1615 1 1 16 . O O 9.788 -6.151 3.908 1.00 . A A . 16 DBU O 1 1 6 1616 1 1 17 GLY C C 10.269 -3.120 6.228 1.00 . A A . 17 GLY C 1 1 6 1617 1 1 17 GLY CA C 9.398 -3.717 5.126 1.00 . A A . 17 GLY CA 1 1 6 1618 1 1 17 GLY H H 10.603 -3.170 3.464 1.00 . A A . 17 GLY H 1 1 6 1619 1 1 17 GLY HA2 H 8.580 -3.045 4.909 1.00 . A A . 17 GLY HA2 1 1 6 1620 1 1 17 GLY HA3 H 8.999 -4.661 5.466 1.00 . A A . 17 GLY HA3 1 1 6 1621 1 1 17 GLY N N 10.172 -3.935 3.908 1.00 . A A . 17 GLY N 1 1 6 1622 1 1 17 GLY O O 9.788 -2.369 7.077 1.00 . A A . 17 GLY O 1 1 6 1623 1 1 18 LEU C C 13.922 -3.140 6.714 1.00 . A A . 18 LEU C 1 1 6 1624 1 1 18 LEU CA C 12.491 -2.946 7.197 1.00 . A A . 18 LEU CA 1 1 6 1625 1 1 18 LEU CB C 12.301 -3.670 8.532 1.00 . A A . 18 LEU CB 1 1 6 1626 1 1 18 LEU CD1 C 12.458 -6.021 9.362 1.00 . A A . 18 LEU CD1 1 1 6 1627 1 1 18 LEU CD2 C 10.349 -5.208 8.300 1.00 . A A . 18 LEU CD2 1 1 6 1628 1 1 18 LEU CG C 11.876 -5.116 8.275 1.00 . A A . 18 LEU CG 1 1 6 1629 1 1 18 LEU H H 11.880 -4.054 5.499 1.00 . A A . 18 LEU H 1 1 6 1630 1 1 18 LEU HA H 12.310 -1.891 7.342 1.00 . A A . 18 LEU HA 1 1 6 1631 1 1 18 LEU HB2 H 13.229 -3.660 9.082 1.00 . A A . 18 LEU HB2 1 1 6 1632 1 1 18 LEU HB3 H 11.536 -3.170 9.107 1.00 . A A . 18 LEU HB3 1 1 6 1633 1 1 18 LEU HD11 H 13.308 -6.557 8.966 1.00 . A A . 18 LEU HD11 1 1 6 1634 1 1 18 LEU HD12 H 11.705 -6.725 9.685 1.00 . A A . 18 LEU HD12 1 1 6 1635 1 1 18 LEU HD13 H 12.772 -5.419 10.202 1.00 . A A . 18 LEU HD13 1 1 6 1636 1 1 18 LEU HD21 H 9.988 -5.485 7.321 1.00 . A A . 18 LEU HD21 1 1 6 1637 1 1 18 LEU HD22 H 9.936 -4.250 8.578 1.00 . A A . 18 LEU HD22 1 1 6 1638 1 1 18 LEU HD23 H 10.046 -5.953 9.021 1.00 . A A . 18 LEU HD23 1 1 6 1639 1 1 18 LEU HG H 12.241 -5.432 7.309 1.00 . A A . 18 LEU HG 1 1 6 1640 1 1 18 LEU N N 11.554 -3.455 6.203 1.00 . A A . 18 LEU N 1 1 6 1641 1 1 18 LEU O O 14.587 -4.105 7.089 1.00 . A A . 18 LEU O 1 1 6 1642 1 1 19 CYS C C 16.347 -3.660 5.529 1.00 . A A . 19 CYS C 1 1 6 1643 1 1 19 CYS CA C 15.731 -2.281 5.321 1.00 . A A . 19 CYS CA 1 1 6 1644 1 1 19 CYS CB C 16.617 -1.224 5.980 1.00 . A A . 19 CYS CB 1 1 6 1645 1 1 19 CYS H H 13.794 -1.477 5.611 1.00 . A A . 19 CYS H 1 1 6 1646 1 1 19 CYS HA H 15.683 -2.084 4.263 1.00 . A A . 19 CYS HA 1 1 6 1647 1 1 19 CYS HB2 H 16.097 -0.278 6.005 1.00 . A A . 19 CYS HB2 1 1 6 1648 1 1 19 CYS HB3 H 16.856 -1.530 6.987 1.00 . A A . 19 CYS HB3 1 1 6 1649 1 1 19 CYS N N 14.381 -2.217 5.873 1.00 . A A . 19 CYS N 1 1 6 1650 1 1 19 CYS O O 17.323 -3.810 6.264 1.00 . A A . 19 CYS O 1 1 6 1651 1 1 19 CYS SG S 18.146 -1.052 5.027 1.00 . A A . 19 CYS SG 1 1 6 1652 1 1 20 VAL C C 17.687 -6.113 4.409 1.00 . A A . 20 VAL C 1 1 6 1653 1 1 20 VAL CA C 16.276 -6.021 4.982 1.00 . A A . 20 VAL CA 1 1 6 1654 1 1 20 VAL CB C 15.354 -6.981 4.229 1.00 . A A . 20 VAL CB 1 1 6 1655 1 1 20 VAL CG1 C 15.981 -8.377 4.205 1.00 . A A . 20 VAL CG1 1 1 6 1656 1 1 20 VAL CG2 C 13.999 -7.046 4.938 1.00 . A A . 20 VAL CG2 1 1 6 1657 1 1 20 VAL H H 15.001 -4.476 4.295 1.00 . A A . 20 VAL H 1 1 6 1658 1 1 20 VAL HA H 16.300 -6.304 6.023 1.00 . A A . 20 VAL HA 1 1 6 1659 1 1 20 VAL HB H 15.218 -6.631 3.217 1.00 . A A . 20 VAL HB 1 1 6 1660 1 1 20 VAL HG11 H 15.702 -8.881 3.291 1.00 . A A . 20 VAL HG11 1 1 6 1661 1 1 20 VAL HG12 H 15.628 -8.946 5.052 1.00 . A A . 20 VAL HG12 1 1 6 1662 1 1 20 VAL HG13 H 17.057 -8.289 4.253 1.00 . A A . 20 VAL HG13 1 1 6 1663 1 1 20 VAL HG21 H 13.388 -6.213 4.620 1.00 . A A . 20 VAL HG21 1 1 6 1664 1 1 20 VAL HG22 H 14.149 -6.995 6.006 1.00 . A A . 20 VAL HG22 1 1 6 1665 1 1 20 VAL HG23 H 13.506 -7.972 4.687 1.00 . A A . 20 VAL HG23 1 1 6 1666 1 1 20 VAL N N 15.773 -4.659 4.871 1.00 . A A . 20 VAL N 1 1 6 1667 1 1 20 VAL O O 18.571 -6.728 5.006 1.00 . A A . 20 VAL O 1 1 6 1668 1 1 21 ARG C C 20.247 -4.877 3.505 1.00 . A A . 21 ARG C 1 1 6 1669 1 1 21 ARG CA C 19.193 -5.512 2.602 1.00 . A A . 21 ARG CA 1 1 6 1670 1 1 21 ARG CB C 19.131 -4.752 1.275 1.00 . A A . 21 ARG CB 1 1 6 1671 1 1 21 ARG CD C 20.452 -4.038 -0.724 1.00 . A A . 21 ARG CD 1 1 6 1672 1 1 21 ARG CG C 20.478 -4.870 0.559 1.00 . A A . 21 ARG CG 1 1 6 1673 1 1 21 ARG CZ C 19.706 -5.722 -2.307 1.00 . A A . 21 ARG CZ 1 1 6 1674 1 1 21 ARG H H 17.144 -5.022 2.822 1.00 . A A . 21 ARG H 1 1 6 1675 1 1 21 ARG HA H 19.473 -6.536 2.405 1.00 . A A . 21 ARG HA 1 1 6 1676 1 1 21 ARG HB2 H 18.356 -5.177 0.654 1.00 . A A . 21 ARG HB2 1 1 6 1677 1 1 21 ARG HB3 H 18.913 -3.710 1.462 1.00 . A A . 21 ARG HB3 1 1 6 1678 1 1 21 ARG HD2 H 20.184 -3.021 -0.484 1.00 . A A . 21 ARG HD2 1 1 6 1679 1 1 21 ARG HD3 H 21.431 -4.051 -1.178 1.00 . A A . 21 ARG HD3 1 1 6 1680 1 1 21 ARG HE H 18.635 -4.105 -1.812 1.00 . A A . 21 ARG HE 1 1 6 1681 1 1 21 ARG HG2 H 21.263 -4.506 1.209 1.00 . A A . 21 ARG HG2 1 1 6 1682 1 1 21 ARG HG3 H 20.667 -5.904 0.312 1.00 . A A . 21 ARG HG3 1 1 6 1683 1 1 21 ARG HH11 H 21.501 -6.015 -1.470 1.00 . A A . 21 ARG HH11 1 1 6 1684 1 1 21 ARG HH12 H 20.993 -7.227 -2.597 1.00 . A A . 21 ARG HH12 1 1 6 1685 1 1 21 ARG HH21 H 17.964 -5.690 -3.293 1.00 . A A . 21 ARG HH21 1 1 6 1686 1 1 21 ARG HH22 H 18.990 -7.044 -3.630 1.00 . A A . 21 ARG HH22 1 1 6 1687 1 1 21 ARG N N 17.887 -5.496 3.249 1.00 . A A . 21 ARG N 1 1 6 1688 1 1 21 ARG NE N 19.476 -4.585 -1.659 1.00 . A A . 21 ARG NE 1 1 6 1689 1 1 21 ARG NH1 N 20.821 -6.372 -2.110 1.00 . A A . 21 ARG NH1 1 1 6 1690 1 1 21 ARG NH2 N 18.818 -6.189 -3.142 1.00 . A A . 21 ARG NH2 1 1 6 1691 1 1 21 ARG O O 21.420 -5.009 3.197 1.00 . A A . 21 ARG O 1 1 6 1692 1 1 21 ARG OXT O 19.866 -4.267 4.490 1.00 . A A . 21 ARG OXT 1 1 7 1693 1 1 1 ALA C C 12.462 0.622 -7.794 1.00 . A A . 1 ALA C 1 1 7 1694 1 1 1 ALA CA C 12.841 -0.742 -8.360 1.00 . A A . 1 ALA CA 1 1 7 1695 1 1 1 ALA CB C 12.574 -0.776 -9.867 1.00 . A A . 1 ALA CB 1 1 7 1696 1 1 1 ALA H1 H 12.476 -2.725 -7.834 1.00 . A A . 1 ALA H1 1 1 7 1697 1 1 1 ALA H2 H 11.069 -1.806 -8.096 1.00 . A A . 1 ALA H2 1 1 7 1698 1 1 1 ALA H3 H 11.972 -1.597 -6.672 1.00 . A A . 1 ALA H3 1 1 7 1699 1 1 1 ALA HA H 13.889 -0.928 -8.177 1.00 . A A . 1 ALA HA 1 1 7 1700 1 1 1 ALA HB1 H 13.430 -0.380 -10.392 1.00 . A A . 1 ALA HB1 1 1 7 1701 1 1 1 ALA HB2 H 11.705 -0.177 -10.091 1.00 . A A . 1 ALA HB2 1 1 7 1702 1 1 1 ALA HB3 H 12.400 -1.795 -10.178 1.00 . A A . 1 ALA HB3 1 1 7 1703 1 1 1 ALA N N 12.029 -1.797 -7.689 1.00 . A A . 1 ALA N 1 1 7 1704 1 1 1 ALA O O 11.597 1.311 -8.336 1.00 . A A . 1 ALA O 1 1 7 1705 1 1 2 GLY C C 13.682 3.400 -6.699 1.00 . A A . 2 GLY C 1 1 7 1706 1 1 2 GLY CA C 12.840 2.292 -6.074 1.00 . A A . 2 GLY CA 1 1 7 1707 1 1 2 GLY H H 13.796 0.417 -6.315 1.00 . A A . 2 GLY H 1 1 7 1708 1 1 2 GLY HA2 H 11.792 2.529 -6.198 1.00 . A A . 2 GLY HA2 1 1 7 1709 1 1 2 GLY HA3 H 13.068 2.229 -5.020 1.00 . A A . 2 GLY HA3 1 1 7 1710 1 1 2 GLY N N 13.116 1.007 -6.704 1.00 . A A . 2 GLY N 1 1 7 1711 1 1 2 GLY O O 14.756 3.144 -7.243 1.00 . A A . 2 GLY O 1 1 7 1712 1 1 3 GLY C C 14.945 6.287 -6.182 1.00 . A A . 3 GLY C 1 1 7 1713 1 1 3 GLY CA C 13.905 5.771 -7.169 1.00 . A A . 3 GLY CA 1 1 7 1714 1 1 3 GLY H H 12.329 4.773 -6.164 1.00 . A A . 3 GLY H 1 1 7 1715 1 1 3 GLY HA2 H 14.398 5.472 -8.082 1.00 . A A . 3 GLY HA2 1 1 7 1716 1 1 3 GLY HA3 H 13.202 6.562 -7.386 1.00 . A A . 3 GLY HA3 1 1 7 1717 1 1 3 GLY N N 13.188 4.631 -6.613 1.00 . A A . 3 GLY N 1 1 7 1718 1 1 3 GLY O O 15.703 7.209 -6.486 1.00 . A A . 3 GLY O 1 1 7 1719 1 1 4 . C C 15.176 6.840 -2.906 1.00 . A A . 4 DBU C 1 1 7 1720 1 1 4 . CA C 15.880 6.068 -3.991 1.00 . A A . 4 DBU CA 1 1 7 1721 1 1 4 . CB C 17.257 5.840 -3.876 1.00 . A A . 4 DBU CB 1 1 7 1722 1 1 4 . CG C 18.122 5.092 -4.862 1.00 . A A . 4 DBU CG 1 1 7 1723 1 1 4 . H H 14.347 4.959 -4.801 1.00 . A A . 4 DBU H 1 1 7 1724 1 1 4 . HB H 17.759 6.231 -3.003 1.00 . A A . 4 DBU HB 1 1 7 1725 1 1 4 . HG1 H 18.947 5.720 -5.161 1.00 . A A . 4 DBU HG1 1 1 7 1726 1 1 4 . HG2 H 17.534 4.830 -5.728 1.00 . A A . 4 DBU HG2 1 1 7 1727 1 1 4 . HG3 H 18.500 4.195 -4.397 1.00 . A A . 4 DBU HG3 1 1 7 1728 1 1 4 . N N 14.971 5.688 -4.998 1.00 . A A . 4 DBU N 1 1 7 1729 1 1 4 . O O 15.104 8.066 -2.975 1.00 . A A . 4 DBU O 1 1 7 1730 1 1 5 ILE C C 12.903 5.834 -0.212 1.00 . A A . 5 ILE C 1 1 7 1731 1 1 5 ILE CA C 13.966 6.764 -0.787 1.00 . A A . 5 ILE CA 1 1 7 1732 1 1 5 ILE CB C 13.314 8.076 -1.232 1.00 . A A . 5 ILE CB 1 1 7 1733 1 1 5 ILE CD1 C 14.153 9.705 0.500 1.00 . A A . 5 ILE CD1 1 1 7 1734 1 1 5 ILE CG1 C 14.279 9.242 -0.957 1.00 . A A . 5 ILE CG1 1 1 7 1735 1 1 5 ILE CG2 C 12.010 8.299 -0.457 1.00 . A A . 5 ILE CG2 1 1 7 1736 1 1 5 ILE H H 14.763 5.152 -1.911 1.00 . A A . 5 ILE H 1 1 7 1737 1 1 5 ILE HA H 14.679 6.983 -0.019 1.00 . A A . 5 ILE HA 1 1 7 1738 1 1 5 ILE HB H 13.101 8.025 -2.290 1.00 . A A . 5 ILE HB 1 1 7 1739 1 1 5 ILE HD11 H 13.533 10.590 0.544 1.00 . A A . 5 ILE HD11 1 1 7 1740 1 1 5 ILE HD12 H 15.132 9.933 0.892 1.00 . A A . 5 ILE HD12 1 1 7 1741 1 1 5 ILE HD13 H 13.701 8.921 1.089 1.00 . A A . 5 ILE HD13 1 1 7 1742 1 1 5 ILE HG12 H 15.293 8.916 -1.138 1.00 . A A . 5 ILE HG12 1 1 7 1743 1 1 5 ILE HG13 H 14.043 10.061 -1.616 1.00 . A A . 5 ILE HG13 1 1 7 1744 1 1 5 ILE HG21 H 11.685 9.322 -0.585 1.00 . A A . 5 ILE HG21 1 1 7 1745 1 1 5 ILE HG22 H 12.182 8.105 0.593 1.00 . A A . 5 ILE HG22 1 1 7 1746 1 1 5 ILE HG23 H 11.250 7.629 -0.829 1.00 . A A . 5 ILE HG23 1 1 7 1747 1 1 5 ILE N N 14.664 6.127 -1.903 1.00 . A A . 5 ILE N 1 1 7 1748 1 1 5 ILE O O 12.772 5.705 1.006 1.00 . A A . 5 ILE O 1 1 7 1749 1 1 6 PRO C C 11.593 3.182 0.250 1.00 . A A . 6 PRO C 1 1 7 1750 1 1 6 PRO CA C 11.054 4.289 -0.627 1.00 . A A . 6 PRO CA 1 1 7 1751 1 1 6 PRO CB C 10.506 3.709 -1.929 1.00 . A A . 6 PRO CB 1 1 7 1752 1 1 6 PRO CD C 12.237 5.291 -2.519 1.00 . A A . 6 PRO CD 1 1 7 1753 1 1 6 PRO CG C 10.931 4.665 -2.995 1.00 . A A . 6 PRO CG 1 1 7 1754 1 1 6 PRO HA H 10.280 4.834 -0.114 1.00 . A A . 6 PRO HA 1 1 7 1755 1 1 6 PRO HB2 H 10.925 2.724 -2.100 1.00 . A A . 6 PRO HB2 1 1 7 1756 1 1 6 PRO HB3 H 9.431 3.657 -1.890 1.00 . A A . 6 PRO HB3 1 1 7 1757 1 1 6 PRO HD2 H 13.085 4.728 -2.882 1.00 . A A . 6 PRO HD2 1 1 7 1758 1 1 6 PRO HD3 H 12.300 6.316 -2.829 1.00 . A A . 6 PRO HD3 1 1 7 1759 1 1 6 PRO HG2 H 11.083 4.140 -3.927 1.00 . A A . 6 PRO HG2 1 1 7 1760 1 1 6 PRO HG3 H 10.190 5.438 -3.117 1.00 . A A . 6 PRO HG3 1 1 7 1761 1 1 6 PRO N N 12.141 5.206 -1.058 1.00 . A A . 6 PRO N 1 1 7 1762 1 1 6 PRO O O 10.914 2.713 1.159 1.00 . A A . 6 PRO O 1 1 7 1763 1 1 7 DAL C C 14.923 1.532 0.393 1.00 . A A . 7 DAL C 1 1 7 1764 1 1 7 DAL CA C 13.437 1.696 0.712 1.00 . A A . 7 DAL CA 1 1 7 1765 1 1 7 DAL CB C 13.249 1.960 2.192 1.00 . A A . 7 DAL CB 1 1 7 1766 1 1 7 DAL H H 13.297 3.170 -0.785 1.00 . A A . 7 DAL H 1 1 7 1767 1 1 7 DAL HA H 12.937 0.786 0.470 1.00 . A A . 7 DAL HA 1 1 7 1768 1 1 7 DAL HB1 H 13.074 3.013 2.352 1.00 . A A . 7 DAL HB1 1 1 7 1769 1 1 7 DAL HB2 H 14.125 1.653 2.732 1.00 . A A . 7 DAL HB2 1 1 7 1770 1 1 7 DAL N N 12.818 2.762 -0.045 1.00 . A A . 7 DAL N 1 1 7 1771 1 1 7 DAL O O 15.624 0.775 1.061 1.00 . A A . 7 DAL O 1 1 7 1772 1 1 8 LEU C C 17.665 2.737 0.091 1.00 . A A . 8 LEU C 1 1 7 1773 1 1 8 LEU CA C 16.808 2.120 -1.002 1.00 . A A . 8 LEU CA 1 1 7 1774 1 1 8 LEU CB C 17.052 2.855 -2.320 1.00 . A A . 8 LEU CB 1 1 7 1775 1 1 8 LEU CD1 C 16.392 2.836 -4.732 1.00 . A A . 8 LEU CD1 1 1 7 1776 1 1 8 LEU CD2 C 15.573 1.031 -3.212 1.00 . A A . 8 LEU CD2 1 1 7 1777 1 1 8 LEU CG C 15.933 2.518 -3.309 1.00 . A A . 8 LEU CG 1 1 7 1778 1 1 8 LEU H H 14.814 2.816 -1.145 1.00 . A A . 8 LEU H 1 1 7 1779 1 1 8 LEU HA H 17.071 1.078 -1.118 1.00 . A A . 8 LEU HA 1 1 7 1780 1 1 8 LEU HB2 H 17.068 3.920 -2.139 1.00 . A A . 8 LEU HB2 1 1 7 1781 1 1 8 LEU HB3 H 18.000 2.544 -2.732 1.00 . A A . 8 LEU HB3 1 1 7 1782 1 1 8 LEU HD11 H 17.462 2.705 -4.802 1.00 . A A . 8 LEU HD11 1 1 7 1783 1 1 8 LEU HD12 H 16.138 3.856 -4.972 1.00 . A A . 8 LEU HD12 1 1 7 1784 1 1 8 LEU HD13 H 15.901 2.168 -5.425 1.00 . A A . 8 LEU HD13 1 1 7 1785 1 1 8 LEU HD21 H 14.738 0.907 -2.536 1.00 . A A . 8 LEU HD21 1 1 7 1786 1 1 8 LEU HD22 H 16.423 0.479 -2.839 1.00 . A A . 8 LEU HD22 1 1 7 1787 1 1 8 LEU HD23 H 15.304 0.661 -4.189 1.00 . A A . 8 LEU HD23 1 1 7 1788 1 1 8 LEU HG H 15.065 3.117 -3.071 1.00 . A A . 8 LEU HG 1 1 7 1789 1 1 8 LEU N N 15.404 2.227 -0.631 1.00 . A A . 8 LEU N 1 1 7 1790 1 1 8 LEU O O 18.851 2.435 0.224 1.00 . A A . 8 LEU O 1 1 7 1791 1 1 9 MET C C 18.218 3.294 2.979 1.00 . A A . 9 MET C 1 1 7 1792 1 1 9 MET CA C 17.723 4.302 1.948 1.00 . A A . 9 MET CA 1 1 7 1793 1 1 9 MET CB C 16.753 5.283 2.603 1.00 . A A . 9 MET CB 1 1 7 1794 1 1 9 MET CE C 16.566 8.422 2.999 1.00 . A A . 9 MET CE 1 1 7 1795 1 1 9 MET CG C 16.158 6.187 1.526 1.00 . A A . 9 MET CG 1 1 7 1796 1 1 9 MET H H 16.098 3.813 0.693 1.00 . A A . 9 MET H 1 1 7 1797 1 1 9 MET HA H 18.565 4.848 1.551 1.00 . A A . 9 MET HA 1 1 7 1798 1 1 9 MET HB2 H 15.962 4.735 3.093 1.00 . A A . 9 MET HB2 1 1 7 1799 1 1 9 MET HB3 H 17.275 5.888 3.323 1.00 . A A . 9 MET HB3 1 1 7 1800 1 1 9 MET HE1 H 16.551 9.430 2.607 1.00 . A A . 9 MET HE1 1 1 7 1801 1 1 9 MET HE2 H 17.493 7.944 2.726 1.00 . A A . 9 MET HE2 1 1 7 1802 1 1 9 MET HE3 H 16.481 8.449 4.076 1.00 . A A . 9 MET HE3 1 1 7 1803 1 1 9 MET HG2 H 16.951 6.627 0.941 1.00 . A A . 9 MET HG2 1 1 7 1804 1 1 9 MET HG3 H 15.523 5.598 0.880 1.00 . A A . 9 MET HG3 1 1 7 1805 1 1 9 MET N N 17.042 3.617 0.863 1.00 . A A . 9 MET N 1 1 7 1806 1 1 9 MET O O 19.329 3.415 3.496 1.00 . A A . 9 MET O 1 1 7 1807 1 1 9 MET SD S 15.177 7.488 2.309 1.00 . A A . 9 MET SD 1 1 7 1808 1 1 10 . C C 17.031 1.447 5.546 1.00 . A A . 10 DBB C 1 1 7 1809 1 1 10 . CA C 17.765 1.263 4.229 1.00 . A A . 10 DBB CA 1 1 7 1810 1 1 10 . CB C 17.464 -0.123 3.660 1.00 . A A . 10 DBB CB 1 1 7 1811 1 1 10 . CG C 15.952 -0.251 3.468 1.00 . A A . 10 DBB CG 1 1 7 1812 1 1 10 . H H 16.522 2.240 2.816 1.00 . A A . 10 DBB H 1 1 7 1813 1 1 10 . HA H 18.828 1.333 4.412 1.00 . A A . 10 DBB HA 1 1 7 1814 1 1 10 . HB2 H 17.921 -0.196 2.693 1.00 . A A . 10 DBB HB2 1 1 7 1815 1 1 10 . HG1 H 15.478 -0.456 4.415 1.00 . A A . 10 DBB HG1 1 1 7 1816 1 1 10 . HG2 H 15.741 -1.054 2.777 1.00 . A A . 10 DBB HG2 1 1 7 1817 1 1 10 . HG3 H 15.569 0.673 3.069 1.00 . A A . 10 DBB HG3 1 1 7 1818 1 1 10 . N N 17.392 2.292 3.266 1.00 . A A . 10 DBB N 1 1 7 1819 1 1 10 . O O 17.656 1.526 6.603 1.00 . A A . 10 DBB O 1 1 7 1820 1 1 11 GLY C C 13.491 2.089 6.442 1.00 . A A . 11 GLY C 1 1 7 1821 1 1 11 GLY CA C 14.938 1.681 6.714 1.00 . A A . 11 GLY CA 1 1 7 1822 1 1 11 GLY H H 15.241 1.441 4.632 1.00 . A A . 11 GLY H 1 1 7 1823 1 1 11 GLY HA2 H 14.945 0.753 7.267 1.00 . A A . 11 GLY HA2 1 1 7 1824 1 1 11 GLY HA3 H 15.415 2.443 7.302 1.00 . A A . 11 GLY HA3 1 1 7 1825 1 1 11 GLY N N 15.704 1.510 5.494 1.00 . A A . 11 GLY N 1 1 7 1826 1 1 11 GLY O O 13.031 3.127 6.919 1.00 . A A . 11 GLY O 1 1 7 1827 1 1 12 CYS C C 10.568 0.267 5.284 1.00 . A A . 12 CYS C 1 1 7 1828 1 1 12 CYS CA C 11.382 1.553 5.355 1.00 . A A . 12 CYS CA 1 1 7 1829 1 1 12 CYS CB C 11.307 2.222 3.996 1.00 . A A . 12 CYS CB 1 1 7 1830 1 1 12 CYS H H 13.196 0.457 5.322 1.00 . A A . 12 CYS H 1 1 7 1831 1 1 12 CYS HA H 10.963 2.210 6.101 1.00 . A A . 12 CYS HA 1 1 7 1832 1 1 12 CYS HB2 H 10.297 2.547 3.797 1.00 . A A . 12 CYS HB2 1 1 7 1833 1 1 12 CYS HB3 H 11.973 3.064 3.964 1.00 . A A . 12 CYS HB3 1 1 7 1834 1 1 12 CYS N N 12.777 1.267 5.679 1.00 . A A . 12 CYS N 1 1 7 1835 1 1 12 CYS O O 10.884 -0.726 5.939 1.00 . A A . 12 CYS O 1 1 7 1836 1 1 12 CYS SG S 11.822 1.019 2.762 1.00 . A A . 12 CYS SG 1 1 7 1837 1 1 13 GLY C C 8.542 -1.140 2.757 1.00 . A A . 13 GLY C 1 1 7 1838 1 1 13 GLY CA C 8.669 -0.852 4.249 1.00 . A A . 13 GLY CA 1 1 7 1839 1 1 13 GLY H H 9.350 1.120 3.951 1.00 . A A . 13 GLY H 1 1 7 1840 1 1 13 GLY HA2 H 9.090 -1.710 4.747 1.00 . A A . 13 GLY HA2 1 1 7 1841 1 1 13 GLY HA3 H 7.689 -0.645 4.651 1.00 . A A . 13 GLY HA3 1 1 7 1842 1 1 13 GLY N N 9.531 0.301 4.453 1.00 . A A . 13 GLY N 1 1 7 1843 1 1 13 GLY O O 7.886 -2.097 2.352 1.00 . A A . 13 GLY O 1 1 7 1844 1 1 14 TRP C C 8.675 -1.817 0.075 1.00 . A A . 14 TRP C 1 1 7 1845 1 1 14 TRP CA C 9.149 -0.419 0.498 1.00 . A A . 14 TRP CA 1 1 7 1846 1 1 14 TRP CB C 10.544 -0.104 -0.076 1.00 . A A . 14 TRP CB 1 1 7 1847 1 1 14 TRP CD1 C 11.401 -1.780 1.596 1.00 . A A . 14 TRP CD1 1 1 7 1848 1 1 14 TRP CD2 C 12.896 -1.367 -0.026 1.00 . A A . 14 TRP CD2 1 1 7 1849 1 1 14 TRP CE2 C 13.496 -2.306 0.842 1.00 . A A . 14 TRP CE2 1 1 7 1850 1 1 14 TRP CE3 C 13.632 -0.931 -1.143 1.00 . A A . 14 TRP CE3 1 1 7 1851 1 1 14 TRP CG C 11.567 -1.043 0.486 1.00 . A A . 14 TRP CG 1 1 7 1852 1 1 14 TRP CH2 C 15.499 -2.356 -0.505 1.00 . A A . 14 TRP CH2 1 1 7 1853 1 1 14 TRP CZ2 C 14.782 -2.800 0.611 1.00 . A A . 14 TRP CZ2 1 1 7 1854 1 1 14 TRP CZ3 C 14.925 -1.424 -1.380 1.00 . A A . 14 TRP CZ3 1 1 7 1855 1 1 14 TRP H H 9.678 0.457 2.349 1.00 . A A . 14 TRP H 1 1 7 1856 1 1 14 TRP HA H 8.450 0.305 0.105 1.00 . A A . 14 TRP HA 1 1 7 1857 1 1 14 TRP HB2 H 10.522 -0.196 -1.145 1.00 . A A . 14 TRP HB2 1 1 7 1858 1 1 14 TRP HB3 H 10.811 0.910 0.183 1.00 . A A . 14 TRP HB3 1 1 7 1859 1 1 14 TRP HD1 H 10.522 -1.779 2.210 1.00 . A A . 14 TRP HD1 1 1 7 1860 1 1 14 TRP HE1 H 12.682 -3.145 2.568 1.00 . A A . 14 TRP HE1 1 1 7 1861 1 1 14 TRP HE3 H 13.200 -0.214 -1.824 1.00 . A A . 14 TRP HE3 1 1 7 1862 1 1 14 TRP HH2 H 16.494 -2.732 -0.692 1.00 . A A . 14 TRP HH2 1 1 7 1863 1 1 14 TRP HZ2 H 15.219 -3.518 1.288 1.00 . A A . 14 TRP HZ2 1 1 7 1864 1 1 14 TRP HZ3 H 15.481 -1.084 -2.242 1.00 . A A . 14 TRP HZ3 1 1 7 1865 1 1 14 TRP N N 9.178 -0.286 1.952 1.00 . A A . 14 TRP N 1 1 7 1866 1 1 14 TRP NE1 N 12.545 -2.528 1.819 1.00 . A A . 14 TRP NE1 1 1 7 1867 1 1 14 TRP O O 7.491 -2.135 0.190 1.00 . A A . 14 TRP O 1 1 7 1868 1 1 15 LEU C C 9.922 -5.018 0.032 1.00 . A A . 15 LEU C 1 1 7 1869 1 1 15 LEU CA C 9.243 -3.984 -0.862 1.00 . A A . 15 LEU CA 1 1 7 1870 1 1 15 LEU CB C 9.708 -4.165 -2.302 1.00 . A A . 15 LEU CB 1 1 7 1871 1 1 15 LEU CD1 C 11.762 -3.998 -3.711 1.00 . A A . 15 LEU CD1 1 1 7 1872 1 1 15 LEU CD2 C 10.824 -1.941 -2.652 1.00 . A A . 15 LEU CD2 1 1 7 1873 1 1 15 LEU CG C 11.050 -3.449 -2.480 1.00 . A A . 15 LEU CG 1 1 7 1874 1 1 15 LEU H H 10.507 -2.349 -0.513 1.00 . A A . 15 LEU H 1 1 7 1875 1 1 15 LEU HA H 8.173 -4.114 -0.815 1.00 . A A . 15 LEU HA 1 1 7 1876 1 1 15 LEU HB2 H 9.825 -5.220 -2.514 1.00 . A A . 15 LEU HB2 1 1 7 1877 1 1 15 LEU HB3 H 8.981 -3.739 -2.975 1.00 . A A . 15 LEU HB3 1 1 7 1878 1 1 15 LEU HD11 H 11.911 -3.201 -4.424 1.00 . A A . 15 LEU HD11 1 1 7 1879 1 1 15 LEU HD12 H 11.161 -4.776 -4.159 1.00 . A A . 15 LEU HD12 1 1 7 1880 1 1 15 LEU HD13 H 12.718 -4.405 -3.419 1.00 . A A . 15 LEU HD13 1 1 7 1881 1 1 15 LEU HD21 H 9.830 -1.680 -2.323 1.00 . A A . 15 LEU HD21 1 1 7 1882 1 1 15 LEU HD22 H 10.940 -1.673 -3.692 1.00 . A A . 15 LEU HD22 1 1 7 1883 1 1 15 LEU HD23 H 11.550 -1.399 -2.062 1.00 . A A . 15 LEU HD23 1 1 7 1884 1 1 15 LEU HG H 11.663 -3.624 -1.607 1.00 . A A . 15 LEU HG 1 1 7 1885 1 1 15 LEU N N 9.588 -2.644 -0.423 1.00 . A A . 15 LEU N 1 1 7 1886 1 1 15 LEU O O 9.470 -6.160 0.137 1.00 . A A . 15 LEU O 1 1 7 1887 1 1 16 . C C 11.123 -5.503 2.890 1.00 . A A . 16 DBU C 1 1 7 1888 1 1 16 . CA C 11.776 -5.422 1.533 1.00 . A A . 16 DBU CA 1 1 7 1889 1 1 16 . CB C 12.973 -6.104 1.271 1.00 . A A . 16 DBU CB 1 1 7 1890 1 1 16 . CG C 13.717 -6.099 -0.043 1.00 . A A . 16 DBU CG 1 1 7 1891 1 1 16 . H H 11.338 -3.691 0.552 1.00 . A A . 16 DBU H 1 1 7 1892 1 1 16 . HB H 13.422 -6.689 2.060 1.00 . A A . 16 DBU HB 1 1 7 1893 1 1 16 . HG1 H 14.645 -6.640 0.067 1.00 . A A . 16 DBU HG1 1 1 7 1894 1 1 16 . HG2 H 13.925 -5.082 -0.337 1.00 . A A . 16 DBU HG2 1 1 7 1895 1 1 16 . HG3 H 13.111 -6.575 -0.801 1.00 . A A . 16 DBU HG3 1 1 7 1896 1 1 16 . N N 11.016 -4.608 0.670 1.00 . A A . 16 DBU N 1 1 7 1897 1 1 16 . O O 10.800 -6.594 3.359 1.00 . A A . 16 DBU O 1 1 7 1898 1 1 17 GLY C C 11.342 -4.333 5.956 1.00 . A A . 17 GLY C 1 1 7 1899 1 1 17 GLY CA C 10.293 -4.339 4.851 1.00 . A A . 17 GLY CA 1 1 7 1900 1 1 17 GLY H H 11.194 -3.506 3.119 1.00 . A A . 17 GLY H 1 1 7 1901 1 1 17 GLY HA2 H 9.677 -3.458 4.939 1.00 . A A . 17 GLY HA2 1 1 7 1902 1 1 17 GLY HA3 H 9.674 -5.218 4.959 1.00 . A A . 17 GLY HA3 1 1 7 1903 1 1 17 GLY N N 10.919 -4.356 3.534 1.00 . A A . 17 GLY N 1 1 7 1904 1 1 17 GLY O O 11.784 -5.385 6.413 1.00 . A A . 17 GLY O 1 1 7 1905 1 1 18 LEU C C 14.130 -3.264 6.884 1.00 . A A . 18 LEU C 1 1 7 1906 1 1 18 LEU CA C 12.733 -2.986 7.430 1.00 . A A . 18 LEU CA 1 1 7 1907 1 1 18 LEU CB C 12.437 -3.945 8.587 1.00 . A A . 18 LEU CB 1 1 7 1908 1 1 18 LEU CD1 C 10.707 -4.697 10.225 1.00 . A A . 18 LEU CD1 1 1 7 1909 1 1 18 LEU CD2 C 10.897 -2.280 9.633 1.00 . A A . 18 LEU CD2 1 1 7 1910 1 1 18 LEU CG C 11.015 -3.708 9.099 1.00 . A A . 18 LEU CG 1 1 7 1911 1 1 18 LEU H H 11.343 -2.334 5.968 1.00 . A A . 18 LEU H 1 1 7 1912 1 1 18 LEU HA H 12.699 -1.972 7.803 1.00 . A A . 18 LEU HA 1 1 7 1913 1 1 18 LEU HB2 H 12.531 -4.964 8.245 1.00 . A A . 18 LEU HB2 1 1 7 1914 1 1 18 LEU HB3 H 13.137 -3.768 9.388 1.00 . A A . 18 LEU HB3 1 1 7 1915 1 1 18 LEU HD11 H 10.251 -4.172 11.052 1.00 . A A . 18 LEU HD11 1 1 7 1916 1 1 18 LEU HD12 H 11.623 -5.163 10.556 1.00 . A A . 18 LEU HD12 1 1 7 1917 1 1 18 LEU HD13 H 10.028 -5.455 9.863 1.00 . A A . 18 LEU HD13 1 1 7 1918 1 1 18 LEU HD21 H 11.867 -1.806 9.610 1.00 . A A . 18 LEU HD21 1 1 7 1919 1 1 18 LEU HD22 H 10.533 -2.303 10.650 1.00 . A A . 18 LEU HD22 1 1 7 1920 1 1 18 LEU HD23 H 10.208 -1.719 9.018 1.00 . A A . 18 LEU HD23 1 1 7 1921 1 1 18 LEU HG H 10.311 -3.853 8.292 1.00 . A A . 18 LEU HG 1 1 7 1922 1 1 18 LEU N N 11.734 -3.134 6.377 1.00 . A A . 18 LEU N 1 1 7 1923 1 1 18 LEU O O 14.803 -4.195 7.326 1.00 . A A . 18 LEU O 1 1 7 1924 1 1 19 CYS C C 16.416 -4.014 5.537 1.00 . A A . 19 CYS C 1 1 7 1925 1 1 19 CYS CA C 15.871 -2.609 5.308 1.00 . A A . 19 CYS CA 1 1 7 1926 1 1 19 CYS CB C 16.849 -1.584 5.889 1.00 . A A . 19 CYS CB 1 1 7 1927 1 1 19 CYS H H 13.967 -1.728 5.612 1.00 . A A . 19 CYS H 1 1 7 1928 1 1 19 CYS HA H 15.785 -2.440 4.247 1.00 . A A . 19 CYS HA 1 1 7 1929 1 1 19 CYS HB2 H 16.341 -0.642 6.035 1.00 . A A . 19 CYS HB2 1 1 7 1930 1 1 19 CYS HB3 H 17.224 -1.941 6.836 1.00 . A A . 19 CYS HB3 1 1 7 1931 1 1 19 CYS N N 14.554 -2.450 5.921 1.00 . A A . 19 CYS N 1 1 7 1932 1 1 19 CYS O O 17.123 -4.266 6.515 1.00 . A A . 19 CYS O 1 1 7 1933 1 1 19 CYS SG S 18.229 -1.360 4.742 1.00 . A A . 19 CYS SG 1 1 7 1934 1 1 20 VAL C C 17.691 -6.559 3.760 1.00 . A A . 20 VAL C 1 1 7 1935 1 1 20 VAL CA C 16.548 -6.303 4.736 1.00 . A A . 20 VAL CA 1 1 7 1936 1 1 20 VAL CB C 15.395 -7.264 4.443 1.00 . A A . 20 VAL CB 1 1 7 1937 1 1 20 VAL CG1 C 15.905 -8.705 4.485 1.00 . A A . 20 VAL CG1 1 1 7 1938 1 1 20 VAL CG2 C 14.302 -7.080 5.498 1.00 . A A . 20 VAL CG2 1 1 7 1939 1 1 20 VAL H H 15.520 -4.665 3.871 1.00 . A A . 20 VAL H 1 1 7 1940 1 1 20 VAL HA H 16.899 -6.477 5.741 1.00 . A A . 20 VAL HA 1 1 7 1941 1 1 20 VAL HB H 14.990 -7.053 3.463 1.00 . A A . 20 VAL HB 1 1 7 1942 1 1 20 VAL HG11 H 16.304 -8.975 3.518 1.00 . A A . 20 VAL HG11 1 1 7 1943 1 1 20 VAL HG12 H 15.091 -9.369 4.737 1.00 . A A . 20 VAL HG12 1 1 7 1944 1 1 20 VAL HG13 H 16.683 -8.790 5.231 1.00 . A A . 20 VAL HG13 1 1 7 1945 1 1 20 VAL HG21 H 14.562 -7.639 6.386 1.00 . A A . 20 VAL HG21 1 1 7 1946 1 1 20 VAL HG22 H 13.361 -7.440 5.109 1.00 . A A . 20 VAL HG22 1 1 7 1947 1 1 20 VAL HG23 H 14.213 -6.032 5.746 1.00 . A A . 20 VAL HG23 1 1 7 1948 1 1 20 VAL N N 16.084 -4.925 4.629 1.00 . A A . 20 VAL N 1 1 7 1949 1 1 20 VAL O O 18.414 -7.549 3.883 1.00 . A A . 20 VAL O 1 1 7 1950 1 1 21 ARG C C 20.250 -5.362 2.377 1.00 . A A . 21 ARG C 1 1 7 1951 1 1 21 ARG CA C 18.910 -5.807 1.798 1.00 . A A . 21 ARG CA 1 1 7 1952 1 1 21 ARG CB C 18.585 -4.974 0.556 1.00 . A A . 21 ARG CB 1 1 7 1953 1 1 21 ARG CD C 19.334 -4.389 -1.757 1.00 . A A . 21 ARG CD 1 1 7 1954 1 1 21 ARG CG C 19.658 -5.213 -0.508 1.00 . A A . 21 ARG CG 1 1 7 1955 1 1 21 ARG CZ C 20.135 -4.172 -4.037 1.00 . A A . 21 ARG CZ 1 1 7 1956 1 1 21 ARG H H 17.245 -4.895 2.740 1.00 . A A . 21 ARG H 1 1 7 1957 1 1 21 ARG HA H 18.981 -6.845 1.512 1.00 . A A . 21 ARG HA 1 1 7 1958 1 1 21 ARG HB2 H 17.620 -5.267 0.168 1.00 . A A . 21 ARG HB2 1 1 7 1959 1 1 21 ARG HB3 H 18.567 -3.924 0.817 1.00 . A A . 21 ARG HB3 1 1 7 1960 1 1 21 ARG HD2 H 18.318 -4.588 -2.061 1.00 . A A . 21 ARG HD2 1 1 7 1961 1 1 21 ARG HD3 H 19.439 -3.338 -1.527 1.00 . A A . 21 ARG HD3 1 1 7 1962 1 1 21 ARG HE H 20.940 -5.411 -2.687 1.00 . A A . 21 ARG HE 1 1 7 1963 1 1 21 ARG HG2 H 20.621 -4.916 -0.120 1.00 . A A . 21 ARG HG2 1 1 7 1964 1 1 21 ARG HG3 H 19.681 -6.260 -0.768 1.00 . A A . 21 ARG HG3 1 1 7 1965 1 1 21 ARG HH11 H 18.579 -3.023 -3.521 1.00 . A A . 21 ARG HH11 1 1 7 1966 1 1 21 ARG HH12 H 19.128 -2.850 -5.155 1.00 . A A . 21 ARG HH12 1 1 7 1967 1 1 21 ARG HH21 H 21.664 -5.194 -4.828 1.00 . A A . 21 ARG HH21 1 1 7 1968 1 1 21 ARG HH22 H 20.876 -4.080 -5.895 1.00 . A A . 21 ARG HH22 1 1 7 1969 1 1 21 ARG N N 17.850 -5.663 2.790 1.00 . A A . 21 ARG N 1 1 7 1970 1 1 21 ARG NE N 20.240 -4.743 -2.842 1.00 . A A . 21 ARG NE 1 1 7 1971 1 1 21 ARG NH1 N 19.209 -3.279 -4.255 1.00 . A A . 21 ARG NH1 1 1 7 1972 1 1 21 ARG NH2 N 20.956 -4.509 -4.995 1.00 . A A . 21 ARG NH2 1 1 7 1973 1 1 21 ARG O O 20.516 -4.172 2.357 1.00 . A A . 21 ARG O 1 1 7 1974 1 1 21 ARG OXT O 20.990 -6.218 2.832 1.00 . A A . 21 ARG OXT 1 1 8 1975 1 1 1 ALA C C 11.244 4.008 -9.354 1.00 . A A . 1 ALA C 1 1 8 1976 1 1 1 ALA CA C 9.826 4.568 -9.340 1.00 . A A . 1 ALA CA 1 1 8 1977 1 1 1 ALA CB C 9.849 6.044 -8.936 1.00 . A A . 1 ALA CB 1 1 8 1978 1 1 1 ALA H1 H 8.702 2.902 -8.791 1.00 . A A . 1 ALA H1 1 1 8 1979 1 1 1 ALA H2 H 8.158 4.360 -8.110 1.00 . A A . 1 ALA H2 1 1 8 1980 1 1 1 ALA H3 H 9.559 3.611 -7.509 1.00 . A A . 1 ALA H3 1 1 8 1981 1 1 1 ALA HA H 9.394 4.473 -10.326 1.00 . A A . 1 ALA HA 1 1 8 1982 1 1 1 ALA HB1 H 9.157 6.205 -8.124 1.00 . A A . 1 ALA HB1 1 1 8 1983 1 1 1 ALA HB2 H 9.560 6.652 -9.781 1.00 . A A . 1 ALA HB2 1 1 8 1984 1 1 1 ALA HB3 H 10.845 6.315 -8.622 1.00 . A A . 1 ALA HB3 1 1 8 1985 1 1 1 ALA N N 8.999 3.802 -8.364 1.00 . A A . 1 ALA N 1 1 8 1986 1 1 1 ALA O O 11.838 3.821 -10.415 1.00 . A A . 1 ALA O 1 1 8 1987 1 1 2 GLY C C 14.173 4.314 -8.100 1.00 . A A . 2 GLY C 1 1 8 1988 1 1 2 GLY CA C 13.131 3.200 -8.055 1.00 . A A . 2 GLY CA 1 1 8 1989 1 1 2 GLY H H 11.261 3.910 -7.354 1.00 . A A . 2 GLY H 1 1 8 1990 1 1 2 GLY HA2 H 13.222 2.668 -7.118 1.00 . A A . 2 GLY HA2 1 1 8 1991 1 1 2 GLY HA3 H 13.308 2.516 -8.871 1.00 . A A . 2 GLY HA3 1 1 8 1992 1 1 2 GLY N N 11.782 3.742 -8.167 1.00 . A A . 2 GLY N 1 1 8 1993 1 1 2 GLY O O 15.373 4.051 -8.172 1.00 . A A . 2 GLY O 1 1 8 1994 1 1 3 GLY C C 15.492 6.742 -6.854 1.00 . A A . 3 GLY C 1 1 8 1995 1 1 3 GLY CA C 14.606 6.704 -8.094 1.00 . A A . 3 GLY CA 1 1 8 1996 1 1 3 GLY H H 12.740 5.706 -8.000 1.00 . A A . 3 GLY H 1 1 8 1997 1 1 3 GLY HA2 H 15.231 6.638 -8.975 1.00 . A A . 3 GLY HA2 1 1 8 1998 1 1 3 GLY HA3 H 14.024 7.611 -8.139 1.00 . A A . 3 GLY HA3 1 1 8 1999 1 1 3 GLY N N 13.705 5.557 -8.058 1.00 . A A . 3 GLY N 1 1 8 2000 1 1 3 GLY O O 16.665 7.103 -6.927 1.00 . A A . 3 GLY O 1 1 8 2001 1 1 4 . C C 14.655 6.803 -3.396 1.00 . A A . 4 DBU C 1 1 8 2002 1 1 4 . CA C 15.602 6.352 -4.483 1.00 . A A . 4 DBU CA 1 1 8 2003 1 1 4 . CB C 16.931 5.994 -4.232 1.00 . A A . 4 DBU CB 1 1 8 2004 1 1 4 . CG C 17.915 5.542 -5.283 1.00 . A A . 4 DBU CG 1 1 8 2005 1 1 4 . H H 13.977 6.092 -5.705 1.00 . A A . 4 DBU H 1 1 8 2006 1 1 4 . HB H 17.294 6.042 -3.217 1.00 . A A . 4 DBU HB 1 1 8 2007 1 1 4 . HG1 H 17.379 5.107 -6.115 1.00 . A A . 4 DBU HG1 1 1 8 2008 1 1 4 . HG2 H 18.582 4.804 -4.858 1.00 . A A . 4 DBU HG2 1 1 8 2009 1 1 4 . HG3 H 18.490 6.390 -5.628 1.00 . A A . 4 DBU HG3 1 1 8 2010 1 1 4 . N N 14.916 6.370 -5.714 1.00 . A A . 4 DBU N 1 1 8 2011 1 1 4 . O O 13.790 7.640 -3.648 1.00 . A A . 4 DBU O 1 1 8 2012 1 1 5 ILE C C 13.055 5.412 -0.655 1.00 . A A . 5 ILE C 1 1 8 2013 1 1 5 ILE CA C 13.986 6.562 -1.037 1.00 . A A . 5 ILE CA 1 1 8 2014 1 1 5 ILE CB C 13.142 7.815 -1.277 1.00 . A A . 5 ILE CB 1 1 8 2015 1 1 5 ILE CD1 C 14.718 9.459 -0.255 1.00 . A A . 5 ILE CD1 1 1 8 2016 1 1 5 ILE CG1 C 14.060 9.010 -1.556 1.00 . A A . 5 ILE CG1 1 1 8 2017 1 1 5 ILE CG2 C 12.303 8.094 -0.027 1.00 . A A . 5 ILE CG2 1 1 8 2018 1 1 5 ILE H H 15.539 5.573 -2.088 1.00 . A A . 5 ILE H 1 1 8 2019 1 1 5 ILE HA H 14.632 6.746 -0.207 1.00 . A A . 5 ILE HA 1 1 8 2020 1 1 5 ILE HB H 12.487 7.651 -2.118 1.00 . A A . 5 ILE HB 1 1 8 2021 1 1 5 ILE HD11 H 15.742 9.738 -0.446 1.00 . A A . 5 ILE HD11 1 1 8 2022 1 1 5 ILE HD12 H 14.692 8.647 0.458 1.00 . A A . 5 ILE HD12 1 1 8 2023 1 1 5 ILE HD13 H 14.180 10.306 0.144 1.00 . A A . 5 ILE HD13 1 1 8 2024 1 1 5 ILE HG12 H 14.823 8.725 -2.264 1.00 . A A . 5 ILE HG12 1 1 8 2025 1 1 5 ILE HG13 H 13.479 9.823 -1.962 1.00 . A A . 5 ILE HG13 1 1 8 2026 1 1 5 ILE HG21 H 12.899 7.907 0.855 1.00 . A A . 5 ILE HG21 1 1 8 2027 1 1 5 ILE HG22 H 11.437 7.447 -0.020 1.00 . A A . 5 ILE HG22 1 1 8 2028 1 1 5 ILE HG23 H 11.982 9.126 -0.031 1.00 . A A . 5 ILE HG23 1 1 8 2029 1 1 5 ILE N N 14.825 6.237 -2.196 1.00 . A A . 5 ILE N 1 1 8 2030 1 1 5 ILE O O 12.747 5.225 0.522 1.00 . A A . 5 ILE O 1 1 8 2031 1 1 6 PRO C C 12.422 2.343 -0.707 1.00 . A A . 6 PRO C 1 1 8 2032 1 1 6 PRO CA C 11.687 3.513 -1.335 1.00 . A A . 6 PRO CA 1 1 8 2033 1 1 6 PRO CB C 11.128 3.132 -2.702 1.00 . A A . 6 PRO CB 1 1 8 2034 1 1 6 PRO CD C 12.905 4.777 -3.031 1.00 . A A . 6 PRO CD 1 1 8 2035 1 1 6 PRO CG C 12.058 3.713 -3.718 1.00 . A A . 6 PRO CG 1 1 8 2036 1 1 6 PRO HA H 10.877 3.832 -0.697 1.00 . A A . 6 PRO HA 1 1 8 2037 1 1 6 PRO HB2 H 11.094 2.054 -2.796 1.00 . A A . 6 PRO HB2 1 1 8 2038 1 1 6 PRO HB3 H 10.141 3.547 -2.826 1.00 . A A . 6 PRO HB3 1 1 8 2039 1 1 6 PRO HD2 H 13.951 4.593 -3.213 1.00 . A A . 6 PRO HD2 1 1 8 2040 1 1 6 PRO HD3 H 12.630 5.759 -3.376 1.00 . A A . 6 PRO HD3 1 1 8 2041 1 1 6 PRO HG2 H 12.693 2.940 -4.121 1.00 . A A . 6 PRO HG2 1 1 8 2042 1 1 6 PRO HG3 H 11.495 4.175 -4.503 1.00 . A A . 6 PRO HG3 1 1 8 2043 1 1 6 PRO N N 12.598 4.648 -1.606 1.00 . A A . 6 PRO N 1 1 8 2044 1 1 6 PRO O O 12.435 1.243 -1.252 1.00 . A A . 6 PRO O 1 1 8 2045 1 1 7 DAL C C 15.211 1.449 0.599 1.00 . A A . 7 DAL C 1 1 8 2046 1 1 7 DAL CA C 13.783 1.547 1.124 1.00 . A A . 7 DAL CA 1 1 8 2047 1 1 7 DAL CB C 13.808 1.817 2.632 1.00 . A A . 7 DAL CB 1 1 8 2048 1 1 7 DAL H H 13.017 3.492 0.821 1.00 . A A . 7 DAL H 1 1 8 2049 1 1 7 DAL HA H 13.290 0.609 0.957 1.00 . A A . 7 DAL HA 1 1 8 2050 1 1 7 DAL HB1 H 14.826 1.825 2.970 1.00 . A A . 7 DAL HB1 1 1 8 2051 1 1 7 DAL HB2 H 13.269 1.036 3.145 1.00 . A A . 7 DAL HB2 1 1 8 2052 1 1 7 DAL N N 13.048 2.593 0.438 1.00 . A A . 7 DAL N 1 1 8 2053 1 1 7 DAL O O 16.039 0.728 1.150 1.00 . A A . 7 DAL O 1 1 8 2054 1 1 8 LEU C C 17.803 2.676 0.064 1.00 . A A . 8 LEU C 1 1 8 2055 1 1 8 LEU CA C 16.863 2.146 -0.998 1.00 . A A . 8 LEU CA 1 1 8 2056 1 1 8 LEU CB C 16.965 2.988 -2.272 1.00 . A A . 8 LEU CB 1 1 8 2057 1 1 8 LEU CD1 C 16.077 3.155 -4.611 1.00 . A A . 8 LEU CD1 1 1 8 2058 1 1 8 LEU CD2 C 15.622 1.113 -3.246 1.00 . A A . 8 LEU CD2 1 1 8 2059 1 1 8 LEU CG C 15.801 2.632 -3.199 1.00 . A A . 8 LEU CG 1 1 8 2060 1 1 8 LEU H H 14.835 2.760 -0.871 1.00 . A A . 8 LEU H 1 1 8 2061 1 1 8 LEU HA H 17.128 1.121 -1.224 1.00 . A A . 8 LEU HA 1 1 8 2062 1 1 8 LEU HB2 H 16.920 4.036 -2.017 1.00 . A A . 8 LEU HB2 1 1 8 2063 1 1 8 LEU HB3 H 17.898 2.775 -2.771 1.00 . A A . 8 LEU HB3 1 1 8 2064 1 1 8 LEU HD11 H 17.116 3.429 -4.700 1.00 . A A . 8 LEU HD11 1 1 8 2065 1 1 8 LEU HD12 H 15.458 4.016 -4.802 1.00 . A A . 8 LEU HD12 1 1 8 2066 1 1 8 LEU HD13 H 15.846 2.382 -5.330 1.00 . A A . 8 LEU HD13 1 1 8 2067 1 1 8 LEU HD21 H 16.590 0.636 -3.273 1.00 . A A . 8 LEU HD21 1 1 8 2068 1 1 8 LEU HD22 H 15.061 0.844 -4.129 1.00 . A A . 8 LEU HD22 1 1 8 2069 1 1 8 LEU HD23 H 15.084 0.790 -2.367 1.00 . A A . 8 LEU HD23 1 1 8 2070 1 1 8 LEU HG H 14.901 3.087 -2.818 1.00 . A A . 8 LEU HG 1 1 8 2071 1 1 8 LEU N N 15.514 2.183 -0.461 1.00 . A A . 8 LEU N 1 1 8 2072 1 1 8 LEU O O 18.957 2.265 0.162 1.00 . A A . 8 LEU O 1 1 8 2073 1 1 9 MET C C 18.332 3.121 3.015 1.00 . A A . 9 MET C 1 1 8 2074 1 1 9 MET CA C 18.044 4.183 1.952 1.00 . A A . 9 MET CA 1 1 8 2075 1 1 9 MET CB C 17.247 5.332 2.573 1.00 . A A . 9 MET CB 1 1 8 2076 1 1 9 MET CE C 14.781 7.150 3.080 1.00 . A A . 9 MET CE 1 1 8 2077 1 1 9 MET CG C 16.786 6.278 1.464 1.00 . A A . 9 MET CG 1 1 8 2078 1 1 9 MET H H 16.346 3.864 0.740 1.00 . A A . 9 MET H 1 1 8 2079 1 1 9 MET HA H 18.975 4.565 1.566 1.00 . A A . 9 MET HA 1 1 8 2080 1 1 9 MET HB2 H 16.387 4.934 3.091 1.00 . A A . 9 MET HB2 1 1 8 2081 1 1 9 MET HB3 H 17.871 5.871 3.269 1.00 . A A . 9 MET HB3 1 1 8 2082 1 1 9 MET HE1 H 14.937 7.254 4.145 1.00 . A A . 9 MET HE1 1 1 8 2083 1 1 9 MET HE2 H 14.668 6.106 2.836 1.00 . A A . 9 MET HE2 1 1 8 2084 1 1 9 MET HE3 H 13.890 7.686 2.788 1.00 . A A . 9 MET HE3 1 1 8 2085 1 1 9 MET HG2 H 17.604 6.474 0.788 1.00 . A A . 9 MET HG2 1 1 8 2086 1 1 9 MET HG3 H 15.973 5.816 0.918 1.00 . A A . 9 MET HG3 1 1 8 2087 1 1 9 MET N N 17.278 3.592 0.870 1.00 . A A . 9 MET N 1 1 8 2088 1 1 9 MET O O 19.429 3.066 3.575 1.00 . A A . 9 MET O 1 1 8 2089 1 1 9 MET SD S 16.208 7.830 2.197 1.00 . A A . 9 MET SD 1 1 8 2090 1 1 10 . C C 16.607 1.448 5.481 1.00 . A A . 10 DBB C 1 1 8 2091 1 1 10 . CA C 17.468 1.196 4.258 1.00 . A A . 10 DBB CA 1 1 8 2092 1 1 10 . CB C 17.055 -0.138 3.622 1.00 . A A . 10 DBB CB 1 1 8 2093 1 1 10 . CG C 15.525 -0.295 3.645 1.00 . A A . 10 DBB CG 1 1 8 2094 1 1 10 . H H 16.490 2.370 2.786 1.00 . A A . 10 DBB H 1 1 8 2095 1 1 10 . HA H 18.501 1.129 4.565 1.00 . A A . 10 DBB HA 1 1 8 2096 1 1 10 . HB2 H 17.365 -0.134 2.596 1.00 . A A . 10 DBB HB2 1 1 8 2097 1 1 10 . HG1 H 15.125 -0.058 2.676 1.00 . A A . 10 DBB HG1 1 1 8 2098 1 1 10 . HG2 H 15.091 0.361 4.377 1.00 . A A . 10 DBB HG2 1 1 8 2099 1 1 10 . HG3 H 15.273 -1.313 3.887 1.00 . A A . 10 DBB HG3 1 1 8 2100 1 1 10 . N N 17.333 2.273 3.275 1.00 . A A . 10 DBB N 1 1 8 2101 1 1 10 . O O 16.893 0.951 6.570 1.00 . A A . 10 DBB O 1 1 8 2102 1 1 11 GLY C C 13.297 2.973 5.829 1.00 . A A . 11 GLY C 1 1 8 2103 1 1 11 GLY CA C 14.639 2.496 6.370 1.00 . A A . 11 GLY CA 1 1 8 2104 1 1 11 GLY H H 15.364 2.566 4.398 1.00 . A A . 11 GLY H 1 1 8 2105 1 1 11 GLY HA2 H 14.494 1.605 6.962 1.00 . A A . 11 GLY HA2 1 1 8 2106 1 1 11 GLY HA3 H 15.075 3.260 6.978 1.00 . A A . 11 GLY HA3 1 1 8 2107 1 1 11 GLY N N 15.546 2.205 5.288 1.00 . A A . 11 GLY N 1 1 8 2108 1 1 11 GLY O O 12.986 4.164 5.875 1.00 . A A . 11 GLY O 1 1 8 2109 1 1 12 CYS C C 10.253 1.190 4.806 1.00 . A A . 12 CYS C 1 1 8 2110 1 1 12 CYS CA C 11.210 2.374 4.736 1.00 . A A . 12 CYS CA 1 1 8 2111 1 1 12 CYS CB C 11.370 2.793 3.274 1.00 . A A . 12 CYS CB 1 1 8 2112 1 1 12 CYS H H 12.819 1.104 5.282 1.00 . A A . 12 CYS H 1 1 8 2113 1 1 12 CYS HA H 10.791 3.199 5.290 1.00 . A A . 12 CYS HA 1 1 8 2114 1 1 12 CYS HB2 H 11.198 1.939 2.637 1.00 . A A . 12 CYS HB2 1 1 8 2115 1 1 12 CYS HB3 H 10.655 3.564 3.037 1.00 . A A . 12 CYS HB3 1 1 8 2116 1 1 12 CYS N N 12.513 2.037 5.301 1.00 . A A . 12 CYS N 1 1 8 2117 1 1 12 CYS O O 10.426 0.275 5.612 1.00 . A A . 12 CYS O 1 1 8 2118 1 1 12 CYS SG S 13.045 3.416 2.999 1.00 . A A . 12 CYS SG 1 1 8 2119 1 1 13 GLY C C 8.237 -0.466 2.493 1.00 . A A . 13 GLY C 1 1 8 2120 1 1 13 GLY CA C 8.255 0.151 3.877 1.00 . A A . 13 GLY CA 1 1 8 2121 1 1 13 GLY H H 9.181 1.975 3.316 1.00 . A A . 13 GLY H 1 1 8 2122 1 1 13 GLY HA2 H 8.496 -0.607 4.606 1.00 . A A . 13 GLY HA2 1 1 8 2123 1 1 13 GLY HA3 H 7.282 0.556 4.087 1.00 . A A . 13 GLY HA3 1 1 8 2124 1 1 13 GLY N N 9.248 1.219 3.938 1.00 . A A . 13 GLY N 1 1 8 2125 1 1 13 GLY O O 7.415 -1.331 2.189 1.00 . A A . 13 GLY O 1 1 8 2126 1 1 14 TRP C C 9.170 -2.037 0.302 1.00 . A A . 14 TRP C 1 1 8 2127 1 1 14 TRP CA C 9.257 -0.514 0.304 1.00 . A A . 14 TRP CA 1 1 8 2128 1 1 14 TRP CB C 10.587 -0.063 -0.295 1.00 . A A . 14 TRP CB 1 1 8 2129 1 1 14 TRP CD1 C 11.681 -1.468 1.489 1.00 . A A . 14 TRP CD1 1 1 8 2130 1 1 14 TRP CD2 C 12.973 -1.258 -0.339 1.00 . A A . 14 TRP CD2 1 1 8 2131 1 1 14 TRP CE2 C 13.694 -2.060 0.577 1.00 . A A . 14 TRP CE2 1 1 8 2132 1 1 14 TRP CE3 C 13.569 -0.971 -1.578 1.00 . A A . 14 TRP CE3 1 1 8 2133 1 1 14 TRP CG C 11.695 -0.898 0.267 1.00 . A A . 14 TRP CG 1 1 8 2134 1 1 14 TRP CH2 C 15.538 -2.264 -0.965 1.00 . A A . 14 TRP CH2 1 1 8 2135 1 1 14 TRP CZ2 C 14.961 -2.560 0.272 1.00 . A A . 14 TRP CZ2 1 1 8 2136 1 1 14 TRP CZ3 C 14.844 -1.471 -1.888 1.00 . A A . 14 TRP CZ3 1 1 8 2137 1 1 14 TRP H H 9.784 0.677 1.964 1.00 . A A . 14 TRP H 1 1 8 2138 1 1 14 TRP HA H 8.450 -0.109 -0.286 1.00 . A A . 14 TRP HA 1 1 8 2139 1 1 14 TRP HB2 H 10.558 -0.165 -1.366 1.00 . A A . 14 TRP HB2 1 1 8 2140 1 1 14 TRP HB3 H 10.758 0.974 -0.041 1.00 . A A . 14 TRP HB3 1 1 8 2141 1 1 14 TRP HD1 H 10.875 -1.396 2.199 1.00 . A A . 14 TRP HD1 1 1 8 2142 1 1 14 TRP HE1 H 13.104 -2.666 2.481 1.00 . A A . 14 TRP HE1 1 1 8 2143 1 1 14 TRP HE3 H 13.045 -0.360 -2.296 1.00 . A A . 14 TRP HE3 1 1 8 2144 1 1 14 TRP HH2 H 16.518 -2.646 -1.211 1.00 . A A . 14 TRP HH2 1 1 8 2145 1 1 14 TRP HZ2 H 15.492 -3.172 0.986 1.00 . A A . 14 TRP HZ2 1 1 8 2146 1 1 14 TRP HZ3 H 15.292 -1.243 -2.845 1.00 . A A . 14 TRP HZ3 1 1 8 2147 1 1 14 TRP N N 9.157 -0.012 1.659 1.00 . A A . 14 TRP N 1 1 8 2148 1 1 14 TRP NE1 N 12.864 -2.161 1.675 1.00 . A A . 14 TRP NE1 1 1 8 2149 1 1 14 TRP O O 9.011 -2.658 1.353 1.00 . A A . 14 TRP O 1 1 8 2150 1 1 15 LEU C C 9.706 -4.775 0.248 1.00 . A A . 15 LEU C 1 1 8 2151 1 1 15 LEU CA C 9.190 -4.081 -1.013 1.00 . A A . 15 LEU CA 1 1 8 2152 1 1 15 LEU CB C 10.016 -4.532 -2.218 1.00 . A A . 15 LEU CB 1 1 8 2153 1 1 15 LEU CD1 C 12.374 -4.657 -3.044 1.00 . A A . 15 LEU CD1 1 1 8 2154 1 1 15 LEU CD2 C 11.315 -2.438 -2.593 1.00 . A A . 15 LEU CD2 1 1 8 2155 1 1 15 LEU CG C 11.405 -3.896 -2.140 1.00 . A A . 15 LEU CG 1 1 8 2156 1 1 15 LEU H H 9.382 -2.080 -1.683 1.00 . A A . 15 LEU H 1 1 8 2157 1 1 15 LEU HA H 8.161 -4.366 -1.172 1.00 . A A . 15 LEU HA 1 1 8 2158 1 1 15 LEU HB2 H 10.109 -5.608 -2.209 1.00 . A A . 15 LEU HB2 1 1 8 2159 1 1 15 LEU HB3 H 9.529 -4.218 -3.128 1.00 . A A . 15 LEU HB3 1 1 8 2160 1 1 15 LEU HD11 H 13.344 -4.699 -2.572 1.00 . A A . 15 LEU HD11 1 1 8 2161 1 1 15 LEU HD12 H 12.455 -4.148 -3.993 1.00 . A A . 15 LEU HD12 1 1 8 2162 1 1 15 LEU HD13 H 12.007 -5.660 -3.201 1.00 . A A . 15 LEU HD13 1 1 8 2163 1 1 15 LEU HD21 H 11.123 -1.814 -1.738 1.00 . A A . 15 LEU HD21 1 1 8 2164 1 1 15 LEU HD22 H 10.510 -2.328 -3.303 1.00 . A A . 15 LEU HD22 1 1 8 2165 1 1 15 LEU HD23 H 12.243 -2.142 -3.054 1.00 . A A . 15 LEU HD23 1 1 8 2166 1 1 15 LEU HG H 11.759 -3.935 -1.121 1.00 . A A . 15 LEU HG 1 1 8 2167 1 1 15 LEU N N 9.265 -2.629 -0.881 1.00 . A A . 15 LEU N 1 1 8 2168 1 1 15 LEU O O 9.196 -5.825 0.638 1.00 . A A . 15 LEU O 1 1 8 2169 1 1 16 . C C 10.495 -4.218 3.253 1.00 . A A . 16 DBU C 1 1 8 2170 1 1 16 . CA C 11.265 -4.729 2.061 1.00 . A A . 16 DBU CA 1 1 8 2171 1 1 16 . CB C 12.345 -5.608 2.204 1.00 . A A . 16 DBU CB 1 1 8 2172 1 1 16 . CG C 13.157 -6.154 1.055 1.00 . A A . 16 DBU CG 1 1 8 2173 1 1 16 . H H 11.087 -3.345 0.545 1.00 . A A . 16 DBU H 1 1 8 2174 1 1 16 . HB H 12.633 -5.926 3.194 1.00 . A A . 16 DBU HB 1 1 8 2175 1 1 16 . HG1 H 13.943 -6.788 1.438 1.00 . A A . 16 DBU HG1 1 1 8 2176 1 1 16 . HG2 H 13.593 -5.331 0.507 1.00 . A A . 16 DBU HG2 1 1 8 2177 1 1 16 . HG3 H 12.518 -6.726 0.401 1.00 . A A . 16 DBU HG3 1 1 8 2178 1 1 16 . N N 10.712 -4.183 0.885 1.00 . A A . 16 DBU N 1 1 8 2179 1 1 16 . O O 9.430 -4.721 3.609 1.00 . A A . 16 DBU O 1 1 8 2180 1 1 17 GLY C C 11.386 -2.485 6.219 1.00 . A A . 17 GLY C 1 1 8 2181 1 1 17 GLY CA C 10.416 -2.580 5.046 1.00 . A A . 17 GLY CA 1 1 8 2182 1 1 17 GLY H H 11.900 -2.823 3.553 1.00 . A A . 17 GLY H 1 1 8 2183 1 1 17 GLY HA2 H 10.074 -1.589 4.788 1.00 . A A . 17 GLY HA2 1 1 8 2184 1 1 17 GLY HA3 H 9.568 -3.181 5.338 1.00 . A A . 17 GLY HA3 1 1 8 2185 1 1 17 GLY N N 11.052 -3.186 3.881 1.00 . A A . 17 GLY N 1 1 8 2186 1 1 17 GLY O O 11.495 -1.442 6.862 1.00 . A A . 17 GLY O 1 1 8 2187 1 1 18 LEU C C 14.472 -3.450 7.071 1.00 . A A . 18 LEU C 1 1 8 2188 1 1 18 LEU CA C 13.046 -3.599 7.597 1.00 . A A . 18 LEU CA 1 1 8 2189 1 1 18 LEU CB C 12.919 -4.907 8.381 1.00 . A A . 18 LEU CB 1 1 8 2190 1 1 18 LEU CD1 C 11.368 -6.341 9.724 1.00 . A A . 18 LEU CD1 1 1 8 2191 1 1 18 LEU CD2 C 11.235 -3.853 9.900 1.00 . A A . 18 LEU CD2 1 1 8 2192 1 1 18 LEU CG C 11.504 -5.026 8.954 1.00 . A A . 18 LEU CG 1 1 8 2193 1 1 18 LEU H H 11.962 -4.384 5.948 1.00 . A A . 18 LEU H 1 1 8 2194 1 1 18 LEU HA H 12.831 -2.774 8.258 1.00 . A A . 18 LEU HA 1 1 8 2195 1 1 18 LEU HB2 H 13.111 -5.742 7.723 1.00 . A A . 18 LEU HB2 1 1 8 2196 1 1 18 LEU HB3 H 13.633 -4.914 9.189 1.00 . A A . 18 LEU HB3 1 1 8 2197 1 1 18 LEU HD11 H 11.576 -6.169 10.770 1.00 . A A . 18 LEU HD11 1 1 8 2198 1 1 18 LEU HD12 H 12.068 -7.062 9.332 1.00 . A A . 18 LEU HD12 1 1 8 2199 1 1 18 LEU HD13 H 10.363 -6.720 9.616 1.00 . A A . 18 LEU HD13 1 1 8 2200 1 1 18 LEU HD21 H 12.173 -3.421 10.214 1.00 . A A . 18 LEU HD21 1 1 8 2201 1 1 18 LEU HD22 H 10.692 -4.205 10.765 1.00 . A A . 18 LEU HD22 1 1 8 2202 1 1 18 LEU HD23 H 10.648 -3.105 9.388 1.00 . A A . 18 LEU HD23 1 1 8 2203 1 1 18 LEU HG H 10.786 -5.009 8.145 1.00 . A A . 18 LEU HG 1 1 8 2204 1 1 18 LEU N N 12.088 -3.579 6.494 1.00 . A A . 18 LEU N 1 1 8 2205 1 1 18 LEU O O 15.433 -3.454 7.841 1.00 . A A . 18 LEU O 1 1 8 2206 1 1 19 CYS C C 16.761 -4.415 5.370 1.00 . A A . 19 CYS C 1 1 8 2207 1 1 19 CYS CA C 15.906 -3.180 5.122 1.00 . A A . 19 CYS CA 1 1 8 2208 1 1 19 CYS CB C 16.629 -1.936 5.650 1.00 . A A . 19 CYS CB 1 1 8 2209 1 1 19 CYS H H 13.793 -3.334 5.195 1.00 . A A . 19 CYS H 1 1 8 2210 1 1 19 CYS HA H 15.764 -3.071 4.057 1.00 . A A . 19 CYS HA 1 1 8 2211 1 1 19 CYS HB2 H 15.927 -1.125 5.756 1.00 . A A . 19 CYS HB2 1 1 8 2212 1 1 19 CYS HB3 H 17.067 -2.156 6.610 1.00 . A A . 19 CYS HB3 1 1 8 2213 1 1 19 CYS N N 14.598 -3.325 5.755 1.00 . A A . 19 CYS N 1 1 8 2214 1 1 19 CYS O O 17.438 -4.525 6.393 1.00 . A A . 19 CYS O 1 1 8 2215 1 1 19 CYS SG S 17.937 -1.467 4.484 1.00 . A A . 19 CYS SG 1 1 8 2216 1 1 20 VAL C C 18.591 -6.612 3.474 1.00 . A A . 20 VAL C 1 1 8 2217 1 1 20 VAL CA C 17.488 -6.572 4.527 1.00 . A A . 20 VAL CA 1 1 8 2218 1 1 20 VAL CB C 16.555 -7.770 4.350 1.00 . A A . 20 VAL CB 1 1 8 2219 1 1 20 VAL CG1 C 15.793 -8.017 5.654 1.00 . A A . 20 VAL CG1 1 1 8 2220 1 1 20 VAL CG2 C 15.555 -7.467 3.231 1.00 . A A . 20 VAL CG2 1 1 8 2221 1 1 20 VAL H H 16.159 -5.192 3.631 1.00 . A A . 20 VAL H 1 1 8 2222 1 1 20 VAL HA H 17.936 -6.624 5.509 1.00 . A A . 20 VAL HA 1 1 8 2223 1 1 20 VAL HB H 17.134 -8.645 4.095 1.00 . A A . 20 VAL HB 1 1 8 2224 1 1 20 VAL HG11 H 15.151 -7.175 5.861 1.00 . A A . 20 VAL HG11 1 1 8 2225 1 1 20 VAL HG12 H 16.497 -8.140 6.464 1.00 . A A . 20 VAL HG12 1 1 8 2226 1 1 20 VAL HG13 H 15.196 -8.912 5.558 1.00 . A A . 20 VAL HG13 1 1 8 2227 1 1 20 VAL HG21 H 15.025 -6.553 3.459 1.00 . A A . 20 VAL HG21 1 1 8 2228 1 1 20 VAL HG22 H 14.850 -8.280 3.150 1.00 . A A . 20 VAL HG22 1 1 8 2229 1 1 20 VAL HG23 H 16.084 -7.353 2.296 1.00 . A A . 20 VAL HG23 1 1 8 2230 1 1 20 VAL N N 16.720 -5.340 4.422 1.00 . A A . 20 VAL N 1 1 8 2231 1 1 20 VAL O O 19.357 -7.575 3.403 1.00 . A A . 20 VAL O 1 1 8 2232 1 1 21 ARG C C 20.855 -6.398 1.912 1.00 . A A . 21 ARG C 1 1 8 2233 1 1 21 ARG CA C 19.673 -5.481 1.605 1.00 . A A . 21 ARG CA 1 1 8 2234 1 1 21 ARG CB C 20.171 -4.040 1.471 1.00 . A A . 21 ARG CB 1 1 8 2235 1 1 21 ARG CD C 21.416 -2.208 2.634 1.00 . A A . 21 ARG CD 1 1 8 2236 1 1 21 ARG CG C 20.811 -3.603 2.790 1.00 . A A . 21 ARG CG 1 1 8 2237 1 1 21 ARG CZ C 20.670 0.041 2.116 1.00 . A A . 21 ARG CZ 1 1 8 2238 1 1 21 ARG H H 18.022 -4.830 2.765 1.00 . A A . 21 ARG H 1 1 8 2239 1 1 21 ARG HA H 19.229 -5.784 0.670 1.00 . A A . 21 ARG HA 1 1 8 2240 1 1 21 ARG HB2 H 20.903 -3.984 0.677 1.00 . A A . 21 ARG HB2 1 1 8 2241 1 1 21 ARG HB3 H 19.339 -3.387 1.241 1.00 . A A . 21 ARG HB3 1 1 8 2242 1 1 21 ARG HD2 H 21.935 -1.939 3.541 1.00 . A A . 21 ARG HD2 1 1 8 2243 1 1 21 ARG HD3 H 22.117 -2.214 1.811 1.00 . A A . 21 ARG HD3 1 1 8 2244 1 1 21 ARG HE H 19.432 -1.507 2.389 1.00 . A A . 21 ARG HE 1 1 8 2245 1 1 21 ARG HG2 H 20.058 -3.584 3.564 1.00 . A A . 21 ARG HG2 1 1 8 2246 1 1 21 ARG HG3 H 21.587 -4.302 3.061 1.00 . A A . 21 ARG HG3 1 1 8 2247 1 1 21 ARG HH11 H 22.647 -0.232 2.280 1.00 . A A . 21 ARG HH11 1 1 8 2248 1 1 21 ARG HH12 H 22.143 1.381 1.904 1.00 . A A . 21 ARG HH12 1 1 8 2249 1 1 21 ARG HH21 H 18.764 0.605 1.893 1.00 . A A . 21 ARG HH21 1 1 8 2250 1 1 21 ARG HH22 H 19.945 1.854 1.685 1.00 . A A . 21 ARG HH22 1 1 8 2251 1 1 21 ARG N N 18.662 -5.564 2.658 1.00 . A A . 21 ARG N 1 1 8 2252 1 1 21 ARG NE N 20.369 -1.226 2.374 1.00 . A A . 21 ARG NE 1 1 8 2253 1 1 21 ARG NH1 N 21.917 0.428 2.099 1.00 . A A . 21 ARG NH1 1 1 8 2254 1 1 21 ARG NH2 N 19.719 0.900 1.881 1.00 . A A . 21 ARG NH2 1 1 8 2255 1 1 21 ARG O O 21.305 -7.075 1.004 1.00 . A A . 21 ARG O 1 1 8 2256 1 1 21 ARG OXT O 21.290 -6.410 3.052 1.00 . A A . 21 ARG OXT 1 1 9 2257 1 1 1 ALA C C 6.316 6.744 -6.622 1.00 . A A . 1 ALA C 1 1 9 2258 1 1 1 ALA CA C 5.038 6.074 -6.127 1.00 . A A . 1 ALA CA 1 1 9 2259 1 1 1 ALA CB C 4.859 6.330 -4.630 1.00 . A A . 1 ALA CB 1 1 9 2260 1 1 1 ALA H1 H 4.200 4.258 -6.709 1.00 . A A . 1 ALA H1 1 1 9 2261 1 1 1 ALA H2 H 5.368 4.121 -5.483 1.00 . A A . 1 ALA H2 1 1 9 2262 1 1 1 ALA H3 H 5.847 4.413 -7.087 1.00 . A A . 1 ALA H3 1 1 9 2263 1 1 1 ALA HA H 4.193 6.479 -6.664 1.00 . A A . 1 ALA HA 1 1 9 2264 1 1 1 ALA HB1 H 5.721 5.962 -4.095 1.00 . A A . 1 ALA HB1 1 1 9 2265 1 1 1 ALA HB2 H 3.972 5.821 -4.281 1.00 . A A . 1 ALA HB2 1 1 9 2266 1 1 1 ALA HB3 H 4.754 7.392 -4.457 1.00 . A A . 1 ALA HB3 1 1 9 2267 1 1 1 ALA N N 5.120 4.606 -6.370 1.00 . A A . 1 ALA N 1 1 9 2268 1 1 1 ALA O O 6.351 7.303 -7.717 1.00 . A A . 1 ALA O 1 1 9 2269 1 1 2 GLY C C 9.782 6.293 -5.991 1.00 . A A . 2 GLY C 1 1 9 2270 1 1 2 GLY CA C 8.639 7.287 -6.170 1.00 . A A . 2 GLY CA 1 1 9 2271 1 1 2 GLY H H 7.277 6.224 -4.944 1.00 . A A . 2 GLY H 1 1 9 2272 1 1 2 GLY HA2 H 8.600 7.604 -7.202 1.00 . A A . 2 GLY HA2 1 1 9 2273 1 1 2 GLY HA3 H 8.816 8.147 -5.541 1.00 . A A . 2 GLY HA3 1 1 9 2274 1 1 2 GLY N N 7.364 6.683 -5.806 1.00 . A A . 2 GLY N 1 1 9 2275 1 1 2 GLY O O 9.776 5.489 -5.059 1.00 . A A . 2 GLY O 1 1 9 2276 1 1 3 GLY C C 13.035 6.070 -5.996 1.00 . A A . 3 GLY C 1 1 9 2277 1 1 3 GLY CA C 11.907 5.452 -6.819 1.00 . A A . 3 GLY CA 1 1 9 2278 1 1 3 GLY H H 10.712 7.016 -7.610 1.00 . A A . 3 GLY H 1 1 9 2279 1 1 3 GLY HA2 H 11.599 4.524 -6.363 1.00 . A A . 3 GLY HA2 1 1 9 2280 1 1 3 GLY HA3 H 12.266 5.254 -7.817 1.00 . A A . 3 GLY HA3 1 1 9 2281 1 1 3 GLY N N 10.761 6.354 -6.889 1.00 . A A . 3 GLY N 1 1 9 2282 1 1 3 GLY O O 13.735 6.969 -6.461 1.00 . A A . 3 GLY O 1 1 9 2283 1 1 4 . C C 13.521 6.726 -2.725 1.00 . A A . 4 DBU C 1 1 9 2284 1 1 4 . CA C 14.200 6.066 -3.895 1.00 . A A . 4 DBU CA 1 1 9 2285 1 1 4 . CB C 15.595 6.002 -3.989 1.00 . A A . 4 DBU CB 1 1 9 2286 1 1 4 . CG C 16.333 5.354 -5.135 1.00 . A A . 4 DBU CG 1 1 9 2287 1 1 4 . H H 12.613 4.868 -4.444 1.00 . A A . 4 DBU H 1 1 9 2288 1 1 4 . HB H 16.193 6.437 -3.201 1.00 . A A . 4 DBU HB 1 1 9 2289 1 1 4 . HG1 H 17.077 4.673 -4.750 1.00 . A A . 4 DBU HG1 1 1 9 2290 1 1 4 . HG2 H 16.816 6.125 -5.715 1.00 . A A . 4 DBU HG2 1 1 9 2291 1 1 4 . HG3 H 15.639 4.812 -5.760 1.00 . A A . 4 DBU HG3 1 1 9 2292 1 1 4 . N N 13.200 5.584 -4.770 1.00 . A A . 4 DBU N 1 1 9 2293 1 1 4 . O O 12.719 7.638 -2.924 1.00 . A A . 4 DBU O 1 1 9 2294 1 1 5 ILE C C 12.197 5.842 0.325 1.00 . A A . 5 ILE C 1 1 9 2295 1 1 5 ILE CA C 13.235 6.790 -0.285 1.00 . A A . 5 ILE CA 1 1 9 2296 1 1 5 ILE CB C 12.589 8.151 -0.523 1.00 . A A . 5 ILE CB 1 1 9 2297 1 1 5 ILE CD1 C 14.617 9.486 0.023 1.00 . A A . 5 ILE CD1 1 1 9 2298 1 1 5 ILE CG1 C 13.636 9.120 -1.084 1.00 . A A . 5 ILE CG1 1 1 9 2299 1 1 5 ILE CG2 C 12.064 8.689 0.808 1.00 . A A . 5 ILE CG2 1 1 9 2300 1 1 5 ILE H H 14.473 5.517 -1.443 1.00 . A A . 5 ILE H 1 1 9 2301 1 1 5 ILE HA H 14.020 6.916 0.429 1.00 . A A . 5 ILE HA 1 1 9 2302 1 1 5 ILE HB H 11.771 8.049 -1.217 1.00 . A A . 5 ILE HB 1 1 9 2303 1 1 5 ILE HD11 H 15.599 9.639 -0.400 1.00 . A A . 5 ILE HD11 1 1 9 2304 1 1 5 ILE HD12 H 14.656 8.682 0.744 1.00 . A A . 5 ILE HD12 1 1 9 2305 1 1 5 ILE HD13 H 14.289 10.392 0.511 1.00 . A A . 5 ILE HD13 1 1 9 2306 1 1 5 ILE HG12 H 14.170 8.651 -1.894 1.00 . A A . 5 ILE HG12 1 1 9 2307 1 1 5 ILE HG13 H 13.150 10.011 -1.443 1.00 . A A . 5 ILE HG13 1 1 9 2308 1 1 5 ILE HG21 H 11.125 8.211 1.043 1.00 . A A . 5 ILE HG21 1 1 9 2309 1 1 5 ILE HG22 H 11.917 9.757 0.732 1.00 . A A . 5 ILE HG22 1 1 9 2310 1 1 5 ILE HG23 H 12.781 8.479 1.587 1.00 . A A . 5 ILE HG23 1 1 9 2311 1 1 5 ILE N N 13.829 6.255 -1.514 1.00 . A A . 5 ILE N 1 1 9 2312 1 1 5 ILE O O 11.986 5.856 1.537 1.00 . A A . 5 ILE O 1 1 9 2313 1 1 6 PRO C C 11.191 2.976 0.860 1.00 . A A . 6 PRO C 1 1 9 2314 1 1 6 PRO CA C 10.539 4.079 0.059 1.00 . A A . 6 PRO CA 1 1 9 2315 1 1 6 PRO CB C 9.841 3.512 -1.177 1.00 . A A . 6 PRO CB 1 1 9 2316 1 1 6 PRO CD C 11.718 4.909 -1.913 1.00 . A A . 6 PRO CD 1 1 9 2317 1 1 6 PRO CG C 10.657 3.913 -2.365 1.00 . A A . 6 PRO CG 1 1 9 2318 1 1 6 PRO HA H 9.823 4.606 0.667 1.00 . A A . 6 PRO HA 1 1 9 2319 1 1 6 PRO HB2 H 9.794 2.434 -1.108 1.00 . A A . 6 PRO HB2 1 1 9 2320 1 1 6 PRO HB3 H 8.847 3.916 -1.257 1.00 . A A . 6 PRO HB3 1 1 9 2321 1 1 6 PRO HD2 H 12.704 4.539 -2.151 1.00 . A A . 6 PRO HD2 1 1 9 2322 1 1 6 PRO HD3 H 11.552 5.863 -2.377 1.00 . A A . 6 PRO HD3 1 1 9 2323 1 1 6 PRO HG2 H 11.128 3.043 -2.798 1.00 . A A . 6 PRO HG2 1 1 9 2324 1 1 6 PRO HG3 H 10.028 4.388 -3.094 1.00 . A A . 6 PRO HG3 1 1 9 2325 1 1 6 PRO N N 11.552 5.023 -0.464 1.00 . A A . 6 PRO N 1 1 9 2326 1 1 6 PRO O O 10.508 2.136 1.440 1.00 . A A . 6 PRO O 1 1 9 2327 1 1 7 DAL C C 14.568 1.639 0.879 1.00 . A A . 7 DAL C 1 1 9 2328 1 1 7 DAL CA C 13.284 1.996 1.607 1.00 . A A . 7 DAL CA 1 1 9 2329 1 1 7 DAL CB C 13.664 2.515 2.996 1.00 . A A . 7 DAL CB 1 1 9 2330 1 1 7 DAL H H 12.993 3.700 0.388 1.00 . A A . 7 DAL H 1 1 9 2331 1 1 7 DAL HA H 12.683 1.109 1.722 1.00 . A A . 7 DAL HA 1 1 9 2332 1 1 7 DAL HB1 H 14.673 2.891 2.973 1.00 . A A . 7 DAL HB1 1 1 9 2333 1 1 7 DAL HB2 H 13.601 1.704 3.703 1.00 . A A . 7 DAL HB2 1 1 9 2334 1 1 7 DAL N N 12.520 2.995 0.878 1.00 . A A . 7 DAL N 1 1 9 2335 1 1 7 DAL O O 15.262 0.718 1.286 1.00 . A A . 7 DAL O 1 1 9 2336 1 1 8 LEU C C 17.306 2.635 -0.035 1.00 . A A . 8 LEU C 1 1 9 2337 1 1 8 LEU CA C 16.153 2.106 -0.877 1.00 . A A . 8 LEU CA 1 1 9 2338 1 1 8 LEU CB C 16.164 2.768 -2.257 1.00 . A A . 8 LEU CB 1 1 9 2339 1 1 8 LEU CD1 C 14.989 2.899 -4.462 1.00 . A A . 8 LEU CD1 1 1 9 2340 1 1 8 LEU CD2 C 14.640 0.914 -2.995 1.00 . A A . 8 LEU CD2 1 1 9 2341 1 1 8 LEU CG C 14.875 2.425 -3.012 1.00 . A A . 8 LEU CG 1 1 9 2342 1 1 8 LEU H H 14.341 3.127 -0.453 1.00 . A A . 8 LEU H 1 1 9 2343 1 1 8 LEU HA H 16.272 1.040 -0.988 1.00 . A A . 8 LEU HA 1 1 9 2344 1 1 8 LEU HB2 H 16.240 3.840 -2.140 1.00 . A A . 8 LEU HB2 1 1 9 2345 1 1 8 LEU HB3 H 17.014 2.409 -2.818 1.00 . A A . 8 LEU HB3 1 1 9 2346 1 1 8 LEU HD11 H 14.435 3.817 -4.585 1.00 . A A . 8 LEU HD11 1 1 9 2347 1 1 8 LEU HD12 H 14.584 2.144 -5.119 1.00 . A A . 8 LEU HD12 1 1 9 2348 1 1 8 LEU HD13 H 16.026 3.069 -4.707 1.00 . A A . 8 LEU HD13 1 1 9 2349 1 1 8 LEU HD21 H 15.390 0.432 -2.388 1.00 . A A . 8 LEU HD21 1 1 9 2350 1 1 8 LEU HD22 H 14.694 0.531 -4.003 1.00 . A A . 8 LEU HD22 1 1 9 2351 1 1 8 LEU HD23 H 13.661 0.710 -2.585 1.00 . A A . 8 LEU HD23 1 1 9 2352 1 1 8 LEU HG H 14.042 2.924 -2.539 1.00 . A A . 8 LEU HG 1 1 9 2353 1 1 8 LEU N N 14.909 2.379 -0.172 1.00 . A A . 8 LEU N 1 1 9 2354 1 1 8 LEU O O 18.439 2.160 -0.122 1.00 . A A . 8 LEU O 1 1 9 2355 1 1 9 MET C C 18.333 3.249 2.800 1.00 . A A . 9 MET C 1 1 9 2356 1 1 9 MET CA C 17.971 4.227 1.687 1.00 . A A . 9 MET CA 1 1 9 2357 1 1 9 MET CB C 17.399 5.509 2.297 1.00 . A A . 9 MET CB 1 1 9 2358 1 1 9 MET CE C 18.373 7.864 0.414 1.00 . A A . 9 MET CE 1 1 9 2359 1 1 9 MET CG C 16.440 6.181 1.308 1.00 . A A . 9 MET CG 1 1 9 2360 1 1 9 MET H H 16.062 3.937 0.823 1.00 . A A . 9 MET H 1 1 9 2361 1 1 9 MET HA H 18.857 4.469 1.122 1.00 . A A . 9 MET HA 1 1 9 2362 1 1 9 MET HB2 H 16.862 5.265 3.203 1.00 . A A . 9 MET HB2 1 1 9 2363 1 1 9 MET HB3 H 18.204 6.190 2.530 1.00 . A A . 9 MET HB3 1 1 9 2364 1 1 9 MET HE1 H 18.862 8.367 -0.409 1.00 . A A . 9 MET HE1 1 1 9 2365 1 1 9 MET HE2 H 19.118 7.445 1.070 1.00 . A A . 9 MET HE2 1 1 9 2366 1 1 9 MET HE3 H 17.766 8.569 0.965 1.00 . A A . 9 MET HE3 1 1 9 2367 1 1 9 MET HG2 H 15.604 5.529 1.105 1.00 . A A . 9 MET HG2 1 1 9 2368 1 1 9 MET HG3 H 16.078 7.099 1.734 1.00 . A A . 9 MET HG3 1 1 9 2369 1 1 9 MET N N 16.986 3.622 0.798 1.00 . A A . 9 MET N 1 1 9 2370 1 1 9 MET O O 19.509 2.992 3.062 1.00 . A A . 9 MET O 1 1 9 2371 1 1 9 MET SD S 17.320 6.540 -0.233 1.00 . A A . 9 MET SD 1 1 9 2372 1 1 10 . C C 16.740 2.119 5.760 1.00 . A A . 10 DBB C 1 1 9 2373 1 1 10 . CA C 17.502 1.713 4.500 1.00 . A A . 10 DBB CA 1 1 9 2374 1 1 10 . CB C 17.020 0.334 4.023 1.00 . A A . 10 DBB CB 1 1 9 2375 1 1 10 . CG C 17.289 0.204 2.528 1.00 . A A . 10 DBB CG 1 1 9 2376 1 1 10 . H H 16.396 2.923 3.162 1.00 . A A . 10 DBB H 1 1 9 2377 1 1 10 . HA H 18.555 1.652 4.730 1.00 . A A . 10 DBB HA 1 1 9 2378 1 1 10 . HB2 H 17.551 -0.446 4.539 1.00 . A A . 10 DBB HB2 1 1 9 2379 1 1 10 . HG1 H 17.078 1.144 2.039 1.00 . A A . 10 DBB HG1 1 1 9 2380 1 1 10 . HG2 H 16.649 -0.562 2.115 1.00 . A A . 10 DBB HG2 1 1 9 2381 1 1 10 . HG3 H 18.322 -0.060 2.367 1.00 . A A . 10 DBB HG3 1 1 9 2382 1 1 10 . N N 17.306 2.688 3.431 1.00 . A A . 10 DBB N 1 1 9 2383 1 1 10 . O O 17.289 2.098 6.863 1.00 . A A . 10 DBB O 1 1 9 2384 1 1 11 GLY C C 13.205 3.149 6.280 1.00 . A A . 11 GLY C 1 1 9 2385 1 1 11 GLY CA C 14.640 2.877 6.724 1.00 . A A . 11 GLY CA 1 1 9 2386 1 1 11 GLY H H 15.082 2.470 4.693 1.00 . A A . 11 GLY H 1 1 9 2387 1 1 11 GLY HA2 H 14.640 2.086 7.461 1.00 . A A . 11 GLY HA2 1 1 9 2388 1 1 11 GLY HA3 H 15.049 3.773 7.164 1.00 . A A . 11 GLY HA3 1 1 9 2389 1 1 11 GLY N N 15.470 2.478 5.593 1.00 . A A . 11 GLY N 1 1 9 2390 1 1 11 GLY O O 12.703 4.266 6.419 1.00 . A A . 11 GLY O 1 1 9 2391 1 1 12 CYS C C 10.431 0.939 5.325 1.00 . A A . 12 CYS C 1 1 9 2392 1 1 12 CYS CA C 11.172 2.269 5.275 1.00 . A A . 12 CYS CA 1 1 9 2393 1 1 12 CYS CB C 11.153 2.742 3.827 1.00 . A A . 12 CYS CB 1 1 9 2394 1 1 12 CYS H H 12.998 1.258 5.652 1.00 . A A . 12 CYS H 1 1 9 2395 1 1 12 CYS HA H 10.663 2.990 5.888 1.00 . A A . 12 CYS HA 1 1 9 2396 1 1 12 CYS HB2 H 11.234 1.880 3.190 1.00 . A A . 12 CYS HB2 1 1 9 2397 1 1 12 CYS HB3 H 10.228 3.254 3.618 1.00 . A A . 12 CYS HB3 1 1 9 2398 1 1 12 CYS N N 12.549 2.124 5.741 1.00 . A A . 12 CYS N 1 1 9 2399 1 1 12 CYS O O 10.694 0.085 6.171 1.00 . A A . 12 CYS O 1 1 9 2400 1 1 12 CYS SG S 12.546 3.835 3.503 1.00 . A A . 12 CYS SG 1 1 9 2401 1 1 13 GLY C C 8.700 -0.826 2.765 1.00 . A A . 13 GLY C 1 1 9 2402 1 1 13 GLY CA C 8.732 -0.430 4.234 1.00 . A A . 13 GLY CA 1 1 9 2403 1 1 13 GLY H H 9.383 1.503 3.725 1.00 . A A . 13 GLY H 1 1 9 2404 1 1 13 GLY HA2 H 9.179 -1.222 4.816 1.00 . A A . 13 GLY HA2 1 1 9 2405 1 1 13 GLY HA3 H 7.725 -0.251 4.574 1.00 . A A . 13 GLY HA3 1 1 9 2406 1 1 13 GLY N N 9.517 0.782 4.374 1.00 . A A . 13 GLY N 1 1 9 2407 1 1 13 GLY O O 7.815 -1.560 2.323 1.00 . A A . 13 GLY O 1 1 9 2408 1 1 14 TRP C C 9.497 -2.072 0.324 1.00 . A A . 14 TRP C 1 1 9 2409 1 1 14 TRP CA C 9.789 -0.597 0.588 1.00 . A A . 14 TRP CA 1 1 9 2410 1 1 14 TRP CB C 11.208 -0.251 0.098 1.00 . A A . 14 TRP CB 1 1 9 2411 1 1 14 TRP CD1 C 11.898 -1.907 1.852 1.00 . A A . 14 TRP CD1 1 1 9 2412 1 1 14 TRP CD2 C 13.605 -1.357 0.507 1.00 . A A . 14 TRP CD2 1 1 9 2413 1 1 14 TRP CE2 C 14.113 -2.289 1.443 1.00 . A A . 14 TRP CE2 1 1 9 2414 1 1 14 TRP CE3 C 14.486 -0.850 -0.460 1.00 . A A . 14 TRP CE3 1 1 9 2415 1 1 14 TRP CG C 12.194 -1.134 0.796 1.00 . A A . 14 TRP CG 1 1 9 2416 1 1 14 TRP CH2 C 16.307 -2.183 0.444 1.00 . A A . 14 TRP CH2 1 1 9 2417 1 1 14 TRP CZ2 C 15.447 -2.699 1.417 1.00 . A A . 14 TRP CZ2 1 1 9 2418 1 1 14 TRP CZ3 C 15.827 -1.260 -0.491 1.00 . A A . 14 TRP CZ3 1 1 9 2419 1 1 14 TRP H H 10.347 0.266 2.439 1.00 . A A . 14 TRP H 1 1 9 2420 1 1 14 TRP HA H 9.074 0.009 0.053 1.00 . A A . 14 TRP HA 1 1 9 2421 1 1 14 TRP HB2 H 11.273 -0.402 -0.965 1.00 . A A . 14 TRP HB2 1 1 9 2422 1 1 14 TRP HB3 H 11.430 0.780 0.324 1.00 . A A . 14 TRP HB3 1 1 9 2423 1 1 14 TRP HD1 H 10.926 -1.975 2.314 1.00 . A A . 14 TRP HD1 1 1 9 2424 1 1 14 TRP HE1 H 13.084 -3.224 2.992 1.00 . A A . 14 TRP HE1 1 1 9 2425 1 1 14 TRP HE3 H 14.130 -0.138 -1.178 1.00 . A A . 14 TRP HE3 1 1 9 2426 1 1 14 TRP HH2 H 17.341 -2.494 0.415 1.00 . A A . 14 TRP HH2 1 1 9 2427 1 1 14 TRP HZ2 H 15.809 -3.413 2.142 1.00 . A A . 14 TRP HZ2 1 1 9 2428 1 1 14 TRP HZ3 H 16.494 -0.862 -1.244 1.00 . A A . 14 TRP HZ3 1 1 9 2429 1 1 14 TRP N N 9.682 -0.316 2.017 1.00 . A A . 14 TRP N 1 1 9 2430 1 1 14 TRP NE1 N 13.033 -2.594 2.243 1.00 . A A . 14 TRP NE1 1 1 9 2431 1 1 14 TRP O O 9.242 -2.837 1.252 1.00 . A A . 14 TRP O 1 1 9 2432 1 1 15 LEU C C 9.666 -4.793 -0.166 1.00 . A A . 15 LEU C 1 1 9 2433 1 1 15 LEU CA C 9.280 -3.852 -1.309 1.00 . A A . 15 LEU CA 1 1 9 2434 1 1 15 LEU CB C 10.086 -4.212 -2.559 1.00 . A A . 15 LEU CB 1 1 9 2435 1 1 15 LEU CD1 C 12.402 -4.542 -3.428 1.00 . A A . 15 LEU CD1 1 1 9 2436 1 1 15 LEU CD2 C 11.824 -2.452 -2.195 1.00 . A A . 15 LEU CD2 1 1 9 2437 1 1 15 LEU CG C 11.569 -3.957 -2.292 1.00 . A A . 15 LEU CG 1 1 9 2438 1 1 15 LEU H H 9.751 -1.812 -1.642 1.00 . A A . 15 LEU H 1 1 9 2439 1 1 15 LEU HA H 8.228 -3.969 -1.524 1.00 . A A . 15 LEU HA 1 1 9 2440 1 1 15 LEU HB2 H 9.933 -5.254 -2.798 1.00 . A A . 15 LEU HB2 1 1 9 2441 1 1 15 LEU HB3 H 9.760 -3.600 -3.387 1.00 . A A . 15 LEU HB3 1 1 9 2442 1 1 15 LEU HD11 H 12.048 -4.154 -4.370 1.00 . A A . 15 LEU HD11 1 1 9 2443 1 1 15 LEU HD12 H 12.312 -5.617 -3.422 1.00 . A A . 15 LEU HD12 1 1 9 2444 1 1 15 LEU HD13 H 13.437 -4.266 -3.291 1.00 . A A . 15 LEU HD13 1 1 9 2445 1 1 15 LEU HD21 H 11.705 -2.144 -1.172 1.00 . A A . 15 LEU HD21 1 1 9 2446 1 1 15 LEU HD22 H 11.115 -1.920 -2.813 1.00 . A A . 15 LEU HD22 1 1 9 2447 1 1 15 LEU HD23 H 12.829 -2.231 -2.523 1.00 . A A . 15 LEU HD23 1 1 9 2448 1 1 15 LEU HG H 11.850 -4.432 -1.363 1.00 . A A . 15 LEU HG 1 1 9 2449 1 1 15 LEU N N 9.539 -2.463 -0.941 1.00 . A A . 15 LEU N 1 1 9 2450 1 1 15 LEU O O 9.000 -5.800 0.071 1.00 . A A . 15 LEU O 1 1 9 2451 1 1 16 . C C 10.317 -5.113 2.816 1.00 . A A . 16 DBU C 1 1 9 2452 1 1 16 . CA C 11.246 -5.199 1.626 1.00 . A A . 16 DBU CA 1 1 9 2453 1 1 16 . CB C 12.429 -5.944 1.688 1.00 . A A . 16 DBU CB 1 1 9 2454 1 1 16 . CG C 13.426 -6.098 0.565 1.00 . A A . 16 DBU CG 1 1 9 2455 1 1 16 . H H 11.241 -3.642 0.314 1.00 . A A . 16 DBU H 1 1 9 2456 1 1 16 . HB H 12.671 -6.459 2.606 1.00 . A A . 16 DBU HB 1 1 9 2457 1 1 16 . HG1 H 14.048 -5.217 0.508 1.00 . A A . 16 DBU HG1 1 1 9 2458 1 1 16 . HG2 H 12.900 -6.228 -0.370 1.00 . A A . 16 DBU HG2 1 1 9 2459 1 1 16 . HG3 H 14.042 -6.963 0.755 1.00 . A A . 16 DBU HG3 1 1 9 2460 1 1 16 . N N 10.743 -4.455 0.538 1.00 . A A . 16 DBU N 1 1 9 2461 1 1 16 . O O 9.554 -6.034 3.108 1.00 . A A . 16 DBU O 1 1 9 2462 1 1 17 GLY C C 10.385 -3.276 5.862 1.00 . A A . 17 GLY C 1 1 9 2463 1 1 17 GLY CA C 9.549 -3.766 4.686 1.00 . A A . 17 GLY CA 1 1 9 2464 1 1 17 GLY H H 11.011 -3.286 3.238 1.00 . A A . 17 GLY H 1 1 9 2465 1 1 17 GLY HA2 H 8.794 -3.029 4.452 1.00 . A A . 17 GLY HA2 1 1 9 2466 1 1 17 GLY HA3 H 9.069 -4.694 4.957 1.00 . A A . 17 GLY HA3 1 1 9 2467 1 1 17 GLY N N 10.385 -3.983 3.514 1.00 . A A . 17 GLY N 1 1 9 2468 1 1 17 GLY O O 10.119 -2.215 6.428 1.00 . A A . 17 GLY O 1 1 9 2469 1 1 18 LEU C C 13.588 -3.106 6.803 1.00 . A A . 18 LEU C 1 1 9 2470 1 1 18 LEU CA C 12.278 -3.691 7.329 1.00 . A A . 18 LEU CA 1 1 9 2471 1 1 18 LEU CB C 12.568 -4.924 8.189 1.00 . A A . 18 LEU CB 1 1 9 2472 1 1 18 LEU CD1 C 11.504 -6.762 9.509 1.00 . A A . 18 LEU CD1 1 1 9 2473 1 1 18 LEU CD2 C 10.870 -4.388 9.943 1.00 . A A . 18 LEU CD2 1 1 9 2474 1 1 18 LEU CG C 11.278 -5.393 8.864 1.00 . A A . 18 LEU CG 1 1 9 2475 1 1 18 LEU H H 11.565 -4.886 5.728 1.00 . A A . 18 LEU H 1 1 9 2476 1 1 18 LEU HA H 11.783 -2.951 7.939 1.00 . A A . 18 LEU HA 1 1 9 2477 1 1 18 LEU HB2 H 12.958 -5.714 7.563 1.00 . A A . 18 LEU HB2 1 1 9 2478 1 1 18 LEU HB3 H 13.297 -4.672 8.945 1.00 . A A . 18 LEU HB3 1 1 9 2479 1 1 18 LEU HD11 H 10.585 -7.102 9.964 1.00 . A A . 18 LEU HD11 1 1 9 2480 1 1 18 LEU HD12 H 12.271 -6.682 10.264 1.00 . A A . 18 LEU HD12 1 1 9 2481 1 1 18 LEU HD13 H 11.815 -7.469 8.754 1.00 . A A . 18 LEU HD13 1 1 9 2482 1 1 18 LEU HD21 H 11.746 -4.072 10.490 1.00 . A A . 18 LEU HD21 1 1 9 2483 1 1 18 LEU HD22 H 10.171 -4.854 10.622 1.00 . A A . 18 LEU HD22 1 1 9 2484 1 1 18 LEU HD23 H 10.403 -3.532 9.479 1.00 . A A . 18 LEU HD23 1 1 9 2485 1 1 18 LEU HG H 10.493 -5.470 8.126 1.00 . A A . 18 LEU HG 1 1 9 2486 1 1 18 LEU N N 11.400 -4.054 6.221 1.00 . A A . 18 LEU N 1 1 9 2487 1 1 18 LEU O O 14.472 -2.738 7.579 1.00 . A A . 18 LEU O 1 1 9 2488 1 1 19 CYS C C 16.033 -3.519 4.901 1.00 . A A . 19 CYS C 1 1 9 2489 1 1 19 CYS CA C 14.907 -2.496 4.848 1.00 . A A . 19 CYS CA 1 1 9 2490 1 1 19 CYS CB C 15.351 -1.205 5.537 1.00 . A A . 19 CYS CB 1 1 9 2491 1 1 19 CYS H H 12.965 -3.343 4.917 1.00 . A A . 19 CYS H 1 1 9 2492 1 1 19 CYS HA H 14.686 -2.277 3.813 1.00 . A A . 19 CYS HA 1 1 9 2493 1 1 19 CYS HB2 H 14.705 -1.005 6.380 1.00 . A A . 19 CYS HB2 1 1 9 2494 1 1 19 CYS HB3 H 16.369 -1.310 5.881 1.00 . A A . 19 CYS HB3 1 1 9 2495 1 1 19 CYS N N 13.703 -3.030 5.481 1.00 . A A . 19 CYS N 1 1 9 2496 1 1 19 CYS O O 16.886 -3.475 5.788 1.00 . A A . 19 CYS O 1 1 9 2497 1 1 19 CYS SG S 15.250 0.163 4.356 1.00 . A A . 19 CYS SG 1 1 9 2498 1 1 20 VAL C C 18.427 -4.856 3.689 1.00 . A A . 20 VAL C 1 1 9 2499 1 1 20 VAL CA C 17.048 -5.477 3.887 1.00 . A A . 20 VAL CA 1 1 9 2500 1 1 20 VAL CB C 16.747 -6.432 2.733 1.00 . A A . 20 VAL CB 1 1 9 2501 1 1 20 VAL CG1 C 17.872 -7.462 2.612 1.00 . A A . 20 VAL CG1 1 1 9 2502 1 1 20 VAL CG2 C 15.421 -7.150 2.999 1.00 . A A . 20 VAL CG2 1 1 9 2503 1 1 20 VAL H H 15.319 -4.424 3.268 1.00 . A A . 20 VAL H 1 1 9 2504 1 1 20 VAL HA H 17.041 -6.031 4.813 1.00 . A A . 20 VAL HA 1 1 9 2505 1 1 20 VAL HB H 16.677 -5.871 1.812 1.00 . A A . 20 VAL HB 1 1 9 2506 1 1 20 VAL HG11 H 17.716 -8.065 1.732 1.00 . A A . 20 VAL HG11 1 1 9 2507 1 1 20 VAL HG12 H 17.875 -8.097 3.487 1.00 . A A . 20 VAL HG12 1 1 9 2508 1 1 20 VAL HG13 H 18.821 -6.952 2.536 1.00 . A A . 20 VAL HG13 1 1 9 2509 1 1 20 VAL HG21 H 14.636 -6.418 3.125 1.00 . A A . 20 VAL HG21 1 1 9 2510 1 1 20 VAL HG22 H 15.507 -7.745 3.896 1.00 . A A . 20 VAL HG22 1 1 9 2511 1 1 20 VAL HG23 H 15.184 -7.790 2.162 1.00 . A A . 20 VAL HG23 1 1 9 2512 1 1 20 VAL N N 16.026 -4.440 3.947 1.00 . A A . 20 VAL N 1 1 9 2513 1 1 20 VAL O O 19.389 -5.230 4.357 1.00 . A A . 20 VAL O 1 1 9 2514 1 1 21 ARG C C 20.155 -2.301 3.632 1.00 . A A . 21 ARG C 1 1 9 2515 1 1 21 ARG CA C 19.776 -3.233 2.486 1.00 . A A . 21 ARG CA 1 1 9 2516 1 1 21 ARG CB C 19.665 -2.432 1.187 1.00 . A A . 21 ARG CB 1 1 9 2517 1 1 21 ARG CD C 19.410 -2.596 -1.293 1.00 . A A . 21 ARG CD 1 1 9 2518 1 1 21 ARG CG C 19.564 -3.394 0.002 1.00 . A A . 21 ARG CG 1 1 9 2519 1 1 21 ARG CZ C 19.120 -3.038 -3.665 1.00 . A A . 21 ARG CZ 1 1 9 2520 1 1 21 ARG H H 17.709 -3.645 2.265 1.00 . A A . 21 ARG H 1 1 9 2521 1 1 21 ARG HA H 20.549 -3.978 2.371 1.00 . A A . 21 ARG HA 1 1 9 2522 1 1 21 ARG HB2 H 18.782 -1.810 1.222 1.00 . A A . 21 ARG HB2 1 1 9 2523 1 1 21 ARG HB3 H 20.539 -1.809 1.070 1.00 . A A . 21 ARG HB3 1 1 9 2524 1 1 21 ARG HD2 H 18.523 -1.984 -1.234 1.00 . A A . 21 ARG HD2 1 1 9 2525 1 1 21 ARG HD3 H 20.275 -1.962 -1.426 1.00 . A A . 21 ARG HD3 1 1 9 2526 1 1 21 ARG HE H 19.345 -4.469 -2.284 1.00 . A A . 21 ARG HE 1 1 9 2527 1 1 21 ARG HG2 H 20.460 -3.996 -0.049 1.00 . A A . 21 ARG HG2 1 1 9 2528 1 1 21 ARG HG3 H 18.706 -4.036 0.131 1.00 . A A . 21 ARG HG3 1 1 9 2529 1 1 21 ARG HH11 H 19.142 -1.115 -3.110 1.00 . A A . 21 ARG HH11 1 1 9 2530 1 1 21 ARG HH12 H 18.925 -1.404 -4.804 1.00 . A A . 21 ARG HH12 1 1 9 2531 1 1 21 ARG HH21 H 19.051 -4.855 -4.501 1.00 . A A . 21 ARG HH21 1 1 9 2532 1 1 21 ARG HH22 H 18.874 -3.522 -5.592 1.00 . A A . 21 ARG HH22 1 1 9 2533 1 1 21 ARG N N 18.511 -3.903 2.766 1.00 . A A . 21 ARG N 1 1 9 2534 1 1 21 ARG NE N 19.293 -3.501 -2.430 1.00 . A A . 21 ARG NE 1 1 9 2535 1 1 21 ARG NH1 N 19.057 -1.751 -3.876 1.00 . A A . 21 ARG NH1 1 1 9 2536 1 1 21 ARG NH2 N 19.006 -3.870 -4.663 1.00 . A A . 21 ARG NH2 1 1 9 2537 1 1 21 ARG O O 20.646 -2.795 4.634 1.00 . A A . 21 ARG O 1 1 9 2538 1 1 21 ARG OXT O 19.948 -1.107 3.491 1.00 . A A . 21 ARG OXT 1 1 10 2539 1 1 1 ALA C C 10.279 2.365 -5.835 1.00 . A A . 1 ALA C 1 1 10 2540 1 1 1 ALA CA C 9.077 2.747 -4.977 1.00 . A A . 1 ALA CA 1 1 10 2541 1 1 1 ALA CB C 8.111 1.565 -4.870 1.00 . A A . 1 ALA CB 1 1 10 2542 1 1 1 ALA H1 H 7.600 4.214 -4.981 1.00 . A A . 1 ALA H1 1 1 10 2543 1 1 1 ALA H2 H 7.987 3.616 -6.524 1.00 . A A . 1 ALA H2 1 1 10 2544 1 1 1 ALA H3 H 9.043 4.686 -5.733 1.00 . A A . 1 ALA H3 1 1 10 2545 1 1 1 ALA HA H 9.415 3.026 -3.991 1.00 . A A . 1 ALA HA 1 1 10 2546 1 1 1 ALA HB1 H 8.251 1.071 -3.920 1.00 . A A . 1 ALA HB1 1 1 10 2547 1 1 1 ALA HB2 H 8.303 0.866 -5.671 1.00 . A A . 1 ALA HB2 1 1 10 2548 1 1 1 ALA HB3 H 7.093 1.923 -4.941 1.00 . A A . 1 ALA HB3 1 1 10 2549 1 1 1 ALA N N 8.374 3.903 -5.601 1.00 . A A . 1 ALA N 1 1 10 2550 1 1 1 ALA O O 10.164 2.215 -7.052 1.00 . A A . 1 ALA O 1 1 10 2551 1 1 2 GLY C C 13.303 3.071 -6.539 1.00 . A A . 2 GLY C 1 1 10 2552 1 1 2 GLY CA C 12.651 1.846 -5.903 1.00 . A A . 2 GLY CA 1 1 10 2553 1 1 2 GLY H H 11.462 2.342 -4.223 1.00 . A A . 2 GLY H 1 1 10 2554 1 1 2 GLY HA2 H 13.344 1.394 -5.209 1.00 . A A . 2 GLY HA2 1 1 10 2555 1 1 2 GLY HA3 H 12.410 1.134 -6.678 1.00 . A A . 2 GLY HA3 1 1 10 2556 1 1 2 GLY N N 11.431 2.211 -5.192 1.00 . A A . 2 GLY N 1 1 10 2557 1 1 2 GLY O O 14.188 2.945 -7.385 1.00 . A A . 2 GLY O 1 1 10 2558 1 1 3 GLY C C 14.378 6.146 -5.689 1.00 . A A . 3 GLY C 1 1 10 2559 1 1 3 GLY CA C 13.407 5.496 -6.668 1.00 . A A . 3 GLY CA 1 1 10 2560 1 1 3 GLY H H 12.150 4.295 -5.452 1.00 . A A . 3 GLY H 1 1 10 2561 1 1 3 GLY HA2 H 13.925 5.280 -7.591 1.00 . A A . 3 GLY HA2 1 1 10 2562 1 1 3 GLY HA3 H 12.597 6.182 -6.870 1.00 . A A . 3 GLY HA3 1 1 10 2563 1 1 3 GLY N N 12.859 4.255 -6.128 1.00 . A A . 3 GLY N 1 1 10 2564 1 1 3 GLY O O 14.966 7.187 -5.985 1.00 . A A . 3 GLY O 1 1 10 2565 1 1 4 . C C 14.583 6.792 -2.524 1.00 . A A . 4 DBU C 1 1 10 2566 1 1 4 . CA C 15.412 6.052 -3.543 1.00 . A A . 4 DBU CA 1 1 10 2567 1 1 4 . CB C 16.805 5.960 -3.437 1.00 . A A . 4 DBU CB 1 1 10 2568 1 1 4 . CG C 17.712 5.244 -4.407 1.00 . A A . 4 DBU CG 1 1 10 2569 1 1 4 . H H 14.049 4.708 -4.325 1.00 . A A . 4 DBU H 1 1 10 2570 1 1 4 . HB H 17.299 6.433 -2.602 1.00 . A A . 4 DBU HB 1 1 10 2571 1 1 4 . HG1 H 17.144 4.916 -5.264 1.00 . A A . 4 DBU HG1 1 1 10 2572 1 1 4 . HG2 H 18.153 4.390 -3.916 1.00 . A A . 4 DBU HG2 1 1 10 2573 1 1 4 . HG3 H 18.492 5.920 -4.728 1.00 . A A . 4 DBU HG3 1 1 10 2574 1 1 4 . N N 14.541 5.532 -4.522 1.00 . A A . 4 DBU N 1 1 10 2575 1 1 4 . O O 13.914 7.761 -2.879 1.00 . A A . 4 DBU O 1 1 10 2576 1 1 5 ILE C C 12.752 6.031 0.333 1.00 . A A . 5 ILE C 1 1 10 2577 1 1 5 ILE CA C 13.877 6.937 -0.165 1.00 . A A . 5 ILE CA 1 1 10 2578 1 1 5 ILE CB C 13.273 8.283 -0.566 1.00 . A A . 5 ILE CB 1 1 10 2579 1 1 5 ILE CD1 C 15.102 9.729 0.341 1.00 . A A . 5 ILE CD1 1 1 10 2580 1 1 5 ILE CG1 C 14.389 9.267 -0.929 1.00 . A A . 5 ILE CG1 1 1 10 2581 1 1 5 ILE CG2 C 12.460 8.836 0.609 1.00 . A A . 5 ILE CG2 1 1 10 2582 1 1 5 ILE H H 15.187 5.543 -1.081 1.00 . A A . 5 ILE H 1 1 10 2583 1 1 5 ILE HA H 14.554 7.095 0.645 1.00 . A A . 5 ILE HA 1 1 10 2584 1 1 5 ILE HB H 12.619 8.141 -1.414 1.00 . A A . 5 ILE HB 1 1 10 2585 1 1 5 ILE HD11 H 16.141 9.444 0.294 1.00 . A A . 5 ILE HD11 1 1 10 2586 1 1 5 ILE HD12 H 14.643 9.266 1.203 1.00 . A A . 5 ILE HD12 1 1 10 2587 1 1 5 ILE HD13 H 15.026 10.801 0.427 1.00 . A A . 5 ILE HD13 1 1 10 2588 1 1 5 ILE HG12 H 15.100 8.782 -1.581 1.00 . A A . 5 ILE HG12 1 1 10 2589 1 1 5 ILE HG13 H 13.965 10.123 -1.430 1.00 . A A . 5 ILE HG13 1 1 10 2590 1 1 5 ILE HG21 H 12.210 9.868 0.420 1.00 . A A . 5 ILE HG21 1 1 10 2591 1 1 5 ILE HG22 H 13.046 8.769 1.516 1.00 . A A . 5 ILE HG22 1 1 10 2592 1 1 5 ILE HG23 H 11.554 8.261 0.722 1.00 . A A . 5 ILE HG23 1 1 10 2593 1 1 5 ILE N N 14.629 6.326 -1.270 1.00 . A A . 5 ILE N 1 1 10 2594 1 1 5 ILE O O 12.433 6.032 1.522 1.00 . A A . 5 ILE O 1 1 10 2595 1 1 6 PRO C C 11.538 3.098 0.469 1.00 . A A . 6 PRO C 1 1 10 2596 1 1 6 PRO CA C 11.034 4.376 -0.164 1.00 . A A . 6 PRO CA 1 1 10 2597 1 1 6 PRO CB C 10.327 4.082 -1.483 1.00 . A A . 6 PRO CB 1 1 10 2598 1 1 6 PRO CD C 12.453 5.191 -1.964 1.00 . A A . 6 PRO CD 1 1 10 2599 1 1 6 PRO CG C 11.324 4.361 -2.562 1.00 . A A . 6 PRO CG 1 1 10 2600 1 1 6 PRO HA H 10.354 4.878 0.503 1.00 . A A . 6 PRO HA 1 1 10 2601 1 1 6 PRO HB2 H 10.022 3.045 -1.517 1.00 . A A . 6 PRO HB2 1 1 10 2602 1 1 6 PRO HB3 H 9.472 4.723 -1.598 1.00 . A A . 6 PRO HB3 1 1 10 2603 1 1 6 PRO HD2 H 13.402 4.699 -2.117 1.00 . A A . 6 PRO HD2 1 1 10 2604 1 1 6 PRO HD3 H 12.460 6.171 -2.398 1.00 . A A . 6 PRO HD3 1 1 10 2605 1 1 6 PRO HG2 H 11.715 3.435 -2.952 1.00 . A A . 6 PRO HG2 1 1 10 2606 1 1 6 PRO HG3 H 10.861 4.925 -3.349 1.00 . A A . 6 PRO HG3 1 1 10 2607 1 1 6 PRO N N 12.144 5.277 -0.537 1.00 . A A . 6 PRO N 1 1 10 2608 1 1 6 PRO O O 10.752 2.286 0.939 1.00 . A A . 6 PRO O 1 1 10 2609 1 1 7 DAL C C 14.885 1.544 0.532 1.00 . A A . 7 DAL C 1 1 10 2610 1 1 7 DAL CA C 13.461 1.739 1.041 1.00 . A A . 7 DAL CA 1 1 10 2611 1 1 7 DAL CB C 13.495 1.847 2.564 1.00 . A A . 7 DAL CB 1 1 10 2612 1 1 7 DAL H H 13.428 3.620 0.074 1.00 . A A . 7 DAL H 1 1 10 2613 1 1 7 DAL HA H 12.871 0.882 0.770 1.00 . A A . 7 DAL HA 1 1 10 2614 1 1 7 DAL HB1 H 14.521 1.880 2.888 1.00 . A A . 7 DAL HB1 1 1 10 2615 1 1 7 DAL HB2 H 13.012 0.984 2.997 1.00 . A A . 7 DAL HB2 1 1 10 2616 1 1 7 DAL N N 12.855 2.930 0.468 1.00 . A A . 7 DAL N 1 1 10 2617 1 1 7 DAL O O 15.636 0.735 1.068 1.00 . A A . 7 DAL O 1 1 10 2618 1 1 8 LEU C C 17.595 2.622 0.076 1.00 . A A . 8 LEU C 1 1 10 2619 1 1 8 LEU CA C 16.626 2.162 -0.998 1.00 . A A . 8 LEU CA 1 1 10 2620 1 1 8 LEU CB C 16.804 2.992 -2.275 1.00 . A A . 8 LEU CB 1 1 10 2621 1 1 8 LEU CD1 C 16.115 2.900 -4.684 1.00 . A A . 8 LEU CD1 1 1 10 2622 1 1 8 LEU CD2 C 15.113 1.293 -3.059 1.00 . A A . 8 LEU CD2 1 1 10 2623 1 1 8 LEU CG C 15.639 2.724 -3.240 1.00 . A A . 8 LEU CG 1 1 10 2624 1 1 8 LEU H H 14.654 2.939 -0.890 1.00 . A A . 8 LEU H 1 1 10 2625 1 1 8 LEU HA H 16.819 1.121 -1.225 1.00 . A A . 8 LEU HA 1 1 10 2626 1 1 8 LEU HB2 H 16.826 4.041 -2.019 1.00 . A A . 8 LEU HB2 1 1 10 2627 1 1 8 LEU HB3 H 17.733 2.719 -2.751 1.00 . A A . 8 LEU HB3 1 1 10 2628 1 1 8 LEU HD11 H 15.821 2.040 -5.265 1.00 . A A . 8 LEU HD11 1 1 10 2629 1 1 8 LEU HD12 H 17.191 2.996 -4.702 1.00 . A A . 8 LEU HD12 1 1 10 2630 1 1 8 LEU HD13 H 15.667 3.787 -5.105 1.00 . A A . 8 LEU HD13 1 1 10 2631 1 1 8 LEU HD21 H 14.376 1.279 -2.271 1.00 . A A . 8 LEU HD21 1 1 10 2632 1 1 8 LEU HD22 H 15.933 0.639 -2.800 1.00 . A A . 8 LEU HD22 1 1 10 2633 1 1 8 LEU HD23 H 14.660 0.956 -3.979 1.00 . A A . 8 LEU HD23 1 1 10 2634 1 1 8 LEU HG H 14.846 3.429 -3.035 1.00 . A A . 8 LEU HG 1 1 10 2635 1 1 8 LEU N N 15.272 2.290 -0.489 1.00 . A A . 8 LEU N 1 1 10 2636 1 1 8 LEU O O 18.704 2.105 0.201 1.00 . A A . 8 LEU O 1 1 10 2637 1 1 9 MET C C 18.216 3.075 2.994 1.00 . A A . 9 MET C 1 1 10 2638 1 1 9 MET CA C 17.966 4.145 1.933 1.00 . A A . 9 MET CA 1 1 10 2639 1 1 9 MET CB C 17.244 5.332 2.570 1.00 . A A . 9 MET CB 1 1 10 2640 1 1 9 MET CE C 17.847 8.501 2.631 1.00 . A A . 9 MET CE 1 1 10 2641 1 1 9 MET CG C 16.783 6.289 1.472 1.00 . A A . 9 MET CG 1 1 10 2642 1 1 9 MET H H 16.256 3.970 0.704 1.00 . A A . 9 MET H 1 1 10 2643 1 1 9 MET HA H 18.910 4.480 1.533 1.00 . A A . 9 MET HA 1 1 10 2644 1 1 9 MET HB2 H 16.386 4.976 3.123 1.00 . A A . 9 MET HB2 1 1 10 2645 1 1 9 MET HB3 H 17.915 5.848 3.238 1.00 . A A . 9 MET HB3 1 1 10 2646 1 1 9 MET HE1 H 18.018 8.409 3.695 1.00 . A A . 9 MET HE1 1 1 10 2647 1 1 9 MET HE2 H 17.891 9.541 2.352 1.00 . A A . 9 MET HE2 1 1 10 2648 1 1 9 MET HE3 H 18.604 7.951 2.091 1.00 . A A . 9 MET HE3 1 1 10 2649 1 1 9 MET HG2 H 17.600 6.490 0.796 1.00 . A A . 9 MET HG2 1 1 10 2650 1 1 9 MET HG3 H 15.968 5.836 0.926 1.00 . A A . 9 MET HG3 1 1 10 2651 1 1 9 MET N N 17.152 3.604 0.857 1.00 . A A . 9 MET N 1 1 10 2652 1 1 9 MET O O 19.321 2.957 3.521 1.00 . A A . 9 MET O 1 1 10 2653 1 1 9 MET SD S 16.215 7.832 2.225 1.00 . A A . 9 MET SD 1 1 10 2654 1 1 10 . C C 16.427 1.475 5.496 1.00 . A A . 10 DBB C 1 1 10 2655 1 1 10 . CA C 17.301 1.216 4.282 1.00 . A A . 10 DBB CA 1 1 10 2656 1 1 10 . CB C 16.906 -0.120 3.645 1.00 . A A . 10 DBB CB 1 1 10 2657 1 1 10 . CG C 15.382 -0.306 3.679 1.00 . A A . 10 DBB CG 1 1 10 2658 1 1 10 . H H 16.325 2.423 2.831 1.00 . A A . 10 DBB H 1 1 10 2659 1 1 10 . HA H 18.329 1.155 4.602 1.00 . A A . 10 DBB HA 1 1 10 2660 1 1 10 . HB2 H 17.210 -0.112 2.616 1.00 . A A . 10 DBB HB2 1 1 10 2661 1 1 10 . HG1 H 14.962 0.204 4.527 1.00 . A A . 10 DBB HG1 1 1 10 2662 1 1 10 . HG2 H 15.153 -1.354 3.751 1.00 . A A . 10 DBB HG2 1 1 10 2663 1 1 10 . HG3 H 14.951 0.085 2.775 1.00 . A A . 10 DBB HG3 1 1 10 2664 1 1 10 . N N 17.180 2.287 3.292 1.00 . A A . 10 DBB N 1 1 10 2665 1 1 10 . O O 16.754 1.063 6.610 1.00 . A A . 10 DBB O 1 1 10 2666 1 1 11 GLY C C 13.028 2.842 5.815 1.00 . A A . 11 GLY C 1 1 10 2667 1 1 11 GLY CA C 14.394 2.431 6.354 1.00 . A A . 11 GLY CA 1 1 10 2668 1 1 11 GLY H H 15.098 2.441 4.370 1.00 . A A . 11 GLY H 1 1 10 2669 1 1 11 GLY HA2 H 14.286 1.552 6.973 1.00 . A A . 11 GLY HA2 1 1 10 2670 1 1 11 GLY HA3 H 14.802 3.227 6.939 1.00 . A A . 11 GLY HA3 1 1 10 2671 1 1 11 GLY N N 15.310 2.143 5.274 1.00 . A A . 11 GLY N 1 1 10 2672 1 1 11 GLY O O 12.698 4.026 5.774 1.00 . A A . 11 GLY O 1 1 10 2673 1 1 12 CYS C C 10.021 0.903 4.870 1.00 . A A . 12 CYS C 1 1 10 2674 1 1 12 CYS CA C 10.915 2.136 4.844 1.00 . A A . 12 CYS CA 1 1 10 2675 1 1 12 CYS CB C 11.037 2.580 3.392 1.00 . A A . 12 CYS CB 1 1 10 2676 1 1 12 CYS H H 12.559 0.929 5.438 1.00 . A A . 12 CYS H 1 1 10 2677 1 1 12 CYS HA H 10.452 2.926 5.413 1.00 . A A . 12 CYS HA 1 1 10 2678 1 1 12 CYS HB2 H 10.945 1.710 2.763 1.00 . A A . 12 CYS HB2 1 1 10 2679 1 1 12 CYS HB3 H 10.253 3.278 3.157 1.00 . A A . 12 CYS HB3 1 1 10 2680 1 1 12 CYS N N 12.241 1.857 5.390 1.00 . A A . 12 CYS N 1 1 10 2681 1 1 12 CYS O O 10.199 -0.003 5.681 1.00 . A A . 12 CYS O 1 1 10 2682 1 1 12 CYS SG S 12.647 3.349 3.107 1.00 . A A . 12 CYS SG 1 1 10 2683 1 1 13 GLY C C 8.028 -0.642 2.355 1.00 . A A . 13 GLY C 1 1 10 2684 1 1 13 GLY CA C 8.128 -0.219 3.811 1.00 . A A . 13 GLY CA 1 1 10 2685 1 1 13 GLY H H 8.994 1.645 3.322 1.00 . A A . 13 GLY H 1 1 10 2686 1 1 13 GLY HA2 H 8.466 -1.051 4.410 1.00 . A A . 13 GLY HA2 1 1 10 2687 1 1 13 GLY HA3 H 7.155 0.092 4.148 1.00 . A A . 13 GLY HA3 1 1 10 2688 1 1 13 GLY N N 9.064 0.890 3.944 1.00 . A A . 13 GLY N 1 1 10 2689 1 1 13 GLY O O 7.088 -1.329 1.958 1.00 . A A . 13 GLY O 1 1 10 2690 1 1 14 TRP C C 8.721 -2.004 -0.105 1.00 . A A . 14 TRP C 1 1 10 2691 1 1 14 TRP CA C 9.022 -0.524 0.143 1.00 . A A . 14 TRP CA 1 1 10 2692 1 1 14 TRP CB C 10.386 -0.152 -0.455 1.00 . A A . 14 TRP CB 1 1 10 2693 1 1 14 TRP CD1 C 11.433 -1.309 1.540 1.00 . A A . 14 TRP CD1 1 1 10 2694 1 1 14 TRP CD2 C 12.819 -1.216 -0.228 1.00 . A A . 14 TRP CD2 1 1 10 2695 1 1 14 TRP CE2 C 13.521 -1.884 0.802 1.00 . A A . 14 TRP CE2 1 1 10 2696 1 1 14 TRP CE3 C 13.475 -1.025 -1.459 1.00 . A A . 14 TRP CE3 1 1 10 2697 1 1 14 TRP CG C 11.493 -0.860 0.268 1.00 . A A . 14 TRP CG 1 1 10 2698 1 1 14 TRP CH2 C 15.459 -2.152 -0.609 1.00 . A A . 14 TRP CH2 1 1 10 2699 1 1 14 TRP CZ2 C 14.824 -2.348 0.619 1.00 . A A . 14 TRP CZ2 1 1 10 2700 1 1 14 TRP CZ3 C 14.786 -1.490 -1.646 1.00 . A A . 14 TRP CZ3 1 1 10 2701 1 1 14 TRP H H 9.716 0.348 1.941 1.00 . A A . 14 TRP H 1 1 10 2702 1 1 14 TRP HA H 8.263 0.065 -0.350 1.00 . A A . 14 TRP HA 1 1 10 2703 1 1 14 TRP HB2 H 10.406 -0.432 -1.488 1.00 . A A . 14 TRP HB2 1 1 10 2704 1 1 14 TRP HB3 H 10.533 0.909 -0.382 1.00 . A A . 14 TRP HB3 1 1 10 2705 1 1 14 TRP HD1 H 10.590 -1.209 2.198 1.00 . A A . 14 TRP HD1 1 1 10 2706 1 1 14 TRP HE1 H 12.849 -2.324 2.724 1.00 . A A . 14 TRP HE1 1 1 10 2707 1 1 14 TRP HE3 H 12.967 -0.516 -2.264 1.00 . A A . 14 TRP HE3 1 1 10 2708 1 1 14 TRP HH2 H 16.467 -2.508 -0.761 1.00 . A A . 14 TRP HH2 1 1 10 2709 1 1 14 TRP HZ2 H 15.338 -2.857 1.421 1.00 . A A . 14 TRP HZ2 1 1 10 2710 1 1 14 TRP HZ3 H 15.279 -1.340 -2.596 1.00 . A A . 14 TRP HZ3 1 1 10 2711 1 1 14 TRP N N 9.001 -0.208 1.563 1.00 . A A . 14 TRP N 1 1 10 2712 1 1 14 TRP NE1 N 12.634 -1.916 1.859 1.00 . A A . 14 TRP NE1 1 1 10 2713 1 1 14 TRP O O 7.610 -2.475 0.139 1.00 . A A . 14 TRP O 1 1 10 2714 1 1 15 LEU C C 10.017 -4.993 0.257 1.00 . A A . 15 LEU C 1 1 10 2715 1 1 15 LEU CA C 9.552 -4.140 -0.918 1.00 . A A . 15 LEU CA 1 1 10 2716 1 1 15 LEU CB C 10.373 -4.486 -2.168 1.00 . A A . 15 LEU CB 1 1 10 2717 1 1 15 LEU CD1 C 12.538 -3.979 -3.320 1.00 . A A . 15 LEU CD1 1 1 10 2718 1 1 15 LEU CD2 C 10.870 -2.149 -2.963 1.00 . A A . 15 LEU CD2 1 1 10 2719 1 1 15 LEU CG C 11.473 -3.434 -2.373 1.00 . A A . 15 LEU CG 1 1 10 2720 1 1 15 LEU H H 10.561 -2.298 -0.806 1.00 . A A . 15 LEU H 1 1 10 2721 1 1 15 LEU HA H 8.510 -4.345 -1.116 1.00 . A A . 15 LEU HA 1 1 10 2722 1 1 15 LEU HB2 H 10.824 -5.461 -2.043 1.00 . A A . 15 LEU HB2 1 1 10 2723 1 1 15 LEU HB3 H 9.725 -4.499 -3.031 1.00 . A A . 15 LEU HB3 1 1 10 2724 1 1 15 LEU HD11 H 12.060 -4.443 -4.171 1.00 . A A . 15 LEU HD11 1 1 10 2725 1 1 15 LEU HD12 H 13.140 -4.709 -2.802 1.00 . A A . 15 LEU HD12 1 1 10 2726 1 1 15 LEU HD13 H 13.165 -3.167 -3.658 1.00 . A A . 15 LEU HD13 1 1 10 2727 1 1 15 LEU HD21 H 10.841 -2.224 -4.038 1.00 . A A . 15 LEU HD21 1 1 10 2728 1 1 15 LEU HD22 H 11.481 -1.302 -2.679 1.00 . A A . 15 LEU HD22 1 1 10 2729 1 1 15 LEU HD23 H 9.868 -2.007 -2.585 1.00 . A A . 15 LEU HD23 1 1 10 2730 1 1 15 LEU HG H 11.930 -3.210 -1.420 1.00 . A A . 15 LEU HG 1 1 10 2731 1 1 15 LEU N N 9.710 -2.726 -0.614 1.00 . A A . 15 LEU N 1 1 10 2732 1 1 15 LEU O O 9.458 -6.058 0.522 1.00 . A A . 15 LEU O 1 1 10 2733 1 1 16 . C C 10.745 -4.873 3.297 1.00 . A A . 16 DBU C 1 1 10 2734 1 1 16 . CA C 11.572 -5.196 2.075 1.00 . A A . 16 DBU CA 1 1 10 2735 1 1 16 . CB C 12.679 -6.048 2.149 1.00 . A A . 16 DBU CB 1 1 10 2736 1 1 16 . CG C 13.555 -6.415 0.978 1.00 . A A . 16 DBU CG 1 1 10 2737 1 1 16 . H H 11.448 -3.662 0.713 1.00 . A A . 16 DBU H 1 1 10 2738 1 1 16 . HB H 12.941 -6.481 3.104 1.00 . A A . 16 DBU HB 1 1 10 2739 1 1 16 . HG1 H 12.977 -6.372 0.067 1.00 . A A . 16 DBU HG1 1 1 10 2740 1 1 16 . HG2 H 13.941 -7.417 1.113 1.00 . A A . 16 DBU HG2 1 1 10 2741 1 1 16 . HG3 H 14.379 -5.719 0.915 1.00 . A A . 16 DBU HG3 1 1 10 2742 1 1 16 . N N 11.039 -4.516 0.961 1.00 . A A . 16 DBU N 1 1 10 2743 1 1 16 . O O 9.907 -5.657 3.745 1.00 . A A . 16 DBU O 1 1 10 2744 1 1 17 GLY C C 11.216 -2.902 6.162 1.00 . A A . 17 GLY C 1 1 10 2745 1 1 17 GLY CA C 10.262 -3.235 5.020 1.00 . A A . 17 GLY CA 1 1 10 2746 1 1 17 GLY H H 11.663 -3.101 3.438 1.00 . A A . 17 GLY H 1 1 10 2747 1 1 17 GLY HA2 H 9.692 -2.356 4.767 1.00 . A A . 17 GLY HA2 1 1 10 2748 1 1 17 GLY HA3 H 9.586 -4.014 5.342 1.00 . A A . 17 GLY HA3 1 1 10 2749 1 1 17 GLY N N 10.987 -3.687 3.840 1.00 . A A . 17 GLY N 1 1 10 2750 1 1 17 GLY O O 11.213 -1.785 6.679 1.00 . A A . 17 GLY O 1 1 10 2751 1 1 18 LEU C C 14.392 -3.495 7.090 1.00 . A A . 18 LEU C 1 1 10 2752 1 1 18 LEU CA C 12.980 -3.677 7.639 1.00 . A A . 18 LEU CA 1 1 10 2753 1 1 18 LEU CB C 12.942 -4.873 8.594 1.00 . A A . 18 LEU CB 1 1 10 2754 1 1 18 LEU CD1 C 11.466 -6.214 10.102 1.00 . A A . 18 LEU CD1 1 1 10 2755 1 1 18 LEU CD2 C 11.427 -3.719 10.208 1.00 . A A . 18 LEU CD2 1 1 10 2756 1 1 18 LEU CG C 11.577 -4.928 9.282 1.00 . A A . 18 LEU CG 1 1 10 2757 1 1 18 LEU H H 11.982 -4.749 6.106 1.00 . A A . 18 LEU H 1 1 10 2758 1 1 18 LEU HA H 12.702 -2.789 8.184 1.00 . A A . 18 LEU HA 1 1 10 2759 1 1 18 LEU HB2 H 13.102 -5.784 8.036 1.00 . A A . 18 LEU HB2 1 1 10 2760 1 1 18 LEU HB3 H 13.715 -4.764 9.338 1.00 . A A . 18 LEU HB3 1 1 10 2761 1 1 18 LEU HD11 H 11.718 -7.060 9.482 1.00 . A A . 18 LEU HD11 1 1 10 2762 1 1 18 LEU HD12 H 10.453 -6.322 10.466 1.00 . A A . 18 LEU HD12 1 1 10 2763 1 1 18 LEU HD13 H 12.145 -6.165 10.941 1.00 . A A . 18 LEU HD13 1 1 10 2764 1 1 18 LEU HD21 H 11.415 -2.814 9.620 1.00 . A A . 18 LEU HD21 1 1 10 2765 1 1 18 LEU HD22 H 12.257 -3.689 10.899 1.00 . A A . 18 LEU HD22 1 1 10 2766 1 1 18 LEU HD23 H 10.503 -3.801 10.761 1.00 . A A . 18 LEU HD23 1 1 10 2767 1 1 18 LEU HG H 10.796 -4.910 8.535 1.00 . A A . 18 LEU HG 1 1 10 2768 1 1 18 LEU N N 12.027 -3.878 6.554 1.00 . A A . 18 LEU N 1 1 10 2769 1 1 18 LEU O O 15.366 -3.490 7.845 1.00 . A A . 18 LEU O 1 1 10 2770 1 1 19 CYS C C 16.671 -4.401 5.359 1.00 . A A . 19 CYS C 1 1 10 2771 1 1 19 CYS CA C 15.791 -3.180 5.127 1.00 . A A . 19 CYS CA 1 1 10 2772 1 1 19 CYS CB C 16.495 -1.927 5.659 1.00 . A A . 19 CYS CB 1 1 10 2773 1 1 19 CYS H H 13.684 -3.372 5.225 1.00 . A A . 19 CYS H 1 1 10 2774 1 1 19 CYS HA H 15.636 -3.068 4.066 1.00 . A A . 19 CYS HA 1 1 10 2775 1 1 19 CYS HB2 H 15.781 -1.126 5.762 1.00 . A A . 19 CYS HB2 1 1 10 2776 1 1 19 CYS HB3 H 16.931 -2.139 6.623 1.00 . A A . 19 CYS HB3 1 1 10 2777 1 1 19 CYS N N 14.495 -3.354 5.774 1.00 . A A . 19 CYS N 1 1 10 2778 1 1 19 CYS O O 17.485 -4.431 6.281 1.00 . A A . 19 CYS O 1 1 10 2779 1 1 19 CYS SG S 17.803 -1.440 4.502 1.00 . A A . 19 CYS SG 1 1 10 2780 1 1 20 VAL C C 18.236 -6.754 3.436 1.00 . A A . 20 VAL C 1 1 10 2781 1 1 20 VAL CA C 17.271 -6.632 4.611 1.00 . A A . 20 VAL CA 1 1 10 2782 1 1 20 VAL CB C 16.327 -7.835 4.632 1.00 . A A . 20 VAL CB 1 1 10 2783 1 1 20 VAL CG1 C 15.595 -7.883 5.975 1.00 . A A . 20 VAL CG1 1 1 10 2784 1 1 20 VAL CG2 C 15.303 -7.693 3.503 1.00 . A A . 20 VAL CG2 1 1 10 2785 1 1 20 VAL H H 15.831 -5.316 3.794 1.00 . A A . 20 VAL H 1 1 10 2786 1 1 20 VAL HA H 17.836 -6.615 5.530 1.00 . A A . 20 VAL HA 1 1 10 2787 1 1 20 VAL HB H 16.895 -8.744 4.497 1.00 . A A . 20 VAL HB 1 1 10 2788 1 1 20 VAL HG11 H 16.269 -8.236 6.741 1.00 . A A . 20 VAL HG11 1 1 10 2789 1 1 20 VAL HG12 H 14.752 -8.556 5.902 1.00 . A A . 20 VAL HG12 1 1 10 2790 1 1 20 VAL HG13 H 15.245 -6.894 6.231 1.00 . A A . 20 VAL HG13 1 1 10 2791 1 1 20 VAL HG21 H 14.555 -8.466 3.598 1.00 . A A . 20 VAL HG21 1 1 10 2792 1 1 20 VAL HG22 H 15.803 -7.788 2.552 1.00 . A A . 20 VAL HG22 1 1 10 2793 1 1 20 VAL HG23 H 14.830 -6.724 3.567 1.00 . A A . 20 VAL HG23 1 1 10 2794 1 1 20 VAL N N 16.496 -5.403 4.508 1.00 . A A . 20 VAL N 1 1 10 2795 1 1 20 VAL O O 19.042 -7.684 3.376 1.00 . A A . 20 VAL O 1 1 10 2796 1 1 21 ARG C C 20.435 -5.411 1.715 1.00 . A A . 21 ARG C 1 1 10 2797 1 1 21 ARG CA C 19.019 -5.827 1.332 1.00 . A A . 21 ARG CA 1 1 10 2798 1 1 21 ARG CB C 18.481 -4.878 0.257 1.00 . A A . 21 ARG CB 1 1 10 2799 1 1 21 ARG CD C 18.852 -4.010 -2.058 1.00 . A A . 21 ARG CD 1 1 10 2800 1 1 21 ARG CG C 19.355 -4.985 -0.994 1.00 . A A . 21 ARG CG 1 1 10 2801 1 1 21 ARG CZ C 19.550 -3.314 -4.278 1.00 . A A . 21 ARG CZ 1 1 10 2802 1 1 21 ARG H H 17.486 -5.096 2.600 1.00 . A A . 21 ARG H 1 1 10 2803 1 1 21 ARG HA H 19.045 -6.830 0.929 1.00 . A A . 21 ARG HA 1 1 10 2804 1 1 21 ARG HB2 H 17.464 -5.152 0.013 1.00 . A A . 21 ARG HB2 1 1 10 2805 1 1 21 ARG HB3 H 18.503 -3.862 0.624 1.00 . A A . 21 ARG HB3 1 1 10 2806 1 1 21 ARG HD2 H 17.794 -4.162 -2.212 1.00 . A A . 21 ARG HD2 1 1 10 2807 1 1 21 ARG HD3 H 19.021 -2.996 -1.724 1.00 . A A . 21 ARG HD3 1 1 10 2808 1 1 21 ARG HE H 20.045 -5.069 -3.453 1.00 . A A . 21 ARG HE 1 1 10 2809 1 1 21 ARG HG2 H 20.377 -4.744 -0.740 1.00 . A A . 21 ARG HG2 1 1 10 2810 1 1 21 ARG HG3 H 19.309 -5.991 -1.380 1.00 . A A . 21 ARG HG3 1 1 10 2811 1 1 21 ARG HH11 H 18.431 -2.015 -3.243 1.00 . A A . 21 ARG HH11 1 1 10 2812 1 1 21 ARG HH12 H 18.908 -1.497 -4.826 1.00 . A A . 21 ARG HH12 1 1 10 2813 1 1 21 ARG HH21 H 20.661 -4.405 -5.536 1.00 . A A . 21 ARG HH21 1 1 10 2814 1 1 21 ARG HH22 H 20.170 -2.852 -6.124 1.00 . A A . 21 ARG HH22 1 1 10 2815 1 1 21 ARG N N 18.148 -5.812 2.502 1.00 . A A . 21 ARG N 1 1 10 2816 1 1 21 ARG NE N 19.556 -4.230 -3.316 1.00 . A A . 21 ARG NE 1 1 10 2817 1 1 21 ARG NH1 N 18.913 -2.188 -4.103 1.00 . A A . 21 ARG NH1 1 1 10 2818 1 1 21 ARG NH2 N 20.175 -3.541 -5.401 1.00 . A A . 21 ARG NH2 1 1 10 2819 1 1 21 ARG O O 20.605 -4.898 2.809 1.00 . A A . 21 ARG O 1 1 10 2820 1 1 21 ARG OXT O 21.329 -5.612 0.910 1.00 . A A . 21 ARG OXT 1 1 11 2821 1 1 1 ALA C C 11.184 4.338 -8.862 1.00 . A A . 1 ALA C 1 1 11 2822 1 1 1 ALA CA C 9.998 3.457 -8.483 1.00 . A A . 1 ALA CA 1 1 11 2823 1 1 1 ALA CB C 8.928 3.523 -9.577 1.00 . A A . 1 ALA CB 1 1 11 2824 1 1 1 ALA H1 H 8.524 3.439 -7.014 1.00 . A A . 1 ALA H1 1 1 11 2825 1 1 1 ALA H2 H 9.241 4.960 -7.257 1.00 . A A . 1 ALA H2 1 1 11 2826 1 1 1 ALA H3 H 10.083 3.743 -6.424 1.00 . A A . 1 ALA H3 1 1 11 2827 1 1 1 ALA HA H 10.331 2.436 -8.369 1.00 . A A . 1 ALA HA 1 1 11 2828 1 1 1 ALA HB1 H 8.476 2.549 -9.698 1.00 . A A . 1 ALA HB1 1 1 11 2829 1 1 1 ALA HB2 H 9.384 3.826 -10.508 1.00 . A A . 1 ALA HB2 1 1 11 2830 1 1 1 ALA HB3 H 8.170 4.240 -9.296 1.00 . A A . 1 ALA HB3 1 1 11 2831 1 1 1 ALA N N 9.418 3.935 -7.198 1.00 . A A . 1 ALA N 1 1 11 2832 1 1 1 ALA O O 11.039 5.307 -9.604 1.00 . A A . 1 ALA O 1 1 11 2833 1 1 2 GLY C C 13.663 5.987 -7.742 1.00 . A A . 2 GLY C 1 1 11 2834 1 1 2 GLY CA C 13.568 4.756 -8.636 1.00 . A A . 2 GLY CA 1 1 11 2835 1 1 2 GLY H H 12.415 3.207 -7.761 1.00 . A A . 2 GLY H 1 1 11 2836 1 1 2 GLY HA2 H 14.431 4.127 -8.473 1.00 . A A . 2 GLY HA2 1 1 11 2837 1 1 2 GLY HA3 H 13.547 5.071 -9.669 1.00 . A A . 2 GLY HA3 1 1 11 2838 1 1 2 GLY N N 12.359 3.990 -8.346 1.00 . A A . 2 GLY N 1 1 11 2839 1 1 2 GLY O O 12.765 6.261 -6.947 1.00 . A A . 2 GLY O 1 1 11 2840 1 1 3 GLY C C 15.782 7.626 -5.831 1.00 . A A . 3 GLY C 1 1 11 2841 1 1 3 GLY CA C 14.963 7.930 -7.080 1.00 . A A . 3 GLY CA 1 1 11 2842 1 1 3 GLY H H 15.442 6.461 -8.530 1.00 . A A . 3 GLY H 1 1 11 2843 1 1 3 GLY HA2 H 15.484 8.667 -7.678 1.00 . A A . 3 GLY HA2 1 1 11 2844 1 1 3 GLY HA3 H 14.003 8.326 -6.784 1.00 . A A . 3 GLY HA3 1 1 11 2845 1 1 3 GLY N N 14.760 6.726 -7.879 1.00 . A A . 3 GLY N 1 1 11 2846 1 1 3 GLY O O 16.178 8.534 -5.101 1.00 . A A . 3 GLY O 1 1 11 2847 1 1 4 . C C 16.259 6.636 -3.227 1.00 . A A . 4 DBU C 1 1 11 2848 1 1 4 . CA C 16.784 5.948 -4.463 1.00 . A A . 4 DBU CA 1 1 11 2849 1 1 4 . CB C 17.864 5.060 -4.392 1.00 . A A . 4 DBU CB 1 1 11 2850 1 1 4 . CG C 18.449 4.329 -5.575 1.00 . A A . 4 DBU CG 1 1 11 2851 1 1 4 . H H 15.700 5.651 -6.198 1.00 . A A . 4 DBU H 1 1 11 2852 1 1 4 . HB H 18.328 4.869 -3.435 1.00 . A A . 4 DBU HB 1 1 11 2853 1 1 4 . HG1 H 19.328 4.850 -5.924 1.00 . A A . 4 DBU HG1 1 1 11 2854 1 1 4 . HG2 H 17.716 4.288 -6.368 1.00 . A A . 4 DBU HG2 1 1 11 2855 1 1 4 . HG3 H 18.717 3.326 -5.281 1.00 . A A . 4 DBU HG3 1 1 11 2856 1 1 4 . N N 16.035 6.343 -5.591 1.00 . A A . 4 DBU N 1 1 11 2857 1 1 4 . O O 16.705 7.722 -2.861 1.00 . A A . 4 DBU O 1 1 11 2858 1 1 5 ILE C C 13.707 5.518 -0.751 1.00 . A A . 5 ILE C 1 1 11 2859 1 1 5 ILE CA C 14.701 6.510 -1.355 1.00 . A A . 5 ILE CA 1 1 11 2860 1 1 5 ILE CB C 13.999 7.845 -1.622 1.00 . A A . 5 ILE CB 1 1 11 2861 1 1 5 ILE CD1 C 14.527 10.153 -0.691 1.00 . A A . 5 ILE CD1 1 1 11 2862 1 1 5 ILE CG1 C 15.044 8.979 -1.534 1.00 . A A . 5 ILE CG1 1 1 11 2863 1 1 5 ILE CG2 C 12.889 8.048 -0.580 1.00 . A A . 5 ILE CG2 1 1 11 2864 1 1 5 ILE H H 15.008 5.112 -2.911 1.00 . A A . 5 ILE H 1 1 11 2865 1 1 5 ILE HA H 15.485 6.679 -0.642 1.00 . A A . 5 ILE HA 1 1 11 2866 1 1 5 ILE HB H 13.565 7.829 -2.611 1.00 . A A . 5 ILE HB 1 1 11 2867 1 1 5 ILE HD11 H 14.563 9.886 0.356 1.00 . A A . 5 ILE HD11 1 1 11 2868 1 1 5 ILE HD12 H 13.507 10.376 -0.969 1.00 . A A . 5 ILE HD12 1 1 11 2869 1 1 5 ILE HD13 H 15.146 11.020 -0.863 1.00 . A A . 5 ILE HD13 1 1 11 2870 1 1 5 ILE HG12 H 15.946 8.593 -1.085 1.00 . A A . 5 ILE HG12 1 1 11 2871 1 1 5 ILE HG13 H 15.267 9.331 -2.531 1.00 . A A . 5 ILE HG13 1 1 11 2872 1 1 5 ILE HG21 H 13.330 8.109 0.405 1.00 . A A . 5 ILE HG21 1 1 11 2873 1 1 5 ILE HG22 H 12.203 7.216 -0.617 1.00 . A A . 5 ILE HG22 1 1 11 2874 1 1 5 ILE HG23 H 12.356 8.964 -0.794 1.00 . A A . 5 ILE HG23 1 1 11 2875 1 1 5 ILE N N 15.302 5.978 -2.574 1.00 . A A . 5 ILE N 1 1 11 2876 1 1 5 ILE O O 13.679 5.331 0.465 1.00 . A A . 5 ILE O 1 1 11 2877 1 1 6 PRO C C 12.567 2.686 -0.451 1.00 . A A . 6 PRO C 1 1 11 2878 1 1 6 PRO CA C 11.891 3.908 -1.060 1.00 . A A . 6 PRO CA 1 1 11 2879 1 1 6 PRO CB C 11.084 3.506 -2.295 1.00 . A A . 6 PRO CB 1 1 11 2880 1 1 6 PRO CD C 12.839 5.022 -3.017 1.00 . A A . 6 PRO CD 1 1 11 2881 1 1 6 PRO CG C 11.459 4.477 -3.371 1.00 . A A . 6 PRO CG 1 1 11 2882 1 1 6 PRO HA H 11.230 4.379 -0.347 1.00 . A A . 6 PRO HA 1 1 11 2883 1 1 6 PRO HB2 H 11.336 2.491 -2.584 1.00 . A A . 6 PRO HB2 1 1 11 2884 1 1 6 PRO HB3 H 10.027 3.581 -2.087 1.00 . A A . 6 PRO HB3 1 1 11 2885 1 1 6 PRO HD2 H 13.607 4.431 -3.488 1.00 . A A . 6 PRO HD2 1 1 11 2886 1 1 6 PRO HD3 H 12.923 6.057 -3.299 1.00 . A A . 6 PRO HD3 1 1 11 2887 1 1 6 PRO HG2 H 11.491 3.975 -4.327 1.00 . A A . 6 PRO HG2 1 1 11 2888 1 1 6 PRO HG3 H 10.752 5.288 -3.399 1.00 . A A . 6 PRO HG3 1 1 11 2889 1 1 6 PRO N N 12.894 4.886 -1.558 1.00 . A A . 6 PRO N 1 1 11 2890 1 1 6 PRO O O 12.760 1.677 -1.130 1.00 . A A . 6 PRO O 1 1 11 2891 1 1 7 DAL C C 14.859 1.270 0.748 1.00 . A A . 7 DAL C 1 1 11 2892 1 1 7 DAL CA C 13.592 1.666 1.490 1.00 . A A . 7 DAL CA 1 1 11 2893 1 1 7 DAL CB C 13.964 2.057 2.924 1.00 . A A . 7 DAL CB 1 1 11 2894 1 1 7 DAL H H 12.776 3.602 1.318 1.00 . A A . 7 DAL H 1 1 11 2895 1 1 7 DAL HA H 12.919 0.822 1.520 1.00 . A A . 7 DAL HA 1 1 11 2896 1 1 7 DAL HB1 H 15.000 2.326 2.963 1.00 . A A . 7 DAL HB1 1 1 11 2897 1 1 7 DAL HB2 H 13.786 1.218 3.579 1.00 . A A . 7 DAL HB2 1 1 11 2898 1 1 7 DAL N N 12.937 2.776 0.823 1.00 . A A . 7 DAL N 1 1 11 2899 1 1 7 DAL O O 15.435 0.214 1.002 1.00 . A A . 7 DAL O 1 1 11 2900 1 1 8 LEU C C 17.685 2.401 -0.046 1.00 . A A . 8 LEU C 1 1 11 2901 1 1 8 LEU CA C 16.534 1.861 -0.877 1.00 . A A . 8 LEU CA 1 1 11 2902 1 1 8 LEU CB C 16.515 2.546 -2.247 1.00 . A A . 8 LEU CB 1 1 11 2903 1 1 8 LEU CD1 C 15.169 2.937 -4.317 1.00 . A A . 8 LEU CD1 1 1 11 2904 1 1 8 LEU CD2 C 15.018 0.750 -3.132 1.00 . A A . 8 LEU CD2 1 1 11 2905 1 1 8 LEU CG C 15.187 2.257 -2.947 1.00 . A A . 8 LEU CG 1 1 11 2906 1 1 8 LEU H H 14.826 2.972 -0.307 1.00 . A A . 8 LEU H 1 1 11 2907 1 1 8 LEU HA H 16.652 0.796 -1.005 1.00 . A A . 8 LEU HA 1 1 11 2908 1 1 8 LEU HB2 H 16.632 3.613 -2.118 1.00 . A A . 8 LEU HB2 1 1 11 2909 1 1 8 LEU HB3 H 17.326 2.165 -2.849 1.00 . A A . 8 LEU HB3 1 1 11 2910 1 1 8 LEU HD11 H 15.606 3.920 -4.236 1.00 . A A . 8 LEU HD11 1 1 11 2911 1 1 8 LEU HD12 H 14.148 3.024 -4.661 1.00 . A A . 8 LEU HD12 1 1 11 2912 1 1 8 LEU HD13 H 15.738 2.347 -5.019 1.00 . A A . 8 LEU HD13 1 1 11 2913 1 1 8 LEU HD21 H 13.968 0.500 -3.094 1.00 . A A . 8 LEU HD21 1 1 11 2914 1 1 8 LEU HD22 H 15.539 0.233 -2.346 1.00 . A A . 8 LEU HD22 1 1 11 2915 1 1 8 LEU HD23 H 15.424 0.456 -4.089 1.00 . A A . 8 LEU HD23 1 1 11 2916 1 1 8 LEU HG H 14.377 2.642 -2.345 1.00 . A A . 8 LEU HG 1 1 11 2917 1 1 8 LEU N N 15.307 2.132 -0.151 1.00 . A A . 8 LEU N 1 1 11 2918 1 1 8 LEU O O 18.815 1.919 -0.120 1.00 . A A . 8 LEU O 1 1 11 2919 1 1 9 MET C C 18.686 3.148 2.793 1.00 . A A . 9 MET C 1 1 11 2920 1 1 9 MET CA C 18.331 4.058 1.618 1.00 . A A . 9 MET CA 1 1 11 2921 1 1 9 MET CB C 17.739 5.365 2.150 1.00 . A A . 9 MET CB 1 1 11 2922 1 1 9 MET CE C 15.499 7.400 2.760 1.00 . A A . 9 MET CE 1 1 11 2923 1 1 9 MET CG C 17.151 6.162 0.989 1.00 . A A . 9 MET CG 1 1 11 2924 1 1 9 MET H H 16.438 3.743 0.748 1.00 . A A . 9 MET H 1 1 11 2925 1 1 9 MET HA H 19.226 4.281 1.056 1.00 . A A . 9 MET HA 1 1 11 2926 1 1 9 MET HB2 H 16.963 5.144 2.868 1.00 . A A . 9 MET HB2 1 1 11 2927 1 1 9 MET HB3 H 18.513 5.948 2.622 1.00 . A A . 9 MET HB3 1 1 11 2928 1 1 9 MET HE1 H 15.172 6.386 2.585 1.00 . A A . 9 MET HE1 1 1 11 2929 1 1 9 MET HE2 H 14.659 8.070 2.665 1.00 . A A . 9 MET HE2 1 1 11 2930 1 1 9 MET HE3 H 15.913 7.484 3.755 1.00 . A A . 9 MET HE3 1 1 11 2931 1 1 9 MET HG2 H 17.861 6.199 0.176 1.00 . A A . 9 MET HG2 1 1 11 2932 1 1 9 MET HG3 H 16.247 5.678 0.654 1.00 . A A . 9 MET HG3 1 1 11 2933 1 1 9 MET N N 17.363 3.418 0.747 1.00 . A A . 9 MET N 1 1 11 2934 1 1 9 MET O O 19.840 3.085 3.215 1.00 . A A . 9 MET O 1 1 11 2935 1 1 9 MET SD S 16.767 7.841 1.545 1.00 . A A . 9 MET SD 1 1 11 2936 1 1 10 . C C 17.070 2.036 5.670 1.00 . A A . 10 DBB C 1 1 11 2937 1 1 10 . CA C 17.886 1.574 4.475 1.00 . A A . 10 DBB CA 1 1 11 2938 1 1 10 . CB C 17.483 0.132 4.148 1.00 . A A . 10 DBB CB 1 1 11 2939 1 1 10 . CG C 16.175 0.161 3.362 1.00 . A A . 10 DBB CG 1 1 11 2940 1 1 10 . H H 16.775 2.566 2.963 1.00 . A A . 10 DBB H 1 1 11 2941 1 1 10 . HA H 18.933 1.588 4.740 1.00 . A A . 10 DBB HA 1 1 11 2942 1 1 10 . HB2 H 18.221 -0.284 3.503 1.00 . A A . 10 DBB HB2 1 1 11 2943 1 1 10 . HG1 H 16.187 1.006 2.696 1.00 . A A . 10 DBB HG1 1 1 11 2944 1 1 10 . HG2 H 15.339 0.244 4.034 1.00 . A A . 10 DBB HG2 1 1 11 2945 1 1 10 . HG3 H 16.082 -0.743 2.785 1.00 . A A . 10 DBB HG3 1 1 11 2946 1 1 10 . N N 17.676 2.461 3.331 1.00 . A A . 10 DBB N 1 1 11 2947 1 1 10 . O O 17.621 2.371 6.719 1.00 . A A . 10 DBB O 1 1 11 2948 1 1 11 GLY C C 13.463 2.763 6.096 1.00 . A A . 11 GLY C 1 1 11 2949 1 1 11 GLY CA C 14.877 2.450 6.594 1.00 . A A . 11 GLY CA 1 1 11 2950 1 1 11 GLY H H 15.364 1.760 4.658 1.00 . A A . 11 GLY H 1 1 11 2951 1 1 11 GLY HA2 H 14.827 1.658 7.326 1.00 . A A . 11 GLY HA2 1 1 11 2952 1 1 11 GLY HA3 H 15.293 3.328 7.051 1.00 . A A . 11 GLY HA3 1 1 11 2953 1 1 11 GLY N N 15.750 2.041 5.511 1.00 . A A . 11 GLY N 1 1 11 2954 1 1 11 GLY O O 13.002 3.900 6.193 1.00 . A A . 11 GLY O 1 1 11 2955 1 1 12 CYS C C 10.676 0.613 4.981 1.00 . A A . 12 CYS C 1 1 11 2956 1 1 12 CYS CA C 11.416 1.934 5.068 1.00 . A A . 12 CYS CA 1 1 11 2957 1 1 12 CYS CB C 11.444 2.554 3.674 1.00 . A A . 12 CYS CB 1 1 11 2958 1 1 12 CYS H H 13.193 0.860 5.521 1.00 . A A . 12 CYS H 1 1 11 2959 1 1 12 CYS HA H 10.880 2.593 5.733 1.00 . A A . 12 CYS HA 1 1 11 2960 1 1 12 CYS HB2 H 11.394 1.769 2.933 1.00 . A A . 12 CYS HB2 1 1 11 2961 1 1 12 CYS HB3 H 10.603 3.215 3.550 1.00 . A A . 12 CYS HB3 1 1 11 2962 1 1 12 CYS N N 12.778 1.748 5.570 1.00 . A A . 12 CYS N 1 1 11 2963 1 1 12 CYS O O 11.045 -0.372 5.619 1.00 . A A . 12 CYS O 1 1 11 2964 1 1 12 CYS SG S 12.977 3.470 3.467 1.00 . A A . 12 CYS SG 1 1 11 2965 1 1 13 GLY C C 8.728 -0.864 2.452 1.00 . A A . 13 GLY C 1 1 11 2966 1 1 13 GLY CA C 8.819 -0.573 3.941 1.00 . A A . 13 GLY CA 1 1 11 2967 1 1 13 GLY H H 9.418 1.436 3.675 1.00 . A A . 13 GLY H 1 1 11 2968 1 1 13 GLY HA2 H 9.265 -1.417 4.447 1.00 . A A . 13 GLY HA2 1 1 11 2969 1 1 13 GLY HA3 H 7.827 -0.405 4.326 1.00 . A A . 13 GLY HA3 1 1 11 2970 1 1 13 GLY N N 9.634 0.613 4.159 1.00 . A A . 13 GLY N 1 1 11 2971 1 1 13 GLY O O 8.015 -1.768 2.021 1.00 . A A . 13 GLY O 1 1 11 2972 1 1 14 TRP C C 8.948 -1.573 -0.219 1.00 . A A . 14 TRP C 1 1 11 2973 1 1 14 TRP CA C 9.512 -0.218 0.230 1.00 . A A . 14 TRP CA 1 1 11 2974 1 1 14 TRP CB C 10.961 -0.033 -0.241 1.00 . A A . 14 TRP CB 1 1 11 2975 1 1 14 TRP CD1 C 11.473 -1.797 1.479 1.00 . A A . 14 TRP CD1 1 1 11 2976 1 1 14 TRP CD2 C 13.231 -1.398 0.142 1.00 . A A . 14 TRP CD2 1 1 11 2977 1 1 14 TRP CE2 C 13.631 -2.407 1.049 1.00 . A A . 14 TRP CE2 1 1 11 2978 1 1 14 TRP CE3 C 14.165 -0.962 -0.813 1.00 . A A . 14 TRP CE3 1 1 11 2979 1 1 14 TRP CG C 11.849 -1.032 0.440 1.00 . A A . 14 TRP CG 1 1 11 2980 1 1 14 TRP CH2 C 15.824 -2.519 0.051 1.00 . A A . 14 TRP CH2 1 1 11 2981 1 1 14 TRP CZ2 C 14.909 -2.964 1.008 1.00 . A A . 14 TRP CZ2 1 1 11 2982 1 1 14 TRP CZ3 C 15.454 -1.521 -0.856 1.00 . A A . 14 TRP CZ3 1 1 11 2983 1 1 14 TRP H H 10.020 0.617 2.102 1.00 . A A . 14 TRP H 1 1 11 2984 1 1 14 TRP HA H 8.909 0.564 -0.208 1.00 . A A . 14 TRP HA 1 1 11 2985 1 1 14 TRP HB2 H 11.017 -0.166 -1.307 1.00 . A A . 14 TRP HB2 1 1 11 2986 1 1 14 TRP HB3 H 11.283 0.959 0.015 1.00 . A A . 14 TRP HB3 1 1 11 2987 1 1 14 TRP HD1 H 10.507 -1.774 1.945 1.00 . A A . 14 TRP HD1 1 1 11 2988 1 1 14 TRP HE1 H 12.504 -3.271 2.573 1.00 . A A . 14 TRP HE1 1 1 11 2989 1 1 14 TRP HE3 H 13.894 -0.192 -1.514 1.00 . A A . 14 TRP HE3 1 1 11 2990 1 1 14 TRP HH2 H 16.817 -2.941 0.013 1.00 . A A . 14 TRP HH2 1 1 11 2991 1 1 14 TRP HZ2 H 15.190 -3.734 1.711 1.00 . A A . 14 TRP HZ2 1 1 11 2992 1 1 14 TRP HZ3 H 16.164 -1.179 -1.593 1.00 . A A . 14 TRP HZ3 1 1 11 2993 1 1 14 TRP N N 9.473 -0.078 1.680 1.00 . A A . 14 TRP N 1 1 11 2994 1 1 14 TRP NE1 N 12.524 -2.616 1.843 1.00 . A A . 14 TRP NE1 1 1 11 2995 1 1 14 TRP O O 7.737 -1.790 -0.171 1.00 . A A . 14 TRP O 1 1 11 2996 1 1 15 LEU C C 9.659 -4.835 -0.040 1.00 . A A . 15 LEU C 1 1 11 2997 1 1 15 LEU CA C 9.380 -3.789 -1.116 1.00 . A A . 15 LEU CA 1 1 11 2998 1 1 15 LEU CB C 10.122 -4.163 -2.402 1.00 . A A . 15 LEU CB 1 1 11 2999 1 1 15 LEU CD1 C 12.401 -4.204 -3.432 1.00 . A A . 15 LEU CD1 1 1 11 3000 1 1 15 LEU CD2 C 11.381 -2.021 -2.763 1.00 . A A . 15 LEU CD2 1 1 11 3001 1 1 15 LEU CG C 11.507 -3.507 -2.405 1.00 . A A . 15 LEU CG 1 1 11 3002 1 1 15 LEU H H 10.763 -2.262 -0.697 1.00 . A A . 15 LEU H 1 1 11 3003 1 1 15 LEU HA H 8.320 -3.760 -1.317 1.00 . A A . 15 LEU HA 1 1 11 3004 1 1 15 LEU HB2 H 10.230 -5.237 -2.454 1.00 . A A . 15 LEU HB2 1 1 11 3005 1 1 15 LEU HB3 H 9.560 -3.817 -3.257 1.00 . A A . 15 LEU HB3 1 1 11 3006 1 1 15 LEU HD11 H 12.081 -5.227 -3.552 1.00 . A A . 15 LEU HD11 1 1 11 3007 1 1 15 LEU HD12 H 13.425 -4.184 -3.090 1.00 . A A . 15 LEU HD12 1 1 11 3008 1 1 15 LEU HD13 H 12.328 -3.690 -4.380 1.00 . A A . 15 LEU HD13 1 1 11 3009 1 1 15 LEU HD21 H 12.058 -1.446 -2.147 1.00 . A A . 15 LEU HD21 1 1 11 3010 1 1 15 LEU HD22 H 10.369 -1.689 -2.589 1.00 . A A . 15 LEU HD22 1 1 11 3011 1 1 15 LEU HD23 H 11.633 -1.877 -3.804 1.00 . A A . 15 LEU HD23 1 1 11 3012 1 1 15 LEU HG H 11.949 -3.605 -1.425 1.00 . A A . 15 LEU HG 1 1 11 3013 1 1 15 LEU N N 9.817 -2.478 -0.664 1.00 . A A . 15 LEU N 1 1 11 3014 1 1 15 LEU O O 8.946 -5.833 0.071 1.00 . A A . 15 LEU O 1 1 11 3015 1 1 16 . C C 10.227 -5.269 3.013 1.00 . A A . 16 DBU C 1 1 11 3016 1 1 16 . CA C 11.110 -5.444 1.801 1.00 . A A . 16 DBU CA 1 1 11 3017 1 1 16 . CB C 12.169 -6.359 1.837 1.00 . A A . 16 DBU CB 1 1 11 3018 1 1 16 . CG C 13.125 -6.630 0.704 1.00 . A A . 16 DBU CG 1 1 11 3019 1 1 16 . H H 11.236 -3.785 0.619 1.00 . A A . 16 DBU H 1 1 11 3020 1 1 16 . HB H 12.329 -6.926 2.742 1.00 . A A . 16 DBU HB 1 1 11 3021 1 1 16 . HG1 H 13.663 -5.726 0.458 1.00 . A A . 16 DBU HG1 1 1 11 3022 1 1 16 . HG2 H 12.571 -6.967 -0.161 1.00 . A A . 16 DBU HG2 1 1 11 3023 1 1 16 . HG3 H 13.826 -7.397 1.001 1.00 . A A . 16 DBU HG3 1 1 11 3024 1 1 16 . N N 10.702 -4.594 0.751 1.00 . A A . 16 DBU N 1 1 11 3025 1 1 16 . O O 9.566 -6.208 3.455 1.00 . A A . 16 DBU O 1 1 11 3026 1 1 17 GLY C C 10.198 -3.060 5.811 1.00 . A A . 17 GLY C 1 1 11 3027 1 1 17 GLY CA C 9.390 -3.773 4.731 1.00 . A A . 17 GLY CA 1 1 11 3028 1 1 17 GLY H H 10.753 -3.341 3.168 1.00 . A A . 17 GLY H 1 1 11 3029 1 1 17 GLY HA2 H 8.558 -3.146 4.439 1.00 . A A . 17 GLY HA2 1 1 11 3030 1 1 17 GLY HA3 H 9.009 -4.702 5.132 1.00 . A A . 17 GLY HA3 1 1 11 3031 1 1 17 GLY N N 10.209 -4.056 3.560 1.00 . A A . 17 GLY N 1 1 11 3032 1 1 17 GLY O O 9.776 -2.028 6.332 1.00 . A A . 17 GLY O 1 1 11 3033 1 1 18 LEU C C 13.294 -2.152 6.545 1.00 . A A . 18 LEU C 1 1 11 3034 1 1 18 LEU CA C 12.207 -3.018 7.173 1.00 . A A . 18 LEU CA 1 1 11 3035 1 1 18 LEU CB C 12.850 -4.106 8.028 1.00 . A A . 18 LEU CB 1 1 11 3036 1 1 18 LEU CD1 C 12.360 -6.005 9.578 1.00 . A A . 18 LEU CD1 1 1 11 3037 1 1 18 LEU CD2 C 11.349 -3.760 9.992 1.00 . A A . 18 LEU CD2 1 1 11 3038 1 1 18 LEU CG C 11.784 -4.754 8.913 1.00 . A A . 18 LEU CG 1 1 11 3039 1 1 18 LEU H H 11.643 -4.443 5.708 1.00 . A A . 18 LEU H 1 1 11 3040 1 1 18 LEU HA H 11.595 -2.396 7.809 1.00 . A A . 18 LEU HA 1 1 11 3041 1 1 18 LEU HB2 H 13.291 -4.856 7.386 1.00 . A A . 18 LEU HB2 1 1 11 3042 1 1 18 LEU HB3 H 13.616 -3.670 8.652 1.00 . A A . 18 LEU HB3 1 1 11 3043 1 1 18 LEU HD11 H 13.253 -6.311 9.056 1.00 . A A . 18 LEU HD11 1 1 11 3044 1 1 18 LEU HD12 H 11.630 -6.801 9.540 1.00 . A A . 18 LEU HD12 1 1 11 3045 1 1 18 LEU HD13 H 12.600 -5.787 10.608 1.00 . A A . 18 LEU HD13 1 1 11 3046 1 1 18 LEU HD21 H 10.959 -2.868 9.523 1.00 . A A . 18 LEU HD21 1 1 11 3047 1 1 18 LEU HD22 H 12.197 -3.503 10.608 1.00 . A A . 18 LEU HD22 1 1 11 3048 1 1 18 LEU HD23 H 10.581 -4.208 10.606 1.00 . A A . 18 LEU HD23 1 1 11 3049 1 1 18 LEU HG H 10.932 -5.027 8.307 1.00 . A A . 18 LEU HG 1 1 11 3050 1 1 18 LEU N N 11.356 -3.618 6.151 1.00 . A A . 18 LEU N 1 1 11 3051 1 1 18 LEU O O 13.403 -0.964 6.852 1.00 . A A . 18 LEU O 1 1 11 3052 1 1 19 CYS C C 16.286 -2.993 4.600 1.00 . A A . 19 CYS C 1 1 11 3053 1 1 19 CYS CA C 15.178 -2.029 5.019 1.00 . A A . 19 CYS CA 1 1 11 3054 1 1 19 CYS CB C 15.747 -0.981 5.976 1.00 . A A . 19 CYS CB 1 1 11 3055 1 1 19 CYS H H 13.975 -3.696 5.468 1.00 . A A . 19 CYS H 1 1 11 3056 1 1 19 CYS HA H 14.788 -1.534 4.145 1.00 . A A . 19 CYS HA 1 1 11 3057 1 1 19 CYS HB2 H 15.259 -0.035 5.814 1.00 . A A . 19 CYS HB2 1 1 11 3058 1 1 19 CYS HB3 H 15.575 -1.300 6.994 1.00 . A A . 19 CYS HB3 1 1 11 3059 1 1 19 CYS N N 14.102 -2.753 5.672 1.00 . A A . 19 CYS N 1 1 11 3060 1 1 19 CYS O O 16.846 -3.707 5.432 1.00 . A A . 19 CYS O 1 1 11 3061 1 1 19 CYS SG S 17.528 -0.810 5.700 1.00 . A A . 19 CYS SG 1 1 11 3062 1 1 20 VAL C C 18.604 -3.087 1.910 1.00 . A A . 20 VAL C 1 1 11 3063 1 1 20 VAL CA C 17.649 -3.876 2.798 1.00 . A A . 20 VAL CA 1 1 11 3064 1 1 20 VAL CB C 17.029 -5.019 1.995 1.00 . A A . 20 VAL CB 1 1 11 3065 1 1 20 VAL CG1 C 18.123 -6.005 1.585 1.00 . A A . 20 VAL CG1 1 1 11 3066 1 1 20 VAL CG2 C 15.989 -5.738 2.858 1.00 . A A . 20 VAL CG2 1 1 11 3067 1 1 20 VAL H H 16.128 -2.411 2.697 1.00 . A A . 20 VAL H 1 1 11 3068 1 1 20 VAL HA H 18.200 -4.290 3.628 1.00 . A A . 20 VAL HA 1 1 11 3069 1 1 20 VAL HB H 16.553 -4.620 1.110 1.00 . A A . 20 VAL HB 1 1 11 3070 1 1 20 VAL HG11 H 19.075 -5.663 1.962 1.00 . A A . 20 VAL HG11 1 1 11 3071 1 1 20 VAL HG12 H 18.165 -6.069 0.508 1.00 . A A . 20 VAL HG12 1 1 11 3072 1 1 20 VAL HG13 H 17.904 -6.980 1.996 1.00 . A A . 20 VAL HG13 1 1 11 3073 1 1 20 VAL HG21 H 15.012 -5.628 2.411 1.00 . A A . 20 VAL HG21 1 1 11 3074 1 1 20 VAL HG22 H 15.983 -5.308 3.847 1.00 . A A . 20 VAL HG22 1 1 11 3075 1 1 20 VAL HG23 H 16.240 -6.787 2.923 1.00 . A A . 20 VAL HG23 1 1 11 3076 1 1 20 VAL N N 16.603 -3.002 3.312 1.00 . A A . 20 VAL N 1 1 11 3077 1 1 20 VAL O O 18.619 -3.258 0.690 1.00 . A A . 20 VAL O 1 1 11 3078 1 1 21 ARG C C 19.647 -0.237 1.109 1.00 . A A . 21 ARG C 1 1 11 3079 1 1 21 ARG CA C 20.351 -1.404 1.791 1.00 . A A . 21 ARG CA 1 1 11 3080 1 1 21 ARG CB C 21.067 -2.255 0.742 1.00 . A A . 21 ARG CB 1 1 11 3081 1 1 21 ARG CD C 23.242 -2.200 1.964 1.00 . A A . 21 ARG CD 1 1 11 3082 1 1 21 ARG CG C 22.533 -1.831 0.659 1.00 . A A . 21 ARG CG 1 1 11 3083 1 1 21 ARG CZ C 25.335 -1.548 3.005 1.00 . A A . 21 ARG CZ 1 1 11 3084 1 1 21 ARG H H 19.336 -2.126 3.504 1.00 . A A . 21 ARG H 1 1 11 3085 1 1 21 ARG HA H 21.084 -1.011 2.480 1.00 . A A . 21 ARG HA 1 1 11 3086 1 1 21 ARG HB2 H 21.007 -3.298 1.024 1.00 . A A . 21 ARG HB2 1 1 11 3087 1 1 21 ARG HB3 H 20.597 -2.114 -0.220 1.00 . A A . 21 ARG HB3 1 1 11 3088 1 1 21 ARG HD2 H 22.773 -1.682 2.786 1.00 . A A . 21 ARG HD2 1 1 11 3089 1 1 21 ARG HD3 H 23.161 -3.267 2.123 1.00 . A A . 21 ARG HD3 1 1 11 3090 1 1 21 ARG HE H 25.097 -1.777 1.030 1.00 . A A . 21 ARG HE 1 1 11 3091 1 1 21 ARG HG2 H 23.010 -2.339 -0.168 1.00 . A A . 21 ARG HG2 1 1 11 3092 1 1 21 ARG HG3 H 22.593 -0.764 0.510 1.00 . A A . 21 ARG HG3 1 1 11 3093 1 1 21 ARG HH11 H 23.783 -1.862 4.230 1.00 . A A . 21 ARG HH11 1 1 11 3094 1 1 21 ARG HH12 H 25.263 -1.397 4.999 1.00 . A A . 21 ARG HH12 1 1 11 3095 1 1 21 ARG HH21 H 27.042 -1.166 2.033 1.00 . A A . 21 ARG HH21 1 1 11 3096 1 1 21 ARG HH22 H 27.109 -1.003 3.755 1.00 . A A . 21 ARG HH22 1 1 11 3097 1 1 21 ARG N N 19.397 -2.220 2.531 1.00 . A A . 21 ARG N 1 1 11 3098 1 1 21 ARG NE N 24.649 -1.824 1.901 1.00 . A A . 21 ARG NE 1 1 11 3099 1 1 21 ARG NH1 N 24.748 -1.608 4.169 1.00 . A A . 21 ARG NH1 1 1 11 3100 1 1 21 ARG NH2 N 26.594 -1.212 2.925 1.00 . A A . 21 ARG NH2 1 1 11 3101 1 1 21 ARG O O 18.967 -0.474 0.122 1.00 . A A . 21 ARG O 1 1 11 3102 1 1 21 ARG OXT O 19.797 0.877 1.583 1.00 . A A . 21 ARG OXT 1 1 12 3103 1 1 1 ALA C C 10.952 3.030 -8.389 1.00 . A A . 1 ALA C 1 1 12 3104 1 1 1 ALA CA C 9.708 2.257 -7.964 1.00 . A A . 1 ALA CA 1 1 12 3105 1 1 1 ALA CB C 9.126 2.861 -6.682 1.00 . A A . 1 ALA CB 1 1 12 3106 1 1 1 ALA H1 H 9.226 0.238 -7.802 1.00 . A A . 1 ALA H1 1 1 12 3107 1 1 1 ALA H2 H 10.472 0.740 -6.761 1.00 . A A . 1 ALA H2 1 1 12 3108 1 1 1 ALA H3 H 10.778 0.531 -8.419 1.00 . A A . 1 ALA H3 1 1 12 3109 1 1 1 ALA HA H 8.969 2.305 -8.751 1.00 . A A . 1 ALA HA 1 1 12 3110 1 1 1 ALA HB1 H 9.809 3.598 -6.289 1.00 . A A . 1 ALA HB1 1 1 12 3111 1 1 1 ALA HB2 H 8.980 2.079 -5.950 1.00 . A A . 1 ALA HB2 1 1 12 3112 1 1 1 ALA HB3 H 8.178 3.329 -6.902 1.00 . A A . 1 ALA HB3 1 1 12 3113 1 1 1 ALA N N 10.073 0.835 -7.718 1.00 . A A . 1 ALA N 1 1 12 3114 1 1 1 ALA O O 10.940 3.740 -9.394 1.00 . A A . 1 ALA O 1 1 12 3115 1 1 2 GLY C C 13.219 5.029 -7.452 1.00 . A A . 2 GLY C 1 1 12 3116 1 1 2 GLY CA C 13.271 3.580 -7.922 1.00 . A A . 2 GLY CA 1 1 12 3117 1 1 2 GLY H H 11.978 2.309 -6.828 1.00 . A A . 2 GLY H 1 1 12 3118 1 1 2 GLY HA2 H 14.088 3.074 -7.426 1.00 . A A . 2 GLY HA2 1 1 12 3119 1 1 2 GLY HA3 H 13.438 3.561 -8.989 1.00 . A A . 2 GLY HA3 1 1 12 3120 1 1 2 GLY N N 12.025 2.888 -7.617 1.00 . A A . 2 GLY N 1 1 12 3121 1 1 2 GLY O O 14.047 5.849 -7.846 1.00 . A A . 2 GLY O 1 1 12 3122 1 1 3 GLY C C 13.303 7.083 -5.237 1.00 . A A . 3 GLY C 1 1 12 3123 1 1 3 GLY CA C 12.097 6.694 -6.087 1.00 . A A . 3 GLY CA 1 1 12 3124 1 1 3 GLY H H 11.610 4.644 -6.324 1.00 . A A . 3 GLY H 1 1 12 3125 1 1 3 GLY HA2 H 12.007 7.382 -6.915 1.00 . A A . 3 GLY HA2 1 1 12 3126 1 1 3 GLY HA3 H 11.206 6.749 -5.481 1.00 . A A . 3 GLY HA3 1 1 12 3127 1 1 3 GLY N N 12.243 5.338 -6.606 1.00 . A A . 3 GLY N 1 1 12 3128 1 1 3 GLY O O 13.738 8.235 -5.248 1.00 . A A . 3 GLY O 1 1 12 3129 1 1 4 . C C 14.521 7.017 -2.381 1.00 . A A . 4 DBU C 1 1 12 3130 1 1 4 . CA C 14.953 6.369 -3.673 1.00 . A A . 4 DBU CA 1 1 12 3131 1 1 4 . CB C 16.312 6.111 -3.891 1.00 . A A . 4 DBU CB 1 1 12 3132 1 1 4 . CG C 16.927 5.474 -5.115 1.00 . A A . 4 DBU CG 1 1 12 3133 1 1 4 . H H 13.451 5.213 -4.521 1.00 . A A . 4 DBU H 1 1 12 3134 1 1 4 . HB H 17.012 6.388 -3.117 1.00 . A A . 4 DBU HB 1 1 12 3135 1 1 4 . HG1 H 17.532 4.630 -4.818 1.00 . A A . 4 DBU HG1 1 1 12 3136 1 1 4 . HG2 H 17.545 6.201 -5.619 1.00 . A A . 4 DBU HG2 1 1 12 3137 1 1 4 . HG3 H 16.146 5.141 -5.781 1.00 . A A . 4 DBU HG3 1 1 12 3138 1 1 4 . N N 13.835 6.115 -4.499 1.00 . A A . 4 DBU N 1 1 12 3139 1 1 4 . O O 14.563 8.237 -2.261 1.00 . A A . 4 DBU O 1 1 12 3140 1 1 5 ILE C C 12.676 5.728 0.532 1.00 . A A . 5 ILE C 1 1 12 3141 1 1 5 ILE CA C 13.662 6.695 -0.115 1.00 . A A . 5 ILE CA 1 1 12 3142 1 1 5 ILE CB C 13.005 8.071 -0.255 1.00 . A A . 5 ILE CB 1 1 12 3143 1 1 5 ILE CD1 C 14.115 9.668 1.370 1.00 . A A . 5 ILE CD1 1 1 12 3144 1 1 5 ILE CG1 C 14.076 9.159 -0.076 1.00 . A A . 5 ILE CG1 1 1 12 3145 1 1 5 ILE CG2 C 11.906 8.237 0.804 1.00 . A A . 5 ILE CG2 1 1 12 3146 1 1 5 ILE H H 14.098 5.231 -1.583 1.00 . A A . 5 ILE H 1 1 12 3147 1 1 5 ILE HA H 14.518 6.793 0.523 1.00 . A A . 5 ILE HA 1 1 12 3148 1 1 5 ILE HB H 12.566 8.157 -1.239 1.00 . A A . 5 ILE HB 1 1 12 3149 1 1 5 ILE HD11 H 15.096 10.068 1.582 1.00 . A A . 5 ILE HD11 1 1 12 3150 1 1 5 ILE HD12 H 13.903 8.852 2.044 1.00 . A A . 5 ILE HD12 1 1 12 3151 1 1 5 ILE HD13 H 13.374 10.444 1.498 1.00 . A A . 5 ILE HD13 1 1 12 3152 1 1 5 ILE HG12 H 15.041 8.747 -0.330 1.00 . A A . 5 ILE HG12 1 1 12 3153 1 1 5 ILE HG13 H 13.855 9.978 -0.740 1.00 . A A . 5 ILE HG13 1 1 12 3154 1 1 5 ILE HG21 H 12.289 7.929 1.767 1.00 . A A . 5 ILE HG21 1 1 12 3155 1 1 5 ILE HG22 H 11.055 7.624 0.542 1.00 . A A . 5 ILE HG22 1 1 12 3156 1 1 5 ILE HG23 H 11.603 9.272 0.851 1.00 . A A . 5 ILE HG23 1 1 12 3157 1 1 5 ILE N N 14.106 6.197 -1.416 1.00 . A A . 5 ILE N 1 1 12 3158 1 1 5 ILE O O 12.715 5.508 1.743 1.00 . A A . 5 ILE O 1 1 12 3159 1 1 6 PRO C C 11.359 2.951 0.813 1.00 . A A . 6 PRO C 1 1 12 3160 1 1 6 PRO CA C 10.757 4.233 0.270 1.00 . A A . 6 PRO CA 1 1 12 3161 1 1 6 PRO CB C 9.835 3.961 -0.923 1.00 . A A . 6 PRO CB 1 1 12 3162 1 1 6 PRO CD C 11.662 5.360 -1.691 1.00 . A A . 6 PRO CD 1 1 12 3163 1 1 6 PRO CG C 10.226 4.944 -1.982 1.00 . A A . 6 PRO CG 1 1 12 3164 1 1 6 PRO HA H 10.196 4.719 1.047 1.00 . A A . 6 PRO HA 1 1 12 3165 1 1 6 PRO HB2 H 9.976 2.948 -1.278 1.00 . A A . 6 PRO HB2 1 1 12 3166 1 1 6 PRO HB3 H 8.806 4.116 -0.639 1.00 . A A . 6 PRO HB3 1 1 12 3167 1 1 6 PRO HD2 H 12.358 4.730 -2.226 1.00 . A A . 6 PRO HD2 1 1 12 3168 1 1 6 PRO HD3 H 11.816 6.388 -1.943 1.00 . A A . 6 PRO HD3 1 1 12 3169 1 1 6 PRO HG2 H 10.159 4.484 -2.957 1.00 . A A . 6 PRO HG2 1 1 12 3170 1 1 6 PRO HG3 H 9.586 5.811 -1.934 1.00 . A A . 6 PRO HG3 1 1 12 3171 1 1 6 PRO N N 11.787 5.169 -0.243 1.00 . A A . 6 PRO N 1 1 12 3172 1 1 6 PRO O O 10.634 2.091 1.309 1.00 . A A . 6 PRO O 1 1 12 3173 1 1 7 DAL C C 14.679 1.391 0.470 1.00 . A A . 7 DAL C 1 1 12 3174 1 1 7 DAL CA C 13.376 1.654 1.225 1.00 . A A . 7 DAL CA 1 1 12 3175 1 1 7 DAL CB C 13.724 1.848 2.705 1.00 . A A . 7 DAL CB 1 1 12 3176 1 1 7 DAL H H 13.196 3.563 0.320 1.00 . A A . 7 DAL H 1 1 12 3177 1 1 7 DAL HA H 12.730 0.795 1.129 1.00 . A A . 7 DAL HA 1 1 12 3178 1 1 7 DAL HB1 H 14.762 2.124 2.792 1.00 . A A . 7 DAL HB1 1 1 12 3179 1 1 7 DAL HB2 H 13.552 0.926 3.239 1.00 . A A . 7 DAL HB2 1 1 12 3180 1 1 7 DAL N N 12.681 2.836 0.720 1.00 . A A . 7 DAL N 1 1 12 3181 1 1 7 DAL O O 15.245 0.303 0.565 1.00 . A A . 7 DAL O 1 1 12 3182 1 1 8 LEU C C 17.530 2.770 -0.001 1.00 . A A . 8 LEU C 1 1 12 3183 1 1 8 LEU CA C 16.443 2.262 -0.932 1.00 . A A . 8 LEU CA 1 1 12 3184 1 1 8 LEU CB C 16.440 3.089 -2.227 1.00 . A A . 8 LEU CB 1 1 12 3185 1 1 8 LEU CD1 C 15.313 3.237 -4.457 1.00 . A A . 8 LEU CD1 1 1 12 3186 1 1 8 LEU CD2 C 14.583 1.502 -2.819 1.00 . A A . 8 LEU CD2 1 1 12 3187 1 1 8 LEU CG C 15.105 2.933 -2.971 1.00 . A A . 8 LEU CG 1 1 12 3188 1 1 8 LEU H H 14.717 3.261 -0.244 1.00 . A A . 8 LEU H 1 1 12 3189 1 1 8 LEU HA H 16.621 1.221 -1.164 1.00 . A A . 8 LEU HA 1 1 12 3190 1 1 8 LEU HB2 H 16.591 4.131 -1.984 1.00 . A A . 8 LEU HB2 1 1 12 3191 1 1 8 LEU HB3 H 17.244 2.754 -2.866 1.00 . A A . 8 LEU HB3 1 1 12 3192 1 1 8 LEU HD11 H 14.767 2.520 -5.053 1.00 . A A . 8 LEU HD11 1 1 12 3193 1 1 8 LEU HD12 H 16.367 3.171 -4.692 1.00 . A A . 8 LEU HD12 1 1 12 3194 1 1 8 LEU HD13 H 14.959 4.232 -4.677 1.00 . A A . 8 LEU HD13 1 1 12 3195 1 1 8 LEU HD21 H 15.416 0.817 -2.790 1.00 . A A . 8 LEU HD21 1 1 12 3196 1 1 8 LEU HD22 H 13.944 1.258 -3.656 1.00 . A A . 8 LEU HD22 1 1 12 3197 1 1 8 LEU HD23 H 14.019 1.424 -1.902 1.00 . A A . 8 LEU HD23 1 1 12 3198 1 1 8 LEU HG H 14.381 3.627 -2.563 1.00 . A A . 8 LEU HG 1 1 12 3199 1 1 8 LEU N N 15.180 2.401 -0.231 1.00 . A A . 8 LEU N 1 1 12 3200 1 1 8 LEU O O 18.691 2.362 -0.070 1.00 . A A . 8 LEU O 1 1 12 3201 1 1 9 MET C C 18.413 3.218 2.901 1.00 . A A . 9 MET C 1 1 12 3202 1 1 9 MET CA C 17.993 4.260 1.872 1.00 . A A . 9 MET CA 1 1 12 3203 1 1 9 MET CB C 17.257 5.406 2.569 1.00 . A A . 9 MET CB 1 1 12 3204 1 1 9 MET CE C 17.609 8.600 2.678 1.00 . A A . 9 MET CE 1 1 12 3205 1 1 9 MET CG C 16.677 6.344 1.513 1.00 . A A . 9 MET CG 1 1 12 3206 1 1 9 MET H H 16.165 3.929 0.881 1.00 . A A . 9 MET H 1 1 12 3207 1 1 9 MET HA H 18.869 4.651 1.379 1.00 . A A . 9 MET HA 1 1 12 3208 1 1 9 MET HB2 H 16.458 5.005 3.175 1.00 . A A . 9 MET HB2 1 1 12 3209 1 1 9 MET HB3 H 17.940 5.956 3.195 1.00 . A A . 9 MET HB3 1 1 12 3210 1 1 9 MET HE1 H 17.455 9.454 3.323 1.00 . A A . 9 MET HE1 1 1 12 3211 1 1 9 MET HE2 H 18.067 8.926 1.757 1.00 . A A . 9 MET HE2 1 1 12 3212 1 1 9 MET HE3 H 18.256 7.884 3.166 1.00 . A A . 9 MET HE3 1 1 12 3213 1 1 9 MET HG2 H 17.448 6.627 0.813 1.00 . A A . 9 MET HG2 1 1 12 3214 1 1 9 MET HG3 H 15.882 5.834 0.989 1.00 . A A . 9 MET HG3 1 1 12 3215 1 1 9 MET N N 17.109 3.666 0.886 1.00 . A A . 9 MET N 1 1 12 3216 1 1 9 MET O O 19.560 3.201 3.351 1.00 . A A . 9 MET O 1 1 12 3217 1 1 9 MET SD S 16.017 7.820 2.321 1.00 . A A . 9 MET SD 1 1 12 3218 1 1 10 . C C 16.956 1.585 5.536 1.00 . A A . 10 DBB C 1 1 12 3219 1 1 10 . CA C 17.749 1.328 4.271 1.00 . A A . 10 DBB CA 1 1 12 3220 1 1 10 . CB C 17.407 -0.059 3.725 1.00 . A A . 10 DBB CB 1 1 12 3221 1 1 10 . CG C 15.937 -0.093 3.304 1.00 . A A . 10 DBB CG 1 1 12 3222 1 1 10 . H H 16.571 2.427 2.895 1.00 . A A . 10 DBB H 1 1 12 3223 1 1 10 . HA H 18.802 1.354 4.509 1.00 . A A . 10 DBB HA 1 1 12 3224 1 1 10 . HB2 H 17.994 -0.231 2.851 1.00 . A A . 10 DBB HB2 1 1 12 3225 1 1 10 . HG1 H 15.773 0.623 2.517 1.00 . A A . 10 DBB HG1 1 1 12 3226 1 1 10 . HG2 H 15.306 0.143 4.144 1.00 . A A . 10 DBB HG2 1 1 12 3227 1 1 10 . HG3 H 15.691 -1.081 2.942 1.00 . A A . 10 DBB HG3 1 1 12 3228 1 1 10 . N N 17.471 2.359 3.281 1.00 . A A . 10 DBB N 1 1 12 3229 1 1 10 . O O 17.507 1.582 6.637 1.00 . A A . 10 DBB O 1 1 12 3230 1 1 11 GLY C C 13.379 2.374 6.105 1.00 . A A . 11 GLY C 1 1 12 3231 1 1 11 GLY CA C 14.814 2.067 6.525 1.00 . A A . 11 GLY CA 1 1 12 3232 1 1 11 GLY H H 15.270 1.805 4.480 1.00 . A A . 11 GLY H 1 1 12 3233 1 1 11 GLY HA2 H 14.820 1.202 7.173 1.00 . A A . 11 GLY HA2 1 1 12 3234 1 1 11 GLY HA3 H 15.218 2.907 7.052 1.00 . A A . 11 GLY HA3 1 1 12 3235 1 1 11 GLY N N 15.660 1.809 5.378 1.00 . A A . 11 GLY N 1 1 12 3236 1 1 11 GLY O O 12.901 3.496 6.273 1.00 . A A . 11 GLY O 1 1 12 3237 1 1 12 CYS C C 10.585 0.206 5.079 1.00 . A A . 12 CYS C 1 1 12 3238 1 1 12 CYS CA C 11.311 1.537 5.131 1.00 . A A . 12 CYS CA 1 1 12 3239 1 1 12 CYS CB C 11.256 2.137 3.729 1.00 . A A . 12 CYS CB 1 1 12 3240 1 1 12 CYS H H 13.133 0.494 5.461 1.00 . A A . 12 CYS H 1 1 12 3241 1 1 12 CYS HA H 10.798 2.195 5.811 1.00 . A A . 12 CYS HA 1 1 12 3242 1 1 12 CYS HB2 H 11.234 1.334 3.010 1.00 . A A . 12 CYS HB2 1 1 12 3243 1 1 12 CYS HB3 H 10.364 2.735 3.625 1.00 . A A . 12 CYS HB3 1 1 12 3244 1 1 12 CYS N N 12.697 1.367 5.566 1.00 . A A . 12 CYS N 1 1 12 3245 1 1 12 CYS O O 10.913 -0.737 5.798 1.00 . A A . 12 CYS O 1 1 12 3246 1 1 12 CYS SG S 12.708 3.159 3.424 1.00 . A A . 12 CYS SG 1 1 12 3247 1 1 13 GLY C C 8.637 -1.264 2.487 1.00 . A A . 13 GLY C 1 1 12 3248 1 1 13 GLY CA C 8.811 -1.046 3.980 1.00 . A A . 13 GLY CA 1 1 12 3249 1 1 13 GLY H H 9.413 0.942 3.642 1.00 . A A . 13 GLY H 1 1 12 3250 1 1 13 GLY HA2 H 9.315 -1.892 4.419 1.00 . A A . 13 GLY HA2 1 1 12 3251 1 1 13 GLY HA3 H 7.841 -0.926 4.436 1.00 . A A . 13 GLY HA3 1 1 12 3252 1 1 13 GLY N N 9.601 0.151 4.191 1.00 . A A . 13 GLY N 1 1 12 3253 1 1 13 GLY O O 7.765 -2.012 2.049 1.00 . A A . 13 GLY O 1 1 12 3254 1 1 14 TRP C C 8.966 -2.049 -0.203 1.00 . A A . 14 TRP C 1 1 12 3255 1 1 14 TRP CA C 9.428 -0.663 0.265 1.00 . A A . 14 TRP CA 1 1 12 3256 1 1 14 TRP CB C 10.810 -0.315 -0.308 1.00 . A A . 14 TRP CB 1 1 12 3257 1 1 14 TRP CD1 C 11.702 -1.998 1.361 1.00 . A A . 14 TRP CD1 1 1 12 3258 1 1 14 TRP CD2 C 13.239 -1.420 -0.175 1.00 . A A . 14 TRP CD2 1 1 12 3259 1 1 14 TRP CE2 C 13.859 -2.354 0.689 1.00 . A A . 14 TRP CE2 1 1 12 3260 1 1 14 TRP CE3 C 13.998 -0.897 -1.236 1.00 . A A . 14 TRP CE3 1 1 12 3261 1 1 14 TRP CG C 11.867 -1.208 0.277 1.00 . A A . 14 TRP CG 1 1 12 3262 1 1 14 TRP CH2 C 15.924 -2.223 -0.553 1.00 . A A . 14 TRP CH2 1 1 12 3263 1 1 14 TRP CZ2 C 15.184 -2.755 0.506 1.00 . A A . 14 TRP CZ2 1 1 12 3264 1 1 14 TRP CZ3 C 15.334 -1.297 -1.423 1.00 . A A . 14 TRP CZ3 1 1 12 3265 1 1 14 TRP H H 10.140 0.009 2.134 1.00 . A A . 14 TRP H 1 1 12 3266 1 1 14 TRP HA H 8.720 0.067 -0.095 1.00 . A A . 14 TRP HA 1 1 12 3267 1 1 14 TRP HB2 H 10.790 -0.426 -1.374 1.00 . A A . 14 TRP HB2 1 1 12 3268 1 1 14 TRP HB3 H 11.041 0.709 -0.070 1.00 . A A . 14 TRP HB3 1 1 12 3269 1 1 14 TRP HD1 H 10.797 -2.090 1.936 1.00 . A A . 14 TRP HD1 1 1 12 3270 1 1 14 TRP HE1 H 13.024 -3.315 2.338 1.00 . A A . 14 TRP HE1 1 1 12 3271 1 1 14 TRP HE3 H 13.550 -0.188 -1.913 1.00 . A A . 14 TRP HE3 1 1 12 3272 1 1 14 TRP HH2 H 16.951 -2.526 -0.703 1.00 . A A . 14 TRP HH2 1 1 12 3273 1 1 14 TRP HZ2 H 15.635 -3.470 1.178 1.00 . A A . 14 TRP HZ2 1 1 12 3274 1 1 14 TRP HZ3 H 15.908 -0.885 -2.241 1.00 . A A . 14 TRP HZ3 1 1 12 3275 1 1 14 TRP N N 9.476 -0.578 1.714 1.00 . A A . 14 TRP N 1 1 12 3276 1 1 14 TRP NE1 N 12.882 -2.679 1.607 1.00 . A A . 14 TRP NE1 1 1 12 3277 1 1 14 TRP O O 7.779 -2.364 -0.144 1.00 . A A . 14 TRP O 1 1 12 3278 1 1 15 LEU C C 10.266 -5.261 -0.370 1.00 . A A . 15 LEU C 1 1 12 3279 1 1 15 LEU CA C 9.558 -4.186 -1.187 1.00 . A A . 15 LEU CA 1 1 12 3280 1 1 15 LEU CB C 9.980 -4.297 -2.648 1.00 . A A . 15 LEU CB 1 1 12 3281 1 1 15 LEU CD1 C 11.960 -4.101 -4.148 1.00 . A A . 15 LEU CD1 1 1 12 3282 1 1 15 LEU CD2 C 11.217 -2.124 -2.825 1.00 . A A . 15 LEU CD2 1 1 12 3283 1 1 15 LEU CG C 11.356 -3.650 -2.826 1.00 . A A . 15 LEU CG 1 1 12 3284 1 1 15 LEU H H 10.818 -2.564 -0.743 1.00 . A A . 15 LEU H 1 1 12 3285 1 1 15 LEU HA H 8.492 -4.328 -1.117 1.00 . A A . 15 LEU HA 1 1 12 3286 1 1 15 LEU HB2 H 10.030 -5.339 -2.931 1.00 . A A . 15 LEU HB2 1 1 12 3287 1 1 15 LEU HB3 H 9.262 -3.786 -3.272 1.00 . A A . 15 LEU HB3 1 1 12 3288 1 1 15 LEU HD11 H 11.190 -4.129 -4.904 1.00 . A A . 15 LEU HD11 1 1 12 3289 1 1 15 LEU HD12 H 12.386 -5.084 -4.027 1.00 . A A . 15 LEU HD12 1 1 12 3290 1 1 15 LEU HD13 H 12.731 -3.406 -4.444 1.00 . A A . 15 LEU HD13 1 1 12 3291 1 1 15 LEU HD21 H 11.456 -1.735 -3.802 1.00 . A A . 15 LEU HD21 1 1 12 3292 1 1 15 LEU HD22 H 11.896 -1.705 -2.095 1.00 . A A . 15 LEU HD22 1 1 12 3293 1 1 15 LEU HD23 H 10.203 -1.854 -2.567 1.00 . A A . 15 LEU HD23 1 1 12 3294 1 1 15 LEU HG H 12.001 -3.953 -2.014 1.00 . A A . 15 LEU HG 1 1 12 3295 1 1 15 LEU N N 9.896 -2.861 -0.693 1.00 . A A . 15 LEU N 1 1 12 3296 1 1 15 LEU O O 10.319 -6.423 -0.773 1.00 . A A . 15 LEU O 1 1 12 3297 1 1 16 . C C 10.911 -5.765 3.011 1.00 . A A . 16 DBU C 1 1 12 3298 1 1 16 . CA C 11.515 -5.740 1.629 1.00 . A A . 16 DBU CA 1 1 12 3299 1 1 16 . CB C 12.634 -6.527 1.339 1.00 . A A . 16 DBU CB 1 1 12 3300 1 1 16 . CG C 13.312 -6.572 -0.009 1.00 . A A . 16 DBU CG 1 1 12 3301 1 1 16 . H H 10.755 -3.925 1.048 1.00 . A A . 16 DBU H 1 1 12 3302 1 1 16 . HB H 13.058 -7.151 2.111 1.00 . A A . 16 DBU HB 1 1 12 3303 1 1 16 . HG1 H 14.334 -6.237 0.092 1.00 . A A . 16 DBU HG1 1 1 12 3304 1 1 16 . HG2 H 12.787 -5.924 -0.696 1.00 . A A . 16 DBU HG2 1 1 12 3305 1 1 16 . HG3 H 13.297 -7.584 -0.383 1.00 . A A . 16 DBU HG3 1 1 12 3306 1 1 16 . N N 10.817 -4.863 0.773 1.00 . A A . 16 DBU N 1 1 12 3307 1 1 16 . O O 10.557 -6.817 3.543 1.00 . A A . 16 DBU O 1 1 12 3308 1 1 17 GLY C C 11.331 -4.361 5.994 1.00 . A A . 17 GLY C 1 1 12 3309 1 1 17 GLY CA C 10.230 -4.463 4.941 1.00 . A A . 17 GLY CA 1 1 12 3310 1 1 17 GLY H H 11.095 -3.774 3.135 1.00 . A A . 17 GLY H 1 1 12 3311 1 1 17 GLY HA2 H 9.616 -3.578 4.980 1.00 . A A . 17 GLY HA2 1 1 12 3312 1 1 17 GLY HA3 H 9.620 -5.328 5.150 1.00 . A A . 17 GLY HA3 1 1 12 3313 1 1 17 GLY N N 10.795 -4.583 3.604 1.00 . A A . 17 GLY N 1 1 12 3314 1 1 17 GLY O O 12.080 -5.313 6.217 1.00 . A A . 17 GLY O 1 1 12 3315 1 1 18 LEU C C 13.835 -3.163 7.072 1.00 . A A . 18 LEU C 1 1 12 3316 1 1 18 LEU CA C 12.440 -2.985 7.660 1.00 . A A . 18 LEU CA 1 1 12 3317 1 1 18 LEU CB C 12.240 -3.971 8.814 1.00 . A A . 18 LEU CB 1 1 12 3318 1 1 18 LEU CD1 C 10.604 -4.764 10.524 1.00 . A A . 18 LEU CD1 1 1 12 3319 1 1 18 LEU CD2 C 11.144 -2.331 10.351 1.00 . A A . 18 LEU CD2 1 1 12 3320 1 1 18 LEU CG C 10.949 -3.628 9.560 1.00 . A A . 18 LEU CG 1 1 12 3321 1 1 18 LEU H H 10.802 -2.479 6.411 1.00 . A A . 18 LEU H 1 1 12 3322 1 1 18 LEU HA H 12.345 -1.979 8.041 1.00 . A A . 18 LEU HA 1 1 12 3323 1 1 18 LEU HB2 H 12.172 -4.975 8.420 1.00 . A A . 18 LEU HB2 1 1 12 3324 1 1 18 LEU HB3 H 13.075 -3.906 9.494 1.00 . A A . 18 LEU HB3 1 1 12 3325 1 1 18 LEU HD11 H 11.411 -4.895 11.231 1.00 . A A . 18 LEU HD11 1 1 12 3326 1 1 18 LEU HD12 H 10.461 -5.678 9.967 1.00 . A A . 18 LEU HD12 1 1 12 3327 1 1 18 LEU HD13 H 9.696 -4.521 11.056 1.00 . A A . 18 LEU HD13 1 1 12 3328 1 1 18 LEU HD21 H 10.632 -2.405 11.298 1.00 . A A . 18 LEU HD21 1 1 12 3329 1 1 18 LEU HD22 H 10.741 -1.502 9.789 1.00 . A A . 18 LEU HD22 1 1 12 3330 1 1 18 LEU HD23 H 12.198 -2.169 10.525 1.00 . A A . 18 LEU HD23 1 1 12 3331 1 1 18 LEU HG H 10.145 -3.503 8.850 1.00 . A A . 18 LEU HG 1 1 12 3332 1 1 18 LEU N N 11.424 -3.201 6.635 1.00 . A A . 18 LEU N 1 1 12 3333 1 1 18 LEU O O 14.605 -4.010 7.525 1.00 . A A . 18 LEU O 1 1 12 3334 1 1 19 CYS C C 16.146 -3.752 5.678 1.00 . A A . 19 CYS C 1 1 12 3335 1 1 19 CYS CA C 15.454 -2.419 5.411 1.00 . A A . 19 CYS CA 1 1 12 3336 1 1 19 CYS CB C 16.344 -1.288 5.919 1.00 . A A . 19 CYS CB 1 1 12 3337 1 1 19 CYS H H 13.492 -1.700 5.751 1.00 . A A . 19 CYS H 1 1 12 3338 1 1 19 CYS HA H 15.318 -2.301 4.347 1.00 . A A . 19 CYS HA 1 1 12 3339 1 1 19 CYS HB2 H 15.836 -0.345 5.800 1.00 . A A . 19 CYS HB2 1 1 12 3340 1 1 19 CYS HB3 H 16.566 -1.446 6.964 1.00 . A A . 19 CYS HB3 1 1 12 3341 1 1 19 CYS N N 14.150 -2.356 6.063 1.00 . A A . 19 CYS N 1 1 12 3342 1 1 19 CYS O O 16.847 -3.905 6.678 1.00 . A A . 19 CYS O 1 1 12 3343 1 1 19 CYS SG S 17.885 -1.281 4.972 1.00 . A A . 19 CYS SG 1 1 12 3344 1 1 20 VAL C C 17.657 -6.235 3.883 1.00 . A A . 20 VAL C 1 1 12 3345 1 1 20 VAL CA C 16.580 -6.020 4.942 1.00 . A A . 20 VAL CA 1 1 12 3346 1 1 20 VAL CB C 15.527 -7.122 4.835 1.00 . A A . 20 VAL CB 1 1 12 3347 1 1 20 VAL CG1 C 14.504 -6.962 5.960 1.00 . A A . 20 VAL CG1 1 1 12 3348 1 1 20 VAL CG2 C 14.818 -7.015 3.483 1.00 . A A . 20 VAL CG2 1 1 12 3349 1 1 20 VAL H H 15.391 -4.539 3.997 1.00 . A A . 20 VAL H 1 1 12 3350 1 1 20 VAL HA H 17.035 -6.069 5.920 1.00 . A A . 20 VAL HA 1 1 12 3351 1 1 20 VAL HB H 16.006 -8.086 4.917 1.00 . A A . 20 VAL HB 1 1 12 3352 1 1 20 VAL HG11 H 14.899 -7.392 6.869 1.00 . A A . 20 VAL HG11 1 1 12 3353 1 1 20 VAL HG12 H 13.590 -7.468 5.689 1.00 . A A . 20 VAL HG12 1 1 12 3354 1 1 20 VAL HG13 H 14.303 -5.912 6.115 1.00 . A A . 20 VAL HG13 1 1 12 3355 1 1 20 VAL HG21 H 14.746 -7.995 3.035 1.00 . A A . 20 VAL HG21 1 1 12 3356 1 1 20 VAL HG22 H 15.380 -6.362 2.832 1.00 . A A . 20 VAL HG22 1 1 12 3357 1 1 20 VAL HG23 H 13.827 -6.612 3.628 1.00 . A A . 20 VAL HG23 1 1 12 3358 1 1 20 VAL N N 15.955 -4.712 4.780 1.00 . A A . 20 VAL N 1 1 12 3359 1 1 20 VAL O O 18.373 -7.236 3.908 1.00 . A A . 20 VAL O 1 1 12 3360 1 1 21 ARG C C 20.111 -4.866 2.366 1.00 . A A . 21 ARG C 1 1 12 3361 1 1 21 ARG CA C 18.759 -5.389 1.891 1.00 . A A . 21 ARG CA 1 1 12 3362 1 1 21 ARG CB C 18.301 -4.589 0.669 1.00 . A A . 21 ARG CB 1 1 12 3363 1 1 21 ARG CD C 18.866 -3.965 -1.686 1.00 . A A . 21 ARG CD 1 1 12 3364 1 1 21 ARG CG C 19.307 -4.780 -0.469 1.00 . A A . 21 ARG CG 1 1 12 3365 1 1 21 ARG CZ C 19.550 -3.658 -3.999 1.00 . A A . 21 ARG CZ 1 1 12 3366 1 1 21 ARG H H 17.168 -4.514 2.985 1.00 . A A . 21 ARG H 1 1 12 3367 1 1 21 ARG HA H 18.866 -6.426 1.609 1.00 . A A . 21 ARG HA 1 1 12 3368 1 1 21 ARG HB2 H 17.329 -4.937 0.354 1.00 . A A . 21 ARG HB2 1 1 12 3369 1 1 21 ARG HB3 H 18.244 -3.542 0.924 1.00 . A A . 21 ARG HB3 1 1 12 3370 1 1 21 ARG HD2 H 17.844 -4.208 -1.930 1.00 . A A . 21 ARG HD2 1 1 12 3371 1 1 21 ARG HD3 H 18.938 -2.911 -1.456 1.00 . A A . 21 ARG HD3 1 1 12 3372 1 1 21 ARG HE H 20.430 -4.938 -2.735 1.00 . A A . 21 ARG HE 1 1 12 3373 1 1 21 ARG HG2 H 20.283 -4.448 -0.146 1.00 . A A . 21 ARG HG2 1 1 12 3374 1 1 21 ARG HG3 H 19.353 -5.825 -0.736 1.00 . A A . 21 ARG HG3 1 1 12 3375 1 1 21 ARG HH11 H 18.018 -2.534 -3.370 1.00 . A A . 21 ARG HH11 1 1 12 3376 1 1 21 ARG HH12 H 18.488 -2.305 -5.021 1.00 . A A . 21 ARG HH12 1 1 12 3377 1 1 21 ARG HH21 H 21.041 -4.646 -4.897 1.00 . A A . 21 ARG HH21 1 1 12 3378 1 1 21 ARG HH22 H 20.199 -3.500 -5.885 1.00 . A A . 21 ARG HH22 1 1 12 3379 1 1 21 ARG N N 17.766 -5.289 2.956 1.00 . A A . 21 ARG N 1 1 12 3380 1 1 21 ARG NE N 19.718 -4.270 -2.829 1.00 . A A . 21 ARG NE 1 1 12 3381 1 1 21 ARG NH1 N 18.611 -2.763 -4.140 1.00 . A A . 21 ARG NH1 1 1 12 3382 1 1 21 ARG NH2 N 20.324 -3.958 -5.005 1.00 . A A . 21 ARG NH2 1 1 12 3383 1 1 21 ARG O O 20.262 -3.658 2.448 1.00 . A A . 21 ARG O 1 1 12 3384 1 1 21 ARG OXT O 20.977 -5.680 2.640 1.00 . A A . 21 ARG OXT 1 1 13 3385 1 1 1 ALA C C 11.987 0.929 -8.106 1.00 . A A . 1 ALA C 1 1 13 3386 1 1 1 ALA CA C 10.495 1.035 -8.394 1.00 . A A . 1 ALA CA 1 1 13 3387 1 1 1 ALA CB C 9.696 0.436 -7.233 1.00 . A A . 1 ALA CB 1 1 13 3388 1 1 1 ALA H1 H 9.305 -0.254 -9.514 1.00 . A A . 1 ALA H1 1 1 13 3389 1 1 1 ALA H2 H 10.963 -0.357 -9.870 1.00 . A A . 1 ALA H2 1 1 13 3390 1 1 1 ALA H3 H 10.052 0.964 -10.427 1.00 . A A . 1 ALA H3 1 1 13 3391 1 1 1 ALA HA H 10.226 2.073 -8.517 1.00 . A A . 1 ALA HA 1 1 13 3392 1 1 1 ALA HB1 H 10.170 -0.474 -6.900 1.00 . A A . 1 ALA HB1 1 1 13 3393 1 1 1 ALA HB2 H 8.690 0.220 -7.562 1.00 . A A . 1 ALA HB2 1 1 13 3394 1 1 1 ALA HB3 H 9.662 1.144 -6.417 1.00 . A A . 1 ALA HB3 1 1 13 3395 1 1 1 ALA N N 10.179 0.291 -9.645 1.00 . A A . 1 ALA N 1 1 13 3396 1 1 1 ALA O O 12.776 0.574 -8.984 1.00 . A A . 1 ALA O 1 1 13 3397 1 1 2 GLY C C 14.535 2.394 -7.005 1.00 . A A . 2 GLY C 1 1 13 3398 1 1 2 GLY CA C 13.775 1.179 -6.485 1.00 . A A . 2 GLY CA 1 1 13 3399 1 1 2 GLY H H 11.701 1.520 -6.215 1.00 . A A . 2 GLY H 1 1 13 3400 1 1 2 GLY HA2 H 13.845 1.148 -5.407 1.00 . A A . 2 GLY HA2 1 1 13 3401 1 1 2 GLY HA3 H 14.219 0.284 -6.896 1.00 . A A . 2 GLY HA3 1 1 13 3402 1 1 2 GLY N N 12.372 1.242 -6.873 1.00 . A A . 2 GLY N 1 1 13 3403 1 1 2 GLY O O 15.762 2.380 -7.095 1.00 . A A . 2 GLY O 1 1 13 3404 1 1 3 GLY C C 15.285 5.313 -6.787 1.00 . A A . 3 GLY C 1 1 13 3405 1 1 3 GLY CA C 14.412 4.663 -7.854 1.00 . A A . 3 GLY CA 1 1 13 3406 1 1 3 GLY H H 12.822 3.397 -7.252 1.00 . A A . 3 GLY H 1 1 13 3407 1 1 3 GLY HA2 H 15.021 4.423 -8.714 1.00 . A A . 3 GLY HA2 1 1 13 3408 1 1 3 GLY HA3 H 13.638 5.356 -8.147 1.00 . A A . 3 GLY HA3 1 1 13 3409 1 1 3 GLY N N 13.797 3.443 -7.347 1.00 . A A . 3 GLY N 1 1 13 3410 1 1 3 GLY O O 16.326 5.896 -7.089 1.00 . A A . 3 GLY O 1 1 13 3411 1 1 4 . C C 14.625 6.430 -3.481 1.00 . A A . 4 DBU C 1 1 13 3412 1 1 4 . CA C 15.567 5.773 -4.458 1.00 . A A . 4 DBU CA 1 1 13 3413 1 1 4 . CB C 16.945 5.801 -4.204 1.00 . A A . 4 DBU CB 1 1 13 3414 1 1 4 . CG C 18.037 5.208 -5.063 1.00 . A A . 4 DBU CG 1 1 13 3415 1 1 4 . H H 14.014 4.739 -5.343 1.00 . A A . 4 DBU H 1 1 13 3416 1 1 4 . HB H 17.280 6.296 -3.305 1.00 . A A . 4 DBU HB 1 1 13 3417 1 1 4 . HG1 H 17.600 4.610 -5.850 1.00 . A A . 4 DBU HG1 1 1 13 3418 1 1 4 . HG2 H 18.677 4.589 -4.452 1.00 . A A . 4 DBU HG2 1 1 13 3419 1 1 4 . HG3 H 18.618 6.009 -5.497 1.00 . A A . 4 DBU HG3 1 1 13 3420 1 1 4 . N N 14.851 5.211 -5.534 1.00 . A A . 4 DBU N 1 1 13 3421 1 1 4 . O O 13.845 7.284 -3.895 1.00 . A A . 4 DBU O 1 1 13 3422 1 1 5 ILE C C 12.837 5.624 -0.632 1.00 . A A . 5 ILE C 1 1 13 3423 1 1 5 ILE CA C 13.866 6.618 -1.145 1.00 . A A . 5 ILE CA 1 1 13 3424 1 1 5 ILE CB C 13.126 7.863 -1.629 1.00 . A A . 5 ILE CB 1 1 13 3425 1 1 5 ILE CD1 C 14.717 9.614 -0.804 1.00 . A A . 5 ILE CD1 1 1 13 3426 1 1 5 ILE CG1 C 14.136 8.938 -2.048 1.00 . A A . 5 ILE CG1 1 1 13 3427 1 1 5 ILE CG2 C 12.241 8.398 -0.500 1.00 . A A . 5 ILE CG2 1 1 13 3428 1 1 5 ILE H H 15.372 5.362 -1.959 1.00 . A A . 5 ILE H 1 1 13 3429 1 1 5 ILE HA H 14.497 6.895 -0.321 1.00 . A A . 5 ILE HA 1 1 13 3430 1 1 5 ILE HB H 12.504 7.598 -2.470 1.00 . A A . 5 ILE HB 1 1 13 3431 1 1 5 ILE HD11 H 14.594 8.962 0.048 1.00 . A A . 5 ILE HD11 1 1 13 3432 1 1 5 ILE HD12 H 14.199 10.544 -0.624 1.00 . A A . 5 ILE HD12 1 1 13 3433 1 1 5 ILE HD13 H 15.768 9.810 -0.958 1.00 . A A . 5 ILE HD13 1 1 13 3434 1 1 5 ILE HG12 H 14.933 8.481 -2.613 1.00 . A A . 5 ILE HG12 1 1 13 3435 1 1 5 ILE HG13 H 13.640 9.678 -2.658 1.00 . A A . 5 ILE HG13 1 1 13 3436 1 1 5 ILE HG21 H 11.852 9.368 -0.776 1.00 . A A . 5 ILE HG21 1 1 13 3437 1 1 5 ILE HG22 H 12.827 8.488 0.403 1.00 . A A . 5 ILE HG22 1 1 13 3438 1 1 5 ILE HG23 H 11.422 7.716 -0.331 1.00 . A A . 5 ILE HG23 1 1 13 3439 1 1 5 ILE N N 14.711 6.044 -2.202 1.00 . A A . 5 ILE N 1 1 13 3440 1 1 5 ILE O O 12.567 5.572 0.568 1.00 . A A . 5 ILE O 1 1 13 3441 1 1 6 PRO C C 11.748 2.958 -0.017 1.00 . A A . 6 PRO C 1 1 13 3442 1 1 6 PRO CA C 11.207 3.880 -1.082 1.00 . A A . 6 PRO CA 1 1 13 3443 1 1 6 PRO CB C 10.883 3.105 -2.355 1.00 . A A . 6 PRO CB 1 1 13 3444 1 1 6 PRO CD C 12.492 4.821 -2.940 1.00 . A A . 6 PRO CD 1 1 13 3445 1 1 6 PRO CG C 11.331 3.988 -3.476 1.00 . A A . 6 PRO CG 1 1 13 3446 1 1 6 PRO HA H 10.329 4.391 -0.728 1.00 . A A . 6 PRO HA 1 1 13 3447 1 1 6 PRO HB2 H 11.419 2.162 -2.360 1.00 . A A . 6 PRO HB2 1 1 13 3448 1 1 6 PRO HB3 H 9.821 2.930 -2.425 1.00 . A A . 6 PRO HB3 1 1 13 3449 1 1 6 PRO HD2 H 13.436 4.337 -3.154 1.00 . A A . 6 PRO HD2 1 1 13 3450 1 1 6 PRO HD3 H 12.468 5.815 -3.349 1.00 . A A . 6 PRO HD3 1 1 13 3451 1 1 6 PRO HG2 H 11.655 3.388 -4.316 1.00 . A A . 6 PRO HG2 1 1 13 3452 1 1 6 PRO HG3 H 10.532 4.644 -3.772 1.00 . A A . 6 PRO HG3 1 1 13 3453 1 1 6 PRO N N 12.243 4.858 -1.496 1.00 . A A . 6 PRO N 1 1 13 3454 1 1 6 PRO O O 11.091 2.699 0.987 1.00 . A A . 6 PRO O 1 1 13 3455 1 1 7 DAL C C 15.117 1.488 0.456 1.00 . A A . 7 DAL C 1 1 13 3456 1 1 7 DAL CA C 13.612 1.596 0.697 1.00 . A A . 7 DAL CA 1 1 13 3457 1 1 7 DAL CB C 13.339 2.093 2.102 1.00 . A A . 7 DAL CB 1 1 13 3458 1 1 7 DAL H H 13.433 2.744 -1.059 1.00 . A A . 7 DAL H 1 1 13 3459 1 1 7 DAL HA H 13.180 0.621 0.597 1.00 . A A . 7 DAL HA 1 1 13 3460 1 1 7 DAL HB1 H 13.075 3.139 2.071 1.00 . A A . 7 DAL HB1 1 1 13 3461 1 1 7 DAL HB2 H 14.211 1.960 2.718 1.00 . A A . 7 DAL HB2 1 1 13 3462 1 1 7 DAL N N 12.968 2.485 -0.246 1.00 . A A . 7 DAL N 1 1 13 3463 1 1 7 DAL O O 15.819 0.807 1.201 1.00 . A A . 7 DAL O 1 1 13 3464 1 1 8 LEU C C 17.819 2.752 0.226 1.00 . A A . 8 LEU C 1 1 13 3465 1 1 8 LEU CA C 17.033 2.096 -0.893 1.00 . A A . 8 LEU CA 1 1 13 3466 1 1 8 LEU CB C 17.314 2.815 -2.212 1.00 . A A . 8 LEU CB 1 1 13 3467 1 1 8 LEU CD1 C 16.799 2.729 -4.655 1.00 . A A . 8 LEU CD1 1 1 13 3468 1 1 8 LEU CD2 C 16.056 0.869 -3.171 1.00 . A A . 8 LEU CD2 1 1 13 3469 1 1 8 LEU CG C 16.287 2.380 -3.258 1.00 . A A . 8 LEU CG 1 1 13 3470 1 1 8 LEU H H 15.016 2.683 -1.157 1.00 . A A . 8 LEU H 1 1 13 3471 1 1 8 LEU HA H 17.337 1.063 -0.981 1.00 . A A . 8 LEU HA 1 1 13 3472 1 1 8 LEU HB2 H 17.248 3.882 -2.060 1.00 . A A . 8 LEU HB2 1 1 13 3473 1 1 8 LEU HB3 H 18.306 2.560 -2.555 1.00 . A A . 8 LEU HB3 1 1 13 3474 1 1 8 LEU HD11 H 16.623 1.896 -5.318 1.00 . A A . 8 LEU HD11 1 1 13 3475 1 1 8 LEU HD12 H 17.858 2.932 -4.610 1.00 . A A . 8 LEU HD12 1 1 13 3476 1 1 8 LEU HD13 H 16.278 3.599 -5.024 1.00 . A A . 8 LEU HD13 1 1 13 3477 1 1 8 LEU HD21 H 15.726 0.500 -4.131 1.00 . A A . 8 LEU HD21 1 1 13 3478 1 1 8 LEU HD22 H 15.300 0.665 -2.427 1.00 . A A . 8 LEU HD22 1 1 13 3479 1 1 8 LEU HD23 H 16.977 0.379 -2.892 1.00 . A A . 8 LEU HD23 1 1 13 3480 1 1 8 LEU HG H 15.359 2.902 -3.076 1.00 . A A . 8 LEU HG 1 1 13 3481 1 1 8 LEU N N 15.612 2.151 -0.586 1.00 . A A . 8 LEU N 1 1 13 3482 1 1 8 LEU O O 18.967 2.399 0.492 1.00 . A A . 8 LEU O 1 1 13 3483 1 1 9 MET C C 18.172 3.482 3.087 1.00 . A A . 9 MET C 1 1 13 3484 1 1 9 MET CA C 17.821 4.445 1.957 1.00 . A A . 9 MET CA 1 1 13 3485 1 1 9 MET CB C 16.866 5.520 2.473 1.00 . A A . 9 MET CB 1 1 13 3486 1 1 9 MET CE C 16.771 8.712 2.565 1.00 . A A . 9 MET CE 1 1 13 3487 1 1 9 MET CG C 16.351 6.349 1.292 1.00 . A A . 9 MET CG 1 1 13 3488 1 1 9 MET H H 16.274 3.959 0.605 1.00 . A A . 9 MET H 1 1 13 3489 1 1 9 MET HA H 18.722 4.914 1.596 1.00 . A A . 9 MET HA 1 1 13 3490 1 1 9 MET HB2 H 16.033 5.051 2.976 1.00 . A A . 9 MET HB2 1 1 13 3491 1 1 9 MET HB3 H 17.389 6.166 3.163 1.00 . A A . 9 MET HB3 1 1 13 3492 1 1 9 MET HE1 H 17.601 8.052 2.775 1.00 . A A . 9 MET HE1 1 1 13 3493 1 1 9 MET HE2 H 16.471 9.209 3.474 1.00 . A A . 9 MET HE2 1 1 13 3494 1 1 9 MET HE3 H 17.066 9.452 1.834 1.00 . A A . 9 MET HE3 1 1 13 3495 1 1 9 MET HG2 H 17.183 6.710 0.708 1.00 . A A . 9 MET HG2 1 1 13 3496 1 1 9 MET HG3 H 15.720 5.730 0.670 1.00 . A A . 9 MET HG3 1 1 13 3497 1 1 9 MET N N 17.186 3.721 0.872 1.00 . A A . 9 MET N 1 1 13 3498 1 1 9 MET O O 19.247 3.574 3.680 1.00 . A A . 9 MET O 1 1 13 3499 1 1 9 MET SD S 15.384 7.746 1.917 1.00 . A A . 9 MET SD 1 1 13 3500 1 1 10 . C C 16.712 1.864 5.669 1.00 . A A . 10 DBB C 1 1 13 3501 1 1 10 . CA C 17.511 1.558 4.414 1.00 . A A . 10 DBB CA 1 1 13 3502 1 1 10 . CB C 17.168 0.160 3.896 1.00 . A A . 10 DBB CB 1 1 13 3503 1 1 10 . CG C 15.652 -0.041 3.929 1.00 . A A . 10 DBB CG 1 1 13 3504 1 1 10 . H H 16.435 2.509 2.853 1.00 . A A . 10 DBB H 1 1 13 3505 1 1 10 . HA H 18.561 1.580 4.664 1.00 . A A . 10 DBB HA 1 1 13 3506 1 1 10 . HB2 H 17.477 0.098 2.870 1.00 . A A . 10 DBB HB2 1 1 13 3507 1 1 10 . HG1 H 15.262 0.266 4.883 1.00 . A A . 10 DBB HG1 1 1 13 3508 1 1 10 . HG2 H 15.425 -1.082 3.764 1.00 . A A . 10 DBB HG2 1 1 13 3509 1 1 10 . HG3 H 15.200 0.547 3.147 1.00 . A A . 10 DBB HG3 1 1 13 3510 1 1 10 . N N 17.268 2.546 3.367 1.00 . A A . 10 DBB N 1 1 13 3511 1 1 10 . O O 17.225 1.740 6.782 1.00 . A A . 10 DBB O 1 1 13 3512 1 1 11 GLY C C 13.200 2.883 6.256 1.00 . A A . 11 GLY C 1 1 13 3513 1 1 11 GLY CA C 14.638 2.577 6.656 1.00 . A A . 11 GLY CA 1 1 13 3514 1 1 11 GLY H H 15.092 2.352 4.599 1.00 . A A . 11 GLY H 1 1 13 3515 1 1 11 GLY HA2 H 14.647 1.738 7.336 1.00 . A A . 11 GLY HA2 1 1 13 3516 1 1 11 GLY HA3 H 15.060 3.433 7.145 1.00 . A A . 11 GLY HA3 1 1 13 3517 1 1 11 GLY N N 15.461 2.264 5.503 1.00 . A A . 11 GLY N 1 1 13 3518 1 1 11 GLY O O 12.685 3.969 6.527 1.00 . A A . 11 GLY O 1 1 13 3519 1 1 12 CYS C C 10.409 0.801 5.245 1.00 . A A . 12 CYS C 1 1 13 3520 1 1 12 CYS CA C 11.189 2.103 5.143 1.00 . A A . 12 CYS CA 1 1 13 3521 1 1 12 CYS CB C 11.214 2.502 3.681 1.00 . A A . 12 CYS CB 1 1 13 3522 1 1 12 CYS H H 13.030 1.089 5.391 1.00 . A A . 12 CYS H 1 1 13 3523 1 1 12 CYS HA H 10.705 2.874 5.719 1.00 . A A . 12 CYS HA 1 1 13 3524 1 1 12 CYS HB2 H 10.212 2.681 3.325 1.00 . A A . 12 CYS HB2 1 1 13 3525 1 1 12 CYS HB3 H 11.810 3.385 3.550 1.00 . A A . 12 CYS HB3 1 1 13 3526 1 1 12 CYS N N 12.563 1.926 5.594 1.00 . A A . 12 CYS N 1 1 13 3527 1 1 12 CYS O O 10.791 -0.123 5.962 1.00 . A A . 12 CYS O 1 1 13 3528 1 1 12 CYS SG S 11.960 1.144 2.768 1.00 . A A . 12 CYS SG 1 1 13 3529 1 1 13 GLY C C 8.382 -0.893 2.968 1.00 . A A . 13 GLY C 1 1 13 3530 1 1 13 GLY CA C 8.491 -0.448 4.415 1.00 . A A . 13 GLY CA 1 1 13 3531 1 1 13 GLY H H 9.103 1.502 3.911 1.00 . A A . 13 GLY H 1 1 13 3532 1 1 13 GLY HA2 H 8.933 -1.235 5.006 1.00 . A A . 13 GLY HA2 1 1 13 3533 1 1 13 GLY HA3 H 7.507 -0.218 4.786 1.00 . A A . 13 GLY HA3 1 1 13 3534 1 1 13 GLY N N 9.327 0.737 4.477 1.00 . A A . 13 GLY N 1 1 13 3535 1 1 13 GLY O O 7.532 -1.706 2.609 1.00 . A A . 13 GLY O 1 1 13 3536 1 1 14 TRP C C 9.099 -2.138 0.513 1.00 . A A . 14 TRP C 1 1 13 3537 1 1 14 TRP CA C 9.292 -0.643 0.726 1.00 . A A . 14 TRP CA 1 1 13 3538 1 1 14 TRP CB C 10.635 -0.191 0.134 1.00 . A A . 14 TRP CB 1 1 13 3539 1 1 14 TRP CD1 C 11.676 -1.942 1.608 1.00 . A A . 14 TRP CD1 1 1 13 3540 1 1 14 TRP CD2 C 12.948 -1.485 -0.183 1.00 . A A . 14 TRP CD2 1 1 13 3541 1 1 14 TRP CE2 C 13.638 -2.472 0.558 1.00 . A A . 14 TRP CE2 1 1 13 3542 1 1 14 TRP CE3 C 13.540 -1.014 -1.367 1.00 . A A . 14 TRP CE3 1 1 13 3543 1 1 14 TRP CG C 11.704 -1.169 0.509 1.00 . A A . 14 TRP CG 1 1 13 3544 1 1 14 TRP CH2 C 15.443 -2.495 -1.042 1.00 . A A . 14 TRP CH2 1 1 13 3545 1 1 14 TRP CZ2 C 14.871 -2.978 0.138 1.00 . A A . 14 TRP CZ2 1 1 13 3546 1 1 14 TRP CZ3 C 14.779 -1.517 -1.792 1.00 . A A . 14 TRP CZ3 1 1 13 3547 1 1 14 TRP H H 9.905 0.313 2.504 1.00 . A A . 14 TRP H 1 1 13 3548 1 1 14 TRP HA H 8.495 -0.109 0.231 1.00 . A A . 14 TRP HA 1 1 13 3549 1 1 14 TRP HB2 H 10.559 -0.129 -0.938 1.00 . A A . 14 TRP HB2 1 1 13 3550 1 1 14 TRP HB3 H 10.887 0.777 0.529 1.00 . A A . 14 TRP HB3 1 1 13 3551 1 1 14 TRP HD1 H 10.886 -1.951 2.335 1.00 . A A . 14 TRP HD1 1 1 13 3552 1 1 14 TRP HE1 H 13.039 -3.373 2.341 1.00 . A A . 14 TRP HE1 1 1 13 3553 1 1 14 TRP HE3 H 13.039 -0.258 -1.952 1.00 . A A . 14 TRP HE3 1 1 13 3554 1 1 14 TRP HH2 H 16.397 -2.876 -1.375 1.00 . A A . 14 TRP HH2 1 1 13 3555 1 1 14 TRP HZ2 H 15.378 -3.732 0.722 1.00 . A A . 14 TRP HZ2 1 1 13 3556 1 1 14 TRP HZ3 H 15.224 -1.146 -2.704 1.00 . A A . 14 TRP HZ3 1 1 13 3557 1 1 14 TRP N N 9.263 -0.331 2.145 1.00 . A A . 14 TRP N 1 1 13 3558 1 1 14 TRP NE1 N 12.819 -2.722 1.642 1.00 . A A . 14 TRP NE1 1 1 13 3559 1 1 14 TRP O O 9.015 -2.905 1.471 1.00 . A A . 14 TRP O 1 1 13 3560 1 1 15 LEU C C 9.446 -4.848 -0.008 1.00 . A A . 15 LEU C 1 1 13 3561 1 1 15 LEU CA C 8.841 -3.949 -1.085 1.00 . A A . 15 LEU CA 1 1 13 3562 1 1 15 LEU CB C 9.511 -4.241 -2.426 1.00 . A A . 15 LEU CB 1 1 13 3563 1 1 15 LEU CD1 C 11.752 -4.378 -3.524 1.00 . A A . 15 LEU CD1 1 1 13 3564 1 1 15 LEU CD2 C 10.991 -2.231 -2.499 1.00 . A A . 15 LEU CD2 1 1 13 3565 1 1 15 LEU CG C 10.960 -3.757 -2.376 1.00 . A A . 15 LEU CG 1 1 13 3566 1 1 15 LEU H H 9.095 -1.882 -1.468 1.00 . A A . 15 LEU H 1 1 13 3567 1 1 15 LEU HA H 7.786 -4.158 -1.168 1.00 . A A . 15 LEU HA 1 1 13 3568 1 1 15 LEU HB2 H 9.489 -5.305 -2.617 1.00 . A A . 15 LEU HB2 1 1 13 3569 1 1 15 LEU HB3 H 8.986 -3.721 -3.214 1.00 . A A . 15 LEU HB3 1 1 13 3570 1 1 15 LEU HD11 H 12.759 -3.988 -3.516 1.00 . A A . 15 LEU HD11 1 1 13 3571 1 1 15 LEU HD12 H 11.277 -4.132 -4.463 1.00 . A A . 15 LEU HD12 1 1 13 3572 1 1 15 LEU HD13 H 11.779 -5.449 -3.403 1.00 . A A . 15 LEU HD13 1 1 13 3573 1 1 15 LEU HD21 H 11.928 -1.920 -2.935 1.00 . A A . 15 LEU HD21 1 1 13 3574 1 1 15 LEU HD22 H 10.888 -1.797 -1.521 1.00 . A A . 15 LEU HD22 1 1 13 3575 1 1 15 LEU HD23 H 10.174 -1.902 -3.124 1.00 . A A . 15 LEU HD23 1 1 13 3576 1 1 15 LEU HG H 11.403 -4.051 -1.435 1.00 . A A . 15 LEU HG 1 1 13 3577 1 1 15 LEU N N 9.024 -2.543 -0.749 1.00 . A A . 15 LEU N 1 1 13 3578 1 1 15 LEU O O 8.920 -5.922 0.282 1.00 . A A . 15 LEU O 1 1 13 3579 1 1 16 . C C 10.395 -5.077 2.874 1.00 . A A . 16 DBU C 1 1 13 3580 1 1 16 . CA C 11.194 -5.138 1.594 1.00 . A A . 16 DBU CA 1 1 13 3581 1 1 16 . CB C 12.396 -5.854 1.527 1.00 . A A . 16 DBU CB 1 1 13 3582 1 1 16 . CG C 13.269 -5.978 0.301 1.00 . A A . 16 DBU CG 1 1 13 3583 1 1 16 . H H 10.928 -3.536 0.323 1.00 . A A . 16 DBU H 1 1 13 3584 1 1 16 . HB H 12.744 -6.366 2.412 1.00 . A A . 16 DBU HB 1 1 13 3585 1 1 16 . HG1 H 14.210 -5.478 0.477 1.00 . A A . 16 DBU HG1 1 1 13 3586 1 1 16 . HG2 H 12.770 -5.523 -0.543 1.00 . A A . 16 DBU HG2 1 1 13 3587 1 1 16 . HG3 H 13.449 -7.023 0.094 1.00 . A A . 16 DBU HG3 1 1 13 3588 1 1 16 . N N 10.548 -4.399 0.583 1.00 . A A . 16 DBU N 1 1 13 3589 1 1 16 . O O 9.673 -6.016 3.215 1.00 . A A . 16 DBU O 1 1 13 3590 1 1 17 GLY C C 10.758 -3.365 5.951 1.00 . A A . 17 GLY C 1 1 13 3591 1 1 17 GLY CA C 9.801 -3.801 4.853 1.00 . A A . 17 GLY CA 1 1 13 3592 1 1 17 GLY H H 11.116 -3.250 3.282 1.00 . A A . 17 GLY H 1 1 13 3593 1 1 17 GLY HA2 H 9.031 -3.054 4.726 1.00 . A A . 17 GLY HA2 1 1 13 3594 1 1 17 GLY HA3 H 9.347 -4.740 5.131 1.00 . A A . 17 GLY HA3 1 1 13 3595 1 1 17 GLY N N 10.522 -3.968 3.596 1.00 . A A . 17 GLY N 1 1 13 3596 1 1 17 GLY O O 10.558 -2.336 6.597 1.00 . A A . 17 GLY O 1 1 13 3597 1 1 18 LEU C C 14.198 -3.906 6.506 1.00 . A A . 18 LEU C 1 1 13 3598 1 1 18 LEU CA C 12.817 -3.842 7.143 1.00 . A A . 18 LEU CA 1 1 13 3599 1 1 18 LEU CB C 12.725 -4.841 8.299 1.00 . A A . 18 LEU CB 1 1 13 3600 1 1 18 LEU CD1 C 11.177 -5.799 10.015 1.00 . A A . 18 LEU CD1 1 1 13 3601 1 1 18 LEU CD2 C 11.446 -3.325 9.817 1.00 . A A . 18 LEU CD2 1 1 13 3602 1 1 18 LEU CG C 11.400 -4.641 9.039 1.00 . A A . 18 LEU CG 1 1 13 3603 1 1 18 LEU H H 11.918 -4.948 5.580 1.00 . A A . 18 LEU H 1 1 13 3604 1 1 18 LEU HA H 12.646 -2.846 7.524 1.00 . A A . 18 LEU HA 1 1 13 3605 1 1 18 LEU HB2 H 12.773 -5.849 7.910 1.00 . A A . 18 LEU HB2 1 1 13 3606 1 1 18 LEU HB3 H 13.544 -4.679 8.983 1.00 . A A . 18 LEU HB3 1 1 13 3607 1 1 18 LEU HD11 H 10.169 -6.173 9.902 1.00 . A A . 18 LEU HD11 1 1 13 3608 1 1 18 LEU HD12 H 11.320 -5.450 11.026 1.00 . A A . 18 LEU HD12 1 1 13 3609 1 1 18 LEU HD13 H 11.880 -6.590 9.802 1.00 . A A . 18 LEU HD13 1 1 13 3610 1 1 18 LEU HD21 H 11.254 -2.502 9.143 1.00 . A A . 18 LEU HD21 1 1 13 3611 1 1 18 LEU HD22 H 12.423 -3.204 10.263 1.00 . A A . 18 LEU HD22 1 1 13 3612 1 1 18 LEU HD23 H 10.696 -3.338 10.593 1.00 . A A . 18 LEU HD23 1 1 13 3613 1 1 18 LEU HG H 10.590 -4.612 8.325 1.00 . A A . 18 LEU HG 1 1 13 3614 1 1 18 LEU N N 11.809 -4.150 6.141 1.00 . A A . 18 LEU N 1 1 13 3615 1 1 18 LEU O O 14.710 -4.989 6.225 1.00 . A A . 18 LEU O 1 1 13 3616 1 1 19 CYS C C 16.904 -3.946 5.979 1.00 . A A . 19 CYS C 1 1 13 3617 1 1 19 CYS CA C 16.107 -2.695 5.637 1.00 . A A . 19 CYS CA 1 1 13 3618 1 1 19 CYS CB C 16.871 -1.452 6.089 1.00 . A A . 19 CYS CB 1 1 13 3619 1 1 19 CYS H H 14.335 -1.908 6.495 1.00 . A A . 19 CYS H 1 1 13 3620 1 1 19 CYS HA H 15.978 -2.651 4.565 1.00 . A A . 19 CYS HA 1 1 13 3621 1 1 19 CYS HB2 H 16.186 -0.625 6.199 1.00 . A A . 19 CYS HB2 1 1 13 3622 1 1 19 CYS HB3 H 17.350 -1.650 7.036 1.00 . A A . 19 CYS HB3 1 1 13 3623 1 1 19 CYS N N 14.793 -2.744 6.262 1.00 . A A . 19 CYS N 1 1 13 3624 1 1 19 CYS O O 17.602 -3.997 6.992 1.00 . A A . 19 CYS O 1 1 13 3625 1 1 19 CYS SG S 18.129 -1.044 4.851 1.00 . A A . 19 CYS SG 1 1 13 3626 1 1 20 VAL C C 18.643 -6.342 4.329 1.00 . A A . 20 VAL C 1 1 13 3627 1 1 20 VAL CA C 17.499 -6.209 5.328 1.00 . A A . 20 VAL CA 1 1 13 3628 1 1 20 VAL CB C 16.528 -7.380 5.169 1.00 . A A . 20 VAL CB 1 1 13 3629 1 1 20 VAL CG1 C 15.695 -7.525 6.444 1.00 . A A . 20 VAL CG1 1 1 13 3630 1 1 20 VAL CG2 C 15.594 -7.110 3.985 1.00 . A A . 20 VAL CG2 1 1 13 3631 1 1 20 VAL H H 16.218 -4.849 4.335 1.00 . A A . 20 VAL H 1 1 13 3632 1 1 20 VAL HA H 17.903 -6.224 6.329 1.00 . A A . 20 VAL HA 1 1 13 3633 1 1 20 VAL HB H 17.084 -8.290 4.996 1.00 . A A . 20 VAL HB 1 1 13 3634 1 1 20 VAL HG11 H 14.653 -7.635 6.183 1.00 . A A . 20 VAL HG11 1 1 13 3635 1 1 20 VAL HG12 H 15.821 -6.647 7.060 1.00 . A A . 20 VAL HG12 1 1 13 3636 1 1 20 VAL HG13 H 16.022 -8.397 6.993 1.00 . A A . 20 VAL HG13 1 1 13 3637 1 1 20 VAL HG21 H 14.939 -6.283 4.221 1.00 . A A . 20 VAL HG21 1 1 13 3638 1 1 20 VAL HG22 H 15.001 -7.991 3.787 1.00 . A A . 20 VAL HG22 1 1 13 3639 1 1 20 VAL HG23 H 16.181 -6.868 3.113 1.00 . A A . 20 VAL HG23 1 1 13 3640 1 1 20 VAL N N 16.790 -4.953 5.123 1.00 . A A . 20 VAL N 1 1 13 3641 1 1 20 VAL O O 19.407 -7.307 4.368 1.00 . A A . 20 VAL O 1 1 13 3642 1 1 21 ARG C C 21.120 -4.850 3.026 1.00 . A A . 21 ARG C 1 1 13 3643 1 1 21 ARG CA C 19.815 -5.374 2.434 1.00 . A A . 21 ARG CA 1 1 13 3644 1 1 21 ARG CB C 19.413 -4.510 1.236 1.00 . A A . 21 ARG CB 1 1 13 3645 1 1 21 ARG CD C 20.122 -3.699 -1.018 1.00 . A A . 21 ARG CD 1 1 13 3646 1 1 21 ARG CG C 20.500 -4.592 0.164 1.00 . A A . 21 ARG CG 1 1 13 3647 1 1 21 ARG CZ C 18.451 -3.634 -2.776 1.00 . A A . 21 ARG CZ 1 1 13 3648 1 1 21 ARG H H 18.122 -4.617 3.457 1.00 . A A . 21 ARG H 1 1 13 3649 1 1 21 ARG HA H 19.967 -6.388 2.097 1.00 . A A . 21 ARG HA 1 1 13 3650 1 1 21 ARG HB2 H 18.478 -4.872 0.831 1.00 . A A . 21 ARG HB2 1 1 13 3651 1 1 21 ARG HB3 H 19.297 -3.483 1.551 1.00 . A A . 21 ARG HB3 1 1 13 3652 1 1 21 ARG HD2 H 19.889 -2.708 -0.655 1.00 . A A . 21 ARG HD2 1 1 13 3653 1 1 21 ARG HD3 H 20.956 -3.640 -1.702 1.00 . A A . 21 ARG HD3 1 1 13 3654 1 1 21 ARG HE H 18.548 -5.069 -1.385 1.00 . A A . 21 ARG HE 1 1 13 3655 1 1 21 ARG HG2 H 21.441 -4.262 0.580 1.00 . A A . 21 ARG HG2 1 1 13 3656 1 1 21 ARG HG3 H 20.594 -5.613 -0.175 1.00 . A A . 21 ARG HG3 1 1 13 3657 1 1 21 ARG HH11 H 19.790 -2.146 -2.755 1.00 . A A . 21 ARG HH11 1 1 13 3658 1 1 21 ARG HH12 H 18.611 -2.073 -4.021 1.00 . A A . 21 ARG HH12 1 1 13 3659 1 1 21 ARG HH21 H 16.998 -4.984 -3.044 1.00 . A A . 21 ARG HH21 1 1 13 3660 1 1 21 ARG HH22 H 17.029 -3.681 -4.185 1.00 . A A . 21 ARG HH22 1 1 13 3661 1 1 21 ARG N N 18.758 -5.362 3.437 1.00 . A A . 21 ARG N 1 1 13 3662 1 1 21 ARG NE N 18.961 -4.242 -1.710 1.00 . A A . 21 ARG NE 1 1 13 3663 1 1 21 ARG NH1 N 18.992 -2.532 -3.219 1.00 . A A . 21 ARG NH1 1 1 13 3664 1 1 21 ARG NH2 N 17.412 -4.139 -3.382 1.00 . A A . 21 ARG NH2 1 1 13 3665 1 1 21 ARG O O 21.978 -5.662 3.332 1.00 . A A . 21 ARG O 1 1 13 3666 1 1 21 ARG OXT O 21.242 -3.644 3.166 1.00 . A A . 21 ARG OXT 1 1 14 3667 1 1 1 ALA C C 18.144 1.876 -8.311 1.00 . A A . 1 ALA C 1 1 14 3668 1 1 1 ALA CA C 18.720 0.541 -7.848 1.00 . A A . 1 ALA CA 1 1 14 3669 1 1 1 ALA CB C 17.756 -0.596 -8.190 1.00 . A A . 1 ALA CB 1 1 14 3670 1 1 1 ALA H1 H 19.597 1.344 -6.137 1.00 . A A . 1 ALA H1 1 1 14 3671 1 1 1 ALA H2 H 19.321 -0.331 -6.054 1.00 . A A . 1 ALA H2 1 1 14 3672 1 1 1 ALA H3 H 18.025 0.756 -5.896 1.00 . A A . 1 ALA H3 1 1 14 3673 1 1 1 ALA HA H 19.667 0.369 -8.340 1.00 . A A . 1 ALA HA 1 1 14 3674 1 1 1 ALA HB1 H 18.194 -1.539 -7.899 1.00 . A A . 1 ALA HB1 1 1 14 3675 1 1 1 ALA HB2 H 17.568 -0.599 -9.255 1.00 . A A . 1 ALA HB2 1 1 14 3676 1 1 1 ALA HB3 H 16.826 -0.452 -7.660 1.00 . A A . 1 ALA HB3 1 1 14 3677 1 1 1 ALA N N 18.932 0.581 -6.372 1.00 . A A . 1 ALA N 1 1 14 3678 1 1 1 ALA O O 18.817 2.906 -8.250 1.00 . A A . 1 ALA O 1 1 14 3679 1 1 2 GLY C C 15.576 3.806 -8.092 1.00 . A A . 2 GLY C 1 1 14 3680 1 1 2 GLY CA C 16.250 3.072 -9.246 1.00 . A A . 2 GLY CA 1 1 14 3681 1 1 2 GLY H H 16.409 1.007 -8.804 1.00 . A A . 2 GLY H 1 1 14 3682 1 1 2 GLY HA2 H 16.988 3.718 -9.697 1.00 . A A . 2 GLY HA2 1 1 14 3683 1 1 2 GLY HA3 H 15.504 2.816 -9.983 1.00 . A A . 2 GLY HA3 1 1 14 3684 1 1 2 GLY N N 16.899 1.854 -8.776 1.00 . A A . 2 GLY N 1 1 14 3685 1 1 2 GLY O O 15.554 3.319 -6.962 1.00 . A A . 2 GLY O 1 1 14 3686 1 1 3 GLY C C 15.353 6.265 -6.319 1.00 . A A . 3 GLY C 1 1 14 3687 1 1 3 GLY CA C 14.356 5.771 -7.359 1.00 . A A . 3 GLY CA 1 1 14 3688 1 1 3 GLY H H 15.073 5.321 -9.301 1.00 . A A . 3 GLY H 1 1 14 3689 1 1 3 GLY HA2 H 13.876 6.620 -7.824 1.00 . A A . 3 GLY HA2 1 1 14 3690 1 1 3 GLY HA3 H 13.610 5.161 -6.871 1.00 . A A . 3 GLY HA3 1 1 14 3691 1 1 3 GLY N N 15.026 4.980 -8.383 1.00 . A A . 3 GLY N 1 1 14 3692 1 1 3 GLY O O 16.034 7.270 -6.526 1.00 . A A . 3 GLY O 1 1 14 3693 1 1 4 . C C 15.612 6.732 -3.120 1.00 . A A . 4 DBU C 1 1 14 3694 1 1 4 . CA C 16.320 5.911 -4.167 1.00 . A A . 4 DBU CA 1 1 14 3695 1 1 4 . CB C 17.681 5.622 -4.002 1.00 . A A . 4 DBU CB 1 1 14 3696 1 1 4 . CG C 18.554 4.824 -4.937 1.00 . A A . 4 DBU CG 1 1 14 3697 1 1 4 . H H 14.871 4.760 -5.081 1.00 . A A . 4 DBU H 1 1 14 3698 1 1 4 . HB H 18.175 6.002 -3.120 1.00 . A A . 4 DBU HB 1 1 14 3699 1 1 4 . HG1 H 18.899 3.936 -4.430 1.00 . A A . 4 DBU HG1 1 1 14 3700 1 1 4 . HG2 H 19.402 5.424 -5.229 1.00 . A A . 4 DBU HG2 1 1 14 3701 1 1 4 . HG3 H 17.992 4.543 -5.814 1.00 . A A . 4 DBU HG3 1 1 14 3702 1 1 4 . N N 15.433 5.553 -5.201 1.00 . A A . 4 DBU N 1 1 14 3703 1 1 4 . O O 15.619 7.958 -3.207 1.00 . A A . 4 DBU O 1 1 14 3704 1 1 5 ILE C C 13.158 5.905 -0.524 1.00 . A A . 5 ILE C 1 1 14 3705 1 1 5 ILE CA C 14.304 6.757 -1.056 1.00 . A A . 5 ILE CA 1 1 14 3706 1 1 5 ILE CB C 13.764 8.108 -1.537 1.00 . A A . 5 ILE CB 1 1 14 3707 1 1 5 ILE CD1 C 14.639 9.722 0.196 1.00 . A A . 5 ILE CD1 1 1 14 3708 1 1 5 ILE CG1 C 14.800 9.208 -1.240 1.00 . A A . 5 ILE CG1 1 1 14 3709 1 1 5 ILE CG2 C 12.452 8.434 -0.815 1.00 . A A . 5 ILE CG2 1 1 14 3710 1 1 5 ILE H H 15.054 5.087 -2.126 1.00 . A A . 5 ILE H 1 1 14 3711 1 1 5 ILE HA H 14.991 6.930 -0.256 1.00 . A A . 5 ILE HA 1 1 14 3712 1 1 5 ILE HB H 13.587 8.058 -2.601 1.00 . A A . 5 ILE HB 1 1 14 3713 1 1 5 ILE HD11 H 14.070 9.009 0.773 1.00 . A A . 5 ILE HD11 1 1 14 3714 1 1 5 ILE HD12 H 14.120 10.669 0.183 1.00 . A A . 5 ILE HD12 1 1 14 3715 1 1 5 ILE HD13 H 15.614 9.851 0.644 1.00 . A A . 5 ILE HD13 1 1 14 3716 1 1 5 ILE HG12 H 15.794 8.804 -1.362 1.00 . A A . 5 ILE HG12 1 1 14 3717 1 1 5 ILE HG13 H 14.659 10.025 -1.931 1.00 . A A . 5 ILE HG13 1 1 14 3718 1 1 5 ILE HG21 H 11.670 7.785 -1.179 1.00 . A A . 5 ILE HG21 1 1 14 3719 1 1 5 ILE HG22 H 12.183 9.462 -0.999 1.00 . A A . 5 ILE HG22 1 1 14 3720 1 1 5 ILE HG23 H 12.583 8.277 0.248 1.00 . A A . 5 ILE HG23 1 1 14 3721 1 1 5 ILE N N 15.013 6.066 -2.132 1.00 . A A . 5 ILE N 1 1 14 3722 1 1 5 ILE O O 12.949 5.820 0.686 1.00 . A A . 5 ILE O 1 1 14 3723 1 1 6 PRO C C 11.712 3.345 -0.057 1.00 . A A . 6 PRO C 1 1 14 3724 1 1 6 PRO CA C 11.264 4.438 -0.997 1.00 . A A . 6 PRO CA 1 1 14 3725 1 1 6 PRO CB C 10.763 3.834 -2.305 1.00 . A A . 6 PRO CB 1 1 14 3726 1 1 6 PRO CD C 12.594 5.319 -2.851 1.00 . A A . 6 PRO CD 1 1 14 3727 1 1 6 PRO CG C 11.294 4.722 -3.382 1.00 . A A . 6 PRO CG 1 1 14 3728 1 1 6 PRO HA H 10.489 5.035 -0.546 1.00 . A A . 6 PRO HA 1 1 14 3729 1 1 6 PRO HB2 H 11.138 2.822 -2.413 1.00 . A A . 6 PRO HB2 1 1 14 3730 1 1 6 PRO HB3 H 9.683 3.835 -2.328 1.00 . A A . 6 PRO HB3 1 1 14 3731 1 1 6 PRO HD2 H 13.441 4.718 -3.147 1.00 . A A . 6 PRO HD2 1 1 14 3732 1 1 6 PRO HD3 H 12.709 6.332 -3.189 1.00 . A A . 6 PRO HD3 1 1 14 3733 1 1 6 PRO HG2 H 11.482 4.149 -4.279 1.00 . A A . 6 PRO HG2 1 1 14 3734 1 1 6 PRO HG3 H 10.597 5.516 -3.585 1.00 . A A . 6 PRO HG3 1 1 14 3735 1 1 6 PRO N N 12.416 5.287 -1.397 1.00 . A A . 6 PRO N 1 1 14 3736 1 1 6 PRO O O 10.971 2.930 0.831 1.00 . A A . 6 PRO O 1 1 14 3737 1 1 7 DAL C C 14.968 1.586 0.307 1.00 . A A . 7 DAL C 1 1 14 3738 1 1 7 DAL CA C 13.480 1.821 0.555 1.00 . A A . 7 DAL CA 1 1 14 3739 1 1 7 DAL CB C 13.234 2.163 2.011 1.00 . A A . 7 DAL CB 1 1 14 3740 1 1 7 DAL H H 13.470 3.247 -0.997 1.00 . A A . 7 DAL H 1 1 14 3741 1 1 7 DAL HA H 12.954 0.920 0.332 1.00 . A A . 7 DAL HA 1 1 14 3742 1 1 7 DAL HB1 H 13.075 3.225 2.110 1.00 . A A . 7 DAL HB1 1 1 14 3743 1 1 7 DAL HB2 H 14.081 1.870 2.605 1.00 . A A . 7 DAL HB2 1 1 14 3744 1 1 7 DAL N N 12.936 2.876 -0.272 1.00 . A A . 7 DAL N 1 1 14 3745 1 1 7 DAL O O 15.614 0.852 1.054 1.00 . A A . 7 DAL O 1 1 14 3746 1 1 8 LEU C C 17.761 2.581 0.088 1.00 . A A . 8 LEU C 1 1 14 3747 1 1 8 LEU CA C 16.923 2.009 -1.045 1.00 . A A . 8 LEU CA 1 1 14 3748 1 1 8 LEU CB C 17.266 2.717 -2.356 1.00 . A A . 8 LEU CB 1 1 14 3749 1 1 8 LEU CD1 C 16.726 2.673 -4.800 1.00 . A A . 8 LEU CD1 1 1 14 3750 1 1 8 LEU CD2 C 15.733 0.954 -3.287 1.00 . A A . 8 LEU CD2 1 1 14 3751 1 1 8 LEU CG C 16.181 2.417 -3.395 1.00 . A A . 8 LEU CG 1 1 14 3752 1 1 8 LEU H H 14.965 2.764 -1.314 1.00 . A A . 8 LEU H 1 1 14 3753 1 1 8 LEU HA H 17.133 0.954 -1.145 1.00 . A A . 8 LEU HA 1 1 14 3754 1 1 8 LEU HB2 H 17.319 3.782 -2.187 1.00 . A A . 8 LEU HB2 1 1 14 3755 1 1 8 LEU HB3 H 18.218 2.361 -2.719 1.00 . A A . 8 LEU HB3 1 1 14 3756 1 1 8 LEU HD11 H 17.790 2.500 -4.811 1.00 . A A . 8 LEU HD11 1 1 14 3757 1 1 8 LEU HD12 H 16.522 3.694 -5.083 1.00 . A A . 8 LEU HD12 1 1 14 3758 1 1 8 LEU HD13 H 16.246 2.004 -5.499 1.00 . A A . 8 LEU HD13 1 1 14 3759 1 1 8 LEU HD21 H 16.561 0.349 -2.947 1.00 . A A . 8 LEU HD21 1 1 14 3760 1 1 8 LEU HD22 H 15.404 0.606 -4.255 1.00 . A A . 8 LEU HD22 1 1 14 3761 1 1 8 LEU HD23 H 14.918 0.878 -2.583 1.00 . A A . 8 LEU HD23 1 1 14 3762 1 1 8 LEU HG H 15.336 3.067 -3.214 1.00 . A A . 8 LEU HG 1 1 14 3763 1 1 8 LEU N N 15.514 2.192 -0.738 1.00 . A A . 8 LEU N 1 1 14 3764 1 1 8 LEU O O 18.908 2.187 0.299 1.00 . A A . 8 LEU O 1 1 14 3765 1 1 9 MET C C 18.133 3.156 3.023 1.00 . A A . 9 MET C 1 1 14 3766 1 1 9 MET CA C 17.829 4.168 1.923 1.00 . A A . 9 MET CA 1 1 14 3767 1 1 9 MET CB C 16.923 5.271 2.468 1.00 . A A . 9 MET CB 1 1 14 3768 1 1 9 MET CE C 16.882 8.424 2.769 1.00 . A A . 9 MET CE 1 1 14 3769 1 1 9 MET CG C 16.489 6.167 1.313 1.00 . A A . 9 MET CG 1 1 14 3770 1 1 9 MET H H 16.246 3.785 0.577 1.00 . A A . 9 MET H 1 1 14 3771 1 1 9 MET HA H 18.752 4.609 1.578 1.00 . A A . 9 MET HA 1 1 14 3772 1 1 9 MET HB2 H 16.052 4.827 2.929 1.00 . A A . 9 MET HB2 1 1 14 3773 1 1 9 MET HB3 H 17.456 5.860 3.193 1.00 . A A . 9 MET HB3 1 1 14 3774 1 1 9 MET HE1 H 17.817 8.123 2.319 1.00 . A A . 9 MET HE1 1 1 14 3775 1 1 9 MET HE2 H 16.895 8.179 3.819 1.00 . A A . 9 MET HE2 1 1 14 3776 1 1 9 MET HE3 H 16.744 9.491 2.651 1.00 . A A . 9 MET HE3 1 1 14 3777 1 1 9 MET HG2 H 17.358 6.538 0.792 1.00 . A A . 9 MET HG2 1 1 14 3778 1 1 9 MET HG3 H 15.883 5.593 0.629 1.00 . A A . 9 MET HG3 1 1 14 3779 1 1 9 MET N N 17.162 3.520 0.806 1.00 . A A . 9 MET N 1 1 14 3780 1 1 9 MET O O 19.198 3.195 3.639 1.00 . A A . 9 MET O 1 1 14 3781 1 1 9 MET SD S 15.518 7.550 1.960 1.00 . A A . 9 MET SD 1 1 14 3782 1 1 10 . C C 16.618 1.567 5.552 1.00 . A A . 10 DBB C 1 1 14 3783 1 1 10 . CA C 17.381 1.222 4.289 1.00 . A A . 10 DBB CA 1 1 14 3784 1 1 10 . CB C 16.925 -0.140 3.769 1.00 . A A . 10 DBB CB 1 1 14 3785 1 1 10 . CG C 15.398 -0.191 3.754 1.00 . A A . 10 DBB CG 1 1 14 3786 1 1 10 . H H 16.365 2.254 2.738 1.00 . A A . 10 DBB H 1 1 14 3787 1 1 10 . HA H 18.433 1.163 4.527 1.00 . A A . 10 DBB HA 1 1 14 3788 1 1 10 . HB2 H 17.258 -0.239 2.757 1.00 . A A . 10 DBB HB2 1 1 14 3789 1 1 10 . HG1 H 15.029 0.414 2.942 1.00 . A A . 10 DBB HG1 1 1 14 3790 1 1 10 . HG2 H 15.009 0.181 4.686 1.00 . A A . 10 DBB HG2 1 1 14 3791 1 1 10 . HG3 H 15.072 -1.211 3.611 1.00 . A A . 10 DBB HG3 1 1 14 3792 1 1 10 . N N 17.192 2.243 3.263 1.00 . A A . 10 DBB N 1 1 14 3793 1 1 10 . O O 17.098 1.330 6.661 1.00 . A A . 10 DBB O 1 1 14 3794 1 1 11 GLY C C 13.192 2.814 6.161 1.00 . A A . 11 GLY C 1 1 14 3795 1 1 11 GLY CA C 14.633 2.489 6.544 1.00 . A A . 11 GLY CA 1 1 14 3796 1 1 11 GLY H H 15.087 2.296 4.488 1.00 . A A . 11 GLY H 1 1 14 3797 1 1 11 GLY HA2 H 14.637 1.670 7.248 1.00 . A A . 11 GLY HA2 1 1 14 3798 1 1 11 GLY HA3 H 15.082 3.346 6.999 1.00 . A A . 11 GLY HA3 1 1 14 3799 1 1 11 GLY N N 15.428 2.125 5.391 1.00 . A A . 11 GLY N 1 1 14 3800 1 1 11 GLY O O 12.685 3.890 6.474 1.00 . A A . 11 GLY O 1 1 14 3801 1 1 12 CYS C C 10.398 0.762 5.069 1.00 . A A . 12 CYS C 1 1 14 3802 1 1 12 CYS CA C 11.162 2.077 5.051 1.00 . A A . 12 CYS CA 1 1 14 3803 1 1 12 CYS CB C 11.147 2.593 3.625 1.00 . A A . 12 CYS CB 1 1 14 3804 1 1 12 CYS H H 13.000 1.044 5.247 1.00 . A A . 12 CYS H 1 1 14 3805 1 1 12 CYS HA H 10.677 2.791 5.696 1.00 . A A . 12 CYS HA 1 1 14 3806 1 1 12 CYS HB2 H 10.142 2.862 3.338 1.00 . A A . 12 CYS HB2 1 1 14 3807 1 1 12 CYS HB3 H 11.792 3.447 3.537 1.00 . A A . 12 CYS HB3 1 1 14 3808 1 1 12 CYS N N 12.542 1.879 5.478 1.00 . A A . 12 CYS N 1 1 14 3809 1 1 12 CYS O O 10.756 -0.174 5.782 1.00 . A A . 12 CYS O 1 1 14 3810 1 1 12 CYS SG S 11.761 1.280 2.559 1.00 . A A . 12 CYS SG 1 1 14 3811 1 1 13 GLY C C 8.475 -0.905 2.653 1.00 . A A . 13 GLY C 1 1 14 3812 1 1 13 GLY CA C 8.546 -0.494 4.116 1.00 . A A . 13 GLY CA 1 1 14 3813 1 1 13 GLY H H 9.147 1.482 3.689 1.00 . A A . 13 GLY H 1 1 14 3814 1 1 13 GLY HA2 H 8.986 -1.288 4.697 1.00 . A A . 13 GLY HA2 1 1 14 3815 1 1 13 GLY HA3 H 7.549 -0.293 4.474 1.00 . A A . 13 GLY HA3 1 1 14 3816 1 1 13 GLY N N 9.359 0.704 4.244 1.00 . A A . 13 GLY N 1 1 14 3817 1 1 13 GLY O O 7.915 -1.946 2.314 1.00 . A A . 13 GLY O 1 1 14 3818 1 1 14 TRP C C 8.670 -1.737 0.015 1.00 . A A . 14 TRP C 1 1 14 3819 1 1 14 TRP CA C 9.068 -0.295 0.357 1.00 . A A . 14 TRP CA 1 1 14 3820 1 1 14 TRP CB C 10.463 0.039 -0.208 1.00 . A A . 14 TRP CB 1 1 14 3821 1 1 14 TRP CD1 C 11.418 -1.382 1.642 1.00 . A A . 14 TRP CD1 1 1 14 3822 1 1 14 TRP CD2 C 12.792 -1.268 -0.130 1.00 . A A . 14 TRP CD2 1 1 14 3823 1 1 14 TRP CE2 C 13.438 -2.083 0.828 1.00 . A A . 14 TRP CE2 1 1 14 3824 1 1 14 TRP CE3 C 13.451 -1.031 -1.352 1.00 . A A . 14 TRP CE3 1 1 14 3825 1 1 14 TRP CG C 11.509 -0.832 0.420 1.00 . A A . 14 TRP CG 1 1 14 3826 1 1 14 TRP CH2 C 15.332 -2.401 -0.635 1.00 . A A . 14 TRP CH2 1 1 14 3827 1 1 14 TRP CZ2 C 14.692 -2.645 0.584 1.00 . A A . 14 TRP CZ2 1 1 14 3828 1 1 14 TRP CZ3 C 14.712 -1.596 -1.601 1.00 . A A . 14 TRP CZ3 1 1 14 3829 1 1 14 TRP H H 9.474 0.751 2.149 1.00 . A A . 14 TRP H 1 1 14 3830 1 1 14 TRP HA H 8.352 0.369 -0.101 1.00 . A A . 14 TRP HA 1 1 14 3831 1 1 14 TRP HB2 H 10.463 -0.116 -1.271 1.00 . A A . 14 TRP HB2 1 1 14 3832 1 1 14 TRP HB3 H 10.690 1.074 -0.001 1.00 . A A . 14 TRP HB3 1 1 14 3833 1 1 14 TRP HD1 H 10.591 -1.258 2.312 1.00 . A A . 14 TRP HD1 1 1 14 3834 1 1 14 TRP HE1 H 12.743 -2.621 2.716 1.00 . A A . 14 TRP HE1 1 1 14 3835 1 1 14 TRP HE3 H 12.985 -0.411 -2.102 1.00 . A A . 14 TRP HE3 1 1 14 3836 1 1 14 TRP HH2 H 16.303 -2.830 -0.833 1.00 . A A . 14 TRP HH2 1 1 14 3837 1 1 14 TRP HZ2 H 15.165 -3.265 1.331 1.00 . A A . 14 TRP HZ2 1 1 14 3838 1 1 14 TRP HZ3 H 15.208 -1.408 -2.543 1.00 . A A . 14 TRP HZ3 1 1 14 3839 1 1 14 TRP N N 9.052 -0.061 1.798 1.00 . A A . 14 TRP N 1 1 14 3840 1 1 14 TRP NE1 N 12.561 -2.123 1.892 1.00 . A A . 14 TRP NE1 1 1 14 3841 1 1 14 TRP O O 7.509 -2.119 0.163 1.00 . A A . 14 TRP O 1 1 14 3842 1 1 15 LEU C C 9.906 -4.849 0.223 1.00 . A A . 15 LEU C 1 1 14 3843 1 1 15 LEU CA C 9.366 -3.898 -0.844 1.00 . A A . 15 LEU CA 1 1 14 3844 1 1 15 LEU CB C 10.054 -4.184 -2.181 1.00 . A A . 15 LEU CB 1 1 14 3845 1 1 15 LEU CD1 C 12.201 -3.787 -3.397 1.00 . A A . 15 LEU CD1 1 1 14 3846 1 1 15 LEU CD2 C 10.731 -1.846 -2.819 1.00 . A A . 15 LEU CD2 1 1 14 3847 1 1 15 LEU CG C 11.236 -3.222 -2.359 1.00 . A A . 15 LEU CG 1 1 14 3848 1 1 15 LEU H H 10.519 -2.166 -0.588 1.00 . A A . 15 LEU H 1 1 14 3849 1 1 15 LEU HA H 8.304 -4.047 -0.953 1.00 . A A . 15 LEU HA 1 1 14 3850 1 1 15 LEU HB2 H 10.412 -5.204 -2.192 1.00 . A A . 15 LEU HB2 1 1 14 3851 1 1 15 LEU HB3 H 9.350 -4.040 -2.986 1.00 . A A . 15 LEU HB3 1 1 14 3852 1 1 15 LEU HD11 H 11.882 -4.778 -3.682 1.00 . A A . 15 LEU HD11 1 1 14 3853 1 1 15 LEU HD12 H 13.193 -3.835 -2.973 1.00 . A A . 15 LEU HD12 1 1 14 3854 1 1 15 LEU HD13 H 12.211 -3.146 -4.265 1.00 . A A . 15 LEU HD13 1 1 14 3855 1 1 15 LEU HD21 H 11.425 -1.081 -2.499 1.00 . A A . 15 LEU HD21 1 1 14 3856 1 1 15 LEU HD22 H 9.761 -1.650 -2.386 1.00 . A A . 15 LEU HD22 1 1 14 3857 1 1 15 LEU HD23 H 10.652 -1.831 -3.895 1.00 . A A . 15 LEU HD23 1 1 14 3858 1 1 15 LEU HG H 11.752 -3.118 -1.415 1.00 . A A . 15 LEU HG 1 1 14 3859 1 1 15 LEU N N 9.626 -2.520 -0.465 1.00 . A A . 15 LEU N 1 1 14 3860 1 1 15 LEU O O 9.369 -5.938 0.427 1.00 . A A . 15 LEU O 1 1 14 3861 1 1 16 . C C 10.766 -5.099 3.172 1.00 . A A . 16 DBU C 1 1 14 3862 1 1 16 . CA C 11.602 -5.163 1.919 1.00 . A A . 16 DBU CA 1 1 14 3863 1 1 16 . CB C 12.806 -5.879 1.895 1.00 . A A . 16 DBU CB 1 1 14 3864 1 1 16 . CG C 13.724 -6.012 0.705 1.00 . A A . 16 DBU CG 1 1 14 3865 1 1 16 . H H 11.360 -3.546 0.703 1.00 . A A . 16 DBU H 1 1 14 3866 1 1 16 . HB H 13.123 -6.386 2.794 1.00 . A A . 16 DBU HB 1 1 14 3867 1 1 16 . HG1 H 13.495 -5.241 -0.017 1.00 . A A . 16 DBU HG1 1 1 14 3868 1 1 16 . HG2 H 13.587 -6.982 0.250 1.00 . A A . 16 DBU HG2 1 1 14 3869 1 1 16 . HG3 H 14.749 -5.909 1.030 1.00 . A A . 16 DBU HG3 1 1 14 3870 1 1 16 . N N 10.970 -4.423 0.901 1.00 . A A . 16 DBU N 1 1 14 3871 1 1 16 . O O 10.099 -6.065 3.545 1.00 . A A . 16 DBU O 1 1 14 3872 1 1 17 GLY C C 10.886 -3.234 6.184 1.00 . A A . 17 GLY C 1 1 14 3873 1 1 17 GLY CA C 10.018 -3.768 5.049 1.00 . A A . 17 GLY CA 1 1 14 3874 1 1 17 GLY H H 11.338 -3.202 3.490 1.00 . A A . 17 GLY H 1 1 14 3875 1 1 17 GLY HA2 H 9.215 -3.074 4.857 1.00 . A A . 17 GLY HA2 1 1 14 3876 1 1 17 GLY HA3 H 9.601 -4.719 5.344 1.00 . A A . 17 GLY HA3 1 1 14 3877 1 1 17 GLY N N 10.793 -3.946 3.830 1.00 . A A . 17 GLY N 1 1 14 3878 1 1 17 GLY O O 10.621 -2.167 6.733 1.00 . A A . 17 GLY O 1 1 14 3879 1 1 18 LEU C C 14.210 -3.265 7.074 1.00 . A A . 18 LEU C 1 1 14 3880 1 1 18 LEU CA C 12.819 -3.582 7.612 1.00 . A A . 18 LEU CA 1 1 14 3881 1 1 18 LEU CB C 12.914 -4.692 8.660 1.00 . A A . 18 LEU CB 1 1 14 3882 1 1 18 LEU CD1 C 11.604 -6.087 10.268 1.00 . A A . 18 LEU CD1 1 1 14 3883 1 1 18 LEU CD2 C 11.109 -3.650 10.035 1.00 . A A . 18 LEU CD2 1 1 14 3884 1 1 18 LEU CG C 11.537 -4.915 9.287 1.00 . A A . 18 LEU CG 1 1 14 3885 1 1 18 LEU H H 12.083 -4.834 6.065 1.00 . A A . 18 LEU H 1 1 14 3886 1 1 18 LEU HA H 12.419 -2.696 8.083 1.00 . A A . 18 LEU HA 1 1 14 3887 1 1 18 LEU HB2 H 13.249 -5.605 8.187 1.00 . A A . 18 LEU HB2 1 1 14 3888 1 1 18 LEU HB3 H 13.616 -4.405 9.427 1.00 . A A . 18 LEU HB3 1 1 14 3889 1 1 18 LEU HD11 H 12.244 -6.858 9.863 1.00 . A A . 18 LEU HD11 1 1 14 3890 1 1 18 LEU HD12 H 10.611 -6.484 10.420 1.00 . A A . 18 LEU HD12 1 1 14 3891 1 1 18 LEU HD13 H 12.004 -5.746 11.210 1.00 . A A . 18 LEU HD13 1 1 14 3892 1 1 18 LEU HD21 H 10.506 -3.922 10.888 1.00 . A A . 18 LEU HD21 1 1 14 3893 1 1 18 LEU HD22 H 10.535 -3.018 9.373 1.00 . A A . 18 LEU HD22 1 1 14 3894 1 1 18 LEU HD23 H 11.986 -3.116 10.371 1.00 . A A . 18 LEU HD23 1 1 14 3895 1 1 18 LEU HG H 10.820 -5.136 8.511 1.00 . A A . 18 LEU HG 1 1 14 3896 1 1 18 LEU N N 11.921 -3.989 6.536 1.00 . A A . 18 LEU N 1 1 14 3897 1 1 18 LEU O O 15.112 -2.910 7.832 1.00 . A A . 18 LEU O 1 1 14 3898 1 1 19 CYS C C 16.586 -4.351 5.289 1.00 . A A . 19 CYS C 1 1 14 3899 1 1 19 CYS CA C 15.673 -3.142 5.138 1.00 . A A . 19 CYS CA 1 1 14 3900 1 1 19 CYS CB C 16.338 -1.920 5.775 1.00 . A A . 19 CYS CB 1 1 14 3901 1 1 19 CYS H H 13.631 -3.698 5.208 1.00 . A A . 19 CYS H 1 1 14 3902 1 1 19 CYS HA H 15.519 -2.948 4.087 1.00 . A A . 19 CYS HA 1 1 14 3903 1 1 19 CYS HB2 H 15.626 -1.114 5.845 1.00 . A A . 19 CYS HB2 1 1 14 3904 1 1 19 CYS HB3 H 16.684 -2.175 6.765 1.00 . A A . 19 CYS HB3 1 1 14 3905 1 1 19 CYS N N 14.382 -3.405 5.763 1.00 . A A . 19 CYS N 1 1 14 3906 1 1 19 CYS O O 17.484 -4.363 6.131 1.00 . A A . 19 CYS O 1 1 14 3907 1 1 19 CYS SG S 17.750 -1.416 4.759 1.00 . A A . 19 CYS SG 1 1 14 3908 1 1 20 VAL C C 18.057 -6.681 3.291 1.00 . A A . 20 VAL C 1 1 14 3909 1 1 20 VAL CA C 17.157 -6.580 4.518 1.00 . A A . 20 VAL CA 1 1 14 3910 1 1 20 VAL CB C 16.243 -7.801 4.587 1.00 . A A . 20 VAL CB 1 1 14 3911 1 1 20 VAL CG1 C 15.578 -7.861 5.963 1.00 . A A . 20 VAL CG1 1 1 14 3912 1 1 20 VAL CG2 C 15.163 -7.688 3.508 1.00 . A A . 20 VAL CG2 1 1 14 3913 1 1 20 VAL H H 15.620 -5.300 3.817 1.00 . A A . 20 VAL H 1 1 14 3914 1 1 20 VAL HA H 17.773 -6.556 5.404 1.00 . A A . 20 VAL HA 1 1 14 3915 1 1 20 VAL HB H 16.823 -8.698 4.427 1.00 . A A . 20 VAL HB 1 1 14 3916 1 1 20 VAL HG11 H 15.977 -8.696 6.520 1.00 . A A . 20 VAL HG11 1 1 14 3917 1 1 20 VAL HG12 H 14.511 -7.985 5.843 1.00 . A A . 20 VAL HG12 1 1 14 3918 1 1 20 VAL HG13 H 15.774 -6.943 6.499 1.00 . A A . 20 VAL HG13 1 1 14 3919 1 1 20 VAL HG21 H 15.622 -7.747 2.532 1.00 . A A . 20 VAL HG21 1 1 14 3920 1 1 20 VAL HG22 H 14.651 -6.742 3.608 1.00 . A A . 20 VAL HG22 1 1 14 3921 1 1 20 VAL HG23 H 14.454 -8.495 3.622 1.00 . A A . 20 VAL HG23 1 1 14 3922 1 1 20 VAL N N 16.351 -5.367 4.467 1.00 . A A . 20 VAL N 1 1 14 3923 1 1 20 VAL O O 18.976 -7.499 3.256 1.00 . A A . 20 VAL O 1 1 14 3924 1 1 21 ARG C C 19.353 -7.136 0.906 1.00 . A A . 21 ARG C 1 1 14 3925 1 1 21 ARG CA C 18.577 -5.832 1.068 1.00 . A A . 21 ARG CA 1 1 14 3926 1 1 21 ARG CB C 19.551 -4.653 1.089 1.00 . A A . 21 ARG CB 1 1 14 3927 1 1 21 ARG CD C 21.366 -3.534 2.392 1.00 . A A . 21 ARG CD 1 1 14 3928 1 1 21 ARG CG C 20.434 -4.744 2.335 1.00 . A A . 21 ARG CG 1 1 14 3929 1 1 21 ARG CZ C 23.440 -4.271 1.366 1.00 . A A . 21 ARG CZ 1 1 14 3930 1 1 21 ARG H H 17.043 -5.209 2.391 1.00 . A A . 21 ARG H 1 1 14 3931 1 1 21 ARG HA H 17.913 -5.716 0.225 1.00 . A A . 21 ARG HA 1 1 14 3932 1 1 21 ARG HB2 H 20.171 -4.680 0.205 1.00 . A A . 21 ARG HB2 1 1 14 3933 1 1 21 ARG HB3 H 18.996 -3.727 1.111 1.00 . A A . 21 ARG HB3 1 1 14 3934 1 1 21 ARG HD2 H 20.782 -2.629 2.328 1.00 . A A . 21 ARG HD2 1 1 14 3935 1 1 21 ARG HD3 H 21.908 -3.543 3.327 1.00 . A A . 21 ARG HD3 1 1 14 3936 1 1 21 ARG HE H 22.115 -3.073 0.462 1.00 . A A . 21 ARG HE 1 1 14 3937 1 1 21 ARG HG2 H 19.811 -4.760 3.217 1.00 . A A . 21 ARG HG2 1 1 14 3938 1 1 21 ARG HG3 H 21.024 -5.648 2.293 1.00 . A A . 21 ARG HG3 1 1 14 3939 1 1 21 ARG HH11 H 23.077 -4.922 3.223 1.00 . A A . 21 ARG HH11 1 1 14 3940 1 1 21 ARG HH12 H 24.562 -5.463 2.517 1.00 . A A . 21 ARG HH12 1 1 14 3941 1 1 21 ARG HH21 H 24.063 -3.777 -0.472 1.00 . A A . 21 ARG HH21 1 1 14 3942 1 1 21 ARG HH22 H 25.121 -4.815 0.425 1.00 . A A . 21 ARG HH22 1 1 14 3943 1 1 21 ARG N N 17.787 -5.840 2.295 1.00 . A A . 21 ARG N 1 1 14 3944 1 1 21 ARG NE N 22.314 -3.571 1.283 1.00 . A A . 21 ARG NE 1 1 14 3945 1 1 21 ARG NH1 N 23.714 -4.937 2.454 1.00 . A A . 21 ARG NH1 1 1 14 3946 1 1 21 ARG NH2 N 24.272 -4.289 0.362 1.00 . A A . 21 ARG NH2 1 1 14 3947 1 1 21 ARG O O 20.539 -7.068 0.628 1.00 . A A . 21 ARG O 1 1 14 3948 1 1 21 ARG OXT O 18.749 -8.185 1.063 1.00 . A A . 21 ARG OXT 1 1 15 3949 1 1 1 ALA C C 12.064 8.306 -9.290 1.00 . A A . 1 ALA C 1 1 15 3950 1 1 1 ALA CA C 12.821 9.630 -9.264 1.00 . A A . 1 ALA CA 1 1 15 3951 1 1 1 ALA CB C 12.073 10.642 -8.395 1.00 . A A . 1 ALA CB 1 1 15 3952 1 1 1 ALA H1 H 13.711 9.672 -11.147 1.00 . A A . 1 ALA H1 1 1 15 3953 1 1 1 ALA H2 H 13.135 11.181 -10.617 1.00 . A A . 1 ALA H2 1 1 15 3954 1 1 1 ALA H3 H 12.046 9.996 -11.161 1.00 . A A . 1 ALA H3 1 1 15 3955 1 1 1 ALA HA H 13.809 9.468 -8.860 1.00 . A A . 1 ALA HA 1 1 15 3956 1 1 1 ALA HB1 H 12.672 10.885 -7.529 1.00 . A A . 1 ALA HB1 1 1 15 3957 1 1 1 ALA HB2 H 11.133 10.216 -8.075 1.00 . A A . 1 ALA HB2 1 1 15 3958 1 1 1 ALA HB3 H 11.887 11.539 -8.967 1.00 . A A . 1 ALA HB3 1 1 15 3959 1 1 1 ALA N N 12.937 10.160 -10.652 1.00 . A A . 1 ALA N 1 1 15 3960 1 1 1 ALA O O 12.072 7.595 -10.296 1.00 . A A . 1 ALA O 1 1 15 3961 1 1 2 GLY C C 11.571 5.571 -7.739 1.00 . A A . 2 GLY C 1 1 15 3962 1 1 2 GLY CA C 10.656 6.739 -8.084 1.00 . A A . 2 GLY CA 1 1 15 3963 1 1 2 GLY H H 11.445 8.587 -7.408 1.00 . A A . 2 GLY H 1 1 15 3964 1 1 2 GLY HA2 H 9.903 6.841 -7.317 1.00 . A A . 2 GLY HA2 1 1 15 3965 1 1 2 GLY HA3 H 10.176 6.543 -9.031 1.00 . A A . 2 GLY HA3 1 1 15 3966 1 1 2 GLY N N 11.414 7.981 -8.178 1.00 . A A . 2 GLY N 1 1 15 3967 1 1 2 GLY O O 11.157 4.413 -7.769 1.00 . A A . 2 GLY O 1 1 15 3968 1 1 3 GLY C C 14.973 5.455 -6.308 1.00 . A A . 3 GLY C 1 1 15 3969 1 1 3 GLY CA C 13.787 4.855 -7.055 1.00 . A A . 3 GLY CA 1 1 15 3970 1 1 3 GLY H H 13.092 6.827 -7.398 1.00 . A A . 3 GLY H 1 1 15 3971 1 1 3 GLY HA2 H 13.307 4.118 -6.427 1.00 . A A . 3 GLY HA2 1 1 15 3972 1 1 3 GLY HA3 H 14.144 4.379 -7.955 1.00 . A A . 3 GLY HA3 1 1 15 3973 1 1 3 GLY N N 12.820 5.886 -7.407 1.00 . A A . 3 GLY N 1 1 15 3974 1 1 3 GLY O O 15.862 6.055 -6.912 1.00 . A A . 3 GLY O 1 1 15 3975 1 1 4 . C C 15.489 6.661 -3.076 1.00 . A A . 4 DBU C 1 1 15 3976 1 1 4 . CA C 16.021 5.786 -4.180 1.00 . A A . 4 DBU CA 1 1 15 3977 1 1 4 . CB C 17.403 5.587 -4.267 1.00 . A A . 4 DBU CB 1 1 15 3978 1 1 4 . CG C 18.086 4.744 -5.312 1.00 . A A . 4 DBU CG 1 1 15 3979 1 1 4 . H H 14.253 4.798 -4.553 1.00 . A A . 4 DBU H 1 1 15 3980 1 1 4 . HB H 18.038 6.068 -3.536 1.00 . A A . 4 DBU HB 1 1 15 3981 1 1 4 . HG1 H 17.346 4.309 -5.966 1.00 . A A . 4 DBU HG1 1 1 15 3982 1 1 4 . HG2 H 18.647 3.959 -4.826 1.00 . A A . 4 DBU HG2 1 1 15 3983 1 1 4 . HG3 H 18.758 5.365 -5.888 1.00 . A A . 4 DBU HG3 1 1 15 3984 1 1 4 . N N 14.982 5.284 -4.990 1.00 . A A . 4 DBU N 1 1 15 3985 1 1 4 . O O 15.580 7.884 -3.151 1.00 . A A . 4 DBU O 1 1 15 3986 1 1 5 ILE C C 13.310 5.952 -0.213 1.00 . A A . 5 ILE C 1 1 15 3987 1 1 5 ILE CA C 14.392 6.769 -0.910 1.00 . A A . 5 ILE CA 1 1 15 3988 1 1 5 ILE CB C 13.825 8.116 -1.375 1.00 . A A . 5 ILE CB 1 1 15 3989 1 1 5 ILE CD1 C 14.845 9.669 0.321 1.00 . A A . 5 ILE CD1 1 1 15 3990 1 1 5 ILE CG1 C 14.877 9.209 -1.141 1.00 . A A . 5 ILE CG1 1 1 15 3991 1 1 5 ILE CG2 C 12.547 8.454 -0.595 1.00 . A A . 5 ILE CG2 1 1 15 3992 1 1 5 ILE H H 14.899 5.052 -2.042 1.00 . A A . 5 ILE H 1 1 15 3993 1 1 5 ILE HA H 15.187 6.953 -0.210 1.00 . A A . 5 ILE HA 1 1 15 3994 1 1 5 ILE HB H 13.595 8.060 -2.430 1.00 . A A . 5 ILE HB 1 1 15 3995 1 1 5 ILE HD11 H 14.333 8.931 0.919 1.00 . A A . 5 ILE HD11 1 1 15 3996 1 1 5 ILE HD12 H 14.325 10.612 0.391 1.00 . A A . 5 ILE HD12 1 1 15 3997 1 1 5 ILE HD13 H 15.855 9.787 0.684 1.00 . A A . 5 ILE HD13 1 1 15 3998 1 1 5 ILE HG12 H 15.857 8.819 -1.369 1.00 . A A . 5 ILE HG12 1 1 15 3999 1 1 5 ILE HG13 H 14.666 10.048 -1.786 1.00 . A A . 5 ILE HG13 1 1 15 4000 1 1 5 ILE HG21 H 11.727 7.870 -0.982 1.00 . A A . 5 ILE HG21 1 1 15 4001 1 1 5 ILE HG22 H 12.326 9.505 -0.705 1.00 . A A . 5 ILE HG22 1 1 15 4002 1 1 5 ILE HG23 H 12.695 8.223 0.448 1.00 . A A . 5 ILE HG23 1 1 15 4003 1 1 5 ILE N N 14.936 6.031 -2.043 1.00 . A A . 5 ILE N 1 1 15 4004 1 1 5 ILE O O 13.294 5.841 1.014 1.00 . A A . 5 ILE O 1 1 15 4005 1 1 6 PRO C C 11.839 3.355 0.323 1.00 . A A . 6 PRO C 1 1 15 4006 1 1 6 PRO CA C 11.304 4.559 -0.423 1.00 . A A . 6 PRO CA 1 1 15 4007 1 1 6 PRO CB C 10.526 4.099 -1.656 1.00 . A A . 6 PRO CB 1 1 15 4008 1 1 6 PRO CD C 12.367 5.457 -2.433 1.00 . A A . 6 PRO CD 1 1 15 4009 1 1 6 PRO CG C 10.942 5.018 -2.757 1.00 . A A . 6 PRO CG 1 1 15 4010 1 1 6 PRO HA H 10.667 5.151 0.214 1.00 . A A . 6 PRO HA 1 1 15 4011 1 1 6 PRO HB2 H 10.782 3.072 -1.892 1.00 . A A . 6 PRO HB2 1 1 15 4012 1 1 6 PRO HB3 H 9.466 4.189 -1.484 1.00 . A A . 6 PRO HB3 1 1 15 4013 1 1 6 PRO HD2 H 13.086 4.782 -2.876 1.00 . A A . 6 PRO HD2 1 1 15 4014 1 1 6 PRO HD3 H 12.538 6.465 -2.762 1.00 . A A . 6 PRO HD3 1 1 15 4015 1 1 6 PRO HG2 H 10.915 4.498 -3.705 1.00 . A A . 6 PRO HG2 1 1 15 4016 1 1 6 PRO HG3 H 10.298 5.882 -2.784 1.00 . A A . 6 PRO HG3 1 1 15 4017 1 1 6 PRO N N 12.415 5.383 -0.970 1.00 . A A . 6 PRO N 1 1 15 4018 1 1 6 PRO O O 11.186 2.815 1.216 1.00 . A A . 6 PRO O 1 1 15 4019 1 1 7 DAL C C 15.028 1.466 0.019 1.00 . A A . 7 DAL C 1 1 15 4020 1 1 7 DAL CA C 13.634 1.770 0.551 1.00 . A A . 7 DAL CA 1 1 15 4021 1 1 7 DAL CB C 13.691 1.962 2.053 1.00 . A A . 7 DAL CB 1 1 15 4022 1 1 7 DAL H H 13.495 3.382 -0.788 1.00 . A A . 7 DAL H 1 1 15 4023 1 1 7 DAL HA H 13.013 0.927 0.347 1.00 . A A . 7 DAL HA 1 1 15 4024 1 1 7 DAL HB1 H 13.573 3.008 2.294 1.00 . A A . 7 DAL HB1 1 1 15 4025 1 1 7 DAL HB2 H 14.637 1.608 2.426 1.00 . A A . 7 DAL HB2 1 1 15 4026 1 1 7 DAL N N 13.033 2.925 -0.069 1.00 . A A . 7 DAL N 1 1 15 4027 1 1 7 DAL O O 15.591 0.433 0.345 1.00 . A A . 7 DAL O 1 1 15 4028 1 1 8 LEU C C 17.959 2.673 -0.355 1.00 . A A . 8 LEU C 1 1 15 4029 1 1 8 LEU CA C 16.929 2.075 -1.301 1.00 . A A . 8 LEU CA 1 1 15 4030 1 1 8 LEU CB C 17.096 2.652 -2.707 1.00 . A A . 8 LEU CB 1 1 15 4031 1 1 8 LEU CD1 C 16.195 2.436 -5.030 1.00 . A A . 8 LEU CD1 1 1 15 4032 1 1 8 LEU CD2 C 15.278 0.987 -3.214 1.00 . A A . 8 LEU CD2 1 1 15 4033 1 1 8 LEU CG C 15.840 2.375 -3.543 1.00 . A A . 8 LEU CG 1 1 15 4034 1 1 8 LEU H H 15.134 3.171 -1.034 1.00 . A A . 8 LEU H 1 1 15 4035 1 1 8 LEU HA H 17.072 1.001 -1.339 1.00 . A A . 8 LEU HA 1 1 15 4036 1 1 8 LEU HB2 H 17.258 3.716 -2.642 1.00 . A A . 8 LEU HB2 1 1 15 4037 1 1 8 LEU HB3 H 17.948 2.186 -3.181 1.00 . A A . 8 LEU HB3 1 1 15 4038 1 1 8 LEU HD11 H 15.779 3.333 -5.464 1.00 . A A . 8 LEU HD11 1 1 15 4039 1 1 8 LEU HD12 H 15.788 1.571 -5.534 1.00 . A A . 8 LEU HD12 1 1 15 4040 1 1 8 LEU HD13 H 17.268 2.445 -5.143 1.00 . A A . 8 LEU HD13 1 1 15 4041 1 1 8 LEU HD21 H 16.079 0.345 -2.879 1.00 . A A . 8 LEU HD21 1 1 15 4042 1 1 8 LEU HD22 H 14.821 0.563 -4.095 1.00 . A A . 8 LEU HD22 1 1 15 4043 1 1 8 LEU HD23 H 14.537 1.076 -2.432 1.00 . A A . 8 LEU HD23 1 1 15 4044 1 1 8 LEU HG H 15.094 3.126 -3.327 1.00 . A A . 8 LEU HG 1 1 15 4045 1 1 8 LEU N N 15.599 2.344 -0.789 1.00 . A A . 8 LEU N 1 1 15 4046 1 1 8 LEU O O 19.165 2.490 -0.525 1.00 . A A . 8 LEU O 1 1 15 4047 1 1 9 MET C C 18.272 3.141 2.924 1.00 . A A . 9 MET C 1 1 15 4048 1 1 9 MET CA C 18.318 3.981 1.658 1.00 . A A . 9 MET CA 1 1 15 4049 1 1 9 MET CB C 17.840 5.397 1.980 1.00 . A A . 9 MET CB 1 1 15 4050 1 1 9 MET CE C 16.018 7.175 3.858 1.00 . A A . 9 MET CE 1 1 15 4051 1 1 9 MET CG C 16.335 5.505 1.738 1.00 . A A . 9 MET CG 1 1 15 4052 1 1 9 MET H H 16.488 3.460 0.740 1.00 . A A . 9 MET H 1 1 15 4053 1 1 9 MET HA H 19.331 4.020 1.288 1.00 . A A . 9 MET HA 1 1 15 4054 1 1 9 MET HB2 H 18.054 5.619 3.012 1.00 . A A . 9 MET HB2 1 1 15 4055 1 1 9 MET HB3 H 18.354 6.099 1.349 1.00 . A A . 9 MET HB3 1 1 15 4056 1 1 9 MET HE1 H 16.822 7.844 4.132 1.00 . A A . 9 MET HE1 1 1 15 4057 1 1 9 MET HE2 H 16.259 6.174 4.176 1.00 . A A . 9 MET HE2 1 1 15 4058 1 1 9 MET HE3 H 15.100 7.491 4.335 1.00 . A A . 9 MET HE3 1 1 15 4059 1 1 9 MET HG2 H 16.115 5.248 0.713 1.00 . A A . 9 MET HG2 1 1 15 4060 1 1 9 MET HG3 H 15.813 4.831 2.400 1.00 . A A . 9 MET HG3 1 1 15 4061 1 1 9 MET N N 17.460 3.370 0.656 1.00 . A A . 9 MET N 1 1 15 4062 1 1 9 MET O O 19.276 2.972 3.617 1.00 . A A . 9 MET O 1 1 15 4063 1 1 9 MET SD S 15.799 7.204 2.061 1.00 . A A . 9 MET SD 1 1 15 4064 1 1 10 . C C 15.893 2.439 5.334 1.00 . A A . 10 DBB C 1 1 15 4065 1 1 10 . CA C 16.895 1.777 4.383 1.00 . A A . 10 DBB CA 1 1 15 4066 1 1 10 . CB C 16.422 0.362 3.967 1.00 . A A . 10 DBB CB 1 1 15 4067 1 1 10 . CG C 16.730 0.131 2.497 1.00 . A A . 10 DBB CG 1 1 15 4068 1 1 10 . H H 16.331 2.779 2.610 1.00 . A A . 10 DBB H 1 1 15 4069 1 1 10 . HA H 17.842 1.691 4.892 1.00 . A A . 10 DBB HA 1 1 15 4070 1 1 10 . HB2 H 16.938 -0.388 4.537 1.00 . A A . 10 DBB HB2 1 1 15 4071 1 1 10 . HG1 H 16.078 -0.637 2.110 1.00 . A A . 10 DBB HG1 1 1 15 4072 1 1 10 . HG2 H 17.757 -0.182 2.388 1.00 . A A . 10 DBB HG2 1 1 15 4073 1 1 10 . HG3 H 16.573 1.044 1.948 1.00 . A A . 10 DBB HG3 1 1 15 4074 1 1 10 . N N 17.088 2.611 3.208 1.00 . A A . 10 DBB N 1 1 15 4075 1 1 10 . O O 15.575 3.618 5.179 1.00 . A A . 10 DBB O 1 1 15 4076 1 1 11 GLY C C 13.117 2.562 6.686 1.00 . A A . 11 GLY C 1 1 15 4077 1 1 11 GLY CA C 14.481 2.252 7.302 1.00 . A A . 11 GLY CA 1 1 15 4078 1 1 11 GLY H H 15.717 0.768 6.421 1.00 . A A . 11 GLY H 1 1 15 4079 1 1 11 GLY HA2 H 14.351 1.545 8.106 1.00 . A A . 11 GLY HA2 1 1 15 4080 1 1 11 GLY HA3 H 14.897 3.164 7.698 1.00 . A A . 11 GLY HA3 1 1 15 4081 1 1 11 GLY N N 15.419 1.695 6.328 1.00 . A A . 11 GLY N 1 1 15 4082 1 1 11 GLY O O 12.492 3.570 7.016 1.00 . A A . 11 GLY O 1 1 15 4083 1 1 12 CYS C C 10.617 0.578 5.054 1.00 . A A . 12 CYS C 1 1 15 4084 1 1 12 CYS CA C 11.378 1.890 5.135 1.00 . A A . 12 CYS CA 1 1 15 4085 1 1 12 CYS CB C 11.611 2.373 3.715 1.00 . A A . 12 CYS CB 1 1 15 4086 1 1 12 CYS H H 13.195 0.922 5.561 1.00 . A A . 12 CYS H 1 1 15 4087 1 1 12 CYS HA H 10.795 2.621 5.671 1.00 . A A . 12 CYS HA 1 1 15 4088 1 1 12 CYS HB2 H 10.671 2.660 3.265 1.00 . A A . 12 CYS HB2 1 1 15 4089 1 1 12 CYS HB3 H 12.286 3.206 3.717 1.00 . A A . 12 CYS HB3 1 1 15 4090 1 1 12 CYS N N 12.660 1.698 5.791 1.00 . A A . 12 CYS N 1 1 15 4091 1 1 12 CYS O O 11.009 -0.424 5.651 1.00 . A A . 12 CYS O 1 1 15 4092 1 1 12 CYS SG S 12.343 1.014 2.783 1.00 . A A . 12 CYS SG 1 1 15 4093 1 1 13 GLY C C 8.671 -0.889 2.568 1.00 . A A . 13 GLY C 1 1 15 4094 1 1 13 GLY CA C 8.742 -0.598 4.057 1.00 . A A . 13 GLY CA 1 1 15 4095 1 1 13 GLY H H 9.313 1.419 3.802 1.00 . A A . 13 GLY H 1 1 15 4096 1 1 13 GLY HA2 H 9.194 -1.433 4.567 1.00 . A A . 13 GLY HA2 1 1 15 4097 1 1 13 GLY HA3 H 7.748 -0.436 4.433 1.00 . A A . 13 GLY HA3 1 1 15 4098 1 1 13 GLY N N 9.549 0.591 4.271 1.00 . A A . 13 GLY N 1 1 15 4099 1 1 13 GLY O O 7.979 -1.804 2.132 1.00 . A A . 13 GLY O 1 1 15 4100 1 1 14 TRP C C 8.915 -1.562 -0.113 1.00 . A A . 14 TRP C 1 1 15 4101 1 1 14 TRP CA C 9.445 -0.202 0.353 1.00 . A A . 14 TRP CA 1 1 15 4102 1 1 14 TRP CB C 10.886 0.018 -0.136 1.00 . A A . 14 TRP CB 1 1 15 4103 1 1 14 TRP CD1 C 11.552 -1.682 1.618 1.00 . A A . 14 TRP CD1 1 1 15 4104 1 1 14 TRP CD2 C 13.172 -1.346 0.098 1.00 . A A . 14 TRP CD2 1 1 15 4105 1 1 14 TRP CE2 C 13.669 -2.311 1.001 1.00 . A A . 14 TRP CE2 1 1 15 4106 1 1 14 TRP CE3 C 14.000 -0.951 -0.964 1.00 . A A . 14 TRP CE3 1 1 15 4107 1 1 14 TRP CG C 11.824 -0.964 0.511 1.00 . A A . 14 TRP CG 1 1 15 4108 1 1 14 TRP CH2 C 15.753 -2.456 -0.218 1.00 . A A . 14 TRP CH2 1 1 15 4109 1 1 14 TRP CZ2 C 14.945 -2.862 0.849 1.00 . A A . 14 TRP CZ2 1 1 15 4110 1 1 14 TRP CZ3 C 15.281 -1.501 -1.121 1.00 . A A . 14 TRP CZ3 1 1 15 4111 1 1 14 TRP H H 9.920 0.634 2.234 1.00 . A A . 14 TRP H 1 1 15 4112 1 1 14 TRP HA H 8.821 0.569 -0.073 1.00 . A A . 14 TRP HA 1 1 15 4113 1 1 14 TRP HB2 H 10.921 -0.106 -1.206 1.00 . A A . 14 TRP HB2 1 1 15 4114 1 1 14 TRP HB3 H 11.193 1.024 0.114 1.00 . A A . 14 TRP HB3 1 1 15 4115 1 1 14 TRP HD1 H 10.634 -1.636 2.176 1.00 . A A . 14 TRP HD1 1 1 15 4116 1 1 14 TRP HE1 H 12.703 -3.105 2.669 1.00 . A A . 14 TRP HE1 1 1 15 4117 1 1 14 TRP HE3 H 13.656 -0.208 -1.650 1.00 . A A . 14 TRP HE3 1 1 15 4118 1 1 14 TRP HH2 H 16.741 -2.874 -0.344 1.00 . A A . 14 TRP HH2 1 1 15 4119 1 1 14 TRP HZ2 H 15.309 -3.594 1.548 1.00 . A A . 14 TRP HZ2 1 1 15 4120 1 1 14 TRP HZ3 H 15.903 -1.187 -1.947 1.00 . A A . 14 TRP HZ3 1 1 15 4121 1 1 14 TRP N N 9.400 -0.078 1.804 1.00 . A A . 14 TRP N 1 1 15 4122 1 1 14 TRP NE1 N 12.644 -2.486 1.913 1.00 . A A . 14 TRP NE1 1 1 15 4123 1 1 14 TRP O O 7.715 -1.829 -0.033 1.00 . A A . 14 TRP O 1 1 15 4124 1 1 15 LEU C C 9.744 -4.777 -0.044 1.00 . A A . 15 LEU C 1 1 15 4125 1 1 15 LEU CA C 9.406 -3.721 -1.091 1.00 . A A . 15 LEU CA 1 1 15 4126 1 1 15 LEU CB C 10.146 -4.030 -2.394 1.00 . A A . 15 LEU CB 1 1 15 4127 1 1 15 LEU CD1 C 12.422 -3.971 -3.418 1.00 . A A . 15 LEU CD1 1 1 15 4128 1 1 15 LEU CD2 C 11.319 -1.832 -2.734 1.00 . A A . 15 LEU CD2 1 1 15 4129 1 1 15 LEU CG C 11.503 -3.317 -2.388 1.00 . A A . 15 LEU CG 1 1 15 4130 1 1 15 LEU H H 10.737 -2.153 -0.670 1.00 . A A . 15 LEU H 1 1 15 4131 1 1 15 LEU HA H 8.342 -3.728 -1.277 1.00 . A A . 15 LEU HA 1 1 15 4132 1 1 15 LEU HB2 H 10.297 -5.096 -2.478 1.00 . A A . 15 LEU HB2 1 1 15 4133 1 1 15 LEU HB3 H 9.562 -3.679 -3.231 1.00 . A A . 15 LEU HB3 1 1 15 4134 1 1 15 LEU HD11 H 13.423 -4.035 -3.020 1.00 . A A . 15 LEU HD11 1 1 15 4135 1 1 15 LEU HD12 H 12.429 -3.380 -4.322 1.00 . A A . 15 LEU HD12 1 1 15 4136 1 1 15 LEU HD13 H 12.059 -4.965 -3.643 1.00 . A A . 15 LEU HD13 1 1 15 4137 1 1 15 LEU HD21 H 12.017 -1.238 -2.159 1.00 . A A . 15 LEU HD21 1 1 15 4138 1 1 15 LEU HD22 H 10.309 -1.525 -2.498 1.00 . A A . 15 LEU HD22 1 1 15 4139 1 1 15 LEU HD23 H 11.503 -1.678 -3.787 1.00 . A A . 15 LEU HD23 1 1 15 4140 1 1 15 LEU HG H 11.949 -3.406 -1.407 1.00 . A A . 15 LEU HG 1 1 15 4141 1 1 15 LEU N N 9.802 -2.411 -0.611 1.00 . A A . 15 LEU N 1 1 15 4142 1 1 15 LEU O O 9.100 -5.822 0.032 1.00 . A A . 15 LEU O 1 1 15 4143 1 1 16 . C C 10.278 -5.224 2.977 1.00 . A A . 16 DBU C 1 1 15 4144 1 1 16 . CA C 11.213 -5.326 1.797 1.00 . A A . 16 DBU CA 1 1 15 4145 1 1 16 . CB C 12.338 -6.163 1.824 1.00 . A A . 16 DBU CB 1 1 15 4146 1 1 16 . CG C 13.334 -6.339 0.703 1.00 . A A . 16 DBU CG 1 1 15 4147 1 1 16 . H H 11.234 -3.633 0.665 1.00 . A A . 16 DBU H 1 1 15 4148 1 1 16 . HB H 12.529 -6.742 2.716 1.00 . A A . 16 DBU HB 1 1 15 4149 1 1 16 . HG1 H 14.315 -6.047 1.048 1.00 . A A . 16 DBU HG1 1 1 15 4150 1 1 16 . HG2 H 13.048 -5.722 -0.136 1.00 . A A . 16 DBU HG2 1 1 15 4151 1 1 16 . HG3 H 13.353 -7.375 0.399 1.00 . A A . 16 DBU HG3 1 1 15 4152 1 1 16 . N N 10.758 -4.483 0.765 1.00 . A A . 16 DBU N 1 1 15 4153 1 1 16 . O O 9.652 -6.209 3.369 1.00 . A A . 16 DBU O 1 1 15 4154 1 1 17 GLY C C 10.077 -3.273 5.888 1.00 . A A . 17 GLY C 1 1 15 4155 1 1 17 GLY CA C 9.298 -3.827 4.703 1.00 . A A . 17 GLY CA 1 1 15 4156 1 1 17 GLY H H 10.699 -3.271 3.206 1.00 . A A . 17 GLY H 1 1 15 4157 1 1 17 GLY HA2 H 8.514 -3.136 4.433 1.00 . A A . 17 GLY HA2 1 1 15 4158 1 1 17 GLY HA3 H 8.857 -4.773 4.982 1.00 . A A . 17 GLY HA3 1 1 15 4159 1 1 17 GLY N N 10.175 -4.030 3.555 1.00 . A A . 17 GLY N 1 1 15 4160 1 1 17 GLY O O 9.821 -2.163 6.352 1.00 . A A . 17 GLY O 1 1 15 4161 1 1 18 LEU C C 13.142 -2.986 6.984 1.00 . A A . 18 LEU C 1 1 15 4162 1 1 18 LEU CA C 11.857 -3.628 7.494 1.00 . A A . 18 LEU CA 1 1 15 4163 1 1 18 LEU CB C 12.191 -4.829 8.383 1.00 . A A . 18 LEU CB 1 1 15 4164 1 1 18 LEU CD1 C 12.247 -3.282 10.342 1.00 . A A . 18 LEU CD1 1 1 15 4165 1 1 18 LEU CD2 C 13.272 -5.553 10.512 1.00 . A A . 18 LEU CD2 1 1 15 4166 1 1 18 LEU CG C 13.017 -4.365 9.583 1.00 . A A . 18 LEU CG 1 1 15 4167 1 1 18 LEU H H 11.198 -4.928 5.959 1.00 . A A . 18 LEU H 1 1 15 4168 1 1 18 LEU HA H 11.309 -2.903 8.078 1.00 . A A . 18 LEU HA 1 1 15 4169 1 1 18 LEU HB2 H 11.275 -5.285 8.730 1.00 . A A . 18 LEU HB2 1 1 15 4170 1 1 18 LEU HB3 H 12.760 -5.549 7.814 1.00 . A A . 18 LEU HB3 1 1 15 4171 1 1 18 LEU HD11 H 12.726 -3.100 11.293 1.00 . A A . 18 LEU HD11 1 1 15 4172 1 1 18 LEU HD12 H 11.231 -3.609 10.506 1.00 . A A . 18 LEU HD12 1 1 15 4173 1 1 18 LEU HD13 H 12.243 -2.371 9.762 1.00 . A A . 18 LEU HD13 1 1 15 4174 1 1 18 LEU HD21 H 13.105 -5.252 11.535 1.00 . A A . 18 LEU HD21 1 1 15 4175 1 1 18 LEU HD22 H 14.291 -5.887 10.396 1.00 . A A . 18 LEU HD22 1 1 15 4176 1 1 18 LEU HD23 H 12.598 -6.358 10.259 1.00 . A A . 18 LEU HD23 1 1 15 4177 1 1 18 LEU HG H 13.958 -3.964 9.239 1.00 . A A . 18 LEU HG 1 1 15 4178 1 1 18 LEU N N 11.035 -4.054 6.371 1.00 . A A . 18 LEU N 1 1 15 4179 1 1 18 LEU O O 13.964 -2.503 7.763 1.00 . A A . 18 LEU O 1 1 15 4180 1 1 19 CYS C C 15.697 -3.320 5.265 1.00 . A A . 19 CYS C 1 1 15 4181 1 1 19 CYS CA C 14.488 -2.420 5.038 1.00 . A A . 19 CYS CA 1 1 15 4182 1 1 19 CYS CB C 14.763 -1.027 5.600 1.00 . A A . 19 CYS CB 1 1 15 4183 1 1 19 CYS H H 12.612 -3.400 5.101 1.00 . A A . 19 CYS H 1 1 15 4184 1 1 19 CYS HA H 14.314 -2.338 3.976 1.00 . A A . 19 CYS HA 1 1 15 4185 1 1 19 CYS HB2 H 14.032 -0.793 6.361 1.00 . A A . 19 CYS HB2 1 1 15 4186 1 1 19 CYS HB3 H 15.752 -1.001 6.031 1.00 . A A . 19 CYS HB3 1 1 15 4187 1 1 19 CYS N N 13.304 -2.995 5.664 1.00 . A A . 19 CYS N 1 1 15 4188 1 1 19 CYS O O 16.625 -2.962 5.990 1.00 . A A . 19 CYS O 1 1 15 4189 1 1 19 CYS SG S 14.655 0.189 4.263 1.00 . A A . 19 CYS SG 1 1 15 4190 1 1 20 VAL C C 18.050 -4.870 4.205 1.00 . A A . 20 VAL C 1 1 15 4191 1 1 20 VAL CA C 16.759 -5.447 4.779 1.00 . A A . 20 VAL CA 1 1 15 4192 1 1 20 VAL CB C 16.400 -6.741 4.044 1.00 . A A . 20 VAL CB 1 1 15 4193 1 1 20 VAL CG1 C 17.378 -7.845 4.445 1.00 . A A . 20 VAL CG1 1 1 15 4194 1 1 20 VAL CG2 C 14.974 -7.155 4.417 1.00 . A A . 20 VAL CG2 1 1 15 4195 1 1 20 VAL H H 14.899 -4.718 4.082 1.00 . A A . 20 VAL H 1 1 15 4196 1 1 20 VAL HA H 16.904 -5.669 5.824 1.00 . A A . 20 VAL HA 1 1 15 4197 1 1 20 VAL HB H 16.461 -6.576 2.977 1.00 . A A . 20 VAL HB 1 1 15 4198 1 1 20 VAL HG11 H 16.851 -8.785 4.511 1.00 . A A . 20 VAL HG11 1 1 15 4199 1 1 20 VAL HG12 H 17.814 -7.608 5.404 1.00 . A A . 20 VAL HG12 1 1 15 4200 1 1 20 VAL HG13 H 18.160 -7.920 3.704 1.00 . A A . 20 VAL HG13 1 1 15 4201 1 1 20 VAL HG21 H 14.693 -8.028 3.847 1.00 . A A . 20 VAL HG21 1 1 15 4202 1 1 20 VAL HG22 H 14.292 -6.346 4.195 1.00 . A A . 20 VAL HG22 1 1 15 4203 1 1 20 VAL HG23 H 14.930 -7.382 5.471 1.00 . A A . 20 VAL HG23 1 1 15 4204 1 1 20 VAL N N 15.669 -4.491 4.643 1.00 . A A . 20 VAL N 1 1 15 4205 1 1 20 VAL O O 19.116 -4.987 4.812 1.00 . A A . 20 VAL O 1 1 15 4206 1 1 21 ARG C C 19.638 -2.483 3.208 1.00 . A A . 21 ARG C 1 1 15 4207 1 1 21 ARG CA C 19.112 -3.656 2.390 1.00 . A A . 21 ARG CA 1 1 15 4208 1 1 21 ARG CB C 18.742 -3.178 0.984 1.00 . A A . 21 ARG CB 1 1 15 4209 1 1 21 ARG CD C 19.615 -2.127 -1.110 1.00 . A A . 21 ARG CD 1 1 15 4210 1 1 21 ARG CG C 19.990 -2.638 0.284 1.00 . A A . 21 ARG CG 1 1 15 4211 1 1 21 ARG CZ C 18.827 -3.036 -3.219 1.00 . A A . 21 ARG CZ 1 1 15 4212 1 1 21 ARG H H 17.071 -4.187 2.600 1.00 . A A . 21 ARG H 1 1 15 4213 1 1 21 ARG HA H 19.887 -4.404 2.310 1.00 . A A . 21 ARG HA 1 1 15 4214 1 1 21 ARG HB2 H 18.338 -4.004 0.417 1.00 . A A . 21 ARG HB2 1 1 15 4215 1 1 21 ARG HB3 H 18.004 -2.392 1.053 1.00 . A A . 21 ARG HB3 1 1 15 4216 1 1 21 ARG HD2 H 18.798 -1.427 -1.024 1.00 . A A . 21 ARG HD2 1 1 15 4217 1 1 21 ARG HD3 H 20.468 -1.628 -1.547 1.00 . A A . 21 ARG HD3 1 1 15 4218 1 1 21 ARG HE H 19.217 -4.150 -1.602 1.00 . A A . 21 ARG HE 1 1 15 4219 1 1 21 ARG HG2 H 20.407 -1.829 0.865 1.00 . A A . 21 ARG HG2 1 1 15 4220 1 1 21 ARG HG3 H 20.721 -3.428 0.191 1.00 . A A . 21 ARG HG3 1 1 15 4221 1 1 21 ARG HH11 H 19.088 -1.052 -3.140 1.00 . A A . 21 ARG HH11 1 1 15 4222 1 1 21 ARG HH12 H 18.526 -1.674 -4.656 1.00 . A A . 21 ARG HH12 1 1 15 4223 1 1 21 ARG HH21 H 18.478 -4.973 -3.587 1.00 . A A . 21 ARG HH21 1 1 15 4224 1 1 21 ARG HH22 H 18.179 -3.893 -4.907 1.00 . A A . 21 ARG HH22 1 1 15 4225 1 1 21 ARG N N 17.946 -4.249 3.036 1.00 . A A . 21 ARG N 1 1 15 4226 1 1 21 ARG NE N 19.210 -3.238 -1.961 1.00 . A A . 21 ARG NE 1 1 15 4227 1 1 21 ARG NH1 N 18.812 -1.826 -3.710 1.00 . A A . 21 ARG NH1 1 1 15 4228 1 1 21 ARG NH2 N 18.467 -4.046 -3.962 1.00 . A A . 21 ARG NH2 1 1 15 4229 1 1 21 ARG O O 18.870 -1.568 3.457 1.00 . A A . 21 ARG O 1 1 15 4230 1 1 21 ARG OXT O 20.803 -2.514 3.572 1.00 . A A . 21 ARG OXT 1 1 16 4231 1 1 1 ALA C C 23.407 3.134 -2.376 1.00 . A A . 1 ALA C 1 1 16 4232 1 1 1 ALA CA C 23.148 1.647 -2.154 1.00 . A A . 1 ALA CA 1 1 16 4233 1 1 1 ALA CB C 24.039 0.821 -3.084 1.00 . A A . 1 ALA CB 1 1 16 4234 1 1 1 ALA H1 H 21.331 0.747 -1.680 1.00 . A A . 1 ALA H1 1 1 16 4235 1 1 1 ALA H2 H 21.646 0.841 -3.348 1.00 . A A . 1 ALA H2 1 1 16 4236 1 1 1 ALA H3 H 21.178 2.230 -2.489 1.00 . A A . 1 ALA H3 1 1 16 4237 1 1 1 ALA HA H 23.371 1.395 -1.127 1.00 . A A . 1 ALA HA 1 1 16 4238 1 1 1 ALA HB1 H 23.671 -0.195 -3.127 1.00 . A A . 1 ALA HB1 1 1 16 4239 1 1 1 ALA HB2 H 25.051 0.821 -2.709 1.00 . A A . 1 ALA HB2 1 1 16 4240 1 1 1 ALA HB3 H 24.022 1.251 -4.075 1.00 . A A . 1 ALA HB3 1 1 16 4241 1 1 1 ALA N N 21.719 1.344 -2.440 1.00 . A A . 1 ALA N 1 1 16 4242 1 1 1 ALA O O 24.059 3.789 -1.562 1.00 . A A . 1 ALA O 1 1 16 4243 1 1 2 GLY C C 22.416 5.956 -2.756 1.00 . A A . 2 GLY C 1 1 16 4244 1 1 2 GLY CA C 23.075 5.070 -3.804 1.00 . A A . 2 GLY CA 1 1 16 4245 1 1 2 GLY H H 22.382 3.088 -4.095 1.00 . A A . 2 GLY H 1 1 16 4246 1 1 2 GLY HA2 H 24.133 5.291 -3.843 1.00 . A A . 2 GLY HA2 1 1 16 4247 1 1 2 GLY HA3 H 22.633 5.275 -4.768 1.00 . A A . 2 GLY HA3 1 1 16 4248 1 1 2 GLY N N 22.893 3.660 -3.483 1.00 . A A . 2 GLY N 1 1 16 4249 1 1 2 GLY O O 22.934 7.017 -2.411 1.00 . A A . 2 GLY O 1 1 16 4250 1 1 3 GLY C C 19.219 6.776 -1.796 1.00 . A A . 3 GLY C 1 1 16 4251 1 1 3 GLY CA C 20.548 6.278 -1.246 1.00 . A A . 3 GLY CA 1 1 16 4252 1 1 3 GLY H H 20.903 4.662 -2.567 1.00 . A A . 3 GLY H 1 1 16 4253 1 1 3 GLY HA2 H 20.365 5.648 -0.388 1.00 . A A . 3 GLY HA2 1 1 16 4254 1 1 3 GLY HA3 H 21.145 7.125 -0.945 1.00 . A A . 3 GLY HA3 1 1 16 4255 1 1 3 GLY N N 21.269 5.514 -2.253 1.00 . A A . 3 GLY N 1 1 16 4256 1 1 3 GLY O O 19.114 7.911 -2.263 1.00 . A A . 3 GLY O 1 1 16 4257 1 1 4 . C C 16.108 6.966 -1.182 1.00 . A A . 4 DBU C 1 1 16 4258 1 1 4 . CA C 16.937 6.273 -2.222 1.00 . A A . 4 DBU CA 1 1 16 4259 1 1 4 . CB C 16.357 6.085 -3.469 1.00 . A A . 4 DBU CB 1 1 16 4260 1 1 4 . CG C 17.059 5.413 -4.618 1.00 . A A . 4 DBU CG 1 1 16 4261 1 1 4 . H H 18.339 5.026 -1.359 1.00 . A A . 4 DBU H 1 1 16 4262 1 1 4 . HB H 15.351 6.459 -3.564 1.00 . A A . 4 DBU HB 1 1 16 4263 1 1 4 . HG1 H 17.442 4.461 -4.285 1.00 . A A . 4 DBU HG1 1 1 16 4264 1 1 4 . HG2 H 17.878 6.039 -4.937 1.00 . A A . 4 DBU HG2 1 1 16 4265 1 1 4 . HG3 H 16.377 5.264 -5.439 1.00 . A A . 4 DBU HG3 1 1 16 4266 1 1 4 . N N 18.208 5.920 -1.739 1.00 . A A . 4 DBU N 1 1 16 4267 1 1 4 . O O 16.536 7.951 -0.589 1.00 . A A . 4 DBU O 1 1 16 4268 1 1 5 ILE C C 12.931 6.027 0.457 1.00 . A A . 5 ILE C 1 1 16 4269 1 1 5 ILE CA C 14.021 7.016 0.048 1.00 . A A . 5 ILE CA 1 1 16 4270 1 1 5 ILE CB C 13.340 8.290 -0.471 1.00 . A A . 5 ILE CB 1 1 16 4271 1 1 5 ILE CD1 C 15.164 9.860 0.225 1.00 . A A . 5 ILE CD1 1 1 16 4272 1 1 5 ILE CG1 C 14.373 9.310 -0.965 1.00 . A A . 5 ILE CG1 1 1 16 4273 1 1 5 ILE CG2 C 12.542 8.915 0.673 1.00 . A A . 5 ILE CG2 1 1 16 4274 1 1 5 ILE H H 14.636 5.648 -1.446 1.00 . A A . 5 ILE H 1 1 16 4275 1 1 5 ILE HA H 14.602 7.266 0.918 1.00 . A A . 5 ILE HA 1 1 16 4276 1 1 5 ILE HB H 12.668 8.031 -1.278 1.00 . A A . 5 ILE HB 1 1 16 4277 1 1 5 ILE HD11 H 15.018 9.220 1.082 1.00 . A A . 5 ILE HD11 1 1 16 4278 1 1 5 ILE HD12 H 14.817 10.859 0.459 1.00 . A A . 5 ILE HD12 1 1 16 4279 1 1 5 ILE HD13 H 16.214 9.895 -0.025 1.00 . A A . 5 ILE HD13 1 1 16 4280 1 1 5 ILE HG12 H 15.045 8.841 -1.665 1.00 . A A . 5 ILE HG12 1 1 16 4281 1 1 5 ILE HG13 H 13.859 10.125 -1.455 1.00 . A A . 5 ILE HG13 1 1 16 4282 1 1 5 ILE HG21 H 13.089 8.789 1.598 1.00 . A A . 5 ILE HG21 1 1 16 4283 1 1 5 ILE HG22 H 11.584 8.426 0.753 1.00 . A A . 5 ILE HG22 1 1 16 4284 1 1 5 ILE HG23 H 12.399 9.966 0.479 1.00 . A A . 5 ILE HG23 1 1 16 4285 1 1 5 ILE N N 14.914 6.441 -0.949 1.00 . A A . 5 ILE N 1 1 16 4286 1 1 5 ILE O O 12.645 5.872 1.643 1.00 . A A . 5 ILE O 1 1 16 4287 1 1 6 PRO C C 11.712 3.164 0.470 1.00 . A A . 6 PRO C 1 1 16 4288 1 1 6 PRO CA C 11.207 4.414 -0.210 1.00 . A A . 6 PRO CA 1 1 16 4289 1 1 6 PRO CB C 10.605 4.091 -1.585 1.00 . A A . 6 PRO CB 1 1 16 4290 1 1 6 PRO CD C 12.560 5.452 -1.932 1.00 . A A . 6 PRO CD 1 1 16 4291 1 1 6 PRO CG C 11.217 5.065 -2.535 1.00 . A A . 6 PRO CG 1 1 16 4292 1 1 6 PRO HA H 10.460 4.886 0.404 1.00 . A A . 6 PRO HA 1 1 16 4293 1 1 6 PRO HB2 H 10.853 3.077 -1.872 1.00 . A A . 6 PRO HB2 1 1 16 4294 1 1 6 PRO HB3 H 9.534 4.220 -1.563 1.00 . A A . 6 PRO HB3 1 1 16 4295 1 1 6 PRO HD2 H 13.320 4.740 -2.225 1.00 . A A . 6 PRO HD2 1 1 16 4296 1 1 6 PRO HD3 H 12.834 6.441 -2.216 1.00 . A A . 6 PRO HD3 1 1 16 4297 1 1 6 PRO HG2 H 11.357 4.602 -3.502 1.00 . A A . 6 PRO HG2 1 1 16 4298 1 1 6 PRO HG3 H 10.593 5.942 -2.624 1.00 . A A . 6 PRO HG3 1 1 16 4299 1 1 6 PRO N N 12.302 5.375 -0.491 1.00 . A A . 6 PRO N 1 1 16 4300 1 1 6 PRO O O 10.929 2.387 0.998 1.00 . A A . 6 PRO O 1 1 16 4301 1 1 7 DAL C C 15.033 1.556 0.501 1.00 . A A . 7 DAL C 1 1 16 4302 1 1 7 DAL CA C 13.626 1.793 1.042 1.00 . A A . 7 DAL CA 1 1 16 4303 1 1 7 DAL CB C 13.699 1.963 2.560 1.00 . A A . 7 DAL CB 1 1 16 4304 1 1 7 DAL H H 13.597 3.623 -0.019 1.00 . A A . 7 DAL H 1 1 16 4305 1 1 7 DAL HA H 13.014 0.934 0.820 1.00 . A A . 7 DAL HA 1 1 16 4306 1 1 7 DAL HB1 H 14.731 1.976 2.860 1.00 . A A . 7 DAL HB1 1 1 16 4307 1 1 7 DAL HB2 H 13.196 1.134 3.036 1.00 . A A . 7 DAL HB2 1 1 16 4308 1 1 7 DAL N N 13.025 2.968 0.433 1.00 . A A . 7 DAL N 1 1 16 4309 1 1 7 DAL O O 15.800 0.775 1.058 1.00 . A A . 7 DAL O 1 1 16 4310 1 1 8 LEU C C 17.731 2.570 -0.105 1.00 . A A . 8 LEU C 1 1 16 4311 1 1 8 LEU CA C 16.715 2.073 -1.128 1.00 . A A . 8 LEU CA 1 1 16 4312 1 1 8 LEU CB C 16.831 2.837 -2.453 1.00 . A A . 8 LEU CB 1 1 16 4313 1 1 8 LEU CD1 C 15.986 2.722 -4.814 1.00 . A A . 8 LEU CD1 1 1 16 4314 1 1 8 LEU CD2 C 15.197 1.044 -3.152 1.00 . A A . 8 LEU CD2 1 1 16 4315 1 1 8 LEU CG C 15.622 2.504 -3.346 1.00 . A A . 8 LEU CG 1 1 16 4316 1 1 8 LEU H H 14.754 2.859 -0.994 1.00 . A A . 8 LEU H 1 1 16 4317 1 1 8 LEU HA H 16.893 1.019 -1.309 1.00 . A A . 8 LEU HA 1 1 16 4318 1 1 8 LEU HB2 H 16.851 3.898 -2.257 1.00 . A A . 8 LEU HB2 1 1 16 4319 1 1 8 LEU HB3 H 17.740 2.547 -2.960 1.00 . A A . 8 LEU HB3 1 1 16 4320 1 1 8 LEU HD11 H 15.546 3.644 -5.162 1.00 . A A . 8 LEU HD11 1 1 16 4321 1 1 8 LEU HD12 H 15.607 1.900 -5.402 1.00 . A A . 8 LEU HD12 1 1 16 4322 1 1 8 LEU HD13 H 17.059 2.773 -4.916 1.00 . A A . 8 LEU HD13 1 1 16 4323 1 1 8 LEU HD21 H 14.505 0.981 -2.328 1.00 . A A . 8 LEU HD21 1 1 16 4324 1 1 8 LEU HD22 H 16.066 0.439 -2.941 1.00 . A A . 8 LEU HD22 1 1 16 4325 1 1 8 LEU HD23 H 14.718 0.685 -4.052 1.00 . A A . 8 LEU HD23 1 1 16 4326 1 1 8 LEU HG H 14.802 3.156 -3.083 1.00 . A A . 8 LEU HG 1 1 16 4327 1 1 8 LEU N N 15.385 2.236 -0.575 1.00 . A A . 8 LEU N 1 1 16 4328 1 1 8 LEU O O 18.841 2.048 -0.001 1.00 . A A . 8 LEU O 1 1 16 4329 1 1 9 MET C C 18.448 3.096 2.787 1.00 . A A . 9 MET C 1 1 16 4330 1 1 9 MET CA C 18.163 4.141 1.705 1.00 . A A . 9 MET CA 1 1 16 4331 1 1 9 MET CB C 17.454 5.342 2.336 1.00 . A A . 9 MET CB 1 1 16 4332 1 1 9 MET CE C 15.502 7.634 3.059 1.00 . A A . 9 MET CE 1 1 16 4333 1 1 9 MET CG C 17.026 6.312 1.243 1.00 . A A . 9 MET CG 1 1 16 4334 1 1 9 MET H H 16.416 3.932 0.537 1.00 . A A . 9 MET H 1 1 16 4335 1 1 9 MET HA H 19.096 4.468 1.272 1.00 . A A . 9 MET HA 1 1 16 4336 1 1 9 MET HB2 H 16.576 5.002 2.863 1.00 . A A . 9 MET HB2 1 1 16 4337 1 1 9 MET HB3 H 18.118 5.843 3.022 1.00 . A A . 9 MET HB3 1 1 16 4338 1 1 9 MET HE1 H 15.749 7.996 4.048 1.00 . A A . 9 MET HE1 1 1 16 4339 1 1 9 MET HE2 H 15.328 6.572 3.102 1.00 . A A . 9 MET HE2 1 1 16 4340 1 1 9 MET HE3 H 14.609 8.129 2.700 1.00 . A A . 9 MET HE3 1 1 16 4341 1 1 9 MET HG2 H 17.756 6.310 0.447 1.00 . A A . 9 MET HG2 1 1 16 4342 1 1 9 MET HG3 H 16.066 5.999 0.851 1.00 . A A . 9 MET HG3 1 1 16 4343 1 1 9 MET N N 17.317 3.574 0.663 1.00 . A A . 9 MET N 1 1 16 4344 1 1 9 MET O O 19.573 2.983 3.273 1.00 . A A . 9 MET O 1 1 16 4345 1 1 9 MET SD S 16.875 7.978 1.934 1.00 . A A . 9 MET SD 1 1 16 4346 1 1 10 . C C 16.739 1.620 5.413 1.00 . A A . 10 DBB C 1 1 16 4347 1 1 10 . CA C 17.568 1.298 4.184 1.00 . A A . 10 DBB CA 1 1 16 4348 1 1 10 . CB C 17.132 -0.059 3.627 1.00 . A A . 10 DBB CB 1 1 16 4349 1 1 10 . CG C 15.598 -0.182 3.667 1.00 . A A . 10 DBB CG 1 1 16 4350 1 1 10 . H H 16.543 2.467 2.739 1.00 . A A . 10 DBB H 1 1 16 4351 1 1 10 . HA H 18.606 1.238 4.470 1.00 . A A . 10 DBB HA 1 1 16 4352 1 1 10 . HB2 H 17.437 -0.119 2.601 1.00 . A A . 10 DBB HB2 1 1 16 4353 1 1 10 . HG1 H 15.325 -1.219 3.768 1.00 . A A . 10 DBB HG1 1 1 16 4354 1 1 10 . HG2 H 15.178 0.204 2.756 1.00 . A A . 10 DBB HG2 1 1 16 4355 1 1 10 . HG3 H 15.204 0.369 4.499 1.00 . A A . 10 DBB HG3 1 1 16 4356 1 1 10 . N N 17.418 2.332 3.159 1.00 . A A . 10 DBB N 1 1 16 4357 1 1 10 . O O 17.092 1.245 6.531 1.00 . A A . 10 DBB O 1 1 16 4358 1 1 11 GLY C C 13.380 3.075 5.772 1.00 . A A . 11 GLY C 1 1 16 4359 1 1 11 GLY CA C 14.757 2.664 6.288 1.00 . A A . 11 GLY CA 1 1 16 4360 1 1 11 GLY H H 15.404 2.575 4.288 1.00 . A A . 11 GLY H 1 1 16 4361 1 1 11 GLY HA2 H 14.654 1.816 6.951 1.00 . A A . 11 GLY HA2 1 1 16 4362 1 1 11 GLY HA3 H 15.199 3.478 6.819 1.00 . A A . 11 GLY HA3 1 1 16 4363 1 1 11 GLY N N 15.634 2.306 5.197 1.00 . A A . 11 GLY N 1 1 16 4364 1 1 11 GLY O O 13.061 4.263 5.707 1.00 . A A . 11 GLY O 1 1 16 4365 1 1 12 CYS C C 10.345 1.119 4.952 1.00 . A A . 12 CYS C 1 1 16 4366 1 1 12 CYS CA C 11.229 2.358 4.889 1.00 . A A . 12 CYS CA 1 1 16 4367 1 1 12 CYS CB C 11.297 2.789 3.433 1.00 . A A . 12 CYS CB 1 1 16 4368 1 1 12 CYS H H 12.882 1.156 5.474 1.00 . A A . 12 CYS H 1 1 16 4369 1 1 12 CYS HA H 10.779 3.148 5.468 1.00 . A A . 12 CYS HA 1 1 16 4370 1 1 12 CYS HB2 H 11.151 1.919 2.821 1.00 . A A . 12 CYS HB2 1 1 16 4371 1 1 12 CYS HB3 H 10.520 3.507 3.226 1.00 . A A . 12 CYS HB3 1 1 16 4372 1 1 12 CYS N N 12.571 2.085 5.402 1.00 . A A . 12 CYS N 1 1 16 4373 1 1 12 CYS O O 10.566 0.212 5.750 1.00 . A A . 12 CYS O 1 1 16 4374 1 1 12 CYS SG S 12.909 3.510 3.059 1.00 . A A . 12 CYS SG 1 1 16 4375 1 1 13 GLY C C 8.237 -0.437 2.522 1.00 . A A . 13 GLY C 1 1 16 4376 1 1 13 GLY CA C 8.411 -0.012 3.974 1.00 . A A . 13 GLY CA 1 1 16 4377 1 1 13 GLY H H 9.241 1.860 3.455 1.00 . A A . 13 GLY H 1 1 16 4378 1 1 13 GLY HA2 H 8.785 -0.841 4.549 1.00 . A A . 13 GLY HA2 1 1 16 4379 1 1 13 GLY HA3 H 7.457 0.292 4.362 1.00 . A A . 13 GLY HA3 1 1 16 4380 1 1 13 GLY N N 9.345 1.102 4.069 1.00 . A A . 13 GLY N 1 1 16 4381 1 1 13 GLY O O 7.249 -1.073 2.163 1.00 . A A . 13 GLY O 1 1 16 4382 1 1 14 TRP C C 8.778 -1.861 0.063 1.00 . A A . 14 TRP C 1 1 16 4383 1 1 14 TRP CA C 9.166 -0.395 0.279 1.00 . A A . 14 TRP CA 1 1 16 4384 1 1 14 TRP CB C 10.534 -0.102 -0.354 1.00 . A A . 14 TRP CB 1 1 16 4385 1 1 14 TRP CD1 C 11.493 -1.424 1.584 1.00 . A A . 14 TRP CD1 1 1 16 4386 1 1 14 TRP CD2 C 12.959 -1.193 -0.108 1.00 . A A . 14 TRP CD2 1 1 16 4387 1 1 14 TRP CE2 C 13.612 -1.942 0.897 1.00 . A A . 14 TRP CE2 1 1 16 4388 1 1 14 TRP CE3 C 13.668 -0.908 -1.288 1.00 . A A . 14 TRP CE3 1 1 16 4389 1 1 14 TRP CG C 11.612 -0.870 0.356 1.00 . A A . 14 TRP CG 1 1 16 4390 1 1 14 TRP CH2 C 15.614 -2.104 -0.440 1.00 . A A . 14 TRP CH2 1 1 16 4391 1 1 14 TRP CZ2 C 14.924 -2.395 0.738 1.00 . A A . 14 TRP CZ2 1 1 16 4392 1 1 14 TRP CZ3 C 14.988 -1.362 -1.451 1.00 . A A . 14 TRP CZ3 1 1 16 4393 1 1 14 TRP H H 9.961 0.448 2.046 1.00 . A A . 14 TRP H 1 1 16 4394 1 1 14 TRP HA H 8.428 0.231 -0.200 1.00 . A A . 14 TRP HA 1 1 16 4395 1 1 14 TRP HB2 H 10.514 -0.387 -1.386 1.00 . A A . 14 TRP HB2 1 1 16 4396 1 1 14 TRP HB3 H 10.742 0.950 -0.286 1.00 . A A . 14 TRP HB3 1 1 16 4397 1 1 14 TRP HD1 H 10.617 -1.379 2.207 1.00 . A A . 14 TRP HD1 1 1 16 4398 1 1 14 TRP HE1 H 12.854 -2.535 2.744 1.00 . A A . 14 TRP HE1 1 1 16 4399 1 1 14 TRP HE3 H 13.196 -0.337 -2.072 1.00 . A A . 14 TRP HE3 1 1 16 4400 1 1 14 TRP HH2 H 16.628 -2.452 -0.573 1.00 . A A . 14 TRP HH2 1 1 16 4401 1 1 14 TRP HZ2 H 15.400 -2.967 1.521 1.00 . A A . 14 TRP HZ2 1 1 16 4402 1 1 14 TRP HZ3 H 15.522 -1.139 -2.362 1.00 . A A . 14 TRP HZ3 1 1 16 4403 1 1 14 TRP N N 9.205 -0.065 1.695 1.00 . A A . 14 TRP N 1 1 16 4404 1 1 14 TRP NE1 N 12.679 -2.057 1.906 1.00 . A A . 14 TRP NE1 1 1 16 4405 1 1 14 TRP O O 7.643 -2.256 0.325 1.00 . A A . 14 TRP O 1 1 16 4406 1 1 15 LEU C C 10.000 -4.917 0.450 1.00 . A A . 15 LEU C 1 1 16 4407 1 1 15 LEU CA C 9.465 -4.059 -0.693 1.00 . A A . 15 LEU CA 1 1 16 4408 1 1 15 LEU CB C 10.149 -4.456 -2.004 1.00 . A A . 15 LEU CB 1 1 16 4409 1 1 15 LEU CD1 C 12.301 -4.260 -3.249 1.00 . A A . 15 LEU CD1 1 1 16 4410 1 1 15 LEU CD2 C 10.996 -2.187 -2.733 1.00 . A A . 15 LEU CD2 1 1 16 4411 1 1 15 LEU CG C 11.395 -3.585 -2.222 1.00 . A A . 15 LEU CG 1 1 16 4412 1 1 15 LEU H H 10.592 -2.291 -0.635 1.00 . A A . 15 LEU H 1 1 16 4413 1 1 15 LEU HA H 8.403 -4.217 -0.789 1.00 . A A . 15 LEU HA 1 1 16 4414 1 1 15 LEU HB2 H 10.439 -5.495 -1.954 1.00 . A A . 15 LEU HB2 1 1 16 4415 1 1 15 LEU HB3 H 9.464 -4.313 -2.825 1.00 . A A . 15 LEU HB3 1 1 16 4416 1 1 15 LEU HD11 H 12.620 -3.534 -3.980 1.00 . A A . 15 LEU HD11 1 1 16 4417 1 1 15 LEU HD12 H 11.755 -5.052 -3.740 1.00 . A A . 15 LEU HD12 1 1 16 4418 1 1 15 LEU HD13 H 13.163 -4.673 -2.749 1.00 . A A . 15 LEU HD13 1 1 16 4419 1 1 15 LEU HD21 H 11.063 -2.162 -3.810 1.00 . A A . 15 LEU HD21 1 1 16 4420 1 1 15 LEU HD22 H 11.664 -1.444 -2.315 1.00 . A A . 15 LEU HD22 1 1 16 4421 1 1 15 LEU HD23 H 9.983 -1.964 -2.430 1.00 . A A . 15 LEU HD23 1 1 16 4422 1 1 15 LEU HG H 11.930 -3.487 -1.287 1.00 . A A . 15 LEU HG 1 1 16 4423 1 1 15 LEU N N 9.718 -2.654 -0.430 1.00 . A A . 15 LEU N 1 1 16 4424 1 1 15 LEU O O 9.499 -6.014 0.704 1.00 . A A . 15 LEU O 1 1 16 4425 1 1 16 . C C 10.744 -4.961 3.454 1.00 . A A . 16 DBU C 1 1 16 4426 1 1 16 . CA C 11.602 -5.102 2.220 1.00 . A A . 16 DBU CA 1 1 16 4427 1 1 16 . CB C 12.790 -5.839 2.255 1.00 . A A . 16 DBU CB 1 1 16 4428 1 1 16 . CG C 13.711 -6.035 1.076 1.00 . A A . 16 DBU CG 1 1 16 4429 1 1 16 . H H 11.384 -3.530 0.901 1.00 . A A . 16 DBU H 1 1 16 4430 1 1 16 . HB H 13.088 -6.309 3.181 1.00 . A A . 16 DBU HB 1 1 16 4431 1 1 16 . HG1 H 14.737 -5.938 1.398 1.00 . A A . 16 DBU HG1 1 1 16 4432 1 1 16 . HG2 H 13.497 -5.288 0.327 1.00 . A A . 16 DBU HG2 1 1 16 4433 1 1 16 . HG3 H 13.556 -7.018 0.659 1.00 . A A . 16 DBU HG3 1 1 16 4434 1 1 16 . N N 11.019 -4.409 1.138 1.00 . A A . 16 DBU N 1 1 16 4435 1 1 16 . O O 10.155 -5.919 3.952 1.00 . A A . 16 DBU O 1 1 16 4436 1 1 17 GLY C C 10.774 -3.261 6.367 1.00 . A A . 17 GLY C 1 1 16 4437 1 1 17 GLY CA C 9.884 -3.442 5.141 1.00 . A A . 17 GLY CA 1 1 16 4438 1 1 17 GLY H H 11.167 -3.006 3.514 1.00 . A A . 17 GLY H 1 1 16 4439 1 1 17 GLY HA2 H 9.317 -2.539 4.974 1.00 . A A . 17 GLY HA2 1 1 16 4440 1 1 17 GLY HA3 H 9.202 -4.259 5.320 1.00 . A A . 17 GLY HA3 1 1 16 4441 1 1 17 GLY N N 10.676 -3.732 3.954 1.00 . A A . 17 GLY N 1 1 16 4442 1 1 17 GLY O O 10.376 -2.626 7.344 1.00 . A A . 17 GLY O 1 1 16 4443 1 1 18 LEU C C 14.356 -3.692 6.911 1.00 . A A . 18 LEU C 1 1 16 4444 1 1 18 LEU CA C 12.919 -3.700 7.421 1.00 . A A . 18 LEU CA 1 1 16 4445 1 1 18 LEU CB C 12.729 -4.866 8.392 1.00 . A A . 18 LEU CB 1 1 16 4446 1 1 18 LEU CD1 C 10.273 -5.267 8.601 1.00 . A A . 18 LEU CD1 1 1 16 4447 1 1 18 LEU CD2 C 11.715 -5.227 10.643 1.00 . A A . 18 LEU CD2 1 1 16 4448 1 1 18 LEU CG C 11.494 -4.618 9.256 1.00 . A A . 18 LEU CG 1 1 16 4449 1 1 18 LEU H H 12.246 -4.305 5.502 1.00 . A A . 18 LEU H 1 1 16 4450 1 1 18 LEU HA H 12.728 -2.777 7.945 1.00 . A A . 18 LEU HA 1 1 16 4451 1 1 18 LEU HB2 H 12.601 -5.782 7.833 1.00 . A A . 18 LEU HB2 1 1 16 4452 1 1 18 LEU HB3 H 13.599 -4.950 9.027 1.00 . A A . 18 LEU HB3 1 1 16 4453 1 1 18 LEU HD11 H 9.398 -4.663 8.793 1.00 . A A . 18 LEU HD11 1 1 16 4454 1 1 18 LEU HD12 H 10.126 -6.254 9.013 1.00 . A A . 18 LEU HD12 1 1 16 4455 1 1 18 LEU HD13 H 10.433 -5.340 7.535 1.00 . A A . 18 LEU HD13 1 1 16 4456 1 1 18 LEU HD21 H 11.036 -4.770 11.349 1.00 . A A . 18 LEU HD21 1 1 16 4457 1 1 18 LEU HD22 H 12.732 -5.051 10.956 1.00 . A A . 18 LEU HD22 1 1 16 4458 1 1 18 LEU HD23 H 11.529 -6.291 10.602 1.00 . A A . 18 LEU HD23 1 1 16 4459 1 1 18 LEU HG H 11.329 -3.555 9.350 1.00 . A A . 18 LEU HG 1 1 16 4460 1 1 18 LEU N N 11.981 -3.814 6.307 1.00 . A A . 18 LEU N 1 1 16 4461 1 1 18 LEU O O 15.254 -4.245 7.547 1.00 . A A . 18 LEU O 1 1 16 4462 1 1 19 CYS C C 16.692 -4.255 5.479 1.00 . A A . 19 CYS C 1 1 16 4463 1 1 19 CYS CA C 15.897 -2.994 5.171 1.00 . A A . 19 CYS CA 1 1 16 4464 1 1 19 CYS CB C 16.648 -1.769 5.701 1.00 . A A . 19 CYS CB 1 1 16 4465 1 1 19 CYS H H 13.812 -2.643 5.298 1.00 . A A . 19 CYS H 1 1 16 4466 1 1 19 CYS HA H 15.801 -2.906 4.101 1.00 . A A . 19 CYS HA 1 1 16 4467 1 1 19 CYS HB2 H 15.969 -0.933 5.783 1.00 . A A . 19 CYS HB2 1 1 16 4468 1 1 19 CYS HB3 H 17.061 -1.989 6.674 1.00 . A A . 19 CYS HB3 1 1 16 4469 1 1 19 CYS N N 14.567 -3.064 5.760 1.00 . A A . 19 CYS N 1 1 16 4470 1 1 19 CYS O O 17.289 -4.385 6.548 1.00 . A A . 19 CYS O 1 1 16 4471 1 1 19 CYS SG S 17.990 -1.351 4.560 1.00 . A A . 19 CYS SG 1 1 16 4472 1 1 20 VAL C C 18.628 -6.472 3.760 1.00 . A A . 20 VAL C 1 1 16 4473 1 1 20 VAL CA C 17.419 -6.431 4.691 1.00 . A A . 20 VAL CA 1 1 16 4474 1 1 20 VAL CB C 16.494 -7.615 4.393 1.00 . A A . 20 VAL CB 1 1 16 4475 1 1 20 VAL CG1 C 16.905 -8.807 5.258 1.00 . A A . 20 VAL CG1 1 1 16 4476 1 1 20 VAL CG2 C 15.047 -7.226 4.712 1.00 . A A . 20 VAL CG2 1 1 16 4477 1 1 20 VAL H H 16.203 -5.016 3.696 1.00 . A A . 20 VAL H 1 1 16 4478 1 1 20 VAL HA H 17.761 -6.506 5.711 1.00 . A A . 20 VAL HA 1 1 16 4479 1 1 20 VAL HB H 16.577 -7.882 3.349 1.00 . A A . 20 VAL HB 1 1 16 4480 1 1 20 VAL HG11 H 17.813 -8.567 5.794 1.00 . A A . 20 VAL HG11 1 1 16 4481 1 1 20 VAL HG12 H 17.077 -9.668 4.627 1.00 . A A . 20 VAL HG12 1 1 16 4482 1 1 20 VAL HG13 H 16.119 -9.029 5.963 1.00 . A A . 20 VAL HG13 1 1 16 4483 1 1 20 VAL HG21 H 14.690 -6.520 3.977 1.00 . A A . 20 VAL HG21 1 1 16 4484 1 1 20 VAL HG22 H 15.003 -6.776 5.694 1.00 . A A . 20 VAL HG22 1 1 16 4485 1 1 20 VAL HG23 H 14.426 -8.109 4.696 1.00 . A A . 20 VAL HG23 1 1 16 4486 1 1 20 VAL N N 16.694 -5.180 4.526 1.00 . A A . 20 VAL N 1 1 16 4487 1 1 20 VAL O O 19.506 -7.323 3.902 1.00 . A A . 20 VAL O 1 1 16 4488 1 1 21 ARG C C 21.068 -5.934 2.519 1.00 . A A . 21 ARG C 1 1 16 4489 1 1 21 ARG CA C 19.771 -5.482 1.856 1.00 . A A . 21 ARG CA 1 1 16 4490 1 1 21 ARG CB C 19.940 -4.052 1.329 1.00 . A A . 21 ARG CB 1 1 16 4491 1 1 21 ARG CD C 20.556 -1.712 1.945 1.00 . A A . 21 ARG CD 1 1 16 4492 1 1 21 ARG CG C 20.441 -3.148 2.457 1.00 . A A . 21 ARG CG 1 1 16 4493 1 1 21 ARG CZ C 22.858 -1.510 1.199 1.00 . A A . 21 ARG CZ 1 1 16 4494 1 1 21 ARG H H 17.937 -4.891 2.740 1.00 . A A . 21 ARG H 1 1 16 4495 1 1 21 ARG HA H 19.556 -6.136 1.026 1.00 . A A . 21 ARG HA 1 1 16 4496 1 1 21 ARG HB2 H 20.658 -4.051 0.521 1.00 . A A . 21 ARG HB2 1 1 16 4497 1 1 21 ARG HB3 H 18.991 -3.680 0.967 1.00 . A A . 21 ARG HB3 1 1 16 4498 1 1 21 ARG HD2 H 19.605 -1.397 1.545 1.00 . A A . 21 ARG HD2 1 1 16 4499 1 1 21 ARG HD3 H 20.829 -1.062 2.764 1.00 . A A . 21 ARG HD3 1 1 16 4500 1 1 21 ARG HE H 21.294 -1.659 -0.041 1.00 . A A . 21 ARG HE 1 1 16 4501 1 1 21 ARG HG2 H 19.746 -3.183 3.283 1.00 . A A . 21 ARG HG2 1 1 16 4502 1 1 21 ARG HG3 H 21.411 -3.488 2.787 1.00 . A A . 21 ARG HG3 1 1 16 4503 1 1 21 ARG HH11 H 22.556 -1.531 3.178 1.00 . A A . 21 ARG HH11 1 1 16 4504 1 1 21 ARG HH12 H 24.207 -1.383 2.674 1.00 . A A . 21 ARG HH12 1 1 16 4505 1 1 21 ARG HH21 H 23.456 -1.459 -0.711 1.00 . A A . 21 ARG HH21 1 1 16 4506 1 1 21 ARG HH22 H 24.716 -1.342 0.472 1.00 . A A . 21 ARG HH22 1 1 16 4507 1 1 21 ARG N N 18.665 -5.543 2.806 1.00 . A A . 21 ARG N 1 1 16 4508 1 1 21 ARG NE N 21.569 -1.628 0.900 1.00 . A A . 21 ARG NE 1 1 16 4509 1 1 21 ARG NH1 N 23.236 -1.471 2.447 1.00 . A A . 21 ARG NH1 1 1 16 4510 1 1 21 ARG NH2 N 23.746 -1.430 0.246 1.00 . A A . 21 ARG NH2 1 1 16 4511 1 1 21 ARG O O 21.924 -6.445 1.817 1.00 . A A . 21 ARG O 1 1 16 4512 1 1 21 ARG OXT O 21.185 -5.764 3.722 1.00 . A A . 21 ARG OXT 1 1 17 4513 1 1 1 ALA C C 17.531 2.230 -9.763 1.00 . A A . 1 ALA C 1 1 17 4514 1 1 1 ALA CA C 18.926 1.860 -10.253 1.00 . A A . 1 ALA CA 1 1 17 4515 1 1 1 ALA CB C 19.979 2.374 -9.269 1.00 . A A . 1 ALA CB 1 1 17 4516 1 1 1 ALA H1 H 18.635 3.367 -11.658 1.00 . A A . 1 ALA H1 1 1 17 4517 1 1 1 ALA H2 H 18.832 1.821 -12.332 1.00 . A A . 1 ALA H2 1 1 17 4518 1 1 1 ALA H3 H 20.175 2.659 -11.714 1.00 . A A . 1 ALA H3 1 1 17 4519 1 1 1 ALA HA H 19.004 0.786 -10.333 1.00 . A A . 1 ALA HA 1 1 17 4520 1 1 1 ALA HB1 H 19.488 2.776 -8.394 1.00 . A A . 1 ALA HB1 1 1 17 4521 1 1 1 ALA HB2 H 20.565 3.147 -9.739 1.00 . A A . 1 ALA HB2 1 1 17 4522 1 1 1 ALA HB3 H 20.625 1.559 -8.975 1.00 . A A . 1 ALA HB3 1 1 17 4523 1 1 1 ALA N N 19.160 2.473 -11.590 1.00 . A A . 1 ALA N 1 1 17 4524 1 1 1 ALA O O 16.681 2.661 -10.542 1.00 . A A . 1 ALA O 1 1 17 4525 1 1 2 GLY C C 15.919 3.863 -7.531 1.00 . A A . 2 GLY C 1 1 17 4526 1 1 2 GLY CA C 16.007 2.381 -7.877 1.00 . A A . 2 GLY CA 1 1 17 4527 1 1 2 GLY H H 18.017 1.714 -7.891 1.00 . A A . 2 GLY H 1 1 17 4528 1 1 2 GLY HA2 H 15.227 2.133 -8.584 1.00 . A A . 2 GLY HA2 1 1 17 4529 1 1 2 GLY HA3 H 15.869 1.800 -6.979 1.00 . A A . 2 GLY HA3 1 1 17 4530 1 1 2 GLY N N 17.303 2.061 -8.464 1.00 . A A . 2 GLY N 1 1 17 4531 1 1 2 GLY O O 16.816 4.640 -7.860 1.00 . A A . 2 GLY O 1 1 17 4532 1 1 3 GLY C C 15.733 6.112 -5.533 1.00 . A A . 3 GLY C 1 1 17 4533 1 1 3 GLY CA C 14.641 5.645 -6.490 1.00 . A A . 3 GLY CA 1 1 17 4534 1 1 3 GLY H H 14.150 3.587 -6.636 1.00 . A A . 3 GLY H 1 1 17 4535 1 1 3 GLY HA2 H 14.659 6.258 -7.379 1.00 . A A . 3 GLY HA2 1 1 17 4536 1 1 3 GLY HA3 H 13.681 5.751 -6.006 1.00 . A A . 3 GLY HA3 1 1 17 4537 1 1 3 GLY N N 14.833 4.250 -6.870 1.00 . A A . 3 GLY N 1 1 17 4538 1 1 3 GLY O O 16.251 7.221 -5.663 1.00 . A A . 3 GLY O 1 1 17 4539 1 1 4 . C C 16.465 6.361 -2.491 1.00 . A A . 4 DBU C 1 1 17 4540 1 1 4 . CA C 17.080 5.593 -3.631 1.00 . A A . 4 DBU CA 1 1 17 4541 1 1 4 . CB C 18.447 5.312 -3.653 1.00 . A A . 4 DBU CB 1 1 17 4542 1 1 4 . CG C 19.047 4.547 -4.797 1.00 . A A . 4 DBU CG 1 1 17 4543 1 1 4 . H H 15.639 4.388 -4.504 1.00 . A A . 4 DBU H 1 1 17 4544 1 1 4 . HB H 19.092 5.638 -2.850 1.00 . A A . 4 DBU HB 1 1 17 4545 1 1 4 . HG1 H 18.258 4.317 -5.498 1.00 . A A . 4 DBU HG1 1 1 17 4546 1 1 4 . HG2 H 19.488 3.631 -4.432 1.00 . A A . 4 DBU HG2 1 1 17 4547 1 1 4 . HG3 H 19.802 5.144 -5.286 1.00 . A A . 4 DBU HG3 1 1 17 4548 1 1 4 . N N 16.081 5.261 -4.572 1.00 . A A . 4 DBU N 1 1 17 4549 1 1 4 . O O 17.084 7.206 -1.848 1.00 . A A . 4 DBU O 1 1 17 4550 1 1 5 ILE C C 13.335 5.837 -0.624 1.00 . A A . 5 ILE C 1 1 17 4551 1 1 5 ILE CA C 14.452 6.707 -1.190 1.00 . A A . 5 ILE CA 1 1 17 4552 1 1 5 ILE CB C 13.859 8.013 -1.718 1.00 . A A . 5 ILE CB 1 1 17 4553 1 1 5 ILE CD1 C 15.855 9.210 -2.638 1.00 . A A . 5 ILE CD1 1 1 17 4554 1 1 5 ILE CG1 C 14.847 9.152 -1.492 1.00 . A A . 5 ILE CG1 1 1 17 4555 1 1 5 ILE CG2 C 12.564 8.337 -0.969 1.00 . A A . 5 ILE CG2 1 1 17 4556 1 1 5 ILE H H 14.769 5.369 -2.795 1.00 . A A . 5 ILE H 1 1 17 4557 1 1 5 ILE HA H 15.130 6.943 -0.399 1.00 . A A . 5 ILE HA 1 1 17 4558 1 1 5 ILE HB H 13.654 7.912 -2.773 1.00 . A A . 5 ILE HB 1 1 17 4559 1 1 5 ILE HD11 H 16.858 9.204 -2.233 1.00 . A A . 5 ILE HD11 1 1 17 4560 1 1 5 ILE HD12 H 15.702 10.113 -3.208 1.00 . A A . 5 ILE HD12 1 1 17 4561 1 1 5 ILE HD13 H 15.720 8.351 -3.279 1.00 . A A . 5 ILE HD13 1 1 17 4562 1 1 5 ILE HG12 H 14.306 10.076 -1.447 1.00 . A A . 5 ILE HG12 1 1 17 4563 1 1 5 ILE HG13 H 15.373 8.994 -0.560 1.00 . A A . 5 ILE HG13 1 1 17 4564 1 1 5 ILE HG21 H 12.354 9.392 -1.053 1.00 . A A . 5 ILE HG21 1 1 17 4565 1 1 5 ILE HG22 H 12.681 8.074 0.074 1.00 . A A . 5 ILE HG22 1 1 17 4566 1 1 5 ILE HG23 H 11.749 7.770 -1.393 1.00 . A A . 5 ILE HG23 1 1 17 4567 1 1 5 ILE N N 15.199 6.046 -2.251 1.00 . A A . 5 ILE N 1 1 17 4568 1 1 5 ILE O O 13.171 5.753 0.592 1.00 . A A . 5 ILE O 1 1 17 4569 1 1 6 PRO C C 11.885 3.335 -0.014 1.00 . A A . 6 PRO C 1 1 17 4570 1 1 6 PRO CA C 11.413 4.383 -0.992 1.00 . A A . 6 PRO CA 1 1 17 4571 1 1 6 PRO CB C 10.871 3.735 -2.262 1.00 . A A . 6 PRO CB 1 1 17 4572 1 1 6 PRO CD C 12.649 5.230 -2.923 1.00 . A A . 6 PRO CD 1 1 17 4573 1 1 6 PRO CG C 11.325 4.626 -3.372 1.00 . A A . 6 PRO CG 1 1 17 4574 1 1 6 PRO HA H 10.652 5.001 -0.545 1.00 . A A . 6 PRO HA 1 1 17 4575 1 1 6 PRO HB2 H 11.277 2.734 -2.370 1.00 . A A . 6 PRO HB2 1 1 17 4576 1 1 6 PRO HB3 H 9.794 3.701 -2.234 1.00 . A A . 6 PRO HB3 1 1 17 4577 1 1 6 PRO HD2 H 13.471 4.620 -3.253 1.00 . A A . 6 PRO HD2 1 1 17 4578 1 1 6 PRO HD3 H 12.755 6.234 -3.285 1.00 . A A . 6 PRO HD3 1 1 17 4579 1 1 6 PRO HG2 H 11.461 4.052 -4.279 1.00 . A A . 6 PRO HG2 1 1 17 4580 1 1 6 PRO HG3 H 10.610 5.415 -3.530 1.00 . A A . 6 PRO HG3 1 1 17 4581 1 1 6 PRO N N 12.548 5.219 -1.459 1.00 . A A . 6 PRO N 1 1 17 4582 1 1 6 PRO O O 11.179 3.000 0.933 1.00 . A A . 6 PRO O 1 1 17 4583 1 1 7 DAL C C 15.145 1.607 0.378 1.00 . A A . 7 DAL C 1 1 17 4584 1 1 7 DAL CA C 13.651 1.814 0.616 1.00 . A A . 7 DAL CA 1 1 17 4585 1 1 7 DAL CB C 13.405 2.217 2.057 1.00 . A A . 7 DAL CB 1 1 17 4586 1 1 7 DAL H H 13.596 3.140 -1.019 1.00 . A A . 7 DAL H 1 1 17 4587 1 1 7 DAL HA H 13.146 0.889 0.435 1.00 . A A . 7 DAL HA 1 1 17 4588 1 1 7 DAL HB1 H 13.244 3.283 2.110 1.00 . A A . 7 DAL HB1 1 1 17 4589 1 1 7 DAL HB2 H 14.248 1.950 2.665 1.00 . A A . 7 DAL HB2 1 1 17 4590 1 1 7 DAL N N 13.088 2.825 -0.252 1.00 . A A . 7 DAL N 1 1 17 4591 1 1 7 DAL O O 15.810 0.927 1.156 1.00 . A A . 7 DAL O 1 1 17 4592 1 1 8 LEU C C 17.906 2.656 0.132 1.00 . A A . 8 LEU C 1 1 17 4593 1 1 8 LEU CA C 17.090 2.031 -0.986 1.00 . A A . 8 LEU CA 1 1 17 4594 1 1 8 LEU CB C 17.430 2.697 -2.320 1.00 . A A . 8 LEU CB 1 1 17 4595 1 1 8 LEU CD1 C 17.045 2.393 -4.773 1.00 . A A . 8 LEU CD1 1 1 17 4596 1 1 8 LEU CD2 C 15.925 0.856 -3.157 1.00 . A A . 8 LEU CD2 1 1 17 4597 1 1 8 LEU CG C 16.404 2.295 -3.388 1.00 . A A . 8 LEU CG 1 1 17 4598 1 1 8 LEU H H 15.113 2.720 -1.291 1.00 . A A . 8 LEU H 1 1 17 4599 1 1 8 LEU HA H 17.325 0.978 -1.049 1.00 . A A . 8 LEU HA 1 1 17 4600 1 1 8 LEU HB2 H 17.418 3.767 -2.193 1.00 . A A . 8 LEU HB2 1 1 17 4601 1 1 8 LEU HB3 H 18.415 2.384 -2.635 1.00 . A A . 8 LEU HB3 1 1 17 4602 1 1 8 LEU HD11 H 16.716 3.297 -5.261 1.00 . A A . 8 LEU HD11 1 1 17 4603 1 1 8 LEU HD12 H 16.753 1.538 -5.365 1.00 . A A . 8 LEU HD12 1 1 17 4604 1 1 8 LEU HD13 H 18.120 2.408 -4.671 1.00 . A A . 8 LEU HD13 1 1 17 4605 1 1 8 LEU HD21 H 15.616 0.424 -4.097 1.00 . A A . 8 LEU HD21 1 1 17 4606 1 1 8 LEU HD22 H 15.091 0.861 -2.471 1.00 . A A . 8 LEU HD22 1 1 17 4607 1 1 8 LEU HD23 H 16.732 0.272 -2.740 1.00 . A A . 8 LEU HD23 1 1 17 4608 1 1 8 LEU HG H 15.560 2.970 -3.336 1.00 . A A . 8 LEU HG 1 1 17 4609 1 1 8 LEU N N 15.676 2.186 -0.693 1.00 . A A . 8 LEU N 1 1 17 4610 1 1 8 LEU O O 19.047 2.267 0.385 1.00 . A A . 8 LEU O 1 1 17 4611 1 1 9 MET C C 18.260 3.324 3.017 1.00 . A A . 9 MET C 1 1 17 4612 1 1 9 MET CA C 17.959 4.319 1.898 1.00 . A A . 9 MET CA 1 1 17 4613 1 1 9 MET CB C 17.045 5.425 2.422 1.00 . A A . 9 MET CB 1 1 17 4614 1 1 9 MET CE C 14.375 6.941 2.757 1.00 . A A . 9 MET CE 1 1 17 4615 1 1 9 MET CG C 16.528 6.247 1.249 1.00 . A A . 9 MET CG 1 1 17 4616 1 1 9 MET H H 16.391 3.890 0.551 1.00 . A A . 9 MET H 1 1 17 4617 1 1 9 MET HA H 18.883 4.755 1.547 1.00 . A A . 9 MET HA 1 1 17 4618 1 1 9 MET HB2 H 16.213 4.989 2.953 1.00 . A A . 9 MET HB2 1 1 17 4619 1 1 9 MET HB3 H 17.596 6.071 3.082 1.00 . A A . 9 MET HB3 1 1 17 4620 1 1 9 MET HE1 H 14.540 5.872 2.772 1.00 . A A . 9 MET HE1 1 1 17 4621 1 1 9 MET HE2 H 13.441 7.152 2.261 1.00 . A A . 9 MET HE2 1 1 17 4622 1 1 9 MET HE3 H 14.335 7.317 3.770 1.00 . A A . 9 MET HE3 1 1 17 4623 1 1 9 MET HG2 H 17.351 6.511 0.598 1.00 . A A . 9 MET HG2 1 1 17 4624 1 1 9 MET HG3 H 15.811 5.659 0.697 1.00 . A A . 9 MET HG3 1 1 17 4625 1 1 9 MET N N 17.301 3.630 0.802 1.00 . A A . 9 MET N 1 1 17 4626 1 1 9 MET O O 19.325 3.367 3.632 1.00 . A A . 9 MET O 1 1 17 4627 1 1 9 MET SD S 15.730 7.748 1.869 1.00 . A A . 9 MET SD 1 1 17 4628 1 1 10 . C C 16.676 1.716 5.531 1.00 . A A . 10 DBB C 1 1 17 4629 1 1 10 . CA C 17.492 1.397 4.289 1.00 . A A . 10 DBB CA 1 1 17 4630 1 1 10 . CB C 17.089 0.026 3.736 1.00 . A A . 10 DBB CB 1 1 17 4631 1 1 10 . CG C 15.570 -0.129 3.798 1.00 . A A . 10 DBB CG 1 1 17 4632 1 1 10 . H H 16.494 2.421 2.725 1.00 . A A . 10 DBB H 1 1 17 4633 1 1 10 . HA H 18.534 1.361 4.563 1.00 . A A . 10 DBB HA 1 1 17 4634 1 1 10 . HB2 H 17.376 -0.020 2.703 1.00 . A A . 10 DBB HB2 1 1 17 4635 1 1 10 . HG1 H 15.311 -1.170 3.676 1.00 . A A . 10 DBB HG1 1 1 17 4636 1 1 10 . HG2 H 15.122 0.446 3.003 1.00 . A A . 10 DBB HG2 1 1 17 4637 1 1 10 . HG3 H 15.202 0.224 4.747 1.00 . A A . 10 DBB HG3 1 1 17 4638 1 1 10 . N N 17.315 2.415 3.258 1.00 . A A . 10 DBB N 1 1 17 4639 1 1 10 . O O 17.136 1.502 6.651 1.00 . A A . 10 DBB O 1 1 17 4640 1 1 11 GLY C C 13.230 2.996 6.021 1.00 . A A . 11 GLY C 1 1 17 4641 1 1 11 GLY CA C 14.623 2.561 6.466 1.00 . A A . 11 GLY CA 1 1 17 4642 1 1 11 GLY H H 15.149 2.380 4.421 1.00 . A A . 11 GLY H 1 1 17 4643 1 1 11 GLY HA2 H 14.538 1.699 7.112 1.00 . A A . 11 GLY HA2 1 1 17 4644 1 1 11 GLY HA3 H 15.088 3.361 7.005 1.00 . A A . 11 GLY HA3 1 1 17 4645 1 1 11 GLY N N 15.469 2.227 5.334 1.00 . A A . 11 GLY N 1 1 17 4646 1 1 11 GLY O O 12.857 4.160 6.164 1.00 . A A . 11 GLY O 1 1 17 4647 1 1 12 CYS C C 10.234 1.124 5.045 1.00 . A A . 12 CYS C 1 1 17 4648 1 1 12 CYS CA C 11.130 2.354 4.979 1.00 . A A . 12 CYS CA 1 1 17 4649 1 1 12 CYS CB C 11.237 2.763 3.526 1.00 . A A . 12 CYS CB 1 1 17 4650 1 1 12 CYS H H 12.829 1.152 5.354 1.00 . A A . 12 CYS H 1 1 17 4651 1 1 12 CYS HA H 10.698 3.161 5.549 1.00 . A A . 12 CYS HA 1 1 17 4652 1 1 12 CYS HB2 H 10.261 3.007 3.135 1.00 . A A . 12 CYS HB2 1 1 17 4653 1 1 12 CYS HB3 H 11.895 3.608 3.428 1.00 . A A . 12 CYS HB3 1 1 17 4654 1 1 12 CYS N N 12.473 2.057 5.463 1.00 . A A . 12 CYS N 1 1 17 4655 1 1 12 CYS O O 10.512 0.164 5.766 1.00 . A A . 12 CYS O 1 1 17 4656 1 1 12 CYS SG S 11.931 1.359 2.636 1.00 . A A . 12 CYS SG 1 1 17 4657 1 1 13 GLY C C 8.213 -0.474 2.731 1.00 . A A . 13 GLY C 1 1 17 4658 1 1 13 GLY CA C 8.232 0.054 4.156 1.00 . A A . 13 GLY CA 1 1 17 4659 1 1 13 GLY H H 9.028 1.948 3.685 1.00 . A A . 13 GLY H 1 1 17 4660 1 1 13 GLY HA2 H 8.531 -0.733 4.831 1.00 . A A . 13 GLY HA2 1 1 17 4661 1 1 13 GLY HA3 H 7.247 0.396 4.412 1.00 . A A . 13 GLY HA3 1 1 17 4662 1 1 13 GLY N N 9.171 1.161 4.246 1.00 . A A . 13 GLY N 1 1 17 4663 1 1 13 GLY O O 7.390 -1.317 2.376 1.00 . A A . 13 GLY O 1 1 17 4664 1 1 14 TRP C C 9.118 -1.884 0.425 1.00 . A A . 14 TRP C 1 1 17 4665 1 1 14 TRP CA C 9.235 -0.368 0.531 1.00 . A A . 14 TRP CA 1 1 17 4666 1 1 14 TRP CB C 10.583 0.097 -0.033 1.00 . A A . 14 TRP CB 1 1 17 4667 1 1 14 TRP CD1 C 11.644 -1.457 1.631 1.00 . A A . 14 TRP CD1 1 1 17 4668 1 1 14 TRP CD2 C 12.885 -1.256 -0.231 1.00 . A A . 14 TRP CD2 1 1 17 4669 1 1 14 TRP CE2 C 13.576 -2.149 0.622 1.00 . A A . 14 TRP CE2 1 1 17 4670 1 1 14 TRP CE3 C 13.462 -0.956 -1.480 1.00 . A A . 14 TRP CE3 1 1 17 4671 1 1 14 TRP CG C 11.654 -0.836 0.438 1.00 . A A . 14 TRP CG 1 1 17 4672 1 1 14 TRP CH2 C 15.351 -2.415 -0.991 1.00 . A A . 14 TRP CH2 1 1 17 4673 1 1 14 TRP CZ2 C 14.792 -2.724 0.252 1.00 . A A . 14 TRP CZ2 1 1 17 4674 1 1 14 TRP CZ3 C 14.688 -1.532 -1.854 1.00 . A A . 14 TRP CZ3 1 1 17 4675 1 1 14 TRP H H 9.756 0.712 2.271 1.00 . A A . 14 TRP H 1 1 17 4676 1 1 14 TRP HA H 8.438 0.092 -0.035 1.00 . A A . 14 TRP HA 1 1 17 4677 1 1 14 TRP HB2 H 10.545 0.106 -1.110 1.00 . A A . 14 TRP HB2 1 1 17 4678 1 1 14 TRP HB3 H 10.794 1.094 0.325 1.00 . A A . 14 TRP HB3 1 1 17 4679 1 1 14 TRP HD1 H 10.871 -1.357 2.370 1.00 . A A . 14 TRP HD1 1 1 17 4680 1 1 14 TRP HE1 H 13.006 -2.796 2.517 1.00 . A A . 14 TRP HE1 1 1 17 4681 1 1 14 TRP HE3 H 12.963 -0.276 -2.152 1.00 . A A . 14 TRP HE3 1 1 17 4682 1 1 14 TRP HH2 H 16.293 -2.855 -1.285 1.00 . A A . 14 TRP HH2 1 1 17 4683 1 1 14 TRP HZ2 H 15.298 -3.404 0.920 1.00 . A A . 14 TRP HZ2 1 1 17 4684 1 1 14 TRP HZ3 H 15.122 -1.295 -2.815 1.00 . A A . 14 TRP HZ3 1 1 17 4685 1 1 14 TRP N N 9.131 0.042 1.922 1.00 . A A . 14 TRP N 1 1 17 4686 1 1 14 TRP NE1 N 12.779 -2.240 1.744 1.00 . A A . 14 TRP NE1 1 1 17 4687 1 1 14 TRP O O 8.963 -2.574 1.432 1.00 . A A . 14 TRP O 1 1 17 4688 1 1 15 LEU C C 9.581 -4.615 0.192 1.00 . A A . 15 LEU C 1 1 17 4689 1 1 15 LEU CA C 9.090 -3.832 -1.026 1.00 . A A . 15 LEU CA 1 1 17 4690 1 1 15 LEU CB C 9.922 -4.217 -2.254 1.00 . A A . 15 LEU CB 1 1 17 4691 1 1 15 LEU CD1 C 12.270 -4.255 -3.104 1.00 . A A . 15 LEU CD1 1 1 17 4692 1 1 15 LEU CD2 C 11.167 -2.074 -2.576 1.00 . A A . 15 LEU CD2 1 1 17 4693 1 1 15 LEU CG C 11.293 -3.545 -2.168 1.00 . A A . 15 LEU CG 1 1 17 4694 1 1 15 LEU H H 9.305 -1.793 -1.561 1.00 . A A . 15 LEU H 1 1 17 4695 1 1 15 LEU HA H 8.058 -4.085 -1.214 1.00 . A A . 15 LEU HA 1 1 17 4696 1 1 15 LEU HB2 H 10.045 -5.289 -2.282 1.00 . A A . 15 LEU HB2 1 1 17 4697 1 1 15 LEU HB3 H 9.416 -3.887 -3.148 1.00 . A A . 15 LEU HB3 1 1 17 4698 1 1 15 LEU HD11 H 11.848 -5.199 -3.417 1.00 . A A . 15 LEU HD11 1 1 17 4699 1 1 15 LEU HD12 H 13.201 -4.431 -2.584 1.00 . A A . 15 LEU HD12 1 1 17 4700 1 1 15 LEU HD13 H 12.454 -3.637 -3.971 1.00 . A A . 15 LEU HD13 1 1 17 4701 1 1 15 LEU HD21 H 12.042 -1.771 -3.133 1.00 . A A . 15 LEU HD21 1 1 17 4702 1 1 15 LEU HD22 H 11.080 -1.467 -1.690 1.00 . A A . 15 LEU HD22 1 1 17 4703 1 1 15 LEU HD23 H 10.288 -1.941 -3.187 1.00 . A A . 15 LEU HD23 1 1 17 4704 1 1 15 LEU HG H 11.660 -3.607 -1.154 1.00 . A A . 15 LEU HG 1 1 17 4705 1 1 15 LEU N N 9.190 -2.394 -0.799 1.00 . A A . 15 LEU N 1 1 17 4706 1 1 15 LEU O O 9.030 -5.664 0.527 1.00 . A A . 15 LEU O 1 1 17 4707 1 1 16 . C C 10.423 -4.232 3.233 1.00 . A A . 16 DBU C 1 1 17 4708 1 1 16 . CA C 11.149 -4.721 2.002 1.00 . A A . 16 DBU CA 1 1 17 4709 1 1 16 . CB C 12.185 -5.658 2.095 1.00 . A A . 16 DBU CB 1 1 17 4710 1 1 16 . CG C 12.961 -6.200 0.921 1.00 . A A . 16 DBU CG 1 1 17 4711 1 1 16 . H H 11.014 -3.255 0.559 1.00 . A A . 16 DBU H 1 1 17 4712 1 1 16 . HB H 12.465 -6.033 3.068 1.00 . A A . 16 DBU HB 1 1 17 4713 1 1 16 . HG1 H 12.299 -6.312 0.074 1.00 . A A . 16 DBU HG1 1 1 17 4714 1 1 16 . HG2 H 13.381 -7.162 1.178 1.00 . A A . 16 DBU HG2 1 1 17 4715 1 1 16 . HG3 H 13.758 -5.517 0.668 1.00 . A A . 16 DBU HG3 1 1 17 4716 1 1 16 . N N 10.611 -4.097 0.855 1.00 . A A . 16 DBU N 1 1 17 4717 1 1 16 . O O 9.331 -4.700 3.554 1.00 . A A . 16 DBU O 1 1 17 4718 1 1 17 GLY C C 11.396 -2.719 6.306 1.00 . A A . 17 GLY C 1 1 17 4719 1 1 17 GLY CA C 10.416 -2.720 5.137 1.00 . A A . 17 GLY CA 1 1 17 4720 1 1 17 GLY H H 11.896 -2.932 3.632 1.00 . A A . 17 GLY H 1 1 17 4721 1 1 17 GLY HA2 H 10.104 -1.705 4.938 1.00 . A A . 17 GLY HA2 1 1 17 4722 1 1 17 GLY HA3 H 9.554 -3.311 5.401 1.00 . A A . 17 GLY HA3 1 1 17 4723 1 1 17 GLY N N 11.027 -3.274 3.933 1.00 . A A . 17 GLY N 1 1 17 4724 1 1 17 GLY O O 11.486 -1.744 7.051 1.00 . A A . 17 GLY O 1 1 17 4725 1 1 18 LEU C C 14.520 -3.858 6.997 1.00 . A A . 18 LEU C 1 1 17 4726 1 1 18 LEU CA C 13.098 -3.927 7.545 1.00 . A A . 18 LEU CA 1 1 17 4727 1 1 18 LEU CB C 12.897 -5.246 8.298 1.00 . A A . 18 LEU CB 1 1 17 4728 1 1 18 LEU CD1 C 11.257 -6.601 9.611 1.00 . A A . 18 LEU CD1 1 1 17 4729 1 1 18 LEU CD2 C 11.636 -4.199 10.185 1.00 . A A . 18 LEU CD2 1 1 17 4730 1 1 18 LEU CG C 11.560 -5.213 9.041 1.00 . A A . 18 LEU CG 1 1 17 4731 1 1 18 LEU H H 12.015 -4.562 5.836 1.00 . A A . 18 LEU H 1 1 17 4732 1 1 18 LEU HA H 12.948 -3.108 8.233 1.00 . A A . 18 LEU HA 1 1 17 4733 1 1 18 LEU HB2 H 12.902 -6.065 7.594 1.00 . A A . 18 LEU HB2 1 1 17 4734 1 1 18 LEU HB3 H 13.699 -5.377 9.010 1.00 . A A . 18 LEU HB3 1 1 17 4735 1 1 18 LEU HD11 H 11.985 -6.845 10.369 1.00 . A A . 18 LEU HD11 1 1 17 4736 1 1 18 LEU HD12 H 11.303 -7.333 8.817 1.00 . A A . 18 LEU HD12 1 1 17 4737 1 1 18 LEU HD13 H 10.268 -6.603 10.046 1.00 . A A . 18 LEU HD13 1 1 17 4738 1 1 18 LEU HD21 H 12.522 -3.592 10.070 1.00 . A A . 18 LEU HD21 1 1 17 4739 1 1 18 LEU HD22 H 11.678 -4.724 11.128 1.00 . A A . 18 LEU HD22 1 1 17 4740 1 1 18 LEU HD23 H 10.761 -3.567 10.164 1.00 . A A . 18 LEU HD23 1 1 17 4741 1 1 18 LEU HG H 10.775 -4.926 8.355 1.00 . A A . 18 LEU HG 1 1 17 4742 1 1 18 LEU N N 12.128 -3.816 6.461 1.00 . A A . 18 LEU N 1 1 17 4743 1 1 18 LEU O O 15.438 -4.470 7.542 1.00 . A A . 18 LEU O 1 1 17 4744 1 1 19 CYS C C 16.860 -4.205 5.574 1.00 . A A . 19 CYS C 1 1 17 4745 1 1 19 CYS CA C 16.004 -2.976 5.286 1.00 . A A . 19 CYS CA 1 1 17 4746 1 1 19 CYS CB C 16.717 -1.729 5.813 1.00 . A A . 19 CYS CB 1 1 17 4747 1 1 19 CYS H H 13.923 -2.652 5.513 1.00 . A A . 19 CYS H 1 1 17 4748 1 1 19 CYS HA H 15.878 -2.879 4.219 1.00 . A A . 19 CYS HA 1 1 17 4749 1 1 19 CYS HB2 H 16.006 -0.926 5.930 1.00 . A A . 19 CYS HB2 1 1 17 4750 1 1 19 CYS HB3 H 17.164 -1.952 6.771 1.00 . A A . 19 CYS HB3 1 1 17 4751 1 1 19 CYS N N 14.692 -3.113 5.907 1.00 . A A . 19 CYS N 1 1 17 4752 1 1 19 CYS O O 17.695 -4.199 6.478 1.00 . A A . 19 CYS O 1 1 17 4753 1 1 19 CYS SG S 18.013 -1.240 4.643 1.00 . A A . 19 CYS SG 1 1 17 4754 1 1 20 VAL C C 18.555 -6.555 3.976 1.00 . A A . 20 VAL C 1 1 17 4755 1 1 20 VAL CA C 17.394 -6.495 4.964 1.00 . A A . 20 VAL CA 1 1 17 4756 1 1 20 VAL CB C 16.472 -7.694 4.743 1.00 . A A . 20 VAL CB 1 1 17 4757 1 1 20 VAL CG1 C 15.519 -7.832 5.933 1.00 . A A . 20 VAL CG1 1 1 17 4758 1 1 20 VAL CG2 C 15.658 -7.472 3.465 1.00 . A A . 20 VAL CG2 1 1 17 4759 1 1 20 VAL H H 15.963 -5.201 4.091 1.00 . A A . 20 VAL H 1 1 17 4760 1 1 20 VAL HA H 17.785 -6.536 5.971 1.00 . A A . 20 VAL HA 1 1 17 4761 1 1 20 VAL HB H 17.064 -8.591 4.647 1.00 . A A . 20 VAL HB 1 1 17 4762 1 1 20 VAL HG11 H 14.901 -8.707 5.797 1.00 . A A . 20 VAL HG11 1 1 17 4763 1 1 20 VAL HG12 H 14.894 -6.955 5.997 1.00 . A A . 20 VAL HG12 1 1 17 4764 1 1 20 VAL HG13 H 16.093 -7.934 6.843 1.00 . A A . 20 VAL HG13 1 1 17 4765 1 1 20 VAL HG21 H 16.326 -7.267 2.643 1.00 . A A . 20 VAL HG21 1 1 17 4766 1 1 20 VAL HG22 H 14.989 -6.636 3.603 1.00 . A A . 20 VAL HG22 1 1 17 4767 1 1 20 VAL HG23 H 15.082 -8.360 3.247 1.00 . A A . 20 VAL HG23 1 1 17 4768 1 1 20 VAL N N 16.642 -5.257 4.795 1.00 . A A . 20 VAL N 1 1 17 4769 1 1 20 VAL O O 19.380 -7.467 4.024 1.00 . A A . 20 VAL O 1 1 17 4770 1 1 21 ARG C C 20.995 -5.976 2.683 1.00 . A A . 21 ARG C 1 1 17 4771 1 1 21 ARG CA C 19.670 -5.520 2.082 1.00 . A A . 21 ARG CA 1 1 17 4772 1 1 21 ARG CB C 19.814 -4.096 1.551 1.00 . A A . 21 ARG CB 1 1 17 4773 1 1 21 ARG CD C 20.680 -1.818 2.064 1.00 . A A . 21 ARG CD 1 1 17 4774 1 1 21 ARG CG C 20.504 -3.233 2.603 1.00 . A A . 21 ARG CG 1 1 17 4775 1 1 21 ARG CZ C 22.303 -0.023 2.248 1.00 . A A . 21 ARG CZ 1 1 17 4776 1 1 21 ARG H H 17.924 -4.874 3.092 1.00 . A A . 21 ARG H 1 1 17 4777 1 1 21 ARG HA H 19.418 -6.171 1.263 1.00 . A A . 21 ARG HA 1 1 17 4778 1 1 21 ARG HB2 H 20.407 -4.107 0.647 1.00 . A A . 21 ARG HB2 1 1 17 4779 1 1 21 ARG HB3 H 18.838 -3.689 1.339 1.00 . A A . 21 ARG HB3 1 1 17 4780 1 1 21 ARG HD2 H 20.710 -1.844 0.985 1.00 . A A . 21 ARG HD2 1 1 17 4781 1 1 21 ARG HD3 H 19.851 -1.204 2.386 1.00 . A A . 21 ARG HD3 1 1 17 4782 1 1 21 ARG HE H 22.493 -1.804 3.146 1.00 . A A . 21 ARG HE 1 1 17 4783 1 1 21 ARG HG2 H 19.901 -3.206 3.499 1.00 . A A . 21 ARG HG2 1 1 17 4784 1 1 21 ARG HG3 H 21.472 -3.652 2.834 1.00 . A A . 21 ARG HG3 1 1 17 4785 1 1 21 ARG HH11 H 20.686 0.350 1.129 1.00 . A A . 21 ARG HH11 1 1 17 4786 1 1 21 ARG HH12 H 21.835 1.641 1.239 1.00 . A A . 21 ARG HH12 1 1 17 4787 1 1 21 ARG HH21 H 24.014 -0.118 3.284 1.00 . A A . 21 ARG HH21 1 1 17 4788 1 1 21 ARG HH22 H 23.720 1.376 2.459 1.00 . A A . 21 ARG HH22 1 1 17 4789 1 1 21 ARG N N 18.610 -5.574 3.082 1.00 . A A . 21 ARG N 1 1 17 4790 1 1 21 ARG NE N 21.924 -1.256 2.566 1.00 . A A . 21 ARG NE 1 1 17 4791 1 1 21 ARG NH1 N 21.550 0.713 1.478 1.00 . A A . 21 ARG NH1 1 1 17 4792 1 1 21 ARG NH2 N 23.433 0.449 2.698 1.00 . A A . 21 ARG NH2 1 1 17 4793 1 1 21 ARG O O 21.818 -6.480 1.938 1.00 . A A . 21 ARG O 1 1 17 4794 1 1 21 ARG OXT O 21.167 -5.812 3.880 1.00 . A A . 21 ARG OXT 1 1 18 4795 1 1 1 ALA C C 13.466 4.986 -10.810 1.00 . A A . 1 ALA C 1 1 18 4796 1 1 1 ALA CA C 12.302 5.723 -11.462 1.00 . A A . 1 ALA CA 1 1 18 4797 1 1 1 ALA CB C 11.553 4.782 -12.410 1.00 . A A . 1 ALA CB 1 1 18 4798 1 1 1 ALA H1 H 12.026 7.423 -12.632 1.00 . A A . 1 ALA H1 1 1 18 4799 1 1 1 ALA H2 H 13.435 6.549 -13.001 1.00 . A A . 1 ALA H2 1 1 18 4800 1 1 1 ALA H3 H 13.368 7.505 -11.599 1.00 . A A . 1 ALA H3 1 1 18 4801 1 1 1 ALA HA H 11.625 6.073 -10.697 1.00 . A A . 1 ALA HA 1 1 18 4802 1 1 1 ALA HB1 H 12.199 4.513 -13.232 1.00 . A A . 1 ALA HB1 1 1 18 4803 1 1 1 ALA HB2 H 10.674 5.280 -12.791 1.00 . A A . 1 ALA HB2 1 1 18 4804 1 1 1 ALA HB3 H 11.260 3.890 -11.876 1.00 . A A . 1 ALA HB3 1 1 18 4805 1 1 1 ALA N N 12.822 6.887 -12.231 1.00 . A A . 1 ALA N 1 1 18 4806 1 1 1 ALA O O 13.525 3.757 -10.831 1.00 . A A . 1 ALA O 1 1 18 4807 1 1 2 GLY C C 15.126 4.289 -8.395 1.00 . A A . 2 GLY C 1 1 18 4808 1 1 2 GLY CA C 15.552 5.151 -9.577 1.00 . A A . 2 GLY CA 1 1 18 4809 1 1 2 GLY H H 14.292 6.721 -10.248 1.00 . A A . 2 GLY H 1 1 18 4810 1 1 2 GLY HA2 H 16.088 4.542 -10.290 1.00 . A A . 2 GLY HA2 1 1 18 4811 1 1 2 GLY HA3 H 16.201 5.939 -9.223 1.00 . A A . 2 GLY HA3 1 1 18 4812 1 1 2 GLY N N 14.391 5.745 -10.233 1.00 . A A . 2 GLY N 1 1 18 4813 1 1 2 GLY O O 15.693 3.224 -8.156 1.00 . A A . 2 GLY O 1 1 18 4814 1 1 3 GLY C C 14.542 4.215 -5.302 1.00 . A A . 3 GLY C 1 1 18 4815 1 1 3 GLY CA C 13.628 4.017 -6.504 1.00 . A A . 3 GLY CA 1 1 18 4816 1 1 3 GLY H H 13.707 5.612 -7.897 1.00 . A A . 3 GLY H 1 1 18 4817 1 1 3 GLY HA2 H 12.634 4.363 -6.258 1.00 . A A . 3 GLY HA2 1 1 18 4818 1 1 3 GLY HA3 H 13.589 2.966 -6.744 1.00 . A A . 3 GLY HA3 1 1 18 4819 1 1 3 GLY N N 14.122 4.756 -7.659 1.00 . A A . 3 GLY N 1 1 18 4820 1 1 3 GLY O O 14.504 3.440 -4.347 1.00 . A A . 3 GLY O 1 1 18 4821 1 1 4 . C C 15.623 6.474 -3.300 1.00 . A A . 4 DBU C 1 1 18 4822 1 1 4 . CA C 16.251 5.538 -4.299 1.00 . A A . 4 DBU CA 1 1 18 4823 1 1 4 . CB C 17.556 5.083 -4.082 1.00 . A A . 4 DBU CB 1 1 18 4824 1 1 4 . CG C 18.283 4.145 -5.015 1.00 . A A . 4 DBU CG 1 1 18 4825 1 1 4 . H H 15.357 5.849 -6.138 1.00 . A A . 4 DBU H 1 1 18 4826 1 1 4 . HB H 18.044 5.440 -3.183 1.00 . A A . 4 DBU HB 1 1 18 4827 1 1 4 . HG1 H 17.562 3.619 -5.625 1.00 . A A . 4 DBU HG1 1 1 18 4828 1 1 4 . HG2 H 18.851 3.434 -4.435 1.00 . A A . 4 DBU HG2 1 1 18 4829 1 1 4 . HG3 H 18.950 4.708 -5.651 1.00 . A A . 4 DBU HG3 1 1 18 4830 1 1 4 . N N 15.363 5.259 -5.356 1.00 . A A . 4 DBU N 1 1 18 4831 1 1 4 . O O 15.669 7.689 -3.480 1.00 . A A . 4 DBU O 1 1 18 4832 1 1 5 ILE C C 13.222 5.919 -0.589 1.00 . A A . 5 ILE C 1 1 18 4833 1 1 5 ILE CA C 14.390 6.691 -1.201 1.00 . A A . 5 ILE CA 1 1 18 4834 1 1 5 ILE CB C 13.884 8.015 -1.784 1.00 . A A . 5 ILE CB 1 1 18 4835 1 1 5 ILE CD1 C 14.807 9.708 -0.165 1.00 . A A . 5 ILE CD1 1 1 18 4836 1 1 5 ILE CG1 C 14.946 9.103 -1.568 1.00 . A A . 5 ILE CG1 1 1 18 4837 1 1 5 ILE CG2 C 12.575 8.431 -1.097 1.00 . A A . 5 ILE CG2 1 1 18 4838 1 1 5 ILE H H 15.039 4.923 -2.173 1.00 . A A . 5 ILE H 1 1 18 4839 1 1 5 ILE HA H 15.106 6.902 -0.426 1.00 . A A . 5 ILE HA 1 1 18 4840 1 1 5 ILE HB H 13.712 7.886 -2.844 1.00 . A A . 5 ILE HB 1 1 18 4841 1 1 5 ILE HD11 H 15.713 10.232 0.094 1.00 . A A . 5 ILE HD11 1 1 18 4842 1 1 5 ILE HD12 H 14.628 8.918 0.550 1.00 . A A . 5 ILE HD12 1 1 18 4843 1 1 5 ILE HD13 H 13.975 10.399 -0.152 1.00 . A A . 5 ILE HD13 1 1 18 4844 1 1 5 ILE HG12 H 15.929 8.669 -1.676 1.00 . A A . 5 ILE HG12 1 1 18 4845 1 1 5 ILE HG13 H 14.816 9.879 -2.308 1.00 . A A . 5 ILE HG13 1 1 18 4846 1 1 5 ILE HG21 H 12.371 9.470 -1.309 1.00 . A A . 5 ILE HG21 1 1 18 4847 1 1 5 ILE HG22 H 12.673 8.295 -0.027 1.00 . A A . 5 ILE HG22 1 1 18 4848 1 1 5 ILE HG23 H 11.762 7.823 -1.463 1.00 . A A . 5 ILE HG23 1 1 18 4849 1 1 5 ILE N N 15.037 5.899 -2.247 1.00 . A A . 5 ILE N 1 1 18 4850 1 1 5 ILE O O 13.057 5.878 0.627 1.00 . A A . 5 ILE O 1 1 18 4851 1 1 6 PRO C C 11.608 3.406 -0.031 1.00 . A A . 6 PRO C 1 1 18 4852 1 1 6 PRO CA C 11.220 4.543 -0.961 1.00 . A A . 6 PRO CA 1 1 18 4853 1 1 6 PRO CB C 10.618 3.992 -2.256 1.00 . A A . 6 PRO CB 1 1 18 4854 1 1 6 PRO CD C 12.535 5.319 -2.878 1.00 . A A . 6 PRO CD 1 1 18 4855 1 1 6 PRO CG C 11.155 4.871 -3.340 1.00 . A A . 6 PRO CG 1 1 18 4856 1 1 6 PRO HA H 10.508 5.194 -0.483 1.00 . A A . 6 PRO HA 1 1 18 4857 1 1 6 PRO HB2 H 10.927 2.963 -2.400 1.00 . A A . 6 PRO HB2 1 1 18 4858 1 1 6 PRO HB3 H 9.542 4.060 -2.224 1.00 . A A . 6 PRO HB3 1 1 18 4859 1 1 6 PRO HD2 H 13.293 4.622 -3.203 1.00 . A A . 6 PRO HD2 1 1 18 4860 1 1 6 PRO HD3 H 12.749 6.310 -3.235 1.00 . A A . 6 PRO HD3 1 1 18 4861 1 1 6 PRO HG2 H 11.227 4.322 -4.270 1.00 . A A . 6 PRO HG2 1 1 18 4862 1 1 6 PRO HG3 H 10.523 5.735 -3.466 1.00 . A A . 6 PRO HG3 1 1 18 4863 1 1 6 PRO N N 12.413 5.322 -1.414 1.00 . A A . 6 PRO N 1 1 18 4864 1 1 6 PRO O O 10.781 2.902 0.728 1.00 . A A . 6 PRO O 1 1 18 4865 1 1 7 DAL C C 14.911 1.806 0.510 1.00 . A A . 7 DAL C 1 1 18 4866 1 1 7 DAL CA C 13.400 1.938 0.706 1.00 . A A . 7 DAL CA 1 1 18 4867 1 1 7 DAL CB C 13.075 2.199 2.171 1.00 . A A . 7 DAL CB 1 1 18 4868 1 1 7 DAL H H 13.467 3.468 -0.732 1.00 . A A . 7 DAL H 1 1 18 4869 1 1 7 DAL HA H 12.928 1.024 0.410 1.00 . A A . 7 DAL HA 1 1 18 4870 1 1 7 DAL HB1 H 12.978 3.258 2.336 1.00 . A A . 7 DAL HB1 1 1 18 4871 1 1 7 DAL HB2 H 13.859 1.811 2.795 1.00 . A A . 7 DAL HB2 1 1 18 4872 1 1 7 DAL N N 12.874 3.015 -0.111 1.00 . A A . 7 DAL N 1 1 18 4873 1 1 7 DAL O O 15.621 1.261 1.348 1.00 . A A . 7 DAL O 1 1 18 4874 1 1 8 LEU C C 17.625 2.842 0.242 1.00 . A A . 8 LEU C 1 1 18 4875 1 1 8 LEU CA C 16.818 2.258 -0.908 1.00 . A A . 8 LEU CA 1 1 18 4876 1 1 8 LEU CB C 17.084 3.063 -2.174 1.00 . A A . 8 LEU CB 1 1 18 4877 1 1 8 LEU CD1 C 17.896 1.391 -3.829 1.00 . A A . 8 LEU CD1 1 1 18 4878 1 1 8 LEU CD2 C 15.501 1.352 -3.126 1.00 . A A . 8 LEU CD2 1 1 18 4879 1 1 8 LEU CG C 16.709 2.252 -3.416 1.00 . A A . 8 LEU CG 1 1 18 4880 1 1 8 LEU H H 14.795 2.744 -1.247 1.00 . A A . 8 LEU H 1 1 18 4881 1 1 8 LEU HA H 17.110 1.233 -1.069 1.00 . A A . 8 LEU HA 1 1 18 4882 1 1 8 LEU HB2 H 16.494 3.965 -2.150 1.00 . A A . 8 LEU HB2 1 1 18 4883 1 1 8 LEU HB3 H 18.132 3.321 -2.221 1.00 . A A . 8 LEU HB3 1 1 18 4884 1 1 8 LEU HD11 H 17.593 0.355 -3.869 1.00 . A A . 8 LEU HD11 1 1 18 4885 1 1 8 LEU HD12 H 18.691 1.510 -3.108 1.00 . A A . 8 LEU HD12 1 1 18 4886 1 1 8 LEU HD13 H 18.242 1.703 -4.802 1.00 . A A . 8 LEU HD13 1 1 18 4887 1 1 8 LEU HD21 H 14.648 1.962 -2.870 1.00 . A A . 8 LEU HD21 1 1 18 4888 1 1 8 LEU HD22 H 15.732 0.691 -2.304 1.00 . A A . 8 LEU HD22 1 1 18 4889 1 1 8 LEU HD23 H 15.270 0.766 -4.005 1.00 . A A . 8 LEU HD23 1 1 18 4890 1 1 8 LEU HG H 16.466 2.933 -4.217 1.00 . A A . 8 LEU HG 1 1 18 4891 1 1 8 LEU N N 15.397 2.320 -0.607 1.00 . A A . 8 LEU N 1 1 18 4892 1 1 8 LEU O O 18.766 2.449 0.479 1.00 . A A . 8 LEU O 1 1 18 4893 1 1 9 MET C C 18.004 3.378 3.147 1.00 . A A . 9 MET C 1 1 18 4894 1 1 9 MET CA C 17.690 4.419 2.072 1.00 . A A . 9 MET CA 1 1 18 4895 1 1 9 MET CB C 16.779 5.496 2.655 1.00 . A A . 9 MET CB 1 1 18 4896 1 1 9 MET CE C 18.556 7.721 0.909 1.00 . A A . 9 MET CE 1 1 18 4897 1 1 9 MET CG C 16.271 6.400 1.536 1.00 . A A . 9 MET CG 1 1 18 4898 1 1 9 MET H H 16.111 4.058 0.712 1.00 . A A . 9 MET H 1 1 18 4899 1 1 9 MET HA H 18.608 4.872 1.731 1.00 . A A . 9 MET HA 1 1 18 4900 1 1 9 MET HB2 H 15.941 5.027 3.142 1.00 . A A . 9 MET HB2 1 1 18 4901 1 1 9 MET HB3 H 17.327 6.089 3.367 1.00 . A A . 9 MET HB3 1 1 18 4902 1 1 9 MET HE1 H 18.912 6.741 1.198 1.00 . A A . 9 MET HE1 1 1 18 4903 1 1 9 MET HE2 H 19.280 8.465 1.202 1.00 . A A . 9 MET HE2 1 1 18 4904 1 1 9 MET HE3 H 18.416 7.759 -0.161 1.00 . A A . 9 MET HE3 1 1 18 4905 1 1 9 MET HG2 H 16.558 5.987 0.576 1.00 . A A . 9 MET HG2 1 1 18 4906 1 1 9 MET HG3 H 15.193 6.460 1.594 1.00 . A A . 9 MET HG3 1 1 18 4907 1 1 9 MET N N 17.021 3.784 0.949 1.00 . A A . 9 MET N 1 1 18 4908 1 1 9 MET O O 19.078 3.398 3.751 1.00 . A A . 9 MET O 1 1 18 4909 1 1 9 MET SD S 16.980 8.054 1.732 1.00 . A A . 9 MET SD 1 1 18 4910 1 1 10 . C C 16.425 1.681 5.612 1.00 . A A . 10 DBB C 1 1 18 4911 1 1 10 . CA C 17.245 1.409 4.369 1.00 . A A . 10 DBB CA 1 1 18 4912 1 1 10 . CB C 16.833 0.058 3.774 1.00 . A A . 10 DBB CB 1 1 18 4913 1 1 10 . CG C 15.305 -0.062 3.761 1.00 . A A . 10 DBB CG 1 1 18 4914 1 1 10 . H H 16.227 2.497 2.860 1.00 . A A . 10 DBB H 1 1 18 4915 1 1 10 . HA H 18.289 1.362 4.639 1.00 . A A . 10 DBB HA 1 1 18 4916 1 1 10 . HB2 H 17.169 0.022 2.756 1.00 . A A . 10 DBB HB2 1 1 18 4917 1 1 10 . HG1 H 14.916 0.454 2.909 1.00 . A A . 10 DBB HG1 1 1 18 4918 1 1 10 . HG2 H 14.889 0.358 4.659 1.00 . A A . 10 DBB HG2 1 1 18 4919 1 1 10 . HG3 H 15.030 -1.096 3.694 1.00 . A A . 10 DBB HG3 1 1 18 4920 1 1 10 . N N 17.061 2.465 3.374 1.00 . A A . 10 DBB N 1 1 18 4921 1 1 10 . O O 16.846 1.379 6.728 1.00 . A A . 10 DBB O 1 1 18 4922 1 1 11 GLY C C 12.956 2.879 6.044 1.00 . A A . 11 GLY C 1 1 18 4923 1 1 11 GLY CA C 14.367 2.525 6.520 1.00 . A A . 11 GLY CA 1 1 18 4924 1 1 11 GLY H H 14.956 2.443 4.496 1.00 . A A . 11 GLY H 1 1 18 4925 1 1 11 GLY HA2 H 14.320 1.659 7.167 1.00 . A A . 11 GLY HA2 1 1 18 4926 1 1 11 GLY HA3 H 14.778 3.348 7.065 1.00 . A A . 11 GLY HA3 1 1 18 4927 1 1 11 GLY N N 15.244 2.236 5.409 1.00 . A A . 11 GLY N 1 1 18 4928 1 1 11 GLY O O 12.556 4.040 6.081 1.00 . A A . 11 GLY O 1 1 18 4929 1 1 12 CYS C C 10.062 0.796 5.029 1.00 . A A . 12 CYS C 1 1 18 4930 1 1 12 CYS CA C 10.854 2.095 5.095 1.00 . A A . 12 CYS CA 1 1 18 4931 1 1 12 CYS CB C 10.911 2.666 3.690 1.00 . A A . 12 CYS CB 1 1 18 4932 1 1 12 CYS H H 12.586 0.969 5.558 1.00 . A A . 12 CYS H 1 1 18 4933 1 1 12 CYS HA H 10.347 2.795 5.741 1.00 . A A . 12 CYS HA 1 1 18 4934 1 1 12 CYS HB2 H 9.924 2.983 3.381 1.00 . A A . 12 CYS HB2 1 1 18 4935 1 1 12 CYS HB3 H 11.584 3.499 3.662 1.00 . A A . 12 CYS HB3 1 1 18 4936 1 1 12 CYS N N 12.211 1.870 5.583 1.00 . A A . 12 CYS N 1 1 18 4937 1 1 12 CYS O O 10.447 -0.220 5.609 1.00 . A A . 12 CYS O 1 1 18 4938 1 1 12 CYS SG S 11.522 1.383 2.580 1.00 . A A . 12 CYS SG 1 1 18 4939 1 1 13 GLY C C 7.935 -0.617 2.622 1.00 . A A . 13 GLY C 1 1 18 4940 1 1 13 GLY CA C 8.088 -0.300 4.103 1.00 . A A . 13 GLY CA 1 1 18 4941 1 1 13 GLY H H 8.723 1.698 3.853 1.00 . A A . 13 GLY H 1 1 18 4942 1 1 13 GLY HA2 H 8.508 -1.152 4.611 1.00 . A A . 13 GLY HA2 1 1 18 4943 1 1 13 GLY HA3 H 7.118 -0.084 4.511 1.00 . A A . 13 GLY HA3 1 1 18 4944 1 1 13 GLY N N 8.956 0.853 4.291 1.00 . A A . 13 GLY N 1 1 18 4945 1 1 13 GLY O O 6.977 -1.272 2.212 1.00 . A A . 13 GLY O 1 1 18 4946 1 1 14 TRP C C 8.577 -1.840 0.077 1.00 . A A . 14 TRP C 1 1 18 4947 1 1 14 TRP CA C 8.867 -0.369 0.390 1.00 . A A . 14 TRP CA 1 1 18 4948 1 1 14 TRP CB C 10.216 0.048 -0.222 1.00 . A A . 14 TRP CB 1 1 18 4949 1 1 14 TRP CD1 C 11.286 -1.278 1.632 1.00 . A A . 14 TRP CD1 1 1 18 4950 1 1 14 TRP CD2 C 12.640 -1.065 -0.144 1.00 . A A . 14 TRP CD2 1 1 18 4951 1 1 14 TRP CE2 C 13.351 -1.819 0.817 1.00 . A A . 14 TRP CE2 1 1 18 4952 1 1 14 TRP CE3 C 13.278 -0.782 -1.364 1.00 . A A . 14 TRP CE3 1 1 18 4953 1 1 14 TRP CG C 11.331 -0.728 0.406 1.00 . A A . 14 TRP CG 1 1 18 4954 1 1 14 TRP CH2 C 15.261 -1.994 -0.648 1.00 . A A . 14 TRP CH2 1 1 18 4955 1 1 14 TRP CZ2 C 14.644 -2.282 0.574 1.00 . A A . 14 TRP CZ2 1 1 18 4956 1 1 14 TRP CZ3 C 14.578 -1.246 -1.614 1.00 . A A . 14 TRP CZ3 1 1 18 4957 1 1 14 TRP H H 9.620 0.371 2.221 1.00 . A A . 14 TRP H 1 1 18 4958 1 1 14 TRP HA H 8.087 0.238 -0.047 1.00 . A A . 14 TRP HA 1 1 18 4959 1 1 14 TRP HB2 H 10.201 -0.139 -1.280 1.00 . A A . 14 TRP HB2 1 1 18 4960 1 1 14 TRP HB3 H 10.373 1.099 -0.055 1.00 . A A . 14 TRP HB3 1 1 18 4961 1 1 14 TRP HD1 H 10.455 -1.219 2.305 1.00 . A A . 14 TRP HD1 1 1 18 4962 1 1 14 TRP HE1 H 12.704 -2.401 2.706 1.00 . A A . 14 TRP HE1 1 1 18 4963 1 1 14 TRP HE3 H 12.763 -0.205 -2.116 1.00 . A A . 14 TRP HE3 1 1 18 4964 1 1 14 TRP HH2 H 16.262 -2.344 -0.844 1.00 . A A . 14 TRP HH2 1 1 18 4965 1 1 14 TRP HZ2 H 15.167 -2.857 1.325 1.00 . A A . 14 TRP HZ2 1 1 18 4966 1 1 14 TRP HZ3 H 15.053 -1.024 -2.556 1.00 . A A . 14 TRP HZ3 1 1 18 4967 1 1 14 TRP N N 8.888 -0.142 1.828 1.00 . A A . 14 TRP N 1 1 18 4968 1 1 14 TRP NE1 N 12.482 -1.924 1.882 1.00 . A A . 14 TRP NE1 1 1 18 4969 1 1 14 TRP O O 7.485 -2.344 0.354 1.00 . A A . 14 TRP O 1 1 18 4970 1 1 15 LEU C C 9.880 -4.822 0.274 1.00 . A A . 15 LEU C 1 1 18 4971 1 1 15 LEU CA C 9.400 -3.924 -0.865 1.00 . A A . 15 LEU CA 1 1 18 4972 1 1 15 LEU CB C 10.208 -4.229 -2.133 1.00 . A A . 15 LEU CB 1 1 18 4973 1 1 15 LEU CD1 C 12.331 -3.677 -3.337 1.00 . A A . 15 LEU CD1 1 1 18 4974 1 1 15 LEU CD2 C 10.686 -1.855 -2.830 1.00 . A A . 15 LEU CD2 1 1 18 4975 1 1 15 LEU CG C 11.304 -3.170 -2.324 1.00 . A A . 15 LEU CG 1 1 18 4976 1 1 15 LEU H H 10.392 -2.076 -0.711 1.00 . A A . 15 LEU H 1 1 18 4977 1 1 15 LEU HA H 8.357 -4.128 -1.058 1.00 . A A . 15 LEU HA 1 1 18 4978 1 1 15 LEU HB2 H 10.662 -5.204 -2.040 1.00 . A A . 15 LEU HB2 1 1 18 4979 1 1 15 LEU HB3 H 9.549 -4.221 -2.989 1.00 . A A . 15 LEU HB3 1 1 18 4980 1 1 15 LEU HD11 H 11.886 -4.453 -3.941 1.00 . A A . 15 LEU HD11 1 1 18 4981 1 1 15 LEU HD12 H 13.184 -4.076 -2.809 1.00 . A A . 15 LEU HD12 1 1 18 4982 1 1 15 LEU HD13 H 12.647 -2.862 -3.969 1.00 . A A . 15 LEU HD13 1 1 18 4983 1 1 15 LEU HD21 H 9.663 -1.780 -2.490 1.00 . A A . 15 LEU HD21 1 1 18 4984 1 1 15 LEU HD22 H 10.710 -1.833 -3.907 1.00 . A A . 15 LEU HD22 1 1 18 4985 1 1 15 LEU HD23 H 11.253 -1.018 -2.442 1.00 . A A . 15 LEU HD23 1 1 18 4986 1 1 15 LEU HG H 11.796 -2.994 -1.379 1.00 . A A . 15 LEU HG 1 1 18 4987 1 1 15 LEU N N 9.555 -2.522 -0.508 1.00 . A A . 15 LEU N 1 1 18 4988 1 1 15 LEU O O 9.264 -5.845 0.571 1.00 . A A . 15 LEU O 1 1 18 4989 1 1 16 . C C 10.707 -4.973 3.227 1.00 . A A . 16 DBU C 1 1 18 4990 1 1 16 . CA C 11.519 -5.184 1.974 1.00 . A A . 16 DBU CA 1 1 18 4991 1 1 16 . CB C 12.634 -6.030 1.968 1.00 . A A . 16 DBU CB 1 1 18 4992 1 1 16 . CG C 13.505 -6.300 0.765 1.00 . A A . 16 DBU CG 1 1 18 4993 1 1 16 . H H 11.444 -3.610 0.644 1.00 . A A . 16 DBU H 1 1 18 4994 1 1 16 . HB H 12.907 -6.534 2.883 1.00 . A A . 16 DBU HB 1 1 18 4995 1 1 16 . HG1 H 13.514 -7.360 0.559 1.00 . A A . 16 DBU HG1 1 1 18 4996 1 1 16 . HG2 H 14.511 -5.965 0.971 1.00 . A A . 16 DBU HG2 1 1 18 4997 1 1 16 . HG3 H 13.116 -5.769 -0.090 1.00 . A A . 16 DBU HG3 1 1 18 4998 1 1 16 . N N 10.983 -4.432 0.909 1.00 . A A . 16 DBU N 1 1 18 4999 1 1 16 . O O 9.931 -5.835 3.642 1.00 . A A . 16 DBU O 1 1 18 5000 1 1 17 GLY C C 11.121 -3.135 6.187 1.00 . A A . 17 GLY C 1 1 18 5001 1 1 17 GLY CA C 10.160 -3.482 5.059 1.00 . A A . 17 GLY CA 1 1 18 5002 1 1 17 GLY H H 11.516 -3.156 3.465 1.00 . A A . 17 GLY H 1 1 18 5003 1 1 17 GLY HA2 H 9.511 -2.642 4.870 1.00 . A A . 17 GLY HA2 1 1 18 5004 1 1 17 GLY HA3 H 9.563 -4.332 5.354 1.00 . A A . 17 GLY HA3 1 1 18 5005 1 1 17 GLY N N 10.886 -3.808 3.839 1.00 . A A . 17 GLY N 1 1 18 5006 1 1 17 GLY O O 11.074 -2.038 6.742 1.00 . A A . 17 GLY O 1 1 18 5007 1 1 18 LEU C C 14.327 -3.513 6.998 1.00 . A A . 18 LEU C 1 1 18 5008 1 1 18 LEU CA C 12.967 -3.865 7.581 1.00 . A A . 18 LEU CA 1 1 18 5009 1 1 18 LEU CB C 13.093 -5.119 8.447 1.00 . A A . 18 LEU CB 1 1 18 5010 1 1 18 LEU CD1 C 11.864 -6.700 9.940 1.00 . A A . 18 LEU CD1 1 1 18 5011 1 1 18 LEU CD2 C 11.499 -4.238 10.153 1.00 . A A . 18 LEU CD2 1 1 18 5012 1 1 18 LEU CG C 11.773 -5.379 9.173 1.00 . A A . 18 LEU CG 1 1 18 5013 1 1 18 LEU H H 11.981 -4.934 6.037 1.00 . A A . 18 LEU H 1 1 18 5014 1 1 18 LEU HA H 12.633 -3.047 8.197 1.00 . A A . 18 LEU HA 1 1 18 5015 1 1 18 LEU HB2 H 13.334 -5.965 7.820 1.00 . A A . 18 LEU HB2 1 1 18 5016 1 1 18 LEU HB3 H 13.878 -4.974 9.174 1.00 . A A . 18 LEU HB3 1 1 18 5017 1 1 18 LEU HD11 H 12.870 -6.837 10.303 1.00 . A A . 18 LEU HD11 1 1 18 5018 1 1 18 LEU HD12 H 11.604 -7.516 9.283 1.00 . A A . 18 LEU HD12 1 1 18 5019 1 1 18 LEU HD13 H 11.180 -6.678 10.775 1.00 . A A . 18 LEU HD13 1 1 18 5020 1 1 18 LEU HD21 H 11.098 -4.640 11.071 1.00 . A A . 18 LEU HD21 1 1 18 5021 1 1 18 LEU HD22 H 10.785 -3.554 9.719 1.00 . A A . 18 LEU HD22 1 1 18 5022 1 1 18 LEU HD23 H 12.419 -3.713 10.362 1.00 . A A . 18 LEU HD23 1 1 18 5023 1 1 18 LEU HG H 10.971 -5.437 8.449 1.00 . A A . 18 LEU HG 1 1 18 5024 1 1 18 LEU N N 11.993 -4.079 6.518 1.00 . A A . 18 LEU N 1 1 18 5025 1 1 18 LEU O O 15.309 -3.378 7.729 1.00 . A A . 18 LEU O 1 1 18 5026 1 1 19 CYS C C 16.595 -4.217 5.066 1.00 . A A . 19 CYS C 1 1 18 5027 1 1 19 CYS CA C 15.639 -3.037 5.021 1.00 . A A . 19 CYS CA 1 1 18 5028 1 1 19 CYS CB C 16.288 -1.832 5.703 1.00 . A A . 19 CYS CB 1 1 18 5029 1 1 19 CYS H H 13.574 -3.493 5.145 1.00 . A A . 19 CYS H 1 1 18 5030 1 1 19 CYS HA H 15.439 -2.795 3.992 1.00 . A A . 19 CYS HA 1 1 18 5031 1 1 19 CYS HB2 H 15.562 -1.044 5.826 1.00 . A A . 19 CYS HB2 1 1 18 5032 1 1 19 CYS HB3 H 16.648 -2.129 6.676 1.00 . A A . 19 CYS HB3 1 1 18 5033 1 1 19 CYS N N 14.385 -3.371 5.682 1.00 . A A . 19 CYS N 1 1 18 5034 1 1 19 CYS O O 17.500 -4.265 5.900 1.00 . A A . 19 CYS O 1 1 18 5035 1 1 19 CYS SG S 17.684 -1.248 4.699 1.00 . A A . 19 CYS SG 1 1 18 5036 1 1 20 VAL C C 18.673 -5.950 3.744 1.00 . A A . 20 VAL C 1 1 18 5037 1 1 20 VAL CA C 17.246 -6.345 4.117 1.00 . A A . 20 VAL CA 1 1 18 5038 1 1 20 VAL CB C 16.703 -7.341 3.094 1.00 . A A . 20 VAL CB 1 1 18 5039 1 1 20 VAL CG1 C 17.622 -8.562 3.041 1.00 . A A . 20 VAL CG1 1 1 18 5040 1 1 20 VAL CG2 C 15.293 -7.771 3.508 1.00 . A A . 20 VAL CG2 1 1 18 5041 1 1 20 VAL H H 15.653 -5.080 3.529 1.00 . A A . 20 VAL H 1 1 18 5042 1 1 20 VAL HA H 17.255 -6.815 5.090 1.00 . A A . 20 VAL HA 1 1 18 5043 1 1 20 VAL HB H 16.669 -6.873 2.121 1.00 . A A . 20 VAL HB 1 1 18 5044 1 1 20 VAL HG11 H 17.031 -9.462 3.117 1.00 . A A . 20 VAL HG11 1 1 18 5045 1 1 20 VAL HG12 H 18.322 -8.522 3.863 1.00 . A A . 20 VAL HG12 1 1 18 5046 1 1 20 VAL HG13 H 18.165 -8.564 2.108 1.00 . A A . 20 VAL HG13 1 1 18 5047 1 1 20 VAL HG21 H 14.610 -6.942 3.380 1.00 . A A . 20 VAL HG21 1 1 18 5048 1 1 20 VAL HG22 H 15.298 -8.076 4.543 1.00 . A A . 20 VAL HG22 1 1 18 5049 1 1 20 VAL HG23 H 14.974 -8.599 2.890 1.00 . A A . 20 VAL HG23 1 1 18 5050 1 1 20 VAL N N 16.391 -5.169 4.167 1.00 . A A . 20 VAL N 1 1 18 5051 1 1 20 VAL O O 19.635 -6.422 4.349 1.00 . A A . 20 VAL O 1 1 18 5052 1 1 21 ARG C C 20.918 -4.066 3.475 1.00 . A A . 21 ARG C 1 1 18 5053 1 1 21 ARG CA C 20.119 -4.629 2.305 1.00 . A A . 21 ARG CA 1 1 18 5054 1 1 21 ARG CB C 19.970 -3.558 1.223 1.00 . A A . 21 ARG CB 1 1 18 5055 1 1 21 ARG CD C 21.202 -2.086 -0.376 1.00 . A A . 21 ARG CD 1 1 18 5056 1 1 21 ARG CG C 21.352 -3.149 0.714 1.00 . A A . 21 ARG CG 1 1 18 5057 1 1 21 ARG CZ C 23.166 -0.659 -0.323 1.00 . A A . 21 ARG CZ 1 1 18 5058 1 1 21 ARG H H 18.001 -4.734 2.300 1.00 . A A . 21 ARG H 1 1 18 5059 1 1 21 ARG HA H 20.654 -5.471 1.889 1.00 . A A . 21 ARG HA 1 1 18 5060 1 1 21 ARG HB2 H 19.385 -3.955 0.403 1.00 . A A . 21 ARG HB2 1 1 18 5061 1 1 21 ARG HB3 H 19.469 -2.695 1.637 1.00 . A A . 21 ARG HB3 1 1 18 5062 1 1 21 ARG HD2 H 20.624 -2.491 -1.193 1.00 . A A . 21 ARG HD2 1 1 18 5063 1 1 21 ARG HD3 H 20.688 -1.226 0.032 1.00 . A A . 21 ARG HD3 1 1 18 5064 1 1 21 ARG HE H 22.918 -2.168 -1.616 1.00 . A A . 21 ARG HE 1 1 18 5065 1 1 21 ARG HG2 H 21.932 -2.747 1.533 1.00 . A A . 21 ARG HG2 1 1 18 5066 1 1 21 ARG HG3 H 21.856 -4.012 0.306 1.00 . A A . 21 ARG HG3 1 1 18 5067 1 1 21 ARG HH11 H 21.736 -0.267 1.023 1.00 . A A . 21 ARG HH11 1 1 18 5068 1 1 21 ARG HH12 H 23.125 0.766 1.083 1.00 . A A . 21 ARG HH12 1 1 18 5069 1 1 21 ARG HH21 H 24.745 -0.816 -1.543 1.00 . A A . 21 ARG HH21 1 1 18 5070 1 1 21 ARG HH22 H 24.829 0.455 -0.370 1.00 . A A . 21 ARG HH22 1 1 18 5071 1 1 21 ARG N N 18.802 -5.080 2.745 1.00 . A A . 21 ARG N 1 1 18 5072 1 1 21 ARG NE N 22.513 -1.680 -0.869 1.00 . A A . 21 ARG NE 1 1 18 5073 1 1 21 ARG NH1 N 22.634 -0.002 0.672 1.00 . A A . 21 ARG NH1 1 1 18 5074 1 1 21 ARG NH2 N 24.337 -0.313 -0.782 1.00 . A A . 21 ARG NH2 1 1 18 5075 1 1 21 ARG O O 21.850 -4.726 3.901 1.00 . A A . 21 ARG O 1 1 18 5076 1 1 21 ARG OXT O 20.584 -2.983 3.927 1.00 . A A . 21 ARG OXT 1 1 19 5077 1 1 1 ALA C C 14.250 8.835 -10.759 1.00 . A A . 1 ALA C 1 1 19 5078 1 1 1 ALA CA C 14.445 10.345 -10.851 1.00 . A A . 1 ALA CA 1 1 19 5079 1 1 1 ALA CB C 13.448 10.941 -11.847 1.00 . A A . 1 ALA CB 1 1 19 5080 1 1 1 ALA H1 H 16.228 9.795 -11.777 1.00 . A A . 1 ALA H1 1 1 19 5081 1 1 1 ALA H2 H 16.423 10.887 -10.489 1.00 . A A . 1 ALA H2 1 1 19 5082 1 1 1 ALA H3 H 15.818 11.428 -11.982 1.00 . A A . 1 ALA H3 1 1 19 5083 1 1 1 ALA HA H 14.290 10.787 -9.879 1.00 . A A . 1 ALA HA 1 1 19 5084 1 1 1 ALA HB1 H 12.919 10.143 -12.348 1.00 . A A . 1 ALA HB1 1 1 19 5085 1 1 1 ALA HB2 H 13.979 11.535 -12.577 1.00 . A A . 1 ALA HB2 1 1 19 5086 1 1 1 ALA HB3 H 12.743 11.566 -11.319 1.00 . A A . 1 ALA HB3 1 1 19 5087 1 1 1 ALA N N 15.833 10.636 -11.309 1.00 . A A . 1 ALA N 1 1 19 5088 1 1 1 ALA O O 14.757 8.081 -11.588 1.00 . A A . 1 ALA O 1 1 19 5089 1 1 2 GLY C C 14.452 6.292 -8.904 1.00 . A A . 2 GLY C 1 1 19 5090 1 1 2 GLY CA C 13.254 6.979 -9.549 1.00 . A A . 2 GLY CA 1 1 19 5091 1 1 2 GLY H H 13.132 9.050 -9.112 1.00 . A A . 2 GLY H 1 1 19 5092 1 1 2 GLY HA2 H 12.388 6.858 -8.913 1.00 . A A . 2 GLY HA2 1 1 19 5093 1 1 2 GLY HA3 H 13.057 6.520 -10.505 1.00 . A A . 2 GLY HA3 1 1 19 5094 1 1 2 GLY N N 13.511 8.403 -9.741 1.00 . A A . 2 GLY N 1 1 19 5095 1 1 2 GLY O O 14.548 5.066 -8.901 1.00 . A A . 2 GLY O 1 1 19 5096 1 1 3 GLY C C 16.193 5.722 -6.494 1.00 . A A . 3 GLY C 1 1 19 5097 1 1 3 GLY CA C 16.556 6.552 -7.719 1.00 . A A . 3 GLY CA 1 1 19 5098 1 1 3 GLY H H 15.233 8.062 -8.397 1.00 . A A . 3 GLY H 1 1 19 5099 1 1 3 GLY HA2 H 17.086 5.930 -8.427 1.00 . A A . 3 GLY HA2 1 1 19 5100 1 1 3 GLY HA3 H 17.194 7.368 -7.416 1.00 . A A . 3 GLY HA3 1 1 19 5101 1 1 3 GLY N N 15.364 7.092 -8.363 1.00 . A A . 3 GLY N 1 1 19 5102 1 1 3 GLY O O 16.823 4.702 -6.213 1.00 . A A . 3 GLY O 1 1 19 5103 1 1 4 . C C 14.778 6.454 -3.425 1.00 . A A . 4 DBU C 1 1 19 5104 1 1 4 . CA C 14.717 5.526 -4.602 1.00 . A A . 4 DBU CA 1 1 19 5105 1 1 4 . CB C 14.238 4.235 -4.387 1.00 . A A . 4 DBU CB 1 1 19 5106 1 1 4 . CG C 14.139 3.233 -5.507 1.00 . A A . 4 DBU CG 1 1 19 5107 1 1 4 . H H 14.709 6.988 -6.026 1.00 . A A . 4 DBU H 1 1 19 5108 1 1 4 . HB H 13.936 3.965 -3.382 1.00 . A A . 4 DBU HB 1 1 19 5109 1 1 4 . HG1 H 14.195 3.761 -6.447 1.00 . A A . 4 DBU HG1 1 1 19 5110 1 1 4 . HG2 H 13.204 2.697 -5.447 1.00 . A A . 4 DBU HG2 1 1 19 5111 1 1 4 . HG3 H 14.961 2.537 -5.437 1.00 . A A . 4 DBU HG3 1 1 19 5112 1 1 4 . N N 15.178 6.169 -5.766 1.00 . A A . 4 DBU N 1 1 19 5113 1 1 4 . O O 15.058 7.646 -3.545 1.00 . A A . 4 DBU O 1 1 19 5114 1 1 5 ILE C C 13.607 5.955 0.000 1.00 . A A . 5 ILE C 1 1 19 5115 1 1 5 ILE CA C 14.516 6.623 -1.023 1.00 . A A . 5 ILE CA 1 1 19 5116 1 1 5 ILE CB C 14.062 8.066 -1.282 1.00 . A A . 5 ILE CB 1 1 19 5117 1 1 5 ILE CD1 C 14.931 10.382 -0.749 1.00 . A A . 5 ILE CD1 1 1 19 5118 1 1 5 ILE CG1 C 15.301 8.983 -1.254 1.00 . A A . 5 ILE CG1 1 1 19 5119 1 1 5 ILE CG2 C 13.043 8.509 -0.217 1.00 . A A . 5 ILE CG2 1 1 19 5120 1 1 5 ILE H H 14.299 4.919 -2.238 1.00 . A A . 5 ILE H 1 1 19 5121 1 1 5 ILE HA H 15.517 6.640 -0.642 1.00 . A A . 5 ILE HA 1 1 19 5122 1 1 5 ILE HB H 13.601 8.114 -2.257 1.00 . A A . 5 ILE HB 1 1 19 5123 1 1 5 ILE HD11 H 13.891 10.580 -0.962 1.00 . A A . 5 ILE HD11 1 1 19 5124 1 1 5 ILE HD12 H 15.548 11.118 -1.243 1.00 . A A . 5 ILE HD12 1 1 19 5125 1 1 5 ILE HD13 H 15.096 10.431 0.319 1.00 . A A . 5 ILE HD13 1 1 19 5126 1 1 5 ILE HG12 H 16.046 8.554 -0.602 1.00 . A A . 5 ILE HG12 1 1 19 5127 1 1 5 ILE HG13 H 15.706 9.063 -2.252 1.00 . A A . 5 ILE HG13 1 1 19 5128 1 1 5 ILE HG21 H 12.680 9.497 -0.456 1.00 . A A . 5 ILE HG21 1 1 19 5129 1 1 5 ILE HG22 H 13.520 8.526 0.752 1.00 . A A . 5 ILE HG22 1 1 19 5130 1 1 5 ILE HG23 H 12.217 7.815 -0.199 1.00 . A A . 5 ILE HG23 1 1 19 5131 1 1 5 ILE N N 14.508 5.873 -2.262 1.00 . A A . 5 ILE N 1 1 19 5132 1 1 5 ILE O O 13.960 5.816 1.167 1.00 . A A . 5 ILE O 1 1 19 5133 1 1 6 PRO C C 12.060 3.703 1.199 1.00 . A A . 6 PRO C 1 1 19 5134 1 1 6 PRO CA C 11.466 4.902 0.498 1.00 . A A . 6 PRO CA 1 1 19 5135 1 1 6 PRO CB C 10.333 4.458 -0.427 1.00 . A A . 6 PRO CB 1 1 19 5136 1 1 6 PRO CD C 11.933 5.641 -1.786 1.00 . A A . 6 PRO CD 1 1 19 5137 1 1 6 PRO CG C 10.448 5.337 -1.628 1.00 . A A . 6 PRO CG 1 1 19 5138 1 1 6 PRO HA H 11.090 5.611 1.214 1.00 . A A . 6 PRO HA 1 1 19 5139 1 1 6 PRO HB2 H 10.465 3.416 -0.699 1.00 . A A . 6 PRO HB2 1 1 19 5140 1 1 6 PRO HB3 H 9.380 4.601 0.050 1.00 . A A . 6 PRO HB3 1 1 19 5141 1 1 6 PRO HD2 H 12.403 4.904 -2.422 1.00 . A A . 6 PRO HD2 1 1 19 5142 1 1 6 PRO HD3 H 12.080 6.633 -2.176 1.00 . A A . 6 PRO HD3 1 1 19 5143 1 1 6 PRO HG2 H 10.073 4.824 -2.504 1.00 . A A . 6 PRO HG2 1 1 19 5144 1 1 6 PRO HG3 H 9.912 6.256 -1.471 1.00 . A A . 6 PRO HG3 1 1 19 5145 1 1 6 PRO N N 12.443 5.549 -0.413 1.00 . A A . 6 PRO N 1 1 19 5146 1 1 6 PRO O O 11.958 3.583 2.408 1.00 . A A . 6 PRO O 1 1 19 5147 1 1 7 DAL C C 14.782 1.568 0.595 1.00 . A A . 7 DAL C 1 1 19 5148 1 1 7 DAL CA C 13.285 1.598 0.890 1.00 . A A . 7 DAL CA 1 1 19 5149 1 1 7 DAL CB C 13.023 1.391 2.384 1.00 . A A . 7 DAL CB 1 1 19 5150 1 1 7 DAL H H 12.696 3.009 -0.557 1.00 . A A . 7 DAL H 1 1 19 5151 1 1 7 DAL HA H 12.831 0.792 0.359 1.00 . A A . 7 DAL HA 1 1 19 5152 1 1 7 DAL HB1 H 13.366 2.251 2.939 1.00 . A A . 7 DAL HB1 1 1 19 5153 1 1 7 DAL HB2 H 13.552 0.512 2.721 1.00 . A A . 7 DAL HB2 1 1 19 5154 1 1 7 DAL N N 12.671 2.827 0.402 1.00 . A A . 7 DAL N 1 1 19 5155 1 1 7 DAL O O 15.538 0.842 1.236 1.00 . A A . 7 DAL O 1 1 19 5156 1 1 8 LEU C C 17.439 2.915 0.389 1.00 . A A . 8 LEU C 1 1 19 5157 1 1 8 LEU CA C 16.608 2.393 -0.765 1.00 . A A . 8 LEU CA 1 1 19 5158 1 1 8 LEU CB C 16.792 3.317 -1.956 1.00 . A A . 8 LEU CB 1 1 19 5159 1 1 8 LEU CD1 C 17.527 1.590 -3.576 1.00 . A A . 8 LEU CD1 1 1 19 5160 1 1 8 LEU CD2 C 15.098 1.829 -3.030 1.00 . A A . 8 LEU CD2 1 1 19 5161 1 1 8 LEU CG C 16.420 2.580 -3.232 1.00 . A A . 8 LEU CG 1 1 19 5162 1 1 8 LEU H H 14.556 2.903 -0.875 1.00 . A A . 8 LEU H 1 1 19 5163 1 1 8 LEU HA H 16.942 1.398 -1.028 1.00 . A A . 8 LEU HA 1 1 19 5164 1 1 8 LEU HB2 H 16.153 4.180 -1.841 1.00 . A A . 8 LEU HB2 1 1 19 5165 1 1 8 LEU HB3 H 17.821 3.632 -2.011 1.00 . A A . 8 LEU HB3 1 1 19 5166 1 1 8 LEU HD11 H 18.245 1.562 -2.770 1.00 . A A . 8 LEU HD11 1 1 19 5167 1 1 8 LEU HD12 H 18.018 1.902 -4.485 1.00 . A A . 8 LEU HD12 1 1 19 5168 1 1 8 LEU HD13 H 17.103 0.607 -3.713 1.00 . A A . 8 LEU HD13 1 1 19 5169 1 1 8 LEU HD21 H 14.359 2.500 -2.616 1.00 . A A . 8 LEU HD21 1 1 19 5170 1 1 8 LEU HD22 H 15.253 1.004 -2.349 1.00 . A A . 8 LEU HD22 1 1 19 5171 1 1 8 LEU HD23 H 14.748 1.448 -3.978 1.00 . A A . 8 LEU HD23 1 1 19 5172 1 1 8 LEU HG H 16.319 3.295 -4.030 1.00 . A A . 8 LEU HG 1 1 19 5173 1 1 8 LEU N N 15.202 2.349 -0.387 1.00 . A A . 8 LEU N 1 1 19 5174 1 1 8 LEU O O 18.557 2.467 0.634 1.00 . A A . 8 LEU O 1 1 19 5175 1 1 9 MET C C 18.008 3.452 3.191 1.00 . A A . 9 MET C 1 1 19 5176 1 1 9 MET CA C 17.536 4.509 2.203 1.00 . A A . 9 MET CA 1 1 19 5177 1 1 9 MET CB C 16.542 5.448 2.865 1.00 . A A . 9 MET CB 1 1 19 5178 1 1 9 MET CE C 18.460 7.548 0.672 1.00 . A A . 9 MET CE 1 1 19 5179 1 1 9 MET CG C 16.243 6.586 1.906 1.00 . A A . 9 MET CG 1 1 19 5180 1 1 9 MET H H 15.982 4.198 0.816 1.00 . A A . 9 MET H 1 1 19 5181 1 1 9 MET HA H 18.382 5.076 1.852 1.00 . A A . 9 MET HA 1 1 19 5182 1 1 9 MET HB2 H 15.627 4.910 3.071 1.00 . A A . 9 MET HB2 1 1 19 5183 1 1 9 MET HB3 H 16.953 5.844 3.776 1.00 . A A . 9 MET HB3 1 1 19 5184 1 1 9 MET HE1 H 18.420 6.488 0.458 1.00 . A A . 9 MET HE1 1 1 19 5185 1 1 9 MET HE2 H 19.483 7.838 0.856 1.00 . A A . 9 MET HE2 1 1 19 5186 1 1 9 MET HE3 H 18.077 8.105 -0.173 1.00 . A A . 9 MET HE3 1 1 19 5187 1 1 9 MET HG2 H 16.293 6.216 0.890 1.00 . A A . 9 MET HG2 1 1 19 5188 1 1 9 MET HG3 H 15.256 6.962 2.108 1.00 . A A . 9 MET HG3 1 1 19 5189 1 1 9 MET N N 16.873 3.886 1.079 1.00 . A A . 9 MET N 1 1 19 5190 1 1 9 MET O O 19.137 3.507 3.679 1.00 . A A . 9 MET O 1 1 19 5191 1 1 9 MET SD S 17.457 7.906 2.133 1.00 . A A . 9 MET SD 1 1 19 5192 1 1 10 . C C 16.745 1.463 5.666 1.00 . A A . 10 DBB C 1 1 19 5193 1 1 10 . CA C 17.513 1.393 4.354 1.00 . A A . 10 DBB CA 1 1 19 5194 1 1 10 . CB C 17.230 0.062 3.668 1.00 . A A . 10 DBB CB 1 1 19 5195 1 1 10 . CG C 15.717 -0.094 3.538 1.00 . A A . 10 DBB CG 1 1 19 5196 1 1 10 . H H 16.277 2.469 3.016 1.00 . A A . 10 DBB H 1 1 19 5197 1 1 10 . HA H 18.569 1.451 4.566 1.00 . A A . 10 DBB HA 1 1 19 5198 1 1 10 . HB2 H 17.635 0.102 2.674 1.00 . A A . 10 DBB HB2 1 1 19 5199 1 1 10 . HG1 H 15.289 0.855 3.236 1.00 . A A . 10 DBB HG1 1 1 19 5200 1 1 10 . HG2 H 15.300 -0.393 4.484 1.00 . A A . 10 DBB HG2 1 1 19 5201 1 1 10 . HG3 H 15.494 -0.840 2.790 1.00 . A A . 10 DBB HG3 1 1 19 5202 1 1 10 . N N 17.153 2.476 3.453 1.00 . A A . 10 DBB N 1 1 19 5203 1 1 10 . O O 17.343 1.442 6.741 1.00 . A A . 10 DBB O 1 1 19 5204 1 1 11 GLY C C 13.154 1.880 6.443 1.00 . A A . 11 GLY C 1 1 19 5205 1 1 11 GLY CA C 14.611 1.586 6.779 1.00 . A A . 11 GLY CA 1 1 19 5206 1 1 11 GLY H H 14.989 1.542 4.707 1.00 . A A . 11 GLY H 1 1 19 5207 1 1 11 GLY HA2 H 14.675 0.639 7.299 1.00 . A A . 11 GLY HA2 1 1 19 5208 1 1 11 GLY HA3 H 14.993 2.364 7.411 1.00 . A A . 11 GLY HA3 1 1 19 5209 1 1 11 GLY N N 15.422 1.530 5.581 1.00 . A A . 11 GLY N 1 1 19 5210 1 1 11 GLY O O 12.628 2.931 6.810 1.00 . A A . 11 GLY O 1 1 19 5211 1 1 12 CYS C C 10.403 -0.126 4.971 1.00 . A A . 12 CYS C 1 1 19 5212 1 1 12 CYS CA C 11.116 1.171 5.349 1.00 . A A . 12 CYS CA 1 1 19 5213 1 1 12 CYS CB C 11.079 2.111 4.160 1.00 . A A . 12 CYS CB 1 1 19 5214 1 1 12 CYS H H 12.971 0.146 5.444 1.00 . A A . 12 CYS H 1 1 19 5215 1 1 12 CYS HA H 10.593 1.636 6.171 1.00 . A A . 12 CYS HA 1 1 19 5216 1 1 12 CYS HB2 H 10.144 2.647 4.150 1.00 . A A . 12 CYS HB2 1 1 19 5217 1 1 12 CYS HB3 H 11.896 2.802 4.230 1.00 . A A . 12 CYS HB3 1 1 19 5218 1 1 12 CYS N N 12.507 0.959 5.730 1.00 . A A . 12 CYS N 1 1 19 5219 1 1 12 CYS O O 11.018 -1.188 4.873 1.00 . A A . 12 CYS O 1 1 19 5220 1 1 12 CYS SG S 11.246 1.153 2.641 1.00 . A A . 12 CYS SG 1 1 19 5221 1 1 13 GLY C C 8.076 -1.162 2.839 1.00 . A A . 13 GLY C 1 1 19 5222 1 1 13 GLY CA C 8.273 -1.153 4.347 1.00 . A A . 13 GLY CA 1 1 19 5223 1 1 13 GLY H H 8.673 0.872 4.821 1.00 . A A . 13 GLY H 1 1 19 5224 1 1 13 GLY HA2 H 8.754 -2.064 4.653 1.00 . A A . 13 GLY HA2 1 1 19 5225 1 1 13 GLY HA3 H 7.310 -1.080 4.818 1.00 . A A . 13 GLY HA3 1 1 19 5226 1 1 13 GLY N N 9.094 -0.009 4.738 1.00 . A A . 13 GLY N 1 1 19 5227 1 1 13 GLY O O 6.986 -1.444 2.342 1.00 . A A . 13 GLY O 1 1 19 5228 1 1 14 TRP C C 8.754 -2.167 0.090 1.00 . A A . 14 TRP C 1 1 19 5229 1 1 14 TRP CA C 9.076 -0.788 0.671 1.00 . A A . 14 TRP CA 1 1 19 5230 1 1 14 TRP CB C 10.403 -0.250 0.109 1.00 . A A . 14 TRP CB 1 1 19 5231 1 1 14 TRP CD1 C 11.564 -1.894 1.633 1.00 . A A . 14 TRP CD1 1 1 19 5232 1 1 14 TRP CD2 C 12.848 -1.318 -0.116 1.00 . A A . 14 TRP CD2 1 1 19 5233 1 1 14 TRP CE2 C 13.606 -2.230 0.652 1.00 . A A . 14 TRP CE2 1 1 19 5234 1 1 14 TRP CE3 C 13.431 -0.791 -1.284 1.00 . A A . 14 TRP CE3 1 1 19 5235 1 1 14 TRP CG C 11.553 -1.121 0.534 1.00 . A A . 14 TRP CG 1 1 19 5236 1 1 14 TRP CH2 C 15.459 -2.074 -0.889 1.00 . A A . 14 TRP CH2 1 1 19 5237 1 1 14 TRP CZ2 C 14.897 -2.609 0.275 1.00 . A A . 14 TRP CZ2 1 1 19 5238 1 1 14 TRP CZ3 C 14.728 -1.168 -1.664 1.00 . A A . 14 TRP CZ3 1 1 19 5239 1 1 14 TRP H H 9.972 -0.612 2.573 1.00 . A A . 14 TRP H 1 1 19 5240 1 1 14 TRP HA H 8.287 -0.107 0.387 1.00 . A A . 14 TRP HA 1 1 19 5241 1 1 14 TRP HB2 H 10.348 -0.227 -0.960 1.00 . A A . 14 TRP HB2 1 1 19 5242 1 1 14 TRP HB3 H 10.561 0.751 0.470 1.00 . A A . 14 TRP HB3 1 1 19 5243 1 1 14 TRP HD1 H 10.756 -1.981 2.334 1.00 . A A . 14 TRP HD1 1 1 19 5244 1 1 14 TRP HE1 H 13.039 -3.180 2.419 1.00 . A A . 14 TRP HE1 1 1 19 5245 1 1 14 TRP HE3 H 12.880 -0.090 -1.887 1.00 . A A . 14 TRP HE3 1 1 19 5246 1 1 14 TRP HH2 H 16.458 -2.354 -1.188 1.00 . A A . 14 TRP HH2 1 1 19 5247 1 1 14 TRP HZ2 H 15.456 -3.308 0.879 1.00 . A A . 14 TRP HZ2 1 1 19 5248 1 1 14 TRP HZ3 H 15.163 -0.758 -2.563 1.00 . A A . 14 TRP HZ3 1 1 19 5249 1 1 14 TRP N N 9.137 -0.835 2.120 1.00 . A A . 14 TRP N 1 1 19 5250 1 1 14 TRP NE1 N 12.778 -2.556 1.709 1.00 . A A . 14 TRP NE1 1 1 19 5251 1 1 14 TRP O O 7.662 -2.697 0.296 1.00 . A A . 14 TRP O 1 1 19 5252 1 1 15 LEU C C 10.210 -5.116 -0.488 1.00 . A A . 15 LEU C 1 1 19 5253 1 1 15 LEU CA C 9.512 -4.020 -1.288 1.00 . A A . 15 LEU CA 1 1 19 5254 1 1 15 LEU CB C 10.098 -3.963 -2.701 1.00 . A A . 15 LEU CB 1 1 19 5255 1 1 15 LEU CD1 C 12.133 -3.193 -3.940 1.00 . A A . 15 LEU CD1 1 1 19 5256 1 1 15 LEU CD2 C 10.662 -1.511 -2.828 1.00 . A A . 15 LEU CD2 1 1 19 5257 1 1 15 LEU CG C 11.235 -2.932 -2.736 1.00 . A A . 15 LEU CG 1 1 19 5258 1 1 15 LEU H H 10.530 -2.248 -0.800 1.00 . A A . 15 LEU H 1 1 19 5259 1 1 15 LEU HA H 8.458 -4.240 -1.352 1.00 . A A . 15 LEU HA 1 1 19 5260 1 1 15 LEU HB2 H 10.482 -4.936 -2.973 1.00 . A A . 15 LEU HB2 1 1 19 5261 1 1 15 LEU HB3 H 9.327 -3.670 -3.399 1.00 . A A . 15 LEU HB3 1 1 19 5262 1 1 15 LEU HD11 H 13.164 -3.038 -3.654 1.00 . A A . 15 LEU HD11 1 1 19 5263 1 1 15 LEU HD12 H 11.872 -2.512 -4.736 1.00 . A A . 15 LEU HD12 1 1 19 5264 1 1 15 LEU HD13 H 12.000 -4.210 -4.272 1.00 . A A . 15 LEU HD13 1 1 19 5265 1 1 15 LEU HD21 H 11.342 -0.821 -2.345 1.00 . A A . 15 LEU HD21 1 1 19 5266 1 1 15 LEU HD22 H 9.701 -1.469 -2.332 1.00 . A A . 15 LEU HD22 1 1 19 5267 1 1 15 LEU HD23 H 10.545 -1.231 -3.862 1.00 . A A . 15 LEU HD23 1 1 19 5268 1 1 15 LEU HG H 11.821 -3.024 -1.832 1.00 . A A . 15 LEU HG 1 1 19 5269 1 1 15 LEU N N 9.696 -2.724 -0.655 1.00 . A A . 15 LEU N 1 1 19 5270 1 1 15 LEU O O 10.184 -6.286 -0.867 1.00 . A A . 15 LEU O 1 1 19 5271 1 1 16 . C C 10.948 -5.613 2.839 1.00 . A A . 16 DBU C 1 1 19 5272 1 1 16 . CA C 11.529 -5.633 1.447 1.00 . A A . 16 DBU CA 1 1 19 5273 1 1 16 . CB C 12.605 -6.469 1.124 1.00 . A A . 16 DBU CB 1 1 19 5274 1 1 16 . CG C 13.251 -6.556 -0.234 1.00 . A A . 16 DBU CG 1 1 19 5275 1 1 16 . H H 10.834 -3.785 0.880 1.00 . A A . 16 DBU H 1 1 19 5276 1 1 16 . HB H 13.015 -7.106 1.893 1.00 . A A . 16 DBU HB 1 1 19 5277 1 1 16 . HG1 H 12.835 -5.799 -0.882 1.00 . A A . 16 DBU HG1 1 1 19 5278 1 1 16 . HG2 H 13.071 -7.533 -0.658 1.00 . A A . 16 DBU HG2 1 1 19 5279 1 1 16 . HG3 H 14.316 -6.399 -0.134 1.00 . A A . 16 DBU HG3 1 1 19 5280 1 1 16 . N N 10.838 -4.727 0.617 1.00 . A A . 16 DBU N 1 1 19 5281 1 1 16 . O O 10.437 -6.622 3.328 1.00 . A A . 16 DBU O 1 1 19 5282 1 1 17 GLY C C 11.606 -4.243 5.864 1.00 . A A . 17 GLY C 1 1 19 5283 1 1 17 GLY CA C 10.486 -4.321 4.833 1.00 . A A . 17 GLY CA 1 1 19 5284 1 1 17 GLY H H 11.432 -3.677 3.051 1.00 . A A . 17 GLY H 1 1 19 5285 1 1 17 GLY HA2 H 9.894 -3.422 4.885 1.00 . A A . 17 GLY HA2 1 1 19 5286 1 1 17 GLY HA3 H 9.861 -5.172 5.055 1.00 . A A . 17 GLY HA3 1 1 19 5287 1 1 17 GLY N N 11.018 -4.454 3.486 1.00 . A A . 17 GLY N 1 1 19 5288 1 1 17 GLY O O 12.335 -5.211 6.080 1.00 . A A . 17 GLY O 1 1 19 5289 1 1 18 LEU C C 14.146 -3.168 6.912 1.00 . A A . 18 LEU C 1 1 19 5290 1 1 18 LEU CA C 12.770 -2.880 7.502 1.00 . A A . 18 LEU CA 1 1 19 5291 1 1 18 LEU CB C 12.523 -3.800 8.701 1.00 . A A . 18 LEU CB 1 1 19 5292 1 1 18 LEU CD1 C 10.867 -4.446 10.457 1.00 . A A . 18 LEU CD1 1 1 19 5293 1 1 18 LEU CD2 C 11.424 -2.040 10.095 1.00 . A A . 18 LEU CD2 1 1 19 5294 1 1 18 LEU CG C 11.229 -3.392 9.407 1.00 . A A . 18 LEU CG 1 1 19 5295 1 1 18 LEU H H 11.126 -2.347 6.275 1.00 . A A . 18 LEU H 1 1 19 5296 1 1 18 LEU HA H 12.739 -1.854 7.837 1.00 . A A . 18 LEU HA 1 1 19 5297 1 1 18 LEU HB2 H 12.441 -4.821 8.358 1.00 . A A . 18 LEU HB2 1 1 19 5298 1 1 18 LEU HB3 H 13.349 -3.717 9.393 1.00 . A A . 18 LEU HB3 1 1 19 5299 1 1 18 LEU HD11 H 10.890 -3.998 11.439 1.00 . A A . 18 LEU HD11 1 1 19 5300 1 1 18 LEU HD12 H 11.581 -5.256 10.414 1.00 . A A . 18 LEU HD12 1 1 19 5301 1 1 18 LEU HD13 H 9.877 -4.828 10.258 1.00 . A A . 18 LEU HD13 1 1 19 5302 1 1 18 LEU HD21 H 10.513 -1.465 10.027 1.00 . A A . 18 LEU HD21 1 1 19 5303 1 1 18 LEU HD22 H 12.226 -1.502 9.611 1.00 . A A . 18 LEU HD22 1 1 19 5304 1 1 18 LEU HD23 H 11.673 -2.198 11.135 1.00 . A A . 18 LEU HD23 1 1 19 5305 1 1 18 LEU HG H 10.431 -3.318 8.683 1.00 . A A . 18 LEU HG 1 1 19 5306 1 1 18 LEU N N 11.736 -3.081 6.495 1.00 . A A . 18 LEU N 1 1 19 5307 1 1 18 LEU O O 14.853 -4.068 7.366 1.00 . A A . 18 LEU O 1 1 19 5308 1 1 19 CYS C C 16.342 -3.980 5.436 1.00 . A A . 19 CYS C 1 1 19 5309 1 1 19 CYS CA C 15.809 -2.566 5.245 1.00 . A A . 19 CYS CA 1 1 19 5310 1 1 19 CYS CB C 16.812 -1.571 5.814 1.00 . A A . 19 CYS CB 1 1 19 5311 1 1 19 CYS H H 13.909 -1.693 5.582 1.00 . A A . 19 CYS H 1 1 19 5312 1 1 19 CYS HA H 15.696 -2.376 4.188 1.00 . A A . 19 CYS HA 1 1 19 5313 1 1 19 CYS HB2 H 16.305 -0.656 6.068 1.00 . A A . 19 CYS HB2 1 1 19 5314 1 1 19 CYS HB3 H 17.266 -1.988 6.702 1.00 . A A . 19 CYS HB3 1 1 19 5315 1 1 19 CYS N N 14.518 -2.394 5.897 1.00 . A A . 19 CYS N 1 1 19 5316 1 1 19 CYS O O 17.016 -4.275 6.424 1.00 . A A . 19 CYS O 1 1 19 5317 1 1 19 CYS SG S 18.092 -1.242 4.581 1.00 . A A . 19 CYS SG 1 1 19 5318 1 1 20 VAL C C 17.347 -6.583 3.326 1.00 . A A . 20 VAL C 1 1 19 5319 1 1 20 VAL CA C 16.500 -6.230 4.549 1.00 . A A . 20 VAL CA 1 1 19 5320 1 1 20 VAL CB C 15.300 -7.171 4.639 1.00 . A A . 20 VAL CB 1 1 19 5321 1 1 20 VAL CG1 C 14.757 -7.163 6.070 1.00 . A A . 20 VAL CG1 1 1 19 5322 1 1 20 VAL CG2 C 14.210 -6.694 3.680 1.00 . A A . 20 VAL CG2 1 1 19 5323 1 1 20 VAL H H 15.506 -4.558 3.715 1.00 . A A . 20 VAL H 1 1 19 5324 1 1 20 VAL HA H 17.104 -6.353 5.436 1.00 . A A . 20 VAL HA 1 1 19 5325 1 1 20 VAL HB H 15.607 -8.173 4.374 1.00 . A A . 20 VAL HB 1 1 19 5326 1 1 20 VAL HG11 H 13.794 -7.650 6.091 1.00 . A A . 20 VAL HG11 1 1 19 5327 1 1 20 VAL HG12 H 14.652 -6.142 6.409 1.00 . A A . 20 VAL HG12 1 1 19 5328 1 1 20 VAL HG13 H 15.442 -7.689 6.719 1.00 . A A . 20 VAL HG13 1 1 19 5329 1 1 20 VAL HG21 H 13.783 -5.773 4.050 1.00 . A A . 20 VAL HG21 1 1 19 5330 1 1 20 VAL HG22 H 13.437 -7.446 3.610 1.00 . A A . 20 VAL HG22 1 1 19 5331 1 1 20 VAL HG23 H 14.638 -6.525 2.703 1.00 . A A . 20 VAL HG23 1 1 19 5332 1 1 20 VAL N N 16.042 -4.851 4.481 1.00 . A A . 20 VAL N 1 1 19 5333 1 1 20 VAL O O 17.880 -7.689 3.230 1.00 . A A . 20 VAL O 1 1 19 5334 1 1 21 ARG C C 19.334 -6.911 1.441 1.00 . A A . 21 ARG C 1 1 19 5335 1 1 21 ARG CA C 18.246 -5.872 1.185 1.00 . A A . 21 ARG CA 1 1 19 5336 1 1 21 ARG CB C 18.891 -4.567 0.709 1.00 . A A . 21 ARG CB 1 1 19 5337 1 1 21 ARG CD C 20.579 -2.814 1.260 1.00 . A A . 21 ARG CD 1 1 19 5338 1 1 21 ARG CG C 19.833 -4.037 1.793 1.00 . A A . 21 ARG CG 1 1 19 5339 1 1 21 ARG CZ C 20.034 -0.646 0.320 1.00 . A A . 21 ARG CZ 1 1 19 5340 1 1 21 ARG H H 17.017 -4.778 2.523 1.00 . A A . 21 ARG H 1 1 19 5341 1 1 21 ARG HA H 17.591 -6.237 0.411 1.00 . A A . 21 ARG HA 1 1 19 5342 1 1 21 ARG HB2 H 19.451 -4.752 -0.195 1.00 . A A . 21 ARG HB2 1 1 19 5343 1 1 21 ARG HB3 H 18.121 -3.832 0.515 1.00 . A A . 21 ARG HB3 1 1 19 5344 1 1 21 ARG HD2 H 21.284 -2.475 2.004 1.00 . A A . 21 ARG HD2 1 1 19 5345 1 1 21 ARG HD3 H 21.114 -3.087 0.361 1.00 . A A . 21 ARG HD3 1 1 19 5346 1 1 21 ARG HE H 18.705 -1.828 1.238 1.00 . A A . 21 ARG HE 1 1 19 5347 1 1 21 ARG HG2 H 19.258 -3.759 2.664 1.00 . A A . 21 ARG HG2 1 1 19 5348 1 1 21 ARG HG3 H 20.543 -4.805 2.059 1.00 . A A . 21 ARG HG3 1 1 19 5349 1 1 21 ARG HH11 H 21.938 -1.240 0.156 1.00 . A A . 21 ARG HH11 1 1 19 5350 1 1 21 ARG HH12 H 21.574 0.308 -0.529 1.00 . A A . 21 ARG HH12 1 1 19 5351 1 1 21 ARG HH21 H 18.217 0.192 0.329 1.00 . A A . 21 ARG HH21 1 1 19 5352 1 1 21 ARG HH22 H 19.468 1.119 -0.432 1.00 . A A . 21 ARG HH22 1 1 19 5353 1 1 21 ARG N N 17.464 -5.640 2.396 1.00 . A A . 21 ARG N 1 1 19 5354 1 1 21 ARG NE N 19.641 -1.741 0.961 1.00 . A A . 21 ARG NE 1 1 19 5355 1 1 21 ARG NH1 N 21.280 -0.516 -0.046 1.00 . A A . 21 ARG NH1 1 1 19 5356 1 1 21 ARG NH2 N 19.173 0.295 0.052 1.00 . A A . 21 ARG NH2 1 1 19 5357 1 1 21 ARG O O 19.515 -7.770 0.593 1.00 . A A . 21 ARG O 1 1 19 5358 1 1 21 ARG OXT O 19.972 -6.830 2.478 1.00 . A A . 21 ARG OXT 1 1 20 5359 1 1 1 ALA C C 10.533 8.991 -4.794 1.00 . A A . 1 ALA C 1 1 20 5360 1 1 1 ALA CA C 9.822 8.510 -3.533 1.00 . A A . 1 ALA CA 1 1 20 5361 1 1 1 ALA CB C 8.403 9.082 -3.484 1.00 . A A . 1 ALA CB 1 1 20 5362 1 1 1 ALA H1 H 11.597 8.824 -2.491 1.00 . A A . 1 ALA H1 1 1 20 5363 1 1 1 ALA H2 H 10.276 8.417 -1.503 1.00 . A A . 1 ALA H2 1 1 20 5364 1 1 1 ALA H3 H 10.394 9.975 -2.168 1.00 . A A . 1 ALA H3 1 1 20 5365 1 1 1 ALA HA H 9.774 7.432 -3.537 1.00 . A A . 1 ALA HA 1 1 20 5366 1 1 1 ALA HB1 H 7.888 8.690 -2.619 1.00 . A A . 1 ALA HB1 1 1 20 5367 1 1 1 ALA HB2 H 7.869 8.799 -4.378 1.00 . A A . 1 ALA HB2 1 1 20 5368 1 1 1 ALA HB3 H 8.451 10.158 -3.418 1.00 . A A . 1 ALA HB3 1 1 20 5369 1 1 1 ALA N N 10.580 8.966 -2.333 1.00 . A A . 1 ALA N 1 1 20 5370 1 1 1 ALA O O 11.367 9.893 -4.741 1.00 . A A . 1 ALA O 1 1 20 5371 1 1 2 GLY C C 12.041 7.902 -7.475 1.00 . A A . 2 GLY C 1 1 20 5372 1 1 2 GLY CA C 10.807 8.753 -7.194 1.00 . A A . 2 GLY CA 1 1 20 5373 1 1 2 GLY H H 9.524 7.667 -5.906 1.00 . A A . 2 GLY H 1 1 20 5374 1 1 2 GLY HA2 H 10.089 8.612 -7.990 1.00 . A A . 2 GLY HA2 1 1 20 5375 1 1 2 GLY HA3 H 11.098 9.792 -7.157 1.00 . A A . 2 GLY HA3 1 1 20 5376 1 1 2 GLY N N 10.196 8.380 -5.924 1.00 . A A . 2 GLY N 1 1 20 5377 1 1 2 GLY O O 12.665 8.023 -8.529 1.00 . A A . 2 GLY O 1 1 20 5378 1 1 3 GLY C C 14.686 6.609 -5.773 1.00 . A A . 3 GLY C 1 1 20 5379 1 1 3 GLY CA C 13.545 6.171 -6.684 1.00 . A A . 3 GLY CA 1 1 20 5380 1 1 3 GLY H H 11.851 6.985 -5.706 1.00 . A A . 3 GLY H 1 1 20 5381 1 1 3 GLY HA2 H 13.264 5.157 -6.438 1.00 . A A . 3 GLY HA2 1 1 20 5382 1 1 3 GLY HA3 H 13.879 6.209 -7.709 1.00 . A A . 3 GLY HA3 1 1 20 5383 1 1 3 GLY N N 12.386 7.040 -6.525 1.00 . A A . 3 GLY N 1 1 20 5384 1 1 3 GLY O O 15.570 7.361 -6.185 1.00 . A A . 3 GLY O 1 1 20 5385 1 1 4 . C C 15.065 7.124 -2.394 1.00 . A A . 4 DBU C 1 1 20 5386 1 1 4 . CA C 15.671 6.469 -3.606 1.00 . A A . 4 DBU CA 1 1 20 5387 1 1 4 . CB C 17.052 6.277 -3.687 1.00 . A A . 4 DBU CB 1 1 20 5388 1 1 4 . CG C 17.758 5.634 -4.853 1.00 . A A . 4 DBU CG 1 1 20 5389 1 1 4 . H H 13.940 5.532 -4.252 1.00 . A A . 4 DBU H 1 1 20 5390 1 1 4 . HB H 17.676 6.605 -2.868 1.00 . A A . 4 DBU HB 1 1 20 5391 1 1 4 . HG1 H 17.038 5.368 -5.614 1.00 . A A . 4 DBU HG1 1 1 20 5392 1 1 4 . HG2 H 18.269 4.746 -4.515 1.00 . A A . 4 DBU HG2 1 1 20 5393 1 1 4 . HG3 H 18.474 6.329 -5.265 1.00 . A A . 4 DBU HG3 1 1 20 5394 1 1 4 . N N 14.664 6.132 -4.534 1.00 . A A . 4 DBU N 1 1 20 5395 1 1 4 . O O 15.026 8.347 -2.305 1.00 . A A . 4 DBU O 1 1 20 5396 1 1 5 ILE C C 12.916 5.825 0.275 1.00 . A A . 5 ILE C 1 1 20 5397 1 1 5 ILE CA C 13.970 6.805 -0.236 1.00 . A A . 5 ILE CA 1 1 20 5398 1 1 5 ILE CB C 13.316 8.165 -0.487 1.00 . A A . 5 ILE CB 1 1 20 5399 1 1 5 ILE CD1 C 14.185 9.692 1.325 1.00 . A A . 5 ILE CD1 1 1 20 5400 1 1 5 ILE CG1 C 14.316 9.279 -0.147 1.00 . A A . 5 ILE CG1 1 1 20 5401 1 1 5 ILE CG2 C 12.064 8.309 0.387 1.00 . A A . 5 ILE CG2 1 1 20 5402 1 1 5 ILE H H 14.652 5.334 -1.600 1.00 . A A . 5 ILE H 1 1 20 5403 1 1 5 ILE HA H 14.730 6.925 0.514 1.00 . A A . 5 ILE HA 1 1 20 5404 1 1 5 ILE HB H 13.038 8.234 -1.527 1.00 . A A . 5 ILE HB 1 1 20 5405 1 1 5 ILE HD11 H 15.142 10.030 1.693 1.00 . A A . 5 ILE HD11 1 1 20 5406 1 1 5 ILE HD12 H 13.856 8.844 1.907 1.00 . A A . 5 ILE HD12 1 1 20 5407 1 1 5 ILE HD13 H 13.463 10.489 1.412 1.00 . A A . 5 ILE HD13 1 1 20 5408 1 1 5 ILE HG12 H 15.320 8.922 -0.328 1.00 . A A . 5 ILE HG12 1 1 20 5409 1 1 5 ILE HG13 H 14.122 10.130 -0.777 1.00 . A A . 5 ILE HG13 1 1 20 5410 1 1 5 ILE HG21 H 12.288 7.959 1.388 1.00 . A A . 5 ILE HG21 1 1 20 5411 1 1 5 ILE HG22 H 11.262 7.720 -0.031 1.00 . A A . 5 ILE HG22 1 1 20 5412 1 1 5 ILE HG23 H 11.769 9.346 0.428 1.00 . A A . 5 ILE HG23 1 1 20 5413 1 1 5 ILE N N 14.590 6.302 -1.460 1.00 . A A . 5 ILE N 1 1 20 5414 1 1 5 ILE O O 12.809 5.587 1.480 1.00 . A A . 5 ILE O 1 1 20 5415 1 1 6 PRO C C 11.582 3.075 0.396 1.00 . A A . 6 PRO C 1 1 20 5416 1 1 6 PRO CA C 11.044 4.333 -0.258 1.00 . A A . 6 PRO CA 1 1 20 5417 1 1 6 PRO CB C 10.372 4.006 -1.598 1.00 . A A . 6 PRO CB 1 1 20 5418 1 1 6 PRO CD C 12.193 5.507 -2.060 1.00 . A A . 6 PRO CD 1 1 20 5419 1 1 6 PRO CG C 10.811 5.081 -2.533 1.00 . A A . 6 PRO CG 1 1 20 5420 1 1 6 PRO HA H 10.335 4.814 0.394 1.00 . A A . 6 PRO HA 1 1 20 5421 1 1 6 PRO HB2 H 10.699 3.036 -1.952 1.00 . A A . 6 PRO HB2 1 1 20 5422 1 1 6 PRO HB3 H 9.300 4.026 -1.494 1.00 . A A . 6 PRO HB3 1 1 20 5423 1 1 6 PRO HD2 H 12.960 4.897 -2.512 1.00 . A A . 6 PRO HD2 1 1 20 5424 1 1 6 PRO HD3 H 12.364 6.538 -2.269 1.00 . A A . 6 PRO HD3 1 1 20 5425 1 1 6 PRO HG2 H 10.857 4.702 -3.544 1.00 . A A . 6 PRO HG2 1 1 20 5426 1 1 6 PRO HG3 H 10.138 5.921 -2.476 1.00 . A A . 6 PRO HG3 1 1 20 5427 1 1 6 PRO N N 12.131 5.282 -0.615 1.00 . A A . 6 PRO N 1 1 20 5428 1 1 6 PRO O O 10.815 2.261 0.889 1.00 . A A . 6 PRO O 1 1 20 5429 1 1 7 DAL C C 14.981 1.624 0.529 1.00 . A A . 7 DAL C 1 1 20 5430 1 1 7 DAL CA C 13.530 1.752 0.980 1.00 . A A . 7 DAL CA 1 1 20 5431 1 1 7 DAL CB C 13.487 1.849 2.505 1.00 . A A . 7 DAL CB 1 1 20 5432 1 1 7 DAL H H 13.455 3.610 -0.035 1.00 . A A . 7 DAL H 1 1 20 5433 1 1 7 DAL HA H 12.991 0.872 0.674 1.00 . A A . 7 DAL HA 1 1 20 5434 1 1 7 DAL HB1 H 14.491 1.861 2.886 1.00 . A A . 7 DAL HB1 1 1 20 5435 1 1 7 DAL HB2 H 12.959 0.996 2.905 1.00 . A A . 7 DAL HB2 1 1 20 5436 1 1 7 DAL N N 12.900 2.923 0.384 1.00 . A A . 7 DAL N 1 1 20 5437 1 1 7 DAL O O 15.763 0.886 1.121 1.00 . A A . 7 DAL O 1 1 20 5438 1 1 8 LEU C C 17.661 2.766 0.090 1.00 . A A . 8 LEU C 1 1 20 5439 1 1 8 LEU CA C 16.713 2.293 -1.003 1.00 . A A . 8 LEU CA 1 1 20 5440 1 1 8 LEU CB C 16.854 3.177 -2.242 1.00 . A A . 8 LEU CB 1 1 20 5441 1 1 8 LEU CD1 C 16.086 3.306 -4.625 1.00 . A A . 8 LEU CD1 1 1 20 5442 1 1 8 LEU CD2 C 15.324 1.414 -3.188 1.00 . A A . 8 LEU CD2 1 1 20 5443 1 1 8 LEU CG C 15.690 2.903 -3.205 1.00 . A A . 8 LEU CG 1 1 20 5444 1 1 8 LEU H H 14.693 2.933 -0.958 1.00 . A A . 8 LEU H 1 1 20 5445 1 1 8 LEU HA H 16.955 1.272 -1.265 1.00 . A A . 8 LEU HA 1 1 20 5446 1 1 8 LEU HB2 H 16.838 4.216 -1.946 1.00 . A A . 8 LEU HB2 1 1 20 5447 1 1 8 LEU HB3 H 17.786 2.957 -2.738 1.00 . A A . 8 LEU HB3 1 1 20 5448 1 1 8 LEU HD11 H 17.160 3.265 -4.726 1.00 . A A . 8 LEU HD11 1 1 20 5449 1 1 8 LEU HD12 H 15.745 4.309 -4.822 1.00 . A A . 8 LEU HD12 1 1 20 5450 1 1 8 LEU HD13 H 15.632 2.628 -5.332 1.00 . A A . 8 LEU HD13 1 1 20 5451 1 1 8 LEU HD21 H 14.607 1.230 -2.401 1.00 . A A . 8 LEU HD21 1 1 20 5452 1 1 8 LEU HD22 H 16.213 0.828 -3.009 1.00 . A A . 8 LEU HD22 1 1 20 5453 1 1 8 LEU HD23 H 14.896 1.139 -4.139 1.00 . A A . 8 LEU HD23 1 1 20 5454 1 1 8 LEU HG H 14.835 3.488 -2.893 1.00 . A A . 8 LEU HG 1 1 20 5455 1 1 8 LEU N N 15.348 2.351 -0.513 1.00 . A A . 8 LEU N 1 1 20 5456 1 1 8 LEU O O 18.798 2.307 0.185 1.00 . A A . 8 LEU O 1 1 20 5457 1 1 9 MET C C 18.255 3.142 3.043 1.00 . A A . 9 MET C 1 1 20 5458 1 1 9 MET CA C 17.985 4.229 2.003 1.00 . A A . 9 MET CA 1 1 20 5459 1 1 9 MET CB C 17.239 5.386 2.662 1.00 . A A . 9 MET CB 1 1 20 5460 1 1 9 MET CE C 17.530 8.562 2.905 1.00 . A A . 9 MET CE 1 1 20 5461 1 1 9 MET CG C 16.723 6.328 1.581 1.00 . A A . 9 MET CG 1 1 20 5462 1 1 9 MET H H 16.263 4.018 0.786 1.00 . A A . 9 MET H 1 1 20 5463 1 1 9 MET HA H 18.923 4.589 1.609 1.00 . A A . 9 MET HA 1 1 20 5464 1 1 9 MET HB2 H 16.413 5.004 3.241 1.00 . A A . 9 MET HB2 1 1 20 5465 1 1 9 MET HB3 H 17.909 5.928 3.307 1.00 . A A . 9 MET HB3 1 1 20 5466 1 1 9 MET HE1 H 17.875 9.245 2.140 1.00 . A A . 9 MET HE1 1 1 20 5467 1 1 9 MET HE2 H 18.279 7.805 3.071 1.00 . A A . 9 MET HE2 1 1 20 5468 1 1 9 MET HE3 H 17.357 9.104 3.825 1.00 . A A . 9 MET HE3 1 1 20 5469 1 1 9 MET HG2 H 17.534 6.626 0.934 1.00 . A A . 9 MET HG2 1 1 20 5470 1 1 9 MET HG3 H 15.972 5.811 1.002 1.00 . A A . 9 MET HG3 1 1 20 5471 1 1 9 MET N N 17.179 3.690 0.914 1.00 . A A . 9 MET N 1 1 20 5472 1 1 9 MET O O 19.356 3.042 3.580 1.00 . A A . 9 MET O 1 1 20 5473 1 1 9 MET SD S 15.987 7.784 2.364 1.00 . A A . 9 MET SD 1 1 20 5474 1 1 10 . C C 16.455 1.486 5.482 1.00 . A A . 10 DBB C 1 1 20 5475 1 1 10 . CA C 17.352 1.243 4.286 1.00 . A A . 10 DBB CA 1 1 20 5476 1 1 10 . CB C 16.975 -0.092 3.629 1.00 . A A . 10 DBB CB 1 1 20 5477 1 1 10 . CG C 15.452 -0.293 3.647 1.00 . A A . 10 DBB CG 1 1 20 5478 1 1 10 . H H 16.380 2.462 2.849 1.00 . A A . 10 DBB H 1 1 20 5479 1 1 10 . HA H 18.376 1.187 4.624 1.00 . A A . 10 DBB HA 1 1 20 5480 1 1 10 . HB2 H 17.283 -0.068 2.604 1.00 . A A . 10 DBB HB2 1 1 20 5481 1 1 10 . HG1 H 15.017 0.141 2.767 1.00 . A A . 10 DBB HG1 1 1 20 5482 1 1 10 . HG2 H 15.026 0.163 4.518 1.00 . A A . 10 DBB HG2 1 1 20 5483 1 1 10 . HG3 H 15.233 -1.344 3.664 1.00 . A A . 10 DBB HG3 1 1 20 5484 1 1 10 . N N 17.233 2.328 3.314 1.00 . A A . 10 DBB N 1 1 20 5485 1 1 10 . O O 16.759 1.063 6.597 1.00 . A A . 10 DBB O 1 1 20 5486 1 1 11 GLY C C 13.055 2.880 5.753 1.00 . A A . 11 GLY C 1 1 20 5487 1 1 11 GLY CA C 14.406 2.431 6.305 1.00 . A A . 11 GLY CA 1 1 20 5488 1 1 11 GLY H H 15.151 2.465 4.336 1.00 . A A . 11 GLY H 1 1 20 5489 1 1 11 GLY HA2 H 14.272 1.540 6.897 1.00 . A A . 11 GLY HA2 1 1 20 5490 1 1 11 GLY HA3 H 14.815 3.204 6.916 1.00 . A A . 11 GLY HA3 1 1 20 5491 1 1 11 GLY N N 15.343 2.156 5.243 1.00 . A A . 11 GLY N 1 1 20 5492 1 1 11 GLY O O 12.757 4.073 5.702 1.00 . A A . 11 GLY O 1 1 20 5493 1 1 12 CYS C C 10.000 0.999 4.866 1.00 . A A . 12 CYS C 1 1 20 5494 1 1 12 CYS CA C 10.920 2.211 4.789 1.00 . A A . 12 CYS CA 1 1 20 5495 1 1 12 CYS CB C 11.035 2.607 3.326 1.00 . A A . 12 CYS CB 1 1 20 5496 1 1 12 CYS H H 12.534 0.975 5.402 1.00 . A A . 12 CYS H 1 1 20 5497 1 1 12 CYS HA H 10.479 3.029 5.341 1.00 . A A . 12 CYS HA 1 1 20 5498 1 1 12 CYS HB2 H 10.938 1.718 2.728 1.00 . A A . 12 CYS HB2 1 1 20 5499 1 1 12 CYS HB3 H 10.248 3.298 3.069 1.00 . A A . 12 CYS HB3 1 1 20 5500 1 1 12 CYS N N 12.241 1.908 5.339 1.00 . A A . 12 CYS N 1 1 20 5501 1 1 12 CYS O O 10.149 0.128 5.721 1.00 . A A . 12 CYS O 1 1 20 5502 1 1 12 CYS SG S 12.642 3.365 3.007 1.00 . A A . 12 CYS SG 1 1 20 5503 1 1 13 GLY C C 8.105 -0.753 2.455 1.00 . A A . 13 GLY C 1 1 20 5504 1 1 13 GLY CA C 8.100 -0.145 3.850 1.00 . A A . 13 GLY CA 1 1 20 5505 1 1 13 GLY H H 9.001 1.680 3.273 1.00 . A A . 13 GLY H 1 1 20 5506 1 1 13 GLY HA2 H 8.366 -0.901 4.573 1.00 . A A . 13 GLY HA2 1 1 20 5507 1 1 13 GLY HA3 H 7.116 0.224 4.063 1.00 . A A . 13 GLY HA3 1 1 20 5508 1 1 13 GLY N N 9.052 0.956 3.932 1.00 . A A . 13 GLY N 1 1 20 5509 1 1 13 GLY O O 7.296 -1.628 2.148 1.00 . A A . 13 GLY O 1 1 20 5510 1 1 14 TRP C C 9.063 -2.293 0.232 1.00 . A A . 14 TRP C 1 1 20 5511 1 1 14 TRP CA C 9.110 -0.770 0.249 1.00 . A A . 14 TRP CA 1 1 20 5512 1 1 14 TRP CB C 10.415 -0.289 -0.388 1.00 . A A . 14 TRP CB 1 1 20 5513 1 1 14 TRP CD1 C 11.572 -1.419 1.555 1.00 . A A . 14 TRP CD1 1 1 20 5514 1 1 14 TRP CD2 C 12.906 -1.243 -0.245 1.00 . A A . 14 TRP CD2 1 1 20 5515 1 1 14 TRP CE2 C 13.667 -1.883 0.760 1.00 . A A . 14 TRP CE2 1 1 20 5516 1 1 14 TRP CE3 C 13.516 -1.009 -1.489 1.00 . A A . 14 TRP CE3 1 1 20 5517 1 1 14 TRP CG C 11.577 -0.954 0.287 1.00 . A A . 14 TRP CG 1 1 20 5518 1 1 14 TRP CH2 C 15.577 -2.042 -0.704 1.00 . A A . 14 TRP CH2 1 1 20 5519 1 1 14 TRP CZ2 C 14.986 -2.280 0.539 1.00 . A A . 14 TRP CZ2 1 1 20 5520 1 1 14 TRP CZ3 C 14.844 -1.407 -1.717 1.00 . A A . 14 TRP CZ3 1 1 20 5521 1 1 14 TRP H H 9.624 0.429 1.914 1.00 . A A . 14 TRP H 1 1 20 5522 1 1 14 TRP HA H 8.280 -0.388 -0.326 1.00 . A A . 14 TRP HA 1 1 20 5523 1 1 14 TRP HB2 H 10.413 -0.526 -1.432 1.00 . A A . 14 TRP HB2 1 1 20 5524 1 1 14 TRP HB3 H 10.496 0.774 -0.274 1.00 . A A . 14 TRP HB3 1 1 20 5525 1 1 14 TRP HD1 H 10.737 -1.367 2.234 1.00 . A A . 14 TRP HD1 1 1 20 5526 1 1 14 TRP HE1 H 13.065 -2.373 2.694 1.00 . A A . 14 TRP HE1 1 1 20 5527 1 1 14 TRP HE3 H 12.961 -0.524 -2.275 1.00 . A A . 14 TRP HE3 1 1 20 5528 1 1 14 TRP HH2 H 16.598 -2.344 -0.886 1.00 . A A . 14 TRP HH2 1 1 20 5529 1 1 14 TRP HZ2 H 15.546 -2.768 1.322 1.00 . A A . 14 TRP HZ2 1 1 20 5530 1 1 14 TRP HZ3 H 15.303 -1.223 -2.677 1.00 . A A . 14 TRP HZ3 1 1 20 5531 1 1 14 TRP N N 9.013 -0.273 1.613 1.00 . A A . 14 TRP N 1 1 20 5532 1 1 14 TRP NE1 N 12.809 -1.969 1.840 1.00 . A A . 14 TRP NE1 1 1 20 5533 1 1 14 TRP O O 8.864 -2.929 1.269 1.00 . A A . 14 TRP O 1 1 20 5534 1 1 15 LEU C C 9.661 -4.999 0.212 1.00 . A A . 15 LEU C 1 1 20 5535 1 1 15 LEU CA C 9.219 -4.326 -1.085 1.00 . A A . 15 LEU CA 1 1 20 5536 1 1 15 LEU CB C 10.145 -4.755 -2.226 1.00 . A A . 15 LEU CB 1 1 20 5537 1 1 15 LEU CD1 C 12.550 -4.776 -2.905 1.00 . A A . 15 LEU CD1 1 1 20 5538 1 1 15 LEU CD2 C 11.357 -2.597 -2.604 1.00 . A A . 15 LEU CD2 1 1 20 5539 1 1 15 LEU CG C 11.488 -4.036 -2.092 1.00 . A A . 15 LEU CG 1 1 20 5540 1 1 15 LEU H H 9.394 -2.317 -1.737 1.00 . A A . 15 LEU H 1 1 20 5541 1 1 15 LEU HA H 8.212 -4.638 -1.318 1.00 . A A . 15 LEU HA 1 1 20 5542 1 1 15 LEU HB2 H 10.302 -5.824 -2.177 1.00 . A A . 15 LEU HB2 1 1 20 5543 1 1 15 LEU HB3 H 9.694 -4.500 -3.172 1.00 . A A . 15 LEU HB3 1 1 20 5544 1 1 15 LEU HD11 H 12.391 -4.590 -3.957 1.00 . A A . 15 LEU HD11 1 1 20 5545 1 1 15 LEU HD12 H 12.476 -5.836 -2.712 1.00 . A A . 15 LEU HD12 1 1 20 5546 1 1 15 LEU HD13 H 13.530 -4.423 -2.621 1.00 . A A . 15 LEU HD13 1 1 20 5547 1 1 15 LEU HD21 H 12.183 -2.362 -3.258 1.00 . A A . 15 LEU HD21 1 1 20 5548 1 1 15 LEU HD22 H 11.363 -1.923 -1.769 1.00 . A A . 15 LEU HD22 1 1 20 5549 1 1 15 LEU HD23 H 10.429 -2.484 -3.144 1.00 . A A . 15 LEU HD23 1 1 20 5550 1 1 15 LEU HG H 11.783 -4.023 -1.052 1.00 . A A . 15 LEU HG 1 1 20 5551 1 1 15 LEU N N 9.245 -2.874 -0.946 1.00 . A A . 15 LEU N 1 1 20 5552 1 1 15 LEU O O 9.123 -6.038 0.594 1.00 . A A . 15 LEU O 1 1 20 5553 1 1 16 . C C 10.387 -4.330 3.271 1.00 . A A . 16 DBU C 1 1 20 5554 1 1 16 . CA C 11.125 -4.930 2.098 1.00 . A A . 16 DBU CA 1 1 20 5555 1 1 16 . CB C 12.139 -5.874 2.290 1.00 . A A . 16 DBU CB 1 1 20 5556 1 1 16 . CG C 12.927 -6.522 1.177 1.00 . A A . 16 DBU CG 1 1 20 5557 1 1 16 . H H 11.036 -3.572 0.551 1.00 . A A . 16 DBU H 1 1 20 5558 1 1 16 . HB H 12.390 -6.173 3.297 1.00 . A A . 16 DBU HB 1 1 20 5559 1 1 16 . HG1 H 13.178 -5.780 0.433 1.00 . A A . 16 DBU HG1 1 1 20 5560 1 1 16 . HG2 H 12.333 -7.302 0.721 1.00 . A A . 16 DBU HG2 1 1 20 5561 1 1 16 . HG3 H 13.833 -6.949 1.581 1.00 . A A . 16 DBU HG3 1 1 20 5562 1 1 16 . N N 10.637 -4.401 0.887 1.00 . A A . 16 DBU N 1 1 20 5563 1 1 16 . O O 9.289 -4.756 3.631 1.00 . A A . 16 DBU O 1 1 20 5564 1 1 17 GLY C C 11.403 -2.512 6.161 1.00 . A A . 17 GLY C 1 1 20 5565 1 1 17 GLY CA C 10.399 -2.648 5.022 1.00 . A A . 17 GLY CA 1 1 20 5566 1 1 17 GLY H H 11.876 -3.020 3.547 1.00 . A A . 17 GLY H 1 1 20 5567 1 1 17 GLY HA2 H 10.064 -1.667 4.723 1.00 . A A . 17 GLY HA2 1 1 20 5568 1 1 17 GLY HA3 H 9.553 -3.224 5.366 1.00 . A A . 17 GLY HA3 1 1 20 5569 1 1 17 GLY N N 11.001 -3.320 3.876 1.00 . A A . 17 GLY N 1 1 20 5570 1 1 17 GLY O O 11.568 -1.433 6.730 1.00 . A A . 17 GLY O 1 1 20 5571 1 1 18 LEU C C 14.464 -3.392 6.998 1.00 . A A . 18 LEU C 1 1 20 5572 1 1 18 LEU CA C 13.062 -3.601 7.559 1.00 . A A . 18 LEU CA 1 1 20 5573 1 1 18 LEU CB C 13.017 -4.920 8.331 1.00 . A A . 18 LEU CB 1 1 20 5574 1 1 18 LEU CD1 C 11.574 -6.443 9.688 1.00 . A A . 18 LEU CD1 1 1 20 5575 1 1 18 LEU CD2 C 11.417 -3.969 9.997 1.00 . A A . 18 LEU CD2 1 1 20 5576 1 1 18 LEU CG C 11.642 -5.088 8.978 1.00 . A A . 18 LEU CG 1 1 20 5577 1 1 18 LEU H H 11.902 -4.443 5.994 1.00 . A A . 18 LEU H 1 1 20 5578 1 1 18 LEU HA H 12.832 -2.793 8.238 1.00 . A A . 18 LEU HA 1 1 20 5579 1 1 18 LEU HB2 H 13.200 -5.742 7.655 1.00 . A A . 18 LEU HB2 1 1 20 5580 1 1 18 LEU HB3 H 13.774 -4.912 9.102 1.00 . A A . 18 LEU HB3 1 1 20 5581 1 1 18 LEU HD11 H 11.272 -7.204 8.982 1.00 . A A . 18 LEU HD11 1 1 20 5582 1 1 18 LEU HD12 H 10.856 -6.392 10.493 1.00 . A A . 18 LEU HD12 1 1 20 5583 1 1 18 LEU HD13 H 12.547 -6.689 10.086 1.00 . A A . 18 LEU HD13 1 1 20 5584 1 1 18 LEU HD21 H 10.904 -3.147 9.520 1.00 . A A . 18 LEU HD21 1 1 20 5585 1 1 18 LEU HD22 H 12.369 -3.628 10.373 1.00 . A A . 18 LEU HD22 1 1 20 5586 1 1 18 LEU HD23 H 10.818 -4.342 10.815 1.00 . A A . 18 LEU HD23 1 1 20 5587 1 1 18 LEU HG H 10.878 -5.044 8.215 1.00 . A A . 18 LEU HG 1 1 20 5588 1 1 18 LEU N N 12.073 -3.613 6.486 1.00 . A A . 18 LEU N 1 1 20 5589 1 1 18 LEU O O 15.429 -3.254 7.750 1.00 . A A . 18 LEU O 1 1 20 5590 1 1 19 CYS C C 16.747 -4.396 5.217 1.00 . A A . 19 CYS C 1 1 20 5591 1 1 19 CYS CA C 15.858 -3.175 5.028 1.00 . A A . 19 CYS CA 1 1 20 5592 1 1 19 CYS CB C 16.555 -1.939 5.606 1.00 . A A . 19 CYS CB 1 1 20 5593 1 1 19 CYS H H 13.765 -3.482 5.125 1.00 . A A . 19 CYS H 1 1 20 5594 1 1 19 CYS HA H 15.700 -3.026 3.972 1.00 . A A . 19 CYS HA 1 1 20 5595 1 1 19 CYS HB2 H 15.839 -1.143 5.729 1.00 . A A . 19 CYS HB2 1 1 20 5596 1 1 19 CYS HB3 H 16.978 -2.182 6.567 1.00 . A A . 19 CYS HB3 1 1 20 5597 1 1 19 CYS N N 14.568 -3.369 5.676 1.00 . A A . 19 CYS N 1 1 20 5598 1 1 19 CYS O O 17.489 -4.492 6.194 1.00 . A A . 19 CYS O 1 1 20 5599 1 1 19 CYS SG S 17.873 -1.414 4.479 1.00 . A A . 19 CYS SG 1 1 20 5600 1 1 20 VAL C C 18.527 -6.535 3.221 1.00 . A A . 20 VAL C 1 1 20 5601 1 1 20 VAL CA C 17.484 -6.530 4.334 1.00 . A A . 20 VAL CA 1 1 20 5602 1 1 20 VAL CB C 16.592 -7.764 4.214 1.00 . A A . 20 VAL CB 1 1 20 5603 1 1 20 VAL CG1 C 15.824 -7.966 5.522 1.00 . A A . 20 VAL CG1 1 1 20 5604 1 1 20 VAL CG2 C 15.596 -7.562 3.069 1.00 . A A . 20 VAL CG2 1 1 20 5605 1 1 20 VAL H H 16.068 -5.186 3.510 1.00 . A A . 20 VAL H 1 1 20 5606 1 1 20 VAL HA H 17.990 -6.557 5.287 1.00 . A A . 20 VAL HA 1 1 20 5607 1 1 20 VAL HB H 17.203 -8.632 4.017 1.00 . A A . 20 VAL HB 1 1 20 5608 1 1 20 VAL HG11 H 16.524 -8.031 6.342 1.00 . A A . 20 VAL HG11 1 1 20 5609 1 1 20 VAL HG12 H 15.250 -8.879 5.466 1.00 . A A . 20 VAL HG12 1 1 20 5610 1 1 20 VAL HG13 H 15.158 -7.130 5.682 1.00 . A A . 20 VAL HG13 1 1 20 5611 1 1 20 VAL HG21 H 16.135 -7.466 2.137 1.00 . A A . 20 VAL HG21 1 1 20 5612 1 1 20 VAL HG22 H 15.017 -6.668 3.246 1.00 . A A . 20 VAL HG22 1 1 20 5613 1 1 20 VAL HG23 H 14.934 -8.415 3.014 1.00 . A A . 20 VAL HG23 1 1 20 5614 1 1 20 VAL N N 16.675 -5.321 4.269 1.00 . A A . 20 VAL N 1 1 20 5615 1 1 20 VAL O O 19.335 -7.460 3.121 1.00 . A A . 20 VAL O 1 1 20 5616 1 1 21 ARG C C 20.878 -5.279 1.808 1.00 . A A . 21 ARG C 1 1 20 5617 1 1 21 ARG CA C 19.451 -5.403 1.281 1.00 . A A . 21 ARG CA 1 1 20 5618 1 1 21 ARG CB C 19.118 -4.188 0.410 1.00 . A A . 21 ARG CB 1 1 20 5619 1 1 21 ARG CD C 19.726 -2.941 -1.667 1.00 . A A . 21 ARG CD 1 1 20 5620 1 1 21 ARG CG C 20.055 -4.156 -0.798 1.00 . A A . 21 ARG CG 1 1 20 5621 1 1 21 ARG CZ C 19.773 -0.521 -1.480 1.00 . A A . 21 ARG CZ 1 1 20 5622 1 1 21 ARG H H 17.836 -4.794 2.511 1.00 . A A . 21 ARG H 1 1 20 5623 1 1 21 ARG HA H 19.379 -6.294 0.676 1.00 . A A . 21 ARG HA 1 1 20 5624 1 1 21 ARG HB2 H 18.095 -4.261 0.070 1.00 . A A . 21 ARG HB2 1 1 20 5625 1 1 21 ARG HB3 H 19.244 -3.281 0.985 1.00 . A A . 21 ARG HB3 1 1 20 5626 1 1 21 ARG HD2 H 20.300 -2.986 -2.578 1.00 . A A . 21 ARG HD2 1 1 20 5627 1 1 21 ARG HD3 H 18.673 -2.950 -1.906 1.00 . A A . 21 ARG HD3 1 1 20 5628 1 1 21 ARG HE H 20.479 -1.760 -0.076 1.00 . A A . 21 ARG HE 1 1 20 5629 1 1 21 ARG HG2 H 21.079 -4.090 -0.457 1.00 . A A . 21 ARG HG2 1 1 20 5630 1 1 21 ARG HG3 H 19.926 -5.056 -1.379 1.00 . A A . 21 ARG HG3 1 1 20 5631 1 1 21 ARG HH11 H 18.975 -1.276 -3.154 1.00 . A A . 21 ARG HH11 1 1 20 5632 1 1 21 ARG HH12 H 18.995 0.452 -3.047 1.00 . A A . 21 ARG HH12 1 1 20 5633 1 1 21 ARG HH21 H 20.512 0.507 0.070 1.00 . A A . 21 ARG HH21 1 1 20 5634 1 1 21 ARG HH22 H 19.864 1.462 -1.222 1.00 . A A . 21 ARG HH22 1 1 20 5635 1 1 21 ARG N N 18.503 -5.502 2.384 1.00 . A A . 21 ARG N 1 1 20 5636 1 1 21 ARG NE N 20.050 -1.710 -0.955 1.00 . A A . 21 ARG NE 1 1 20 5637 1 1 21 ARG NH1 N 19.203 -0.442 -2.652 1.00 . A A . 21 ARG NH1 1 1 20 5638 1 1 21 ARG NH2 N 20.073 0.568 -0.825 1.00 . A A . 21 ARG NH2 1 1 20 5639 1 1 21 ARG O O 21.445 -6.297 2.173 1.00 . A A . 21 ARG O 1 1 20 5640 1 1 21 ARG OXT O 21.384 -4.169 1.839 1.00 . A A . 21 ARG OXT 1 1 stop_ save_
Contact the webmaster for help, if required. Tuesday, May 14, 2024 1:37:22 PM GMT (wattos1)