NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
632124 | 5zcn | 36167 | cing | 4-filtered-FRED | STAR | entry | full | 149 |
data_FRED_restraints_with_modified_coordinates_PDB_code_5zcn # This FRED archive file contains, for PDB entry <5zcn>: # # - 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_5zcn _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 5zcn _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 2198.41 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 $brevunsin A . 1 1 stop_ save_ save_brevunsin _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name brevunsin _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code DGMGEEFIEGLVRDSLYPPAG _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 ASP . 1 1 2 GLY . 1 1 3 MET . 1 1 4 GLY . 1 1 5 GLU . 1 1 6 GLU . 1 1 7 PHE . 1 1 8 ILE . 1 1 9 GLU . 1 1 10 GLY . 1 1 11 LEU . 1 1 12 VAL . 1 1 13 ARG . 1 1 14 ASP . 1 1 15 SER . 1 1 16 LEU . 1 1 17 TYR . 1 1 18 PRO . 1 1 19 PRO . 1 1 20 ALA . 1 1 21 GLY . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID ASP 1 1 1 1 GLY 2 2 1 1 MET 3 3 1 1 GLY 4 4 1 1 GLU 5 5 1 1 GLU 6 6 1 1 PHE 7 7 1 1 ILE 8 8 1 1 GLU 9 9 1 1 GLY 10 10 1 1 LEU 11 11 1 1 VAL 12 12 1 1 ARG 13 13 1 1 ASP 14 14 1 1 SER 15 15 1 1 LEU 16 16 1 1 TYR 17 17 1 1 PRO 18 18 1 1 PRO 19 19 1 1 ALA 20 20 1 1 GLY 21 21 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 1 ASP HA . 1 . HA 1 1 1 1 2 1 1 2 GLY H . 2 . HN 1 1 2 1 1 1 1 2 GLY H . 2 . HN 1 1 2 1 2 1 1 9 GLU QG . 9 . HG# 1 1 3 1 1 1 1 2 GLY H . 2 . HN 1 1 3 1 2 1 1 15 SER HA . 15 . HA 1 1 4 1 1 1 1 2 GLY QA . 2 . HA# 1 1 4 1 2 1 1 3 MET H . 3 . HN 1 1 5 1 1 1 1 2 GLY QA . 2 . HA# 1 1 5 1 2 1 1 13 ARG QB . 13 . HB# 1 1 6 1 1 1 1 2 GLY QA . 2 . HA# 1 1 6 1 2 1 1 13 ARG QD . 13 . HD# 1 1 7 1 1 1 1 2 GLY QA . 2 . HA# 1 1 7 1 2 1 1 13 ARG QG . 13 . HG# 1 1 8 1 1 1 1 3 MET H . 3 . HN 1 1 8 1 2 1 1 3 MET QB . 3 . HB# 1 1 9 1 1 1 1 3 MET H . 3 . HN 1 1 9 1 2 1 1 3 MET QG . 3 . HG# 1 1 10 1 1 1 1 3 MET H . 3 . HN 1 1 10 1 2 1 1 4 GLY H . 4 . HN 1 1 11 1 1 1 1 3 MET HA . 3 . HA 1 1 11 1 2 1 1 4 GLY H . 4 . HN 1 1 12 1 1 1 1 3 MET HA . 3 . HA 1 1 12 1 2 1 1 16 LEU QD . 16 . HD# 1 1 13 1 1 1 1 3 MET QG . 3 . HG# 1 1 13 1 2 1 1 16 LEU QD . 16 . HD# 1 1 14 1 1 1 1 4 GLY H . 4 . HN 1 1 14 1 2 1 1 16 LEU QD . 16 . HD# 1 1 15 1 1 1 1 4 GLY H . 4 . HN 1 1 15 1 2 1 1 16 LEU HG . 16 . HG 1 1 16 1 1 1 1 4 GLY QA . 4 . HA# 1 1 16 1 2 1 1 5 GLU H . 5 . HN 1 1 17 1 1 1 1 4 GLY QA . 4 . HA# 1 1 17 1 2 1 1 5 GLU HA . 5 . HA 1 1 18 1 1 1 1 4 GLY QA . 4 . HA# 1 1 18 1 2 1 1 6 GLU H . 6 . HN 1 1 19 1 1 1 1 4 GLY QA . 4 . HA# 1 1 19 1 2 1 1 15 SER H . 15 . HN 1 1 20 1 1 1 1 4 GLY QA . 4 . HA# 1 1 20 1 2 1 1 16 LEU HA . 16 . HA 1 1 21 1 1 1 1 4 GLY QA . 4 . HA# 1 1 21 1 2 1 1 16 LEU QD . 16 . HD# 1 1 22 1 1 1 1 4 GLY QA . 4 . HA# 1 1 22 1 2 1 1 16 LEU HG . 16 . HG 1 1 23 1 1 1 1 5 GLU H . 5 . HN 1 1 23 1 2 1 1 5 GLU QB . 5 . HB# 1 1 24 1 1 1 1 5 GLU H . 5 . HN 1 1 24 1 2 1 1 5 GLU QG . 5 . HG# 1 1 25 1 1 1 1 5 GLU H . 5 . HN 1 1 25 1 2 1 1 6 GLU H . 6 . HN 1 1 26 1 1 1 1 5 GLU H . 5 . HN 1 1 26 1 2 1 1 16 LEU HA . 16 . HA 1 1 27 1 1 1 1 5 GLU H . 5 . HN 1 1 27 1 2 1 1 16 LEU HG . 16 . HG 1 1 28 1 1 1 1 5 GLU HA . 5 . HA 1 1 28 1 2 1 1 6 GLU H . 6 . HN 1 1 29 1 1 1 1 5 GLU HA . 5 . HA 1 1 29 1 2 1 1 6 GLU HA . 6 . HA 1 1 30 1 1 1 1 5 GLU HA . 5 . HA 1 1 30 1 2 1 1 6 GLU QB . 6 . HB# 1 1 31 1 1 1 1 5 GLU HA . 5 . HA 1 1 31 1 2 1 1 7 PHE H . 7 . HN 1 1 32 1 1 1 1 5 GLU HA . 5 . HA 1 1 32 1 2 1 1 13 ARG QG . 13 . HG# 1 1 33 1 1 1 1 5 GLU HA . 5 . HA 1 1 33 1 2 1 1 14 ASP H . 14 . HN 1 1 34 1 1 1 1 5 GLU HA . 5 . HA 1 1 34 1 2 1 1 14 ASP HA . 14 . HA 1 1 35 1 1 1 1 5 GLU HA . 5 . HA 1 1 35 1 2 1 1 14 ASP QB . 14 . HB# 1 1 36 1 1 1 1 5 GLU HA . 5 . HA 1 1 36 1 2 1 1 15 SER H . 15 . HN 1 1 37 1 1 1 1 5 GLU QB . 5 . HB# 1 1 37 1 2 1 1 6 GLU H . 6 . HN 1 1 38 1 1 1 1 6 GLU H . 6 . HN 1 1 38 1 2 1 1 6 GLU QB . 6 . HB# 1 1 39 1 1 1 1 6 GLU H . 6 . HN 1 1 39 1 2 1 1 6 GLU QG . 6 . HG# 1 1 40 1 1 1 1 6 GLU H . 6 . HN 1 1 40 1 2 1 1 7 PHE H . 7 . HN 1 1 41 1 1 1 1 6 GLU H . 6 . HN 1 1 41 1 2 1 1 15 SER H . 15 . HN 1 1 42 1 1 1 1 6 GLU H . 6 . HN 1 1 42 1 2 1 1 16 LEU HA . 16 . HA 1 1 43 1 1 1 1 6 GLU H . 6 . HN 1 1 43 1 2 1 1 16 LEU HG . 16 . HG 1 1 44 1 1 1 1 6 GLU HA . 6 . HA 1 1 44 1 2 1 1 7 PHE H . 7 . HN 1 1 45 1 1 1 1 6 GLU HA . 6 . HA 1 1 45 1 2 1 1 7 PHE HA . 7 . HA 1 1 46 1 1 1 1 6 GLU HA . 6 . HA 1 1 46 1 2 1 1 7 PHE QD . 7 . HD# 1 1 47 1 1 1 1 6 GLU QB . 6 . HB# 1 1 47 1 2 1 1 7 PHE H . 7 . HN 1 1 48 1 1 1 1 6 GLU QB . 6 . HB# 1 1 48 1 2 1 1 7 PHE QD . 7 . HD# 1 1 49 1 1 1 1 6 GLU QB . 6 . HB# 1 1 49 1 2 1 1 7 PHE QE . 7 . HE# 1 1 50 1 1 1 1 6 GLU QB . 6 . HB# 1 1 50 1 2 1 1 7 PHE HZ . 7 . HZ 1 1 51 1 1 1 1 6 GLU QB . 6 . HB# 1 1 51 1 2 1 1 16 LEU HA . 16 . HA 1 1 52 1 1 1 1 6 GLU QG . 6 . HG# 1 1 52 1 2 1 1 7 PHE QD . 7 . HD# 1 1 53 1 1 1 1 6 GLU QG . 6 . HG# 1 1 53 1 2 1 1 7 PHE QE . 7 . HE# 1 1 54 1 1 1 1 7 PHE H . 7 . HN 1 1 54 1 2 1 1 7 PHE QB . 7 . HB# 1 1 55 1 1 1 1 7 PHE H . 7 . HN 1 1 55 1 2 1 1 7 PHE QD . 7 . HD# 1 1 56 1 1 1 1 7 PHE H . 7 . HN 1 1 56 1 2 1 1 8 ILE H . 8 . HN 1 1 57 1 1 1 1 7 PHE H . 7 . HN 1 1 57 1 2 1 1 15 SER H . 15 . HN 1 1 58 1 1 1 1 7 PHE H . 7 . HN 1 1 58 1 2 1 1 15 SER QB . 15 . HB# 1 1 59 1 1 1 1 7 PHE HA . 7 . HA 1 1 59 1 2 1 1 8 ILE H . 8 . HN 1 1 60 1 1 1 1 7 PHE HA . 7 . HA 1 1 60 1 2 1 1 8 ILE QG . 8 . HG1# 1 1 61 1 1 1 1 7 PHE HA . 7 . HA 1 1 61 1 2 1 1 14 ASP H . 14 . HN 1 1 62 1 1 1 1 7 PHE HA . 7 . HA 1 1 62 1 2 1 1 14 ASP HA . 14 . HA 1 1 63 1 1 1 1 7 PHE HA . 7 . HA 1 1 63 1 2 1 1 15 SER QB . 15 . HB# 1 1 64 1 1 1 1 7 PHE QB . 7 . HB# 1 1 64 1 2 1 1 8 ILE H . 8 . HN 1 1 65 1 1 1 1 7 PHE QD . 7 . HD# 1 1 65 1 2 1 1 8 ILE H . 8 . HN 1 1 66 1 1 1 1 7 PHE QD . 7 . HD# 1 1 66 1 2 1 1 8 ILE HA . 8 . HA 1 1 67 1 1 1 1 7 PHE QD . 7 . HD# 1 1 67 1 2 1 1 15 SER QB . 15 . HB# 1 1 68 1 1 1 1 7 PHE QE . 7 . HE# 1 1 68 1 2 1 1 8 ILE HA . 8 . HA 1 1 69 1 1 1 1 7 PHE QE . 7 . HE# 1 1 69 1 2 1 1 15 SER QB . 15 . HB# 1 1 70 1 1 1 1 8 ILE H . 8 . HN 1 1 70 1 2 1 1 8 ILE HB . 8 . HB 1 1 71 1 1 1 1 8 ILE H . 8 . HN 1 1 71 1 2 1 1 8 ILE MD . 8 . HD1# 1 1 72 1 1 1 1 8 ILE H . 8 . HN 1 1 72 1 2 1 1 8 ILE QG . 8 . HG1# 1 1 73 1 1 1 1 8 ILE H . 8 . HN 1 1 73 1 2 1 1 8 ILE MG . 8 . HG2# 1 1 74 1 1 1 1 8 ILE HA . 8 . HA 1 1 74 1 2 1 1 14 ASP H . 14 . HN 1 1 75 1 1 1 1 8 ILE HA . 8 . HA 1 1 75 1 2 1 1 14 ASP HA . 14 . HA 1 1 76 1 1 1 1 8 ILE HA . 8 . HA 1 1 76 1 2 1 1 15 SER H . 15 . HN 1 1 77 1 1 1 1 8 ILE MD . 8 . HD1# 1 1 77 1 2 1 1 14 ASP HA . 14 . HA 1 1 78 1 1 1 1 8 ILE MG . 8 . HG2# 1 1 78 1 2 1 1 14 ASP H . 14 . HN 1 1 79 1 1 1 1 8 ILE MG . 8 . HG2# 1 1 79 1 2 1 1 15 SER H . 15 . HN 1 1 80 1 1 1 1 9 GLU H . 9 . HN 1 1 80 1 2 1 1 9 GLU QB . 9 . HB# 1 1 81 1 1 1 1 9 GLU H . 9 . HN 1 1 81 1 2 1 1 9 GLU QG . 9 . HG# 1 1 82 1 1 1 1 9 GLU H . 9 . HN 1 1 82 1 2 1 1 14 ASP HA . 14 . HA 1 1 83 1 1 1 1 9 GLU H . 9 . HN 1 1 83 1 2 1 1 15 SER HA . 15 . HA 1 1 84 1 1 1 1 9 GLU H . 9 . HN 1 1 84 1 2 1 1 15 SER QB . 15 . HB# 1 1 85 1 1 1 1 9 GLU HA . 9 . HA 1 1 85 1 2 1 1 10 GLY H . 10 . HN 1 1 86 1 1 1 1 9 GLU HA . 9 . HA 1 1 86 1 2 1 1 11 LEU H . 11 . HN 1 1 87 1 1 1 1 9 GLU HA . 9 . HA 1 1 87 1 2 1 1 15 SER QB . 15 . HB# 1 1 88 1 1 1 1 9 GLU QB . 9 . HB# 1 1 88 1 2 1 1 10 GLY H . 10 . HN 1 1 89 1 1 1 1 9 GLU QB . 9 . HB# 1 1 89 1 2 1 1 12 VAL H . 12 . HN 1 1 90 1 1 1 1 9 GLU QB . 9 . HB# 1 1 90 1 2 1 1 14 ASP HA . 14 . HA 1 1 91 1 1 1 1 9 GLU QB . 9 . HB# 1 1 91 1 2 1 1 15 SER H . 15 . HN 1 1 92 1 1 1 1 9 GLU QG . 9 . HG# 1 1 92 1 2 1 1 15 SER H . 15 . HN 1 1 93 1 1 1 1 9 GLU QG . 9 . HG# 1 1 93 1 2 1 1 15 SER QB . 15 . HB# 1 1 94 1 1 1 1 10 GLY QA . 10 . HA# 1 1 94 1 2 1 1 11 LEU H . 11 . HN 1 1 95 1 1 1 1 10 GLY QA . 10 . HA# 1 1 95 1 2 1 1 11 LEU QD . 11 . HD# 1 1 96 1 1 1 1 11 LEU H . 11 . HN 1 1 96 1 2 1 1 11 LEU QB . 11 . HB# 1 1 97 1 1 1 1 11 LEU H . 11 . HN 1 1 97 1 2 1 1 11 LEU QD . 11 . HD# 1 1 98 1 1 1 1 11 LEU H . 11 . HN 1 1 98 1 2 1 1 11 LEU HG . 11 . HG 1 1 99 1 1 1 1 11 LEU H . 11 . HN 1 1 99 1 2 1 1 12 VAL H . 12 . HN 1 1 100 1 1 1 1 11 LEU HA . 11 . HA 1 1 100 1 2 1 1 12 VAL H . 12 . HN 1 1 101 1 1 1 1 11 LEU QB . 11 . HB# 1 1 101 1 2 1 1 12 VAL H . 12 . HN 1 1 102 1 1 1 1 12 VAL H . 12 . HN 1 1 102 1 2 1 1 12 VAL QG . 12 . HG# 1 1 103 1 1 1 1 12 VAL H . 12 . HN 1 1 103 1 2 1 1 13 ARG H . 13 . HN 1 1 104 1 1 1 1 12 VAL HA . 12 . HA 1 1 104 1 2 1 1 13 ARG H . 13 . HN 1 1 105 1 1 1 1 12 VAL QG . 12 . HG# 1 1 105 1 2 1 1 14 ASP H . 14 . HN 1 1 106 1 1 1 1 13 ARG H . 13 . HN 1 1 106 1 2 1 1 13 ARG QB . 13 . HB# 1 1 107 1 1 1 1 13 ARG H . 13 . HN 1 1 107 1 2 1 1 13 ARG QG . 13 . HG# 1 1 108 1 1 1 1 13 ARG H . 13 . HN 1 1 108 1 2 1 1 14 ASP H . 14 . HN 1 1 109 1 1 1 1 13 ARG HA . 13 . HA 1 1 109 1 2 1 1 14 ASP H . 14 . HN 1 1 110 1 1 1 1 13 ARG HA . 13 . HA 1 1 110 1 2 1 1 14 ASP HA . 14 . HA 1 1 111 1 1 1 1 13 ARG HA . 13 . HA 1 1 111 1 2 1 1 15 SER H . 15 . HN 1 1 112 1 1 1 1 13 ARG QB . 13 . HB# 1 1 112 1 2 1 1 14 ASP H . 14 . HN 1 1 113 1 1 1 1 13 ARG QG . 13 . HG# 1 1 113 1 2 1 1 14 ASP H . 14 . HN 1 1 114 1 1 1 1 14 ASP H . 14 . HN 1 1 114 1 2 1 1 14 ASP QB . 14 . HB# 1 1 115 1 1 1 1 14 ASP H . 14 . HN 1 1 115 1 2 1 1 15 SER H . 15 . HN 1 1 116 1 1 1 1 14 ASP HA . 14 . HA 1 1 116 1 2 1 1 15 SER H . 15 . HN 1 1 117 1 1 1 1 14 ASP QB . 14 . HB# 1 1 117 1 2 1 1 15 SER H . 15 . HN 1 1 118 1 1 1 1 15 SER H . 15 . HN 1 1 118 1 2 1 1 15 SER QB . 15 . HB# 1 1 119 1 1 1 1 16 LEU HA . 16 . HA 1 1 119 1 2 1 1 16 LEU QB . 16 . HB# 1 1 120 1 1 1 1 16 LEU QB . 16 . HB# 1 1 120 1 2 1 1 17 TYR H . 17 . HN 1 1 121 1 1 1 1 16 LEU QB . 16 . HB# 1 1 121 1 2 1 1 17 TYR QD . 17 . HD# 1 1 122 1 1 1 1 16 LEU QB . 16 . HB# 1 1 122 1 2 1 1 17 TYR QE . 17 . HE# 1 1 123 1 1 1 1 16 LEU QD . 16 . HD# 1 1 123 1 2 1 1 17 TYR H . 17 . HN 1 1 124 1 1 1 1 16 LEU QD . 16 . HD# 1 1 124 1 2 1 1 17 TYR QD . 17 . HD# 1 1 125 1 1 1 1 16 LEU QD . 16 . HD# 1 1 125 1 2 1 1 17 TYR QE . 17 . HE# 1 1 126 1 1 1 1 16 LEU QD . 16 . HD# 1 1 126 1 2 1 1 17 TYR HH . 17 . HH 1 1 127 1 1 1 1 16 LEU HG . 16 . HG 1 1 127 1 2 1 1 17 TYR H . 17 . HN 1 1 128 1 1 1 1 16 LEU HG . 16 . HG 1 1 128 1 2 1 1 17 TYR QD . 17 . HD# 1 1 129 1 1 1 1 16 LEU HG . 16 . HG 1 1 129 1 2 1 1 17 TYR QE . 17 . HE# 1 1 130 1 1 1 1 17 TYR H . 17 . HN 1 1 130 1 2 1 1 17 TYR QB . 17 . HB# 1 1 131 1 1 1 1 17 TYR H . 17 . HN 1 1 131 1 2 1 1 18 PRO QD . 18 . HD# 1 1 132 1 1 1 1 17 TYR HA . 17 . HA 1 1 132 1 2 1 1 18 PRO QD . 18 . HD# 1 1 133 1 1 1 1 17 TYR QB . 17 . HB# 1 1 133 1 2 1 1 18 PRO QD . 18 . HD# 1 1 134 1 1 1 1 17 TYR QD . 17 . HD# 1 1 134 1 2 1 1 18 PRO QD . 18 . HD# 1 1 135 1 1 1 1 19 PRO HA . 19 . HA 1 1 135 1 2 1 1 20 ALA H . 20 . HN 1 1 136 1 1 1 1 19 PRO HA . 19 . HA 1 1 136 1 2 1 1 20 ALA MB . 20 . HB# 1 1 137 1 1 1 1 19 PRO QB . 19 . HB# 1 1 137 1 2 1 1 20 ALA H . 20 . HN 1 1 138 1 1 1 1 19 PRO QB . 19 . HB# 1 1 138 1 2 1 1 21 GLY H . 21 . HN 1 1 139 1 1 1 1 19 PRO QG . 19 . HG# 1 1 139 1 2 1 1 20 ALA H . 20 . HN 1 1 140 1 1 1 1 20 ALA H . 20 . HN 1 1 140 1 2 1 1 20 ALA MB . 20 . HB# 1 1 141 1 1 1 1 20 ALA H . 20 . HN 1 1 141 1 2 1 1 21 GLY H . 21 . HN 1 1 142 1 1 1 1 20 ALA HA . 20 . HA 1 1 142 1 2 1 1 21 GLY H . 21 . HN 1 1 143 1 1 1 1 20 ALA MB . 20 . HB# 1 1 143 1 2 1 1 21 GLY H . 21 . HN 1 1 144 1 1 1 1 20 ALA MB . 20 . HB# 1 1 144 1 2 1 1 21 GLY QA . 21 . HA# 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 2.0 1.8 5.0 1 1 2 1 . . . . . 2.0 1.8 6.0 1 1 3 1 . . . . . 2.0 1.8 5.0 1 1 4 1 . . . . . 2.0 1.8 6.0 1 1 5 1 . . . . . 2.0 1.8 7.0 1 1 6 1 . . . . . 2.0 1.8 7.0 1 1 7 1 . . . . . 2.0 1.8 7.0 1 1 8 1 . . . . . 2.0 1.8 6.0 1 1 9 1 . . . . . 2.0 1.8 6.0 1 1 10 1 . . . . . 2.0 1.8 5.0 1 1 11 1 . . . . . 2.0 1.8 5.0 1 1 12 1 . . . . . 2.0 1.8 7.4 1 1 13 1 . . . . . 2.0 1.8 8.4 1 1 14 1 . . . . . 2.0 1.8 7.4 1 1 15 1 . . . . . 2.0 1.8 5.0 1 1 16 1 . . . . . 2.0 1.8 6.0 1 1 17 1 . . . . . 2.0 1.8 6.0 1 1 18 1 . . . . . 2.0 1.8 6.0 1 1 19 1 . . . . . 2.0 1.8 6.0 1 1 20 1 . . . . . 2.0 1.8 6.0 1 1 21 1 . . . . . 2.0 1.8 8.4 1 1 22 1 . . . . . 2.0 1.8 5.0 1 1 23 1 . . . . . 2.0 1.8 6.0 1 1 24 1 . . . . . 2.0 1.8 6.0 1 1 25 1 . . . . . 2.0 1.8 5.0 1 1 26 1 . . . . . 2.0 1.8 5.0 1 1 27 1 . . . . . 2.0 1.8 5.0 1 1 28 1 . . . . . 2.0 1.8 3.5 1 1 29 1 . . . . . 2.0 1.8 5.0 1 1 30 1 . . . . . 2.0 1.8 6.0 1 1 31 1 . . . . . 2.0 1.8 5.0 1 1 32 1 . . . . . 2.0 1.8 6.0 1 1 33 1 . . . . . 2.0 1.8 6.0 1 1 34 1 . . . . . 2.0 1.8 5.0 1 1 35 1 . . . . . 2.0 1.8 6.0 1 1 36 1 . . . . . 2.0 1.8 5.0 1 1 37 1 . . . . . 2.0 1.8 6.0 1 1 38 1 . . . . . 2.0 1.8 4.5 1 1 39 1 . . . . . 2.0 1.8 6.0 1 1 40 1 . . . . . 2.0 1.8 3.5 1 1 41 1 . . . . . 2.0 1.8 5.0 1 1 42 1 . . . . . 2.0 1.8 3.5 1 1 43 1 . . . . . 2.0 1.8 5.0 1 1 44 1 . . . . . 2.0 1.8 5.0 1 1 45 1 . . . . . 2.0 1.8 5.0 1 1 46 1 . . . . . 2.0 1.8 7.4 1 1 47 1 . . . . . 2.0 1.8 6.0 1 1 48 1 . . . . . 2.0 1.8 8.4 1 1 49 1 . . . . . 2.0 1.8 8.4 1 1 50 1 . . . . . 2.0 1.8 6.0 1 1 51 1 . . . . . 2.0 1.8 6.0 1 1 52 1 . . . . . 2.0 1.8 6.0 1 1 53 1 . . . . . 2.0 1.8 7.4 1 1 54 1 . . . . . 2.0 1.8 6.0 1 1 55 1 . . . . . 2.0 1.8 7.4 1 1 56 1 . . . . . 2.0 1.8 5.0 1 1 57 1 . . . . . 2.0 1.8 4.0 1 1 58 1 . . . . . 2.0 1.8 6.0 1 1 59 1 . . . . . 2.0 1.8 3.5 1 1 60 1 . . . . . 2.0 1.8 6.0 1 1 61 1 . . . . . 2.0 1.8 5.0 1 1 62 1 . . . . . 2.0 1.8 5.0 1 1 63 1 . . . . . 2.0 1.8 6.0 1 1 64 1 . . . . . 2.0 1.8 4.5 1 1 65 1 . . . . . 2.0 1.8 7.4 1 1 66 1 . . . . . 2.0 1.8 7.4 1 1 67 1 . . . . . 2.0 1.8 6.0 1 1 68 1 . . . . . 2.0 1.8 8.4 1 1 69 1 . . . . . 2.0 1.8 6.0 1 1 70 1 . . . . . 2.0 1.8 3.5 1 1 71 1 . . . . . 2.0 1.8 6.5 1 1 72 1 . . . . . 2.0 1.8 6.0 1 1 73 1 . . . . . 2.0 1.8 6.5 1 1 74 1 . . . . . 2.0 1.8 5.0 1 1 75 1 . . . . . 2.0 1.8 5.0 1 1 76 1 . . . . . 2.0 1.8 5.0 1 1 77 1 . . . . . 2.0 1.8 7.5 1 1 78 1 . . . . . 2.0 1.8 7.5 1 1 79 1 . . . . . 2.0 1.8 6.5 1 1 80 1 . . . . . 2.0 1.8 6.0 1 1 81 1 . . . . . 2.0 1.8 6.0 1 1 82 1 . . . . . 2.0 1.8 5.0 1 1 83 1 . . . . . 2.0 1.8 5.0 1 1 84 1 . . . . . 2.0 1.8 6.0 1 1 85 1 . . . . . 2.0 1.8 5.0 1 1 86 1 . . . . . 2.0 1.8 5.0 1 1 87 1 . . . . . 2.0 1.8 6.0 1 1 88 1 . . . . . 2.0 1.8 6.0 1 1 89 1 . . . . . 2.0 1.8 6.0 1 1 90 1 . . . . . 2.0 1.8 7.0 1 1 91 1 . . . . . 2.0 1.8 6.0 1 1 92 1 . . . . . 2.0 1.8 6.0 1 1 93 1 . . . . . 2.0 1.8 7.0 1 1 94 1 . . . . . 2.0 1.8 3.9 1 1 95 1 . . . . . 2.0 1.8 8.4 1 1 96 1 . . . . . 2.0 1.8 3.9 1 1 97 1 . . . . . 2.0 1.8 7.4 1 1 98 1 . . . . . 2.0 1.8 3.5 1 1 99 1 . . . . . 2.0 1.8 3.5 1 1 100 1 . . . . . 2.0 1.8 5.0 1 1 101 1 . . . . . 2.0 1.8 6.0 1 1 102 1 . . . . . 2.0 1.8 5.9 1 1 103 1 . . . . . 2.0 1.8 5.0 1 1 104 1 . . . . . 2.0 1.8 5.0 1 1 105 1 . . . . . 2.0 1.8 7.4 1 1 106 1 . . . . . 2.0 1.8 6.0 1 1 107 1 . . . . . 2.0 1.8 6.0 1 1 108 1 . . . . . 2.0 1.8 5.0 1 1 109 1 . . . . . 2.0 1.8 5.0 1 1 110 1 . . . . . 2.0 1.8 5.0 1 1 111 1 . . . . . 2.0 1.8 5.0 1 1 112 1 . . . . . 2.0 1.8 6.0 1 1 113 1 . . . . . 2.0 1.8 6.0 1 1 114 1 . . . . . 2.0 1.8 4.5 1 1 115 1 . . . . . 2.0 1.8 5.0 1 1 116 1 . . . . . 2.0 1.8 3.5 1 1 117 1 . . . . . 2.0 1.8 6.0 1 1 118 1 . . . . . 2.0 1.8 6.0 1 1 119 1 . . . . . 2.0 1.8 6.0 1 1 120 1 . . . . . 2.0 1.8 6.0 1 1 121 1 . . . . . 2.0 1.8 8.4 1 1 122 1 . . . . . 2.0 1.8 8.4 1 1 123 1 . . . . . 2.0 1.8 7.4 1 1 124 1 . . . . . 2.0 1.8 9.8 1 1 125 1 . . . . . 2.0 1.8 9.8 1 1 126 1 . . . . . 2.0 1.8 7.4 1 1 127 1 . . . . . 2.0 1.8 5.0 1 1 128 1 . . . . . 2.0 1.8 5.9 1 1 129 1 . . . . . 2.0 1.8 5.9 1 1 130 1 . . . . . 2.0 1.8 6.0 1 1 131 1 . . . . . 2.0 1.8 6.0 1 1 132 1 . . . . . 2.0 1.8 6.0 1 1 133 1 . . . . . 2.0 1.8 7.0 1 1 134 1 . . . . . 2.0 1.8 8.4 1 1 135 1 . . . . . 2.0 1.8 5.0 1 1 136 1 . . . . . 2.0 1.8 6.5 1 1 137 1 . . . . . 2.0 1.8 5.0 1 1 138 1 . . . . . 2.0 1.8 6.0 1 1 139 1 . . . . . 2.0 1.8 6.0 1 1 140 1 . . . . . 2.0 1.8 4.4 1 1 141 1 . . . . . 2.0 1.8 5.0 1 1 142 1 . . . . . 2.0 1.8 2.9 1 1 143 1 . . . . . 2.0 1.8 5.0 1 1 144 1 . . . . . 2.0 1.8 7.5 1 1 stop_ save_ save_CNS/XPLOR_dihedral_3 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 1 1 5 GLU C 1 1 6 GLU N 1 1 6 GLU CA 1 1 6 GLU C -150.0 -89.99999 . 5 . C . 6 . N . 6 . CA . 6 . C 1 1 2 . 1 1 8 ILE C 1 1 9 GLU N 1 1 9 GLU CA 1 1 9 GLU C -179.99998 -20.0 . 8 . C . 9 . N . 9 . CA . 9 . C 1 1 3 . 1 1 13 ARG C 1 1 14 ASP N 1 1 14 ASP CA 1 1 14 ASP C -179.99998 -20.0 . 13 . C . 14 . N . 14 . CA . 14 . C 1 1 4 . 1 1 14 ASP C 1 1 15 SER N 1 1 15 SER CA 1 1 15 SER C -179.99998 -20.0 . 14 . C . 15 . N . 15 . CA . 15 . C 1 1 5 . 1 1 19 PRO C 1 1 20 ALA N 1 1 20 ALA CA 1 1 20 ALA C -160.0 -80.0 . 19 . C . 20 . N . 20 . CA . 20 . C 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 ASP C C -4.631 -2.396 -1.582 1.00 . A A . 1 ASP C 1 1 1 2 1 1 1 ASP CA C -3.427 -1.874 -2.361 1.00 . A A . 1 ASP CA 1 1 1 3 1 1 1 ASP CB C -2.132 -2.395 -1.733 1.00 . A A . 1 ASP CB 1 1 1 4 1 1 1 ASP CG C -2.057 -3.909 -1.733 1.00 . A A . 1 ASP CG 1 1 1 5 1 1 1 ASP H1 H -3.373 -0.218 -1.438 1.00 . A A . 1 ASP H1 1 1 1 6 1 1 1 ASP HA H -3.490 -2.229 -3.378 1.00 . A A . 1 ASP HA 1 1 1 7 1 1 1 ASP HB2 H -1.290 -2.012 -2.290 1.00 . A A . 1 ASP HB2 1 1 1 8 1 1 1 ASP HB3 H -2.070 -2.049 -0.711 1.00 . A A . 1 ASP HB3 1 1 1 9 1 1 1 ASP N N -3.422 -0.415 -2.397 1.00 . A A . 1 ASP N 1 1 1 10 1 1 1 ASP O O -5.568 -2.943 -2.164 1.00 . A A . 1 ASP O 1 1 1 11 1 1 1 ASP OD1 O -2.630 -4.532 -2.651 1.00 . A A . 1 ASP OD1 1 1 1 12 1 1 1 ASP OD2 O -1.424 -4.473 -0.815 1.00 . A A . 1 ASP OD2 1 1 1 13 1 1 2 GLY C C -5.216 -3.342 1.849 1.00 . A A . 2 GLY C 1 1 1 14 1 1 2 GLY CA C -5.694 -2.685 0.569 1.00 . A A . 2 GLY CA 1 1 1 15 1 1 2 GLY H H -3.827 -1.782 0.145 1.00 . A A . 2 GLY H 1 1 1 16 1 1 2 GLY HA2 H -6.318 -1.840 0.822 1.00 . A A . 2 GLY HA2 1 1 1 17 1 1 2 GLY HA3 H -6.282 -3.398 0.010 1.00 . A A . 2 GLY HA3 1 1 1 18 1 1 2 GLY N N -4.599 -2.224 -0.264 1.00 . A A . 2 GLY N 1 1 1 19 1 1 2 GLY O O -5.525 -2.876 2.946 1.00 . A A . 2 GLY O 1 1 1 20 1 1 3 MET C C -2.437 -4.941 3.008 1.00 . A A . 3 MET C 1 1 1 21 1 1 3 MET CA C -3.941 -5.150 2.865 1.00 . A A . 3 MET CA 1 1 1 22 1 1 3 MET CB C -4.251 -6.643 2.741 1.00 . A A . 3 MET CB 1 1 1 23 1 1 3 MET CE C -3.226 -9.583 2.639 1.00 . A A . 3 MET CE 1 1 1 24 1 1 3 MET CG C -3.926 -7.219 1.372 1.00 . A A . 3 MET CG 1 1 1 25 1 1 3 MET H H -4.250 -4.750 0.809 1.00 . A A . 3 MET H 1 1 1 26 1 1 3 MET HA H -4.431 -4.763 3.746 1.00 . A A . 3 MET HA 1 1 1 27 1 1 3 MET HB2 H -3.676 -7.181 3.480 1.00 . A A . 3 MET HB2 1 1 1 28 1 1 3 MET HB3 H -5.303 -6.798 2.932 1.00 . A A . 3 MET HB3 1 1 1 29 1 1 3 MET HE1 H -3.266 -10.662 2.675 1.00 . A A . 3 MET HE1 1 1 1 30 1 1 3 MET HE2 H -3.606 -9.178 3.566 1.00 . A A . 3 MET HE2 1 1 1 31 1 1 3 MET HE3 H -2.204 -9.265 2.499 1.00 . A A . 3 MET HE3 1 1 1 32 1 1 3 MET HG2 H -4.538 -6.724 0.634 1.00 . A A . 3 MET HG2 1 1 1 33 1 1 3 MET HG3 H -2.884 -7.032 1.157 1.00 . A A . 3 MET HG3 1 1 1 34 1 1 3 MET N N -4.461 -4.427 1.710 1.00 . A A . 3 MET N 1 1 1 35 1 1 3 MET O O -1.640 -5.734 2.506 1.00 . A A . 3 MET O 1 1 1 36 1 1 3 MET SD S -4.228 -8.994 1.276 1.00 . A A . 3 MET SD 1 1 1 37 1 1 4 GLY C C -0.421 -2.568 5.002 1.00 . A A . 4 GLY C 1 1 1 38 1 1 4 GLY CA C -0.649 -3.577 3.895 1.00 . A A . 4 GLY CA 1 1 1 39 1 1 4 GLY H H -2.737 -3.275 4.075 1.00 . A A . 4 GLY H 1 1 1 40 1 1 4 GLY HA2 H -0.133 -4.492 4.145 1.00 . A A . 4 GLY HA2 1 1 1 41 1 1 4 GLY HA3 H -0.240 -3.184 2.976 1.00 . A A . 4 GLY HA3 1 1 1 42 1 1 4 GLY N N -2.056 -3.871 3.697 1.00 . A A . 4 GLY N 1 1 1 43 1 1 4 GLY O O -1.336 -2.258 5.765 1.00 . A A . 4 GLY O 1 1 1 44 1 1 5 GLU C C 2.325 -0.211 5.682 1.00 . A A . 5 GLU C 1 1 1 45 1 1 5 GLU CA C 1.136 -1.068 6.112 1.00 . A A . 5 GLU CA 1 1 1 46 1 1 5 GLU CB C 1.443 -1.765 7.439 1.00 . A A . 5 GLU CB 1 1 1 47 1 1 5 GLU CD C 3.768 -2.233 8.314 1.00 . A A . 5 GLU CD 1 1 1 48 1 1 5 GLU CG C 2.658 -2.678 7.381 1.00 . A A . 5 GLU CG 1 1 1 49 1 1 5 GLU H H 1.488 -2.334 4.453 1.00 . A A . 5 GLU H 1 1 1 50 1 1 5 GLU HA H 0.278 -0.427 6.243 1.00 . A A . 5 GLU HA 1 1 1 51 1 1 5 GLU HB2 H 1.618 -1.014 8.195 1.00 . A A . 5 GLU HB2 1 1 1 52 1 1 5 GLU HB3 H 0.587 -2.359 7.726 1.00 . A A . 5 GLU HB3 1 1 1 53 1 1 5 GLU HG2 H 2.355 -3.677 7.659 1.00 . A A . 5 GLU HG2 1 1 1 54 1 1 5 GLU HG3 H 3.038 -2.686 6.370 1.00 . A A . 5 GLU HG3 1 1 1 55 1 1 5 GLU N N 0.800 -2.051 5.090 1.00 . A A . 5 GLU N 1 1 1 56 1 1 5 GLU O O 3.292 -0.051 6.427 1.00 . A A . 5 GLU O 1 1 1 57 1 1 5 GLU OE1 O 3.465 -1.887 9.475 1.00 . A A . 5 GLU OE1 1 1 1 58 1 1 5 GLU OE2 O 4.940 -2.231 7.883 1.00 . A A . 5 GLU OE2 1 1 1 59 1 1 6 GLU C C 2.883 2.649 3.931 1.00 . A A . 6 GLU C 1 1 1 60 1 1 6 GLU CA C 3.306 1.183 3.943 1.00 . A A . 6 GLU CA 1 1 1 61 1 1 6 GLU CB C 3.681 0.736 2.529 1.00 . A A . 6 GLU CB 1 1 1 62 1 1 6 GLU CD C 5.547 0.146 0.933 1.00 . A A . 6 GLU CD 1 1 1 63 1 1 6 GLU CG C 5.170 0.819 2.238 1.00 . A A . 6 GLU CG 1 1 1 64 1 1 6 GLU H H 1.445 0.175 3.929 1.00 . A A . 6 GLU H 1 1 1 65 1 1 6 GLU HA H 4.168 1.074 4.585 1.00 . A A . 6 GLU HA 1 1 1 66 1 1 6 GLU HB2 H 3.366 -0.289 2.392 1.00 . A A . 6 GLU HB2 1 1 1 67 1 1 6 GLU HB3 H 3.161 1.360 1.817 1.00 . A A . 6 GLU HB3 1 1 1 68 1 1 6 GLU HG2 H 5.456 1.859 2.184 1.00 . A A . 6 GLU HG2 1 1 1 69 1 1 6 GLU HG3 H 5.708 0.340 3.043 1.00 . A A . 6 GLU HG3 1 1 1 70 1 1 6 GLU N N 2.242 0.339 4.475 1.00 . A A . 6 GLU N 1 1 1 71 1 1 6 GLU O O 3.510 3.492 4.573 1.00 . A A . 6 GLU O 1 1 1 72 1 1 6 GLU OE1 O 6.569 -0.572 0.909 1.00 . A A . 6 GLU OE1 1 1 1 73 1 1 6 GLU OE2 O 4.820 0.335 -0.065 1.00 . A A . 6 GLU OE2 1 1 1 74 1 1 7 PHE C C 0.027 4.357 2.272 1.00 . A A . 7 PHE C 1 1 1 75 1 1 7 PHE CA C 1.306 4.310 3.102 1.00 . A A . 7 PHE CA 1 1 1 76 1 1 7 PHE CB C 2.363 5.228 2.485 1.00 . A A . 7 PHE CB 1 1 1 77 1 1 7 PHE CD1 C 2.308 5.460 -0.013 1.00 . A A . 7 PHE CD1 1 1 1 78 1 1 7 PHE CD2 C 3.681 3.757 0.937 1.00 . A A . 7 PHE CD2 1 1 1 79 1 1 7 PHE CE1 C 2.700 5.074 -1.280 1.00 . A A . 7 PHE CE1 1 1 1 80 1 1 7 PHE CE2 C 4.077 3.366 -0.328 1.00 . A A . 7 PHE CE2 1 1 1 81 1 1 7 PHE CG C 2.792 4.807 1.109 1.00 . A A . 7 PHE CG 1 1 1 82 1 1 7 PHE CZ C 3.586 4.026 -1.438 1.00 . A A . 7 PHE CZ 1 1 1 83 1 1 7 PHE H H 1.356 2.230 2.709 1.00 . A A . 7 PHE H 1 1 1 84 1 1 7 PHE HA H 1.084 4.651 4.102 1.00 . A A . 7 PHE HA 1 1 1 85 1 1 7 PHE HB2 H 1.964 6.229 2.417 1.00 . A A . 7 PHE HB2 1 1 1 86 1 1 7 PHE HB3 H 3.237 5.236 3.120 1.00 . A A . 7 PHE HB3 1 1 1 87 1 1 7 PHE HD1 H 1.615 6.280 0.109 1.00 . A A . 7 PHE HD1 1 1 1 88 1 1 7 PHE HD2 H 4.065 3.241 1.805 1.00 . A A . 7 PHE HD2 1 1 1 89 1 1 7 PHE HE1 H 2.315 5.591 -2.147 1.00 . A A . 7 PHE HE1 1 1 1 90 1 1 7 PHE HE2 H 4.770 2.547 -0.448 1.00 . A A . 7 PHE HE2 1 1 1 91 1 1 7 PHE HZ H 3.894 3.722 -2.428 1.00 . A A . 7 PHE HZ 1 1 1 92 1 1 7 PHE N N 1.814 2.945 3.197 1.00 . A A . 7 PHE N 1 1 1 93 1 1 7 PHE O O -0.260 3.438 1.506 1.00 . A A . 7 PHE O 1 1 1 94 1 1 8 ILE C C -1.819 5.275 0.216 1.00 . A A . 8 ILE C 1 1 1 95 1 1 8 ILE CA C -1.992 5.602 1.698 1.00 . A A . 8 ILE CA 1 1 1 96 1 1 8 ILE CB C -2.533 7.040 1.836 1.00 . A A . 8 ILE CB 1 1 1 97 1 1 8 ILE CD1 C -1.921 8.752 3.620 1.00 . A A . 8 ILE CD1 1 1 1 98 1 1 8 ILE CG1 C -2.613 7.442 3.312 1.00 . A A . 8 ILE CG1 1 1 1 99 1 1 8 ILE CG2 C -3.898 7.161 1.174 1.00 . A A . 8 ILE CG2 1 1 1 100 1 1 8 ILE H H -0.456 6.132 3.057 1.00 . A A . 8 ILE H 1 1 1 101 1 1 8 ILE HA H -2.719 4.925 2.122 1.00 . A A . 8 ILE HA 1 1 1 102 1 1 8 ILE HB H -1.854 7.706 1.326 1.00 . A A . 8 ILE HB 1 1 1 103 1 1 8 ILE HD11 H -1.062 8.567 4.248 1.00 . A A . 8 ILE HD11 1 1 1 104 1 1 8 ILE HD12 H -2.607 9.410 4.132 1.00 . A A . 8 ILE HD12 1 1 1 105 1 1 8 ILE HD13 H -1.599 9.214 2.698 1.00 . A A . 8 ILE HD13 1 1 1 106 1 1 8 ILE HG12 H -3.650 7.542 3.597 1.00 . A A . 8 ILE HG12 1 1 1 107 1 1 8 ILE HG13 H -2.152 6.673 3.915 1.00 . A A . 8 ILE HG13 1 1 1 108 1 1 8 ILE HG21 H -4.369 6.189 1.140 1.00 . A A . 8 ILE HG21 1 1 1 109 1 1 8 ILE HG22 H -3.779 7.538 0.169 1.00 . A A . 8 ILE HG22 1 1 1 110 1 1 8 ILE HG23 H -4.516 7.840 1.742 1.00 . A A . 8 ILE HG23 1 1 1 111 1 1 8 ILE N N -0.739 5.433 2.431 1.00 . A A . 8 ILE N 1 1 1 112 1 1 8 ILE O O -1.144 5.999 -0.516 1.00 . A A . 8 ILE O 1 1 1 113 1 1 9 GLU C C -3.201 4.649 -2.505 1.00 . A A . 9 GLU C 1 1 1 114 1 1 9 GLU CA C -2.350 3.753 -1.610 1.00 . A A . 9 GLU CA 1 1 1 115 1 1 9 GLU CB C -2.798 2.295 -1.748 1.00 . A A . 9 GLU CB 1 1 1 116 1 1 9 GLU CD C -2.647 0.259 -3.240 1.00 . A A . 9 GLU CD 1 1 1 117 1 1 9 GLU CG C -2.740 1.772 -3.174 1.00 . A A . 9 GLU CG 1 1 1 118 1 1 9 GLU H H -2.957 3.642 0.415 1.00 . A A . 9 GLU H 1 1 1 119 1 1 9 GLU HA H -1.318 3.833 -1.918 1.00 . A A . 9 GLU HA 1 1 1 120 1 1 9 GLU HB2 H -2.162 1.675 -1.134 1.00 . A A . 9 GLU HB2 1 1 1 121 1 1 9 GLU HB3 H -3.816 2.209 -1.397 1.00 . A A . 9 GLU HB3 1 1 1 122 1 1 9 GLU HG2 H -3.633 2.084 -3.695 1.00 . A A . 9 GLU HG2 1 1 1 123 1 1 9 GLU HG3 H -1.874 2.193 -3.663 1.00 . A A . 9 GLU HG3 1 1 1 124 1 1 9 GLU N N -2.434 4.178 -0.217 1.00 . A A . 9 GLU N 1 1 1 125 1 1 9 GLU O O -4.171 4.195 -3.115 1.00 . A A . 9 GLU O 1 1 1 126 1 1 9 GLU OE1 O -1.888 -0.292 -4.038 1.00 . A A . 9 GLU OE1 1 1 1 127 1 1 10 GLY C C -4.945 7.170 -2.844 1.00 . A A . 10 GLY C 1 1 1 128 1 1 10 GLY CA C -3.571 6.861 -3.405 1.00 . A A . 10 GLY CA 1 1 1 129 1 1 10 GLY H H -2.051 6.228 -2.075 1.00 . A A . 10 GLY H 1 1 1 130 1 1 10 GLY HA2 H -3.009 7.781 -3.476 1.00 . A A . 10 GLY HA2 1 1 1 131 1 1 10 GLY HA3 H -3.684 6.443 -4.394 1.00 . A A . 10 GLY HA3 1 1 1 132 1 1 10 GLY N N -2.832 5.923 -2.581 1.00 . A A . 10 GLY N 1 1 1 133 1 1 10 GLY O O -5.205 8.289 -2.401 1.00 . A A . 10 GLY O 1 1 1 134 1 1 11 LEU C C -7.664 5.088 -1.641 1.00 . A A . 11 LEU C 1 1 1 135 1 1 11 LEU CA C -7.182 6.350 -2.352 1.00 . A A . 11 LEU CA 1 1 1 136 1 1 11 LEU CB C -8.140 6.709 -3.493 1.00 . A A . 11 LEU CB 1 1 1 137 1 1 11 LEU CD1 C -7.948 4.556 -4.765 1.00 . A A . 11 LEU CD1 1 1 1 138 1 1 11 LEU CD2 C -8.717 6.630 -5.932 1.00 . A A . 11 LEU CD2 1 1 1 139 1 1 11 LEU CG C -7.813 6.069 -4.844 1.00 . A A . 11 LEU CG 1 1 1 140 1 1 11 LEU H H -5.561 5.307 -3.228 1.00 . A A . 11 LEU H 1 1 1 141 1 1 11 LEU HA H -7.165 7.163 -1.642 1.00 . A A . 11 LEU HA 1 1 1 142 1 1 11 LEU HB2 H -9.137 6.405 -3.206 1.00 . A A . 11 LEU HB2 1 1 1 143 1 1 11 LEU HB3 H -8.132 7.781 -3.617 1.00 . A A . 11 LEU HB3 1 1 1 144 1 1 11 LEU HD11 H -8.006 4.148 -5.763 1.00 . A A . 11 LEU HD11 1 1 1 145 1 1 11 LEU HD12 H -8.845 4.303 -4.220 1.00 . A A . 11 LEU HD12 1 1 1 146 1 1 11 LEU HD13 H -7.089 4.144 -4.257 1.00 . A A . 11 LEU HD13 1 1 1 147 1 1 11 LEU HD21 H -8.422 7.644 -6.157 1.00 . A A . 11 LEU HD21 1 1 1 148 1 1 11 LEU HD22 H -9.741 6.620 -5.590 1.00 . A A . 11 LEU HD22 1 1 1 149 1 1 11 LEU HD23 H -8.629 6.023 -6.821 1.00 . A A . 11 LEU HD23 1 1 1 150 1 1 11 LEU HG H -6.791 6.299 -5.105 1.00 . A A . 11 LEU HG 1 1 1 151 1 1 11 LEU N N -5.827 6.177 -2.862 1.00 . A A . 11 LEU N 1 1 1 152 1 1 11 LEU O O -8.702 4.525 -1.988 1.00 . A A . 11 LEU O 1 1 1 153 1 1 12 VAL C C -6.720 3.541 1.549 1.00 . A A . 12 VAL C 1 1 1 154 1 1 12 VAL CA C -7.255 3.458 0.118 1.00 . A A . 12 VAL CA 1 1 1 155 1 1 12 VAL CB C -6.727 2.179 -0.567 1.00 . A A . 12 VAL CB 1 1 1 156 1 1 12 VAL CG1 C -7.067 0.944 0.255 1.00 . A A . 12 VAL CG1 1 1 1 157 1 1 12 VAL CG2 C -7.291 2.059 -1.975 1.00 . A A . 12 VAL CG2 1 1 1 158 1 1 12 VAL H H -6.088 5.143 -0.410 1.00 . A A . 12 VAL H 1 1 1 159 1 1 12 VAL HA H -8.333 3.399 0.156 1.00 . A A . 12 VAL HA 1 1 1 160 1 1 12 VAL HB H -5.652 2.250 -0.641 1.00 . A A . 12 VAL HB 1 1 1 161 1 1 12 VAL HG11 H -6.231 0.694 0.891 1.00 . A A . 12 VAL HG11 1 1 1 162 1 1 12 VAL HG12 H -7.275 0.116 -0.407 1.00 . A A . 12 VAL HG12 1 1 1 163 1 1 12 VAL HG13 H -7.935 1.144 0.864 1.00 . A A . 12 VAL HG13 1 1 1 164 1 1 12 VAL HG21 H -8.362 2.192 -1.946 1.00 . A A . 12 VAL HG21 1 1 1 165 1 1 12 VAL HG22 H -7.060 1.082 -2.374 1.00 . A A . 12 VAL HG22 1 1 1 166 1 1 12 VAL HG23 H -6.850 2.818 -2.605 1.00 . A A . 12 VAL HG23 1 1 1 167 1 1 12 VAL N N -6.903 4.651 -0.642 1.00 . A A . 12 VAL N 1 1 1 168 1 1 12 VAL O O -7.436 3.955 2.460 1.00 . A A . 12 VAL O 1 1 1 169 1 1 13 ARG C C -3.398 2.692 3.005 1.00 . A A . 13 ARG C 1 1 1 170 1 1 13 ARG CA C -4.841 3.185 3.065 1.00 . A A . 13 ARG CA 1 1 1 171 1 1 13 ARG CB C -5.648 2.337 4.057 1.00 . A A . 13 ARG CB 1 1 1 172 1 1 13 ARG CD C -6.809 0.111 4.200 1.00 . A A . 13 ARG CD 1 1 1 173 1 1 13 ARG CG C -5.529 0.839 3.821 1.00 . A A . 13 ARG CG 1 1 1 174 1 1 13 ARG CZ C -8.763 -0.811 3.016 1.00 . A A . 13 ARG CZ 1 1 1 175 1 1 13 ARG H H -4.934 2.832 0.981 1.00 . A A . 13 ARG H 1 1 1 176 1 1 13 ARG HA H -4.839 4.210 3.401 1.00 . A A . 13 ARG HA 1 1 1 177 1 1 13 ARG HB2 H -5.303 2.549 5.057 1.00 . A A . 13 ARG HB2 1 1 1 178 1 1 13 ARG HB3 H -6.689 2.609 3.982 1.00 . A A . 13 ARG HB3 1 1 1 179 1 1 13 ARG HD2 H -6.565 -0.685 4.888 1.00 . A A . 13 ARG HD2 1 1 1 180 1 1 13 ARG HD3 H -7.478 0.810 4.682 1.00 . A A . 13 ARG HD3 1 1 1 181 1 1 13 ARG HE H -6.945 -0.589 2.224 1.00 . A A . 13 ARG HE 1 1 1 182 1 1 13 ARG HG2 H -5.324 0.664 2.775 1.00 . A A . 13 ARG HG2 1 1 1 183 1 1 13 ARG HG3 H -4.716 0.454 4.418 1.00 . A A . 13 ARG HG3 1 1 1 184 1 1 13 ARG HH11 H -9.125 -0.268 4.930 1.00 . A A . 13 ARG HH11 1 1 1 185 1 1 13 ARG HH12 H -10.482 -0.918 4.074 1.00 . A A . 13 ARG HH12 1 1 1 186 1 1 13 ARG HH21 H -8.729 -1.445 1.097 1.00 . A A . 13 ARG HH21 1 1 1 187 1 1 13 ARG HH22 H -10.258 -1.587 1.898 1.00 . A A . 13 ARG HH22 1 1 1 188 1 1 13 ARG N N -5.460 3.149 1.743 1.00 . A A . 13 ARG N 1 1 1 189 1 1 13 ARG NE N -7.480 -0.460 3.035 1.00 . A A . 13 ARG NE 1 1 1 190 1 1 13 ARG NH1 N -9.518 -0.653 4.095 1.00 . A A . 13 ARG NH1 1 1 1 191 1 1 13 ARG NH2 N -9.293 -1.323 1.913 1.00 . A A . 13 ARG NH2 1 1 1 192 1 1 13 ARG O O -2.813 2.586 1.928 1.00 . A A . 13 ARG O 1 1 1 193 1 1 14 ASP C C -1.247 0.707 3.335 1.00 . A A . 14 ASP C 1 1 1 194 1 1 14 ASP CA C -1.458 1.908 4.254 1.00 . A A . 14 ASP CA 1 1 1 195 1 1 14 ASP CB C -1.111 1.532 5.696 1.00 . A A . 14 ASP CB 1 1 1 196 1 1 14 ASP CG C -1.563 2.580 6.694 1.00 . A A . 14 ASP CG 1 1 1 197 1 1 14 ASP H H -3.349 2.497 4.995 1.00 . A A . 14 ASP H 1 1 1 198 1 1 14 ASP HA H -0.807 2.707 3.934 1.00 . A A . 14 ASP HA 1 1 1 199 1 1 14 ASP HB2 H -1.589 0.596 5.943 1.00 . A A . 14 ASP HB2 1 1 1 200 1 1 14 ASP HB3 H -0.040 1.418 5.782 1.00 . A A . 14 ASP HB3 1 1 1 201 1 1 14 ASP N N -2.831 2.391 4.171 1.00 . A A . 14 ASP N 1 1 1 202 1 1 14 ASP O O -1.493 -0.435 3.718 1.00 . A A . 14 ASP O 1 1 1 203 1 1 14 ASP OD1 O -2.375 2.243 7.582 1.00 . A A . 14 ASP OD1 1 1 1 204 1 1 14 ASP OD2 O -1.104 3.737 6.589 1.00 . A A . 14 ASP OD2 1 1 1 205 1 1 15 SER C C 0.527 -1.027 1.606 1.00 . A A . 15 SER C 1 1 1 206 1 1 15 SER CA C -0.550 -0.059 1.127 1.00 . A A . 15 SER CA 1 1 1 207 1 1 15 SER CB C -0.128 0.569 -0.204 1.00 . A A . 15 SER CB 1 1 1 208 1 1 15 SER H H -0.626 1.917 1.880 1.00 . A A . 15 SER H 1 1 1 209 1 1 15 SER HA H -1.470 -0.604 0.982 1.00 . A A . 15 SER HA 1 1 1 210 1 1 15 SER HB2 H -0.405 1.613 -0.210 1.00 . A A . 15 SER HB2 1 1 1 211 1 1 15 SER HB3 H 0.942 0.480 -0.319 1.00 . A A . 15 SER HB3 1 1 1 212 1 1 15 SER HG H -0.137 -0.160 -2.021 1.00 . A A . 15 SER HG 1 1 1 213 1 1 15 SER N N -0.796 0.984 2.118 1.00 . A A . 15 SER N 1 1 1 214 1 1 15 SER O O 0.916 -1.008 2.771 1.00 . A A . 15 SER O 1 1 1 215 1 1 15 SER OG O -0.760 -0.075 -1.296 1.00 . A A . 15 SER OG 1 1 1 216 1 1 16 LEU C C 3.229 -2.719 0.077 1.00 . A A . 16 LEU C 1 1 1 217 1 1 16 LEU CA C 2.044 -2.841 1.031 1.00 . A A . 16 LEU CA 1 1 1 218 1 1 16 LEU CB C 1.478 -4.263 0.989 1.00 . A A . 16 LEU CB 1 1 1 219 1 1 16 LEU CD1 C 1.132 -6.480 2.107 1.00 . A A . 16 LEU CD1 1 1 1 220 1 1 16 LEU CD2 C 3.353 -5.340 2.259 1.00 . A A . 16 LEU CD2 1 1 1 221 1 1 16 LEU CG C 1.846 -5.140 2.187 1.00 . A A . 16 LEU CG 1 1 1 222 1 1 16 LEU H H 0.661 -1.837 -0.219 1.00 . A A . 16 LEU H 1 1 1 223 1 1 16 LEU HA H 2.383 -2.629 2.034 1.00 . A A . 16 LEU HA 1 1 1 224 1 1 16 LEU HB2 H 0.401 -4.197 0.935 1.00 . A A . 16 LEU HB2 1 1 1 225 1 1 16 LEU HB3 H 1.837 -4.748 0.093 1.00 . A A . 16 LEU HB3 1 1 1 226 1 1 16 LEU HD11 H 1.796 -7.216 1.678 1.00 . A A . 16 LEU HD11 1 1 1 227 1 1 16 LEU HD12 H 0.253 -6.383 1.487 1.00 . A A . 16 LEU HD12 1 1 1 228 1 1 16 LEU HD13 H 0.841 -6.793 3.099 1.00 . A A . 16 LEU HD13 1 1 1 229 1 1 16 LEU HD21 H 3.681 -5.233 3.283 1.00 . A A . 16 LEU HD21 1 1 1 230 1 1 16 LEU HD22 H 3.845 -4.599 1.646 1.00 . A A . 16 LEU HD22 1 1 1 231 1 1 16 LEU HD23 H 3.604 -6.327 1.902 1.00 . A A . 16 LEU HD23 1 1 1 232 1 1 16 LEU HG H 1.530 -4.648 3.095 1.00 . A A . 16 LEU HG 1 1 1 233 1 1 16 LEU N N 1.008 -1.870 0.697 1.00 . A A . 16 LEU N 1 1 1 234 1 1 16 LEU O O 4.301 -2.252 0.462 1.00 . A A . 16 LEU O 1 1 1 235 1 1 17 TYR C C 3.589 -3.550 -3.537 1.00 . A A . 17 TYR C 1 1 1 236 1 1 17 TYR CA C 4.085 -3.066 -2.175 1.00 . A A . 17 TYR CA 1 1 1 237 1 1 17 TYR CB C 5.300 -3.893 -1.737 1.00 . A A . 17 TYR CB 1 1 1 238 1 1 17 TYR CD1 C 5.862 -5.895 -0.305 1.00 . A A . 17 TYR CD1 1 1 1 239 1 1 17 TYR CD2 C 3.740 -5.864 -1.392 1.00 . A A . 17 TYR CD2 1 1 1 240 1 1 17 TYR CE1 C 5.565 -7.126 0.248 1.00 . A A . 17 TYR CE1 1 1 1 241 1 1 17 TYR CE2 C 3.436 -7.095 -0.840 1.00 . A A . 17 TYR CE2 1 1 1 242 1 1 17 TYR CG C 4.957 -5.242 -1.134 1.00 . A A . 17 TYR CG 1 1 1 243 1 1 17 TYR CZ C 4.352 -7.721 -0.022 1.00 . A A . 17 TYR CZ 1 1 1 244 1 1 17 TYR H H 2.153 -3.497 -1.420 1.00 . A A . 17 TYR H 1 1 1 245 1 1 17 TYR HA H 4.382 -2.032 -2.264 1.00 . A A . 17 TYR HA 1 1 1 246 1 1 17 TYR HB2 H 5.931 -4.068 -2.595 1.00 . A A . 17 TYR HB2 1 1 1 247 1 1 17 TYR HB3 H 5.856 -3.332 -1.000 1.00 . A A . 17 TYR HB3 1 1 1 248 1 1 17 TYR HD1 H 6.812 -5.426 -0.094 1.00 . A A . 17 TYR HD1 1 1 1 249 1 1 17 TYR HD2 H 3.023 -5.373 -2.032 1.00 . A A . 17 TYR HD2 1 1 1 250 1 1 17 TYR HE1 H 6.283 -7.616 0.889 1.00 . A A . 17 TYR HE1 1 1 1 251 1 1 17 TYR HE2 H 2.486 -7.561 -1.052 1.00 . A A . 17 TYR HE2 1 1 1 252 1 1 17 TYR HH H 4.256 -9.639 -0.105 1.00 . A A . 17 TYR HH 1 1 1 253 1 1 17 TYR N N 3.029 -3.137 -1.170 1.00 . A A . 17 TYR N 1 1 1 254 1 1 17 TYR O O 4.093 -4.536 -4.076 1.00 . A A . 17 TYR O 1 1 1 255 1 1 17 TYR OH O 4.053 -8.946 0.527 1.00 . A A . 17 TYR OH 1 1 1 256 1 1 18 PRO C C 3.099 -3.236 -6.526 1.00 . A A . 18 PRO C 1 1 1 257 1 1 18 PRO CA C 2.038 -3.229 -5.425 1.00 . A A . 18 PRO CA 1 1 1 258 1 1 18 PRO CB C 0.987 -2.147 -5.701 1.00 . A A . 18 PRO CB 1 1 1 259 1 1 18 PRO CD C 1.929 -1.671 -3.553 1.00 . A A . 18 PRO CD 1 1 1 260 1 1 18 PRO CG C 0.672 -1.559 -4.368 1.00 . A A . 18 PRO CG 1 1 1 261 1 1 18 PRO HA H 1.559 -4.196 -5.388 1.00 . A A . 18 PRO HA 1 1 1 262 1 1 18 PRO HB2 H 1.396 -1.407 -6.373 1.00 . A A . 18 PRO HB2 1 1 1 263 1 1 18 PRO HB3 H 0.114 -2.599 -6.147 1.00 . A A . 18 PRO HB3 1 1 1 264 1 1 18 PRO HD2 H 2.541 -0.790 -3.677 1.00 . A A . 18 PRO HD2 1 1 1 265 1 1 18 PRO HD3 H 1.690 -1.822 -2.511 1.00 . A A . 18 PRO HD3 1 1 1 266 1 1 18 PRO HG2 H 0.391 -0.522 -4.481 1.00 . A A . 18 PRO HG2 1 1 1 267 1 1 18 PRO HG3 H -0.127 -2.116 -3.902 1.00 . A A . 18 PRO HG3 1 1 1 268 1 1 18 PRO N N 2.592 -2.860 -4.118 1.00 . A A . 18 PRO N 1 1 1 269 1 1 18 PRO O O 3.184 -4.185 -7.305 1.00 . A A . 18 PRO O 1 1 1 270 1 1 19 PRO C C 6.249 -2.803 -7.214 1.00 . A A . 19 PRO C 1 1 1 271 1 1 19 PRO CA C 4.974 -2.073 -7.623 1.00 . A A . 19 PRO CA 1 1 1 272 1 1 19 PRO CB C 5.219 -0.570 -7.699 1.00 . A A . 19 PRO CB 1 1 1 273 1 1 19 PRO CD C 3.903 -0.990 -5.728 1.00 . A A . 19 PRO CD 1 1 1 274 1 1 19 PRO CG C 4.953 -0.078 -6.316 1.00 . A A . 19 PRO CG 1 1 1 275 1 1 19 PRO HA H 4.639 -2.438 -8.582 1.00 . A A . 19 PRO HA 1 1 1 276 1 1 19 PRO HB2 H 6.241 -0.383 -7.997 1.00 . A A . 19 PRO HB2 1 1 1 277 1 1 19 PRO HB3 H 4.542 -0.126 -8.412 1.00 . A A . 19 PRO HB3 1 1 1 278 1 1 19 PRO HD2 H 4.167 -1.260 -4.717 1.00 . A A . 19 PRO HD2 1 1 1 279 1 1 19 PRO HD3 H 2.937 -0.511 -5.750 1.00 . A A . 19 PRO HD3 1 1 1 280 1 1 19 PRO HG2 H 5.859 -0.127 -5.731 1.00 . A A . 19 PRO HG2 1 1 1 281 1 1 19 PRO HG3 H 4.587 0.937 -6.355 1.00 . A A . 19 PRO HG3 1 1 1 282 1 1 19 PRO N N 3.925 -2.175 -6.610 1.00 . A A . 19 PRO N 1 1 1 283 1 1 19 PRO O O 6.807 -2.549 -6.147 1.00 . A A . 19 PRO O 1 1 1 284 1 1 20 ALA C C 8.497 -5.060 -9.083 1.00 . A A . 20 ALA C 1 1 1 285 1 1 20 ALA CA C 7.917 -4.475 -7.799 1.00 . A A . 20 ALA CA 1 1 1 286 1 1 20 ALA CB C 7.629 -5.580 -6.795 1.00 . A A . 20 ALA CB 1 1 1 287 1 1 20 ALA H H 6.219 -3.868 -8.907 1.00 . A A . 20 ALA H 1 1 1 288 1 1 20 ALA HA H 8.643 -3.805 -7.362 1.00 . A A . 20 ALA HA 1 1 1 289 1 1 20 ALA HB1 H 6.995 -5.196 -6.009 1.00 . A A . 20 ALA HB1 1 1 1 290 1 1 20 ALA HB2 H 8.557 -5.931 -6.369 1.00 . A A . 20 ALA HB2 1 1 1 291 1 1 20 ALA HB3 H 7.129 -6.398 -7.293 1.00 . A A . 20 ALA HB3 1 1 1 292 1 1 20 ALA N N 6.707 -3.710 -8.071 1.00 . A A . 20 ALA N 1 1 1 293 1 1 20 ALA O O 7.952 -6.010 -9.645 1.00 . A A . 20 ALA O 1 1 1 294 1 1 21 GLY C C 10.836 -3.840 -11.579 1.00 . A A . 21 GLY C 1 1 1 295 1 1 21 GLY CA C 10.238 -4.964 -10.756 1.00 . A A . 21 GLY CA 1 1 1 296 1 1 21 GLY H H 9.994 -3.732 -9.052 1.00 . A A . 21 GLY H 1 1 1 297 1 1 21 GLY HA2 H 11.023 -5.658 -10.490 1.00 . A A . 21 GLY HA2 1 1 1 298 1 1 21 GLY HA3 H 9.502 -5.481 -11.354 1.00 . A A . 21 GLY HA3 1 1 1 299 1 1 21 GLY N N 9.604 -4.486 -9.541 1.00 . A A . 21 GLY N 1 1 2 300 1 1 1 ASP C C -5.846 -1.255 -1.766 1.00 . A A . 1 ASP C 1 1 2 301 1 1 1 ASP CA C -4.962 -1.117 -3.002 1.00 . A A . 1 ASP CA 1 1 2 302 1 1 1 ASP CB C -4.288 -2.455 -3.319 1.00 . A A . 1 ASP CB 1 1 2 303 1 1 1 ASP CG C -4.599 -2.941 -4.721 1.00 . A A . 1 ASP CG 1 1 2 304 1 1 1 ASP H1 H -3.730 0.196 -1.894 1.00 . A A . 1 ASP H1 1 1 2 305 1 1 1 ASP HA H -5.579 -0.827 -3.840 1.00 . A A . 1 ASP HA 1 1 2 306 1 1 1 ASP HB2 H -3.218 -2.342 -3.227 1.00 . A A . 1 ASP HB2 1 1 2 307 1 1 1 ASP HB3 H -4.628 -3.200 -2.615 1.00 . A A . 1 ASP HB3 1 1 2 308 1 1 1 ASP N N -3.957 -0.078 -2.807 1.00 . A A . 1 ASP N 1 1 2 309 1 1 1 ASP O O -7.070 -1.339 -1.872 1.00 . A A . 1 ASP O 1 1 2 310 1 1 1 ASP OD1 O -4.527 -4.166 -4.954 1.00 . A A . 1 ASP OD1 1 1 2 311 1 1 1 ASP OD2 O -4.916 -2.097 -5.585 1.00 . A A . 1 ASP OD2 1 1 2 312 1 1 2 GLY C C -5.206 -2.189 1.697 1.00 . A A . 2 GLY C 1 1 2 313 1 1 2 GLY CA C -5.963 -1.405 0.643 1.00 . A A . 2 GLY CA 1 1 2 314 1 1 2 GLY H H -4.241 -1.207 -0.572 1.00 . A A . 2 GLY H 1 1 2 315 1 1 2 GLY HA2 H -6.173 -0.417 1.027 1.00 . A A . 2 GLY HA2 1 1 2 316 1 1 2 GLY HA3 H -6.897 -1.907 0.439 1.00 . A A . 2 GLY HA3 1 1 2 317 1 1 2 GLY N N -5.218 -1.277 -0.595 1.00 . A A . 2 GLY N 1 1 2 318 1 1 2 GLY O O -4.745 -1.624 2.689 1.00 . A A . 2 GLY O 1 1 2 319 1 1 3 MET C C -2.873 -4.077 2.396 1.00 . A A . 3 MET C 1 1 2 320 1 1 3 MET CA C -4.372 -4.357 2.421 1.00 . A A . 3 MET CA 1 1 2 321 1 1 3 MET CB C -4.635 -5.827 2.090 1.00 . A A . 3 MET CB 1 1 2 322 1 1 3 MET CE C -6.802 -5.876 -0.812 1.00 . A A . 3 MET CE 1 1 2 323 1 1 3 MET CG C -6.104 -6.145 1.857 1.00 . A A . 3 MET CG 1 1 2 324 1 1 3 MET H H -5.467 -3.886 0.673 1.00 . A A . 3 MET H 1 1 2 325 1 1 3 MET HA H -4.748 -4.148 3.411 1.00 . A A . 3 MET HA 1 1 2 326 1 1 3 MET HB2 H -4.085 -6.087 1.198 1.00 . A A . 3 MET HB2 1 1 2 327 1 1 3 MET HB3 H -4.283 -6.437 2.909 1.00 . A A . 3 MET HB3 1 1 2 328 1 1 3 MET HE1 H -6.886 -4.923 -0.310 1.00 . A A . 3 MET HE1 1 1 2 329 1 1 3 MET HE2 H -7.745 -6.122 -1.278 1.00 . A A . 3 MET HE2 1 1 2 330 1 1 3 MET HE3 H -6.032 -5.818 -1.567 1.00 . A A . 3 MET HE3 1 1 2 331 1 1 3 MET HG2 H -6.482 -6.684 2.712 1.00 . A A . 3 MET HG2 1 1 2 332 1 1 3 MET HG3 H -6.645 -5.216 1.752 1.00 . A A . 3 MET HG3 1 1 2 333 1 1 3 MET N N -5.078 -3.494 1.482 1.00 . A A . 3 MET N 1 1 2 334 1 1 3 MET O O -2.285 -3.887 1.331 1.00 . A A . 3 MET O 1 1 2 335 1 1 3 MET SD S -6.376 -7.143 0.380 1.00 . A A . 3 MET SD 1 1 2 336 1 1 4 GLY C C -0.494 -2.793 4.750 1.00 . A A . 4 GLY C 1 1 2 337 1 1 4 GLY CA C -0.835 -3.792 3.664 1.00 . A A . 4 GLY CA 1 1 2 338 1 1 4 GLY H H -2.779 -4.209 4.391 1.00 . A A . 4 GLY H 1 1 2 339 1 1 4 GLY HA2 H -0.322 -4.719 3.870 1.00 . A A . 4 GLY HA2 1 1 2 340 1 1 4 GLY HA3 H -0.491 -3.405 2.716 1.00 . A A . 4 GLY HA3 1 1 2 341 1 1 4 GLY N N -2.260 -4.051 3.575 1.00 . A A . 4 GLY N 1 1 2 342 1 1 4 GLY O O -1.320 -2.499 5.613 1.00 . A A . 4 GLY O 1 1 2 343 1 1 5 GLU C C 2.363 -0.492 5.186 1.00 . A A . 5 GLU C 1 1 2 344 1 1 5 GLU CA C 1.165 -1.289 5.692 1.00 . A A . 5 GLU CA 1 1 2 345 1 1 5 GLU CB C 1.516 -1.984 7.009 1.00 . A A . 5 GLU CB 1 1 2 346 1 1 5 GLU CD C 2.271 -4.375 6.707 1.00 . A A . 5 GLU CD 1 1 2 347 1 1 5 GLU CG C 2.698 -2.933 6.900 1.00 . A A . 5 GLU CG 1 1 2 348 1 1 5 GLU H H 1.339 -2.535 3.990 1.00 . A A . 5 GLU H 1 1 2 349 1 1 5 GLU HA H 0.347 -0.609 5.863 1.00 . A A . 5 GLU HA 1 1 2 350 1 1 5 GLU HB2 H 1.753 -1.232 7.747 1.00 . A A . 5 GLU HB2 1 1 2 351 1 1 5 GLU HB3 H 0.659 -2.548 7.344 1.00 . A A . 5 GLU HB3 1 1 2 352 1 1 5 GLU HG2 H 3.304 -2.638 6.057 1.00 . A A . 5 GLU HG2 1 1 2 353 1 1 5 GLU HG3 H 3.283 -2.864 7.805 1.00 . A A . 5 GLU HG3 1 1 2 354 1 1 5 GLU N N 0.725 -2.265 4.705 1.00 . A A . 5 GLU N 1 1 2 355 1 1 5 GLU O O 3.262 -0.148 5.954 1.00 . A A . 5 GLU O 1 1 2 356 1 1 5 GLU OE1 O 1.312 -4.805 7.382 1.00 . A A . 5 GLU OE1 1 1 2 357 1 1 5 GLU OE2 O 2.895 -5.074 5.881 1.00 . A A . 5 GLU OE2 1 1 2 358 1 1 6 GLU C C 3.159 2.060 3.332 1.00 . A A . 6 GLU C 1 1 2 359 1 1 6 GLU CA C 3.454 0.564 3.284 1.00 . A A . 6 GLU CA 1 1 2 360 1 1 6 GLU CB C 3.669 0.122 1.836 1.00 . A A . 6 GLU CB 1 1 2 361 1 1 6 GLU CD C 5.898 -1.060 1.724 1.00 . A A . 6 GLU CD 1 1 2 362 1 1 6 GLU CG C 5.119 0.195 1.387 1.00 . A A . 6 GLU CG 1 1 2 363 1 1 6 GLU H H 1.622 -0.498 3.329 1.00 . A A . 6 GLU H 1 1 2 364 1 1 6 GLU HA H 4.353 0.368 3.849 1.00 . A A . 6 GLU HA 1 1 2 365 1 1 6 GLU HB2 H 3.332 -0.898 1.731 1.00 . A A . 6 GLU HB2 1 1 2 366 1 1 6 GLU HB3 H 3.081 0.754 1.188 1.00 . A A . 6 GLU HB3 1 1 2 367 1 1 6 GLU HG2 H 5.144 0.339 0.317 1.00 . A A . 6 GLU HG2 1 1 2 368 1 1 6 GLU HG3 H 5.591 1.037 1.873 1.00 . A A . 6 GLU HG3 1 1 2 369 1 1 6 GLU N N 2.368 -0.198 3.891 1.00 . A A . 6 GLU N 1 1 2 370 1 1 6 GLU O O 3.861 2.821 3.999 1.00 . A A . 6 GLU O 1 1 2 371 1 1 6 GLU OE1 O 5.589 -1.691 2.757 1.00 . A A . 6 GLU OE1 1 1 2 372 1 1 6 GLU OE2 O 6.817 -1.413 0.955 1.00 . A A . 6 GLU OE2 1 1 2 373 1 1 7 PHE C C 0.448 4.062 1.766 1.00 . A A . 7 PHE C 1 1 2 374 1 1 7 PHE CA C 1.723 3.879 2.582 1.00 . A A . 7 PHE CA 1 1 2 375 1 1 7 PHE CB C 2.849 4.733 1.993 1.00 . A A . 7 PHE CB 1 1 2 376 1 1 7 PHE CD1 C 2.775 3.889 -0.369 1.00 . A A . 7 PHE CD1 1 1 2 377 1 1 7 PHE CD2 C 4.845 3.776 0.811 1.00 . A A . 7 PHE CD2 1 1 2 378 1 1 7 PHE CE1 C 3.375 3.326 -1.480 1.00 . A A . 7 PHE CE1 1 1 2 379 1 1 7 PHE CE2 C 5.449 3.212 -0.297 1.00 . A A . 7 PHE CE2 1 1 2 380 1 1 7 PHE CG C 3.503 4.120 0.787 1.00 . A A . 7 PHE CG 1 1 2 381 1 1 7 PHE CZ C 4.713 2.987 -1.444 1.00 . A A . 7 PHE CZ 1 1 2 382 1 1 7 PHE H H 1.594 1.819 2.112 1.00 . A A . 7 PHE H 1 1 2 383 1 1 7 PHE HA H 1.535 4.198 3.596 1.00 . A A . 7 PHE HA 1 1 2 384 1 1 7 PHE HB2 H 2.448 5.692 1.701 1.00 . A A . 7 PHE HB2 1 1 2 385 1 1 7 PHE HB3 H 3.610 4.881 2.745 1.00 . A A . 7 PHE HB3 1 1 2 386 1 1 7 PHE HD1 H 1.729 4.154 -0.399 1.00 . A A . 7 PHE HD1 1 1 2 387 1 1 7 PHE HD2 H 5.421 3.952 1.707 1.00 . A A . 7 PHE HD2 1 1 2 388 1 1 7 PHE HE1 H 2.797 3.150 -2.376 1.00 . A A . 7 PHE HE1 1 1 2 389 1 1 7 PHE HE2 H 6.496 2.949 -0.265 1.00 . A A . 7 PHE HE2 1 1 2 390 1 1 7 PHE HZ H 5.184 2.547 -2.310 1.00 . A A . 7 PHE HZ 1 1 2 391 1 1 7 PHE N N 2.115 2.474 2.621 1.00 . A A . 7 PHE N 1 1 2 392 1 1 7 PHE O O -0.086 3.104 1.209 1.00 . A A . 7 PHE O 1 1 2 393 1 1 8 ILE C C -1.116 5.184 -0.511 1.00 . A A . 8 ILE C 1 1 2 394 1 1 8 ILE CA C -1.251 5.602 0.950 1.00 . A A . 8 ILE CA 1 1 2 395 1 1 8 ILE CB C -1.595 7.104 1.015 1.00 . A A . 8 ILE CB 1 1 2 396 1 1 8 ILE CD1 C -2.702 6.829 3.291 1.00 . A A . 8 ILE CD1 1 1 2 397 1 1 8 ILE CG1 C -1.672 7.573 2.469 1.00 . A A . 8 ILE CG1 1 1 2 398 1 1 8 ILE CG2 C -2.907 7.380 0.296 1.00 . A A . 8 ILE CG2 1 1 2 399 1 1 8 ILE H H 0.433 6.022 2.164 1.00 . A A . 8 ILE H 1 1 2 400 1 1 8 ILE HA H -2.064 5.049 1.398 1.00 . A A . 8 ILE HA 1 1 2 401 1 1 8 ILE HB H -0.814 7.651 0.508 1.00 . A A . 8 ILE HB 1 1 2 402 1 1 8 ILE HD11 H -3.182 6.083 2.676 1.00 . A A . 8 ILE HD11 1 1 2 403 1 1 8 ILE HD12 H -3.442 7.525 3.656 1.00 . A A . 8 ILE HD12 1 1 2 404 1 1 8 ILE HD13 H -2.216 6.348 4.127 1.00 . A A . 8 ILE HD13 1 1 2 405 1 1 8 ILE HG12 H -0.710 7.433 2.938 1.00 . A A . 8 ILE HG12 1 1 2 406 1 1 8 ILE HG13 H -1.927 8.623 2.488 1.00 . A A . 8 ILE HG13 1 1 2 407 1 1 8 ILE HG21 H -2.707 7.636 -0.734 1.00 . A A . 8 ILE HG21 1 1 2 408 1 1 8 ILE HG22 H -3.417 8.200 0.779 1.00 . A A . 8 ILE HG22 1 1 2 409 1 1 8 ILE HG23 H -3.529 6.497 0.332 1.00 . A A . 8 ILE HG23 1 1 2 410 1 1 8 ILE N N -0.036 5.298 1.699 1.00 . A A . 8 ILE N 1 1 2 411 1 1 8 ILE O O -0.273 5.705 -1.242 1.00 . A A . 8 ILE O 1 1 2 412 1 1 9 GLU C C -2.444 4.823 -3.267 1.00 . A A . 9 GLU C 1 1 2 413 1 1 9 GLU CA C -1.934 3.756 -2.305 1.00 . A A . 9 GLU CA 1 1 2 414 1 1 9 GLU CB C -2.784 2.491 -2.433 1.00 . A A . 9 GLU CB 1 1 2 415 1 1 9 GLU CD C -3.287 0.445 -3.828 1.00 . A A . 9 GLU CD 1 1 2 416 1 1 9 GLU CG C -2.272 1.517 -3.482 1.00 . A A . 9 GLU CG 1 1 2 417 1 1 9 GLU H H -2.606 3.868 -0.301 1.00 . A A . 9 GLU H 1 1 2 418 1 1 9 GLU HA H -0.912 3.519 -2.557 1.00 . A A . 9 GLU HA 1 1 2 419 1 1 9 GLU HB2 H -2.801 1.984 -1.480 1.00 . A A . 9 GLU HB2 1 1 2 420 1 1 9 GLU HB3 H -3.792 2.774 -2.698 1.00 . A A . 9 GLU HB3 1 1 2 421 1 1 9 GLU HG2 H -2.033 2.068 -4.379 1.00 . A A . 9 GLU HG2 1 1 2 422 1 1 9 GLU HG3 H -1.379 1.039 -3.105 1.00 . A A . 9 GLU HG3 1 1 2 423 1 1 9 GLU N N -1.955 4.243 -0.931 1.00 . A A . 9 GLU N 1 1 2 424 1 1 9 GLU O O -2.028 4.880 -4.424 1.00 . A A . 9 GLU O 1 1 2 425 1 1 9 GLU OE1 O -3.464 0.096 -4.995 1.00 . A A . 9 GLU OE1 1 1 2 426 1 1 10 GLY C C -5.333 7.058 -3.238 1.00 . A A . 10 GLY C 1 1 2 427 1 1 10 GLY CA C -3.903 6.719 -3.611 1.00 . A A . 10 GLY CA 1 1 2 428 1 1 10 GLY H H -3.644 5.571 -1.852 1.00 . A A . 10 GLY H 1 1 2 429 1 1 10 GLY HA2 H -3.295 7.605 -3.503 1.00 . A A . 10 GLY HA2 1 1 2 430 1 1 10 GLY HA3 H -3.877 6.401 -4.642 1.00 . A A . 10 GLY HA3 1 1 2 431 1 1 10 GLY N N -3.349 5.666 -2.781 1.00 . A A . 10 GLY N 1 1 2 432 1 1 10 GLY O O -5.790 8.179 -3.461 1.00 . A A . 10 GLY O 1 1 2 433 1 1 11 LEU C C -7.919 5.134 -1.399 1.00 . A A . 11 LEU C 1 1 2 434 1 1 11 LEU CA C -7.427 6.290 -2.264 1.00 . A A . 11 LEU CA 1 1 2 435 1 1 11 LEU CB C -8.323 6.439 -3.495 1.00 . A A . 11 LEU CB 1 1 2 436 1 1 11 LEU CD1 C -9.747 5.234 -5.170 1.00 . A A . 11 LEU CD1 1 1 2 437 1 1 11 LEU CD2 C -7.259 4.999 -5.248 1.00 . A A . 11 LEU CD2 1 1 2 438 1 1 11 LEU CG C -8.470 5.176 -4.346 1.00 . A A . 11 LEU CG 1 1 2 439 1 1 11 LEU H H -5.621 5.215 -2.516 1.00 . A A . 11 LEU H 1 1 2 440 1 1 11 LEU HA H -7.473 7.201 -1.685 1.00 . A A . 11 LEU HA 1 1 2 441 1 1 11 LEU HB2 H -9.306 6.741 -3.163 1.00 . A A . 11 LEU HB2 1 1 2 442 1 1 11 LEU HB3 H -7.916 7.220 -4.119 1.00 . A A . 11 LEU HB3 1 1 2 443 1 1 11 LEU HD11 H -9.837 4.333 -5.758 1.00 . A A . 11 LEU HD11 1 1 2 444 1 1 11 LEU HD12 H -9.713 6.091 -5.826 1.00 . A A . 11 LEU HD12 1 1 2 445 1 1 11 LEU HD13 H -10.598 5.320 -4.510 1.00 . A A . 11 LEU HD13 1 1 2 446 1 1 11 LEU HD21 H -7.024 5.939 -5.725 1.00 . A A . 11 LEU HD21 1 1 2 447 1 1 11 LEU HD22 H -7.477 4.258 -6.003 1.00 . A A . 11 LEU HD22 1 1 2 448 1 1 11 LEU HD23 H -6.415 4.674 -4.658 1.00 . A A . 11 LEU HD23 1 1 2 449 1 1 11 LEU HG H -8.533 4.317 -3.695 1.00 . A A . 11 LEU HG 1 1 2 450 1 1 11 LEU N N -6.041 6.087 -2.668 1.00 . A A . 11 LEU N 1 1 2 451 1 1 11 LEU O O -9.088 4.753 -1.463 1.00 . A A . 11 LEU O 1 1 2 452 1 1 12 VAL C C -6.672 3.599 1.643 1.00 . A A . 12 VAL C 1 1 2 453 1 1 12 VAL CA C -7.370 3.470 0.289 1.00 . A A . 12 VAL CA 1 1 2 454 1 1 12 VAL CB C -7.025 2.103 -0.344 1.00 . A A . 12 VAL CB 1 1 2 455 1 1 12 VAL CG1 C -8.242 1.515 -1.040 1.00 . A A . 12 VAL CG1 1 1 2 456 1 1 12 VAL CG2 C -5.859 2.228 -1.316 1.00 . A A . 12 VAL CG2 1 1 2 457 1 1 12 VAL H H -6.106 4.929 -0.581 1.00 . A A . 12 VAL H 1 1 2 458 1 1 12 VAL HA H -8.439 3.505 0.450 1.00 . A A . 12 VAL HA 1 1 2 459 1 1 12 VAL HB H -6.733 1.427 0.448 1.00 . A A . 12 VAL HB 1 1 2 460 1 1 12 VAL HG11 H -8.291 1.884 -2.054 1.00 . A A . 12 VAL HG11 1 1 2 461 1 1 12 VAL HG12 H -9.136 1.806 -0.508 1.00 . A A . 12 VAL HG12 1 1 2 462 1 1 12 VAL HG13 H -8.165 0.438 -1.052 1.00 . A A . 12 VAL HG13 1 1 2 463 1 1 12 VAL HG21 H -6.237 2.419 -2.310 1.00 . A A . 12 VAL HG21 1 1 2 464 1 1 12 VAL HG22 H -5.291 1.309 -1.317 1.00 . A A . 12 VAL HG22 1 1 2 465 1 1 12 VAL HG23 H -5.221 3.045 -1.011 1.00 . A A . 12 VAL HG23 1 1 2 466 1 1 12 VAL N N -7.022 4.581 -0.590 1.00 . A A . 12 VAL N 1 1 2 467 1 1 12 VAL O O -7.242 4.139 2.591 1.00 . A A . 12 VAL O 1 1 2 468 1 1 13 ARG C C -3.278 2.588 2.787 1.00 . A A . 13 ARG C 1 1 2 469 1 1 13 ARG CA C -4.674 3.175 2.971 1.00 . A A . 13 ARG CA 1 1 2 470 1 1 13 ARG CB C -5.413 2.438 4.094 1.00 . A A . 13 ARG CB 1 1 2 471 1 1 13 ARG CD C -6.386 0.263 4.904 1.00 . A A . 13 ARG CD 1 1 2 472 1 1 13 ARG CG C -5.409 0.924 3.943 1.00 . A A . 13 ARG CG 1 1 2 473 1 1 13 ARG CZ C -6.321 -1.223 6.868 1.00 . A A . 13 ARG CZ 1 1 2 474 1 1 13 ARG H H -5.030 2.689 0.943 1.00 . A A . 13 ARG H 1 1 2 475 1 1 13 ARG HA H -4.574 4.214 3.240 1.00 . A A . 13 ARG HA 1 1 2 476 1 1 13 ARG HB2 H -4.949 2.684 5.037 1.00 . A A . 13 ARG HB2 1 1 2 477 1 1 13 ARG HB3 H -6.440 2.773 4.113 1.00 . A A . 13 ARG HB3 1 1 2 478 1 1 13 ARG HD2 H -7.000 1.027 5.357 1.00 . A A . 13 ARG HD2 1 1 2 479 1 1 13 ARG HD3 H -7.012 -0.418 4.347 1.00 . A A . 13 ARG HD3 1 1 2 480 1 1 13 ARG HE H -4.720 -0.418 5.989 1.00 . A A . 13 ARG HE 1 1 2 481 1 1 13 ARG HG2 H -5.690 0.672 2.931 1.00 . A A . 13 ARG HG2 1 1 2 482 1 1 13 ARG HG3 H -4.414 0.555 4.144 1.00 . A A . 13 ARG HG3 1 1 2 483 1 1 13 ARG HH11 H -8.179 -0.847 6.163 1.00 . A A . 13 ARG HH11 1 1 2 484 1 1 13 ARG HH12 H -8.107 -1.889 7.543 1.00 . A A . 13 ARG HH12 1 1 2 485 1 1 13 ARG HH21 H -4.622 -1.790 7.805 1.00 . A A . 13 ARG HH21 1 1 2 486 1 1 13 ARG HH22 H -6.088 -2.425 8.476 1.00 . A A . 13 ARG HH22 1 1 2 487 1 1 13 ARG N N -5.437 3.106 1.730 1.00 . A A . 13 ARG N 1 1 2 488 1 1 13 ARG NE N -5.698 -0.479 5.958 1.00 . A A . 13 ARG NE 1 1 2 489 1 1 13 ARG NH1 N -7.644 -1.328 6.857 1.00 . A A . 13 ARG NH1 1 1 2 490 1 1 13 ARG NH2 N -5.620 -1.866 7.792 1.00 . A A . 13 ARG NH2 1 1 2 491 1 1 13 ARG O O -2.824 2.382 1.661 1.00 . A A . 13 ARG O 1 1 2 492 1 1 14 ASP C C -1.214 0.502 2.997 1.00 . A A . 14 ASP C 1 1 2 493 1 1 14 ASP CA C -1.256 1.759 3.864 1.00 . A A . 14 ASP CA 1 1 2 494 1 1 14 ASP CB C -0.775 1.440 5.280 1.00 . A A . 14 ASP CB 1 1 2 495 1 1 14 ASP CG C -1.055 2.565 6.258 1.00 . A A . 14 ASP CG 1 1 2 496 1 1 14 ASP H H -3.017 2.508 4.767 1.00 . A A . 14 ASP H 1 1 2 497 1 1 14 ASP HA H -0.600 2.499 3.431 1.00 . A A . 14 ASP HA 1 1 2 498 1 1 14 ASP HB2 H -1.276 0.551 5.632 1.00 . A A . 14 ASP HB2 1 1 2 499 1 1 14 ASP HB3 H 0.290 1.264 5.259 1.00 . A A . 14 ASP HB3 1 1 2 500 1 1 14 ASP N N -2.601 2.321 3.900 1.00 . A A . 14 ASP N 1 1 2 501 1 1 14 ASP O O -1.494 -0.602 3.464 1.00 . A A . 14 ASP O 1 1 2 502 1 1 14 ASP OD1 O -1.716 2.308 7.286 1.00 . A A . 14 ASP OD1 1 1 2 503 1 1 14 ASP OD2 O -0.613 3.704 5.995 1.00 . A A . 14 ASP OD2 1 1 2 504 1 1 15 SER C C 0.311 -1.397 1.139 1.00 . A A . 15 SER C 1 1 2 505 1 1 15 SER CA C -0.797 -0.410 0.770 1.00 . A A . 15 SER CA 1 1 2 506 1 1 15 SER CB C -0.563 0.139 -0.640 1.00 . A A . 15 SER CB 1 1 2 507 1 1 15 SER H H -0.671 1.599 1.428 1.00 . A A . 15 SER H 1 1 2 508 1 1 15 SER HA H -1.743 -0.930 0.789 1.00 . A A . 15 SER HA 1 1 2 509 1 1 15 SER HB2 H -1.237 0.962 -0.820 1.00 . A A . 15 SER HB2 1 1 2 510 1 1 15 SER HB3 H 0.457 0.484 -0.725 1.00 . A A . 15 SER HB3 1 1 2 511 1 1 15 SER HG H -1.603 -0.664 -2.093 1.00 . A A . 15 SER HG 1 1 2 512 1 1 15 SER N N -0.872 0.690 1.729 1.00 . A A . 15 SER N 1 1 2 513 1 1 15 SER O O 0.784 -1.415 2.273 1.00 . A A . 15 SER O 1 1 2 514 1 1 15 SER OG O -0.790 -0.859 -1.621 1.00 . A A . 15 SER OG 1 1 2 515 1 1 16 LEU C C 3.039 -2.851 -0.358 1.00 . A A . 16 LEU C 1 1 2 516 1 1 16 LEU CA C 1.763 -3.212 0.399 1.00 . A A . 16 LEU CA 1 1 2 517 1 1 16 LEU CB C 1.280 -4.600 -0.030 1.00 . A A . 16 LEU CB 1 1 2 518 1 1 16 LEU CD1 C 0.018 -6.697 0.509 1.00 . A A . 16 LEU CD1 1 1 2 519 1 1 16 LEU CD2 C 1.695 -5.798 2.132 1.00 . A A . 16 LEU CD2 1 1 2 520 1 1 16 LEU CG C 0.653 -5.440 1.082 1.00 . A A . 16 LEU CG 1 1 2 521 1 1 16 LEU H H 0.298 -2.163 -0.712 1.00 . A A . 16 LEU H 1 1 2 522 1 1 16 LEU HA H 1.980 -3.229 1.457 1.00 . A A . 16 LEU HA 1 1 2 523 1 1 16 LEU HB2 H 0.549 -4.476 -0.816 1.00 . A A . 16 LEU HB2 1 1 2 524 1 1 16 LEU HB3 H 2.123 -5.145 -0.429 1.00 . A A . 16 LEU HB3 1 1 2 525 1 1 16 LEU HD11 H -0.987 -6.475 0.182 1.00 . A A . 16 LEU HD11 1 1 2 526 1 1 16 LEU HD12 H -0.012 -7.464 1.269 1.00 . A A . 16 LEU HD12 1 1 2 527 1 1 16 LEU HD13 H 0.601 -7.044 -0.331 1.00 . A A . 16 LEU HD13 1 1 2 528 1 1 16 LEU HD21 H 2.519 -5.102 2.073 1.00 . A A . 16 LEU HD21 1 1 2 529 1 1 16 LEU HD22 H 2.056 -6.799 1.953 1.00 . A A . 16 LEU HD22 1 1 2 530 1 1 16 LEU HD23 H 1.249 -5.745 3.114 1.00 . A A . 16 LEU HD23 1 1 2 531 1 1 16 LEU HG H -0.123 -4.864 1.563 1.00 . A A . 16 LEU HG 1 1 2 532 1 1 16 LEU N N 0.716 -2.221 0.172 1.00 . A A . 16 LEU N 1 1 2 533 1 1 16 LEU O O 4.001 -2.357 0.228 1.00 . A A . 16 LEU O 1 1 2 534 1 1 17 TYR C C 3.781 -2.511 -3.932 1.00 . A A . 17 TYR C 1 1 2 535 1 1 17 TYR CA C 4.204 -2.815 -2.495 1.00 . A A . 17 TYR CA 1 1 2 536 1 1 17 TYR CB C 5.196 -3.988 -2.481 1.00 . A A . 17 TYR CB 1 1 2 537 1 1 17 TYR CD1 C 5.299 -5.332 -0.343 1.00 . A A . 17 TYR CD1 1 1 2 538 1 1 17 TYR CD2 C 3.833 -6.076 -2.070 1.00 . A A . 17 TYR CD2 1 1 2 539 1 1 17 TYR CE1 C 4.911 -6.395 0.450 1.00 . A A . 17 TYR CE1 1 1 2 540 1 1 17 TYR CE2 C 3.440 -7.142 -1.283 1.00 . A A . 17 TYR CE2 1 1 2 541 1 1 17 TYR CG C 4.767 -5.154 -1.615 1.00 . A A . 17 TYR CG 1 1 2 542 1 1 17 TYR CZ C 3.981 -7.297 -0.024 1.00 . A A . 17 TYR CZ 1 1 2 543 1 1 17 TYR H H 2.247 -3.508 -2.073 1.00 . A A . 17 TYR H 1 1 2 544 1 1 17 TYR HA H 4.691 -1.943 -2.084 1.00 . A A . 17 TYR HA 1 1 2 545 1 1 17 TYR HB2 H 5.321 -4.357 -3.488 1.00 . A A . 17 TYR HB2 1 1 2 546 1 1 17 TYR HB3 H 6.149 -3.636 -2.113 1.00 . A A . 17 TYR HB3 1 1 2 547 1 1 17 TYR HD1 H 6.026 -4.624 0.025 1.00 . A A . 17 TYR HD1 1 1 2 548 1 1 17 TYR HD2 H 3.411 -5.952 -3.057 1.00 . A A . 17 TYR HD2 1 1 2 549 1 1 17 TYR HE1 H 5.335 -6.516 1.436 1.00 . A A . 17 TYR HE1 1 1 2 550 1 1 17 TYR HE2 H 2.712 -7.847 -1.655 1.00 . A A . 17 TYR HE2 1 1 2 551 1 1 17 TYR HH H 3.558 -8.080 1.681 1.00 . A A . 17 TYR HH 1 1 2 552 1 1 17 TYR N N 3.042 -3.108 -1.662 1.00 . A A . 17 TYR N 1 1 2 553 1 1 17 TYR O O 3.466 -3.422 -4.698 1.00 . A A . 17 TYR O 1 1 2 554 1 1 17 TYR OH O 3.592 -8.357 0.762 1.00 . A A . 17 TYR OH 1 1 2 555 1 1 18 PRO C C 4.204 -1.520 -6.758 1.00 . A A . 18 PRO C 1 1 2 556 1 1 18 PRO CA C 3.386 -0.814 -5.676 1.00 . A A . 18 PRO CA 1 1 2 557 1 1 18 PRO CB C 3.659 0.693 -5.693 1.00 . A A . 18 PRO CB 1 1 2 558 1 1 18 PRO CD C 4.134 -0.070 -3.479 1.00 . A A . 18 PRO CD 1 1 2 559 1 1 18 PRO CG C 3.622 1.106 -4.263 1.00 . A A . 18 PRO CG 1 1 2 560 1 1 18 PRO HA H 2.335 -0.992 -5.854 1.00 . A A . 18 PRO HA 1 1 2 561 1 1 18 PRO HB2 H 4.626 0.881 -6.135 1.00 . A A . 18 PRO HB2 1 1 2 562 1 1 18 PRO HB3 H 2.893 1.193 -6.267 1.00 . A A . 18 PRO HB3 1 1 2 563 1 1 18 PRO HD2 H 5.205 -0.004 -3.355 1.00 . A A . 18 PRO HD2 1 1 2 564 1 1 18 PRO HD3 H 3.644 -0.125 -2.518 1.00 . A A . 18 PRO HD3 1 1 2 565 1 1 18 PRO HG2 H 4.260 1.964 -4.111 1.00 . A A . 18 PRO HG2 1 1 2 566 1 1 18 PRO HG3 H 2.608 1.336 -3.973 1.00 . A A . 18 PRO HG3 1 1 2 567 1 1 18 PRO N N 3.771 -1.224 -4.322 1.00 . A A . 18 PRO N 1 1 2 568 1 1 18 PRO O O 3.646 -2.020 -7.734 1.00 . A A . 18 PRO O 1 1 2 569 1 1 19 PRO C C 6.408 -3.744 -7.451 1.00 . A A . 19 PRO C 1 1 2 570 1 1 19 PRO CA C 6.416 -2.225 -7.584 1.00 . A A . 19 PRO CA 1 1 2 571 1 1 19 PRO CB C 7.794 -1.665 -7.242 1.00 . A A . 19 PRO CB 1 1 2 572 1 1 19 PRO CD C 6.309 -1.007 -5.475 1.00 . A A . 19 PRO CD 1 1 2 573 1 1 19 PRO CG C 7.735 -1.390 -5.779 1.00 . A A . 19 PRO CG 1 1 2 574 1 1 19 PRO HA H 6.153 -1.950 -8.594 1.00 . A A . 19 PRO HA 1 1 2 575 1 1 19 PRO HB2 H 8.552 -2.398 -7.477 1.00 . A A . 19 PRO HB2 1 1 2 576 1 1 19 PRO HB3 H 7.971 -0.762 -7.806 1.00 . A A . 19 PRO HB3 1 1 2 577 1 1 19 PRO HD2 H 5.997 -1.446 -4.539 1.00 . A A . 19 PRO HD2 1 1 2 578 1 1 19 PRO HD3 H 6.208 0.067 -5.441 1.00 . A A . 19 PRO HD3 1 1 2 579 1 1 19 PRO HG2 H 8.009 -2.277 -5.228 1.00 . A A . 19 PRO HG2 1 1 2 580 1 1 19 PRO HG3 H 8.401 -0.576 -5.533 1.00 . A A . 19 PRO HG3 1 1 2 581 1 1 19 PRO N N 5.542 -1.574 -6.605 1.00 . A A . 19 PRO N 1 1 2 582 1 1 19 PRO O O 5.617 -4.307 -6.694 1.00 . A A . 19 PRO O 1 1 2 583 1 1 20 ALA C C 8.452 -6.314 -7.169 1.00 . A A . 20 ALA C 1 1 2 584 1 1 20 ALA CA C 7.387 -5.856 -8.161 1.00 . A A . 20 ALA CA 1 1 2 585 1 1 20 ALA CB C 7.689 -6.396 -9.551 1.00 . A A . 20 ALA CB 1 1 2 586 1 1 20 ALA H H 7.895 -3.897 -8.778 1.00 . A A . 20 ALA H 1 1 2 587 1 1 20 ALA HA H 6.429 -6.245 -7.849 1.00 . A A . 20 ALA HA 1 1 2 588 1 1 20 ALA HB1 H 8.744 -6.613 -9.632 1.00 . A A . 20 ALA HB1 1 1 2 589 1 1 20 ALA HB2 H 7.415 -5.659 -10.291 1.00 . A A . 20 ALA HB2 1 1 2 590 1 1 20 ALA HB3 H 7.122 -7.300 -9.717 1.00 . A A . 20 ALA HB3 1 1 2 591 1 1 20 ALA N N 7.292 -4.402 -8.194 1.00 . A A . 20 ALA N 1 1 2 592 1 1 20 ALA O O 9.306 -7.139 -7.494 1.00 . A A . 20 ALA O 1 1 2 593 1 1 21 GLY C C 9.033 -5.528 -3.585 1.00 . A A . 21 GLY C 1 1 2 594 1 1 21 GLY CA C 9.359 -6.137 -4.935 1.00 . A A . 21 GLY CA 1 1 2 595 1 1 21 GLY H H 7.692 -5.120 -5.754 1.00 . A A . 21 GLY H 1 1 2 596 1 1 21 GLY HA2 H 9.375 -7.213 -4.838 1.00 . A A . 21 GLY HA2 1 1 2 597 1 1 21 GLY HA3 H 10.338 -5.800 -5.243 1.00 . A A . 21 GLY HA3 1 1 2 598 1 1 21 GLY N N 8.395 -5.772 -5.956 1.00 . A A . 21 GLY N 1 1 3 599 1 1 1 ASP C C -6.310 -2.827 -1.071 1.00 . A A . 1 ASP C 1 1 3 600 1 1 1 ASP CA C -5.485 -2.876 -2.353 1.00 . A A . 1 ASP CA 1 1 3 601 1 1 1 ASP CB C -4.807 -4.241 -2.485 1.00 . A A . 1 ASP CB 1 1 3 602 1 1 1 ASP CG C -4.718 -4.705 -3.925 1.00 . A A . 1 ASP CG 1 1 3 603 1 1 1 ASP H1 H -4.077 -1.537 -1.527 1.00 . A A . 1 ASP H1 1 1 3 604 1 1 1 ASP HA H -6.143 -2.729 -3.196 1.00 . A A . 1 ASP HA 1 1 3 605 1 1 1 ASP HB2 H -3.806 -4.179 -2.084 1.00 . A A . 1 ASP HB2 1 1 3 606 1 1 1 ASP HB3 H -5.370 -4.972 -1.924 1.00 . A A . 1 ASP HB3 1 1 3 607 1 1 1 ASP N N -4.489 -1.811 -2.373 1.00 . A A . 1 ASP N 1 1 3 608 1 1 1 ASP O O -7.532 -2.684 -1.113 1.00 . A A . 1 ASP O 1 1 3 609 1 1 1 ASP OD1 O -4.588 -3.843 -4.820 1.00 . A A . 1 ASP OD1 1 1 3 610 1 1 1 ASP OD2 O -4.780 -5.930 -4.159 1.00 . A A . 1 ASP OD2 1 1 3 611 1 1 2 GLY C C -5.946 -4.083 2.234 1.00 . A A . 2 GLY C 1 1 3 612 1 1 2 GLY CA C -6.320 -2.913 1.345 1.00 . A A . 2 GLY CA 1 1 3 613 1 1 2 GLY H H -4.660 -3.057 0.038 1.00 . A A . 2 GLY H 1 1 3 614 1 1 2 GLY HA2 H -6.067 -1.994 1.853 1.00 . A A . 2 GLY HA2 1 1 3 615 1 1 2 GLY HA3 H -7.385 -2.934 1.171 1.00 . A A . 2 GLY HA3 1 1 3 616 1 1 2 GLY N N -5.633 -2.945 0.067 1.00 . A A . 2 GLY N 1 1 3 617 1 1 2 GLY O O -6.817 -4.743 2.801 1.00 . A A . 2 GLY O 1 1 3 618 1 1 3 MET C C -2.690 -5.240 3.538 1.00 . A A . 3 MET C 1 1 3 619 1 1 3 MET CA C -4.160 -5.439 3.181 1.00 . A A . 3 MET CA 1 1 3 620 1 1 3 MET CB C -4.344 -6.773 2.453 1.00 . A A . 3 MET CB 1 1 3 621 1 1 3 MET CE C -5.000 -10.358 4.325 1.00 . A A . 3 MET CE 1 1 3 622 1 1 3 MET CG C -3.997 -7.984 3.303 1.00 . A A . 3 MET CG 1 1 3 623 1 1 3 MET H H -4.002 -3.779 1.877 1.00 . A A . 3 MET H 1 1 3 624 1 1 3 MET HA H -4.740 -5.453 4.091 1.00 . A A . 3 MET HA 1 1 3 625 1 1 3 MET HB2 H -5.374 -6.861 2.142 1.00 . A A . 3 MET HB2 1 1 3 626 1 1 3 MET HB3 H -3.711 -6.782 1.578 1.00 . A A . 3 MET HB3 1 1 3 627 1 1 3 MET HE1 H -5.821 -11.058 4.268 1.00 . A A . 3 MET HE1 1 1 3 628 1 1 3 MET HE2 H -5.181 -9.655 5.124 1.00 . A A . 3 MET HE2 1 1 3 629 1 1 3 MET HE3 H -4.083 -10.894 4.518 1.00 . A A . 3 MET HE3 1 1 3 630 1 1 3 MET HG2 H -2.934 -8.160 3.239 1.00 . A A . 3 MET HG2 1 1 3 631 1 1 3 MET HG3 H -4.264 -7.775 4.329 1.00 . A A . 3 MET HG3 1 1 3 632 1 1 3 MET N N -4.648 -4.341 2.355 1.00 . A A . 3 MET N 1 1 3 633 1 1 3 MET O O -1.953 -6.206 3.737 1.00 . A A . 3 MET O 1 1 3 634 1 1 3 MET SD S -4.861 -9.475 2.773 1.00 . A A . 3 MET SD 1 1 3 635 1 1 4 GLY C C -0.770 -2.585 4.989 1.00 . A A . 4 GLY C 1 1 3 636 1 1 4 GLY CA C -0.890 -3.678 3.946 1.00 . A A . 4 GLY CA 1 1 3 637 1 1 4 GLY H H -2.902 -3.252 3.446 1.00 . A A . 4 GLY H 1 1 3 638 1 1 4 GLY HA2 H -0.414 -4.571 4.319 1.00 . A A . 4 GLY HA2 1 1 3 639 1 1 4 GLY HA3 H -0.380 -3.358 3.049 1.00 . A A . 4 GLY HA3 1 1 3 640 1 1 4 GLY N N -2.270 -3.981 3.615 1.00 . A A . 4 GLY N 1 1 3 641 1 1 4 GLY O O -1.678 -2.385 5.795 1.00 . A A . 4 GLY O 1 1 3 642 1 1 5 GLU C C 1.842 -0.007 5.544 1.00 . A A . 5 GLU C 1 1 3 643 1 1 5 GLU CA C 0.584 -0.788 5.913 1.00 . A A . 5 GLU CA 1 1 3 644 1 1 5 GLU CB C 0.704 -1.336 7.336 1.00 . A A . 5 GLU CB 1 1 3 645 1 1 5 GLU CD C 2.610 -1.989 8.859 1.00 . A A . 5 GLU CD 1 1 3 646 1 1 5 GLU CG C 1.906 -2.243 7.541 1.00 . A A . 5 GLU CG 1 1 3 647 1 1 5 GLU H H 1.035 -2.077 4.296 1.00 . A A . 5 GLU H 1 1 3 648 1 1 5 GLU HA H -0.264 -0.121 5.863 1.00 . A A . 5 GLU HA 1 1 3 649 1 1 5 GLU HB2 H 0.785 -0.506 8.023 1.00 . A A . 5 GLU HB2 1 1 3 650 1 1 5 GLU HB3 H -0.188 -1.898 7.568 1.00 . A A . 5 GLU HB3 1 1 3 651 1 1 5 GLU HG2 H 1.574 -3.270 7.520 1.00 . A A . 5 GLU HG2 1 1 3 652 1 1 5 GLU HG3 H 2.608 -2.077 6.736 1.00 . A A . 5 GLU HG3 1 1 3 653 1 1 5 GLU N N 0.351 -1.872 4.967 1.00 . A A . 5 GLU N 1 1 3 654 1 1 5 GLU O O 2.613 0.397 6.415 1.00 . A A . 5 GLU O 1 1 3 655 1 1 5 GLU OE1 O 2.970 -0.823 9.125 1.00 . A A . 5 GLU OE1 1 1 3 656 1 1 5 GLU OE2 O 2.801 -2.956 9.626 1.00 . A A . 5 GLU OE2 1 1 3 657 1 1 6 GLU C C 2.806 2.337 3.292 1.00 . A A . 6 GLU C 1 1 3 658 1 1 6 GLU CA C 3.200 0.937 3.757 1.00 . A A . 6 GLU CA 1 1 3 659 1 1 6 GLU CB C 3.866 0.171 2.612 1.00 . A A . 6 GLU CB 1 1 3 660 1 1 6 GLU CD C 6.012 1.477 2.886 1.00 . A A . 6 GLU CD 1 1 3 661 1 1 6 GLU CG C 5.381 0.108 2.721 1.00 . A A . 6 GLU CG 1 1 3 662 1 1 6 GLU H H 1.388 -0.144 3.603 1.00 . A A . 6 GLU H 1 1 3 663 1 1 6 GLU HA H 3.902 1.027 4.572 1.00 . A A . 6 GLU HA 1 1 3 664 1 1 6 GLU HB2 H 3.486 -0.840 2.603 1.00 . A A . 6 GLU HB2 1 1 3 665 1 1 6 GLU HB3 H 3.613 0.649 1.677 1.00 . A A . 6 GLU HB3 1 1 3 666 1 1 6 GLU HG2 H 5.643 -0.497 3.577 1.00 . A A . 6 GLU HG2 1 1 3 667 1 1 6 GLU HG3 H 5.775 -0.348 1.825 1.00 . A A . 6 GLU HG3 1 1 3 668 1 1 6 GLU N N 2.040 0.203 4.247 1.00 . A A . 6 GLU N 1 1 3 669 1 1 6 GLU O O 3.170 3.332 3.918 1.00 . A A . 6 GLU O 1 1 3 670 1 1 6 GLU OE1 O 6.026 1.991 4.024 1.00 . A A . 6 GLU OE1 1 1 3 671 1 1 6 GLU OE2 O 6.492 2.034 1.877 1.00 . A A . 6 GLU OE2 1 1 3 672 1 1 7 PHE C C 0.311 3.553 0.887 1.00 . A A . 7 PHE C 1 1 3 673 1 1 7 PHE CA C 1.624 3.692 1.651 1.00 . A A . 7 PHE CA 1 1 3 674 1 1 7 PHE CB C 2.700 4.283 0.737 1.00 . A A . 7 PHE CB 1 1 3 675 1 1 7 PHE CD1 C 2.591 2.618 -1.139 1.00 . A A . 7 PHE CD1 1 1 3 676 1 1 7 PHE CD2 C 4.691 2.985 -0.069 1.00 . A A . 7 PHE CD2 1 1 3 677 1 1 7 PHE CE1 C 3.178 1.691 -1.980 1.00 . A A . 7 PHE CE1 1 1 3 678 1 1 7 PHE CE2 C 5.283 2.059 -0.907 1.00 . A A . 7 PHE CE2 1 1 3 679 1 1 7 PHE CG C 3.340 3.274 -0.175 1.00 . A A . 7 PHE CG 1 1 3 680 1 1 7 PHE CZ C 4.525 1.411 -1.864 1.00 . A A . 7 PHE CZ 1 1 3 681 1 1 7 PHE H H 1.802 1.582 1.733 1.00 . A A . 7 PHE H 1 1 3 682 1 1 7 PHE HA H 1.466 4.361 2.484 1.00 . A A . 7 PHE HA 1 1 3 683 1 1 7 PHE HB2 H 2.257 5.052 0.122 1.00 . A A . 7 PHE HB2 1 1 3 684 1 1 7 PHE HB3 H 3.477 4.722 1.346 1.00 . A A . 7 PHE HB3 1 1 3 685 1 1 7 PHE HD1 H 1.537 2.836 -1.231 1.00 . A A . 7 PHE HD1 1 1 3 686 1 1 7 PHE HD2 H 5.284 3.490 0.678 1.00 . A A . 7 PHE HD2 1 1 3 687 1 1 7 PHE HE1 H 2.583 1.186 -2.727 1.00 . A A . 7 PHE HE1 1 1 3 688 1 1 7 PHE HE2 H 6.337 1.842 -0.814 1.00 . A A . 7 PHE HE2 1 1 3 689 1 1 7 PHE HZ H 4.986 0.688 -2.520 1.00 . A A . 7 PHE HZ 1 1 3 690 1 1 7 PHE N N 2.062 2.408 2.191 1.00 . A A . 7 PHE N 1 1 3 691 1 1 7 PHE O O -0.006 2.487 0.360 1.00 . A A . 7 PHE O 1 1 3 692 1 1 8 ILE C C -1.686 3.963 -1.193 1.00 . A A . 8 ILE C 1 1 3 693 1 1 8 ILE CA C -1.739 4.669 0.162 1.00 . A A . 8 ILE CA 1 1 3 694 1 1 8 ILE CB C -2.224 6.119 -0.034 1.00 . A A . 8 ILE CB 1 1 3 695 1 1 8 ILE CD1 C 0.089 7.007 -0.628 1.00 . A A . 8 ILE CD1 1 1 3 696 1 1 8 ILE CG1 C -1.353 6.852 -1.059 1.00 . A A . 8 ILE CG1 1 1 3 697 1 1 8 ILE CG2 C -2.218 6.861 1.294 1.00 . A A . 8 ILE CG2 1 1 3 698 1 1 8 ILE H H -0.145 5.457 1.290 1.00 . A A . 8 ILE H 1 1 3 699 1 1 8 ILE HA H -2.455 4.160 0.790 1.00 . A A . 8 ILE HA 1 1 3 700 1 1 8 ILE HB H -3.236 6.087 -0.391 1.00 . A A . 8 ILE HB 1 1 3 701 1 1 8 ILE HD11 H 0.622 6.087 -0.816 1.00 . A A . 8 ILE HD11 1 1 3 702 1 1 8 ILE HD12 H 0.127 7.237 0.426 1.00 . A A . 8 ILE HD12 1 1 3 703 1 1 8 ILE HD13 H 0.548 7.809 -1.188 1.00 . A A . 8 ILE HD13 1 1 3 704 1 1 8 ILE HG12 H -1.363 6.304 -1.989 1.00 . A A . 8 ILE HG12 1 1 3 705 1 1 8 ILE HG13 H -1.758 7.840 -1.225 1.00 . A A . 8 ILE HG13 1 1 3 706 1 1 8 ILE HG21 H -2.848 7.736 1.221 1.00 . A A . 8 ILE HG21 1 1 3 707 1 1 8 ILE HG22 H -1.209 7.163 1.534 1.00 . A A . 8 ILE HG22 1 1 3 708 1 1 8 ILE HG23 H -2.594 6.212 2.071 1.00 . A A . 8 ILE HG23 1 1 3 709 1 1 8 ILE N N -0.453 4.643 0.844 1.00 . A A . 8 ILE N 1 1 3 710 1 1 8 ILE O O -0.761 4.170 -1.978 1.00 . A A . 8 ILE O 1 1 3 711 1 1 9 GLU C C -3.310 3.279 -3.838 1.00 . A A . 9 GLU C 1 1 3 712 1 1 9 GLU CA C -2.764 2.398 -2.715 1.00 . A A . 9 GLU CA 1 1 3 713 1 1 9 GLU CB C -3.648 1.160 -2.551 1.00 . A A . 9 GLU CB 1 1 3 714 1 1 9 GLU CD C -4.231 -1.117 -3.476 1.00 . A A . 9 GLU CD 1 1 3 715 1 1 9 GLU CG C -3.172 -0.039 -3.356 1.00 . A A . 9 GLU CG 1 1 3 716 1 1 9 GLU H H -3.397 3.010 -0.790 1.00 . A A . 9 GLU H 1 1 3 717 1 1 9 GLU HA H -1.765 2.083 -2.974 1.00 . A A . 9 GLU HA 1 1 3 718 1 1 9 GLU HB2 H -3.668 0.881 -1.508 1.00 . A A . 9 GLU HB2 1 1 3 719 1 1 9 GLU HB3 H -4.651 1.404 -2.869 1.00 . A A . 9 GLU HB3 1 1 3 720 1 1 9 GLU HG2 H -2.904 0.293 -4.348 1.00 . A A . 9 GLU HG2 1 1 3 721 1 1 9 GLU HG3 H -2.303 -0.460 -2.871 1.00 . A A . 9 GLU HG3 1 1 3 722 1 1 9 GLU N N -2.689 3.132 -1.457 1.00 . A A . 9 GLU N 1 1 3 723 1 1 9 GLU O O -3.351 2.865 -4.996 1.00 . A A . 9 GLU O 1 1 3 724 1 1 9 GLU OE1 O -4.805 -1.321 -4.546 1.00 . A A . 9 GLU OE1 1 1 3 725 1 1 10 GLY C C -5.202 6.434 -3.888 1.00 . A A . 10 GLY C 1 1 3 726 1 1 10 GLY CA C -4.266 5.403 -4.488 1.00 . A A . 10 GLY CA 1 1 3 727 1 1 10 GLY H H -3.678 4.776 -2.556 1.00 . A A . 10 GLY H 1 1 3 728 1 1 10 GLY HA2 H -3.447 5.915 -4.971 1.00 . A A . 10 GLY HA2 1 1 3 729 1 1 10 GLY HA3 H -4.806 4.831 -5.229 1.00 . A A . 10 GLY HA3 1 1 3 730 1 1 10 GLY N N -3.731 4.494 -3.493 1.00 . A A . 10 GLY N 1 1 3 731 1 1 10 GLY O O -5.386 7.516 -4.447 1.00 . A A . 10 GLY O 1 1 3 732 1 1 11 LEU C C -6.256 7.288 -0.642 1.00 . A A . 11 LEU C 1 1 3 733 1 1 11 LEU CA C -6.718 7.006 -2.071 1.00 . A A . 11 LEU CA 1 1 3 734 1 1 11 LEU CB C -8.131 6.417 -2.064 1.00 . A A . 11 LEU CB 1 1 3 735 1 1 11 LEU CD1 C -9.845 5.267 -3.486 1.00 . A A . 11 LEU CD1 1 1 3 736 1 1 11 LEU CD2 C -9.513 7.738 -3.685 1.00 . A A . 11 LEU CD2 1 1 3 737 1 1 11 LEU CG C -8.834 6.402 -3.422 1.00 . A A . 11 LEU CG 1 1 3 738 1 1 11 LEU H H -5.610 5.224 -2.349 1.00 . A A . 11 LEU H 1 1 3 739 1 1 11 LEU HA H -6.729 7.935 -2.621 1.00 . A A . 11 LEU HA 1 1 3 740 1 1 11 LEU HB2 H -8.073 5.401 -1.701 1.00 . A A . 11 LEU HB2 1 1 3 741 1 1 11 LEU HB3 H -8.734 6.992 -1.378 1.00 . A A . 11 LEU HB3 1 1 3 742 1 1 11 LEU HD11 H -10.784 5.597 -3.066 1.00 . A A . 11 LEU HD11 1 1 3 743 1 1 11 LEU HD12 H -9.475 4.424 -2.922 1.00 . A A . 11 LEU HD12 1 1 3 744 1 1 11 LEU HD13 H -9.993 4.975 -4.515 1.00 . A A . 11 LEU HD13 1 1 3 745 1 1 11 LEU HD21 H -10.480 7.752 -3.204 1.00 . A A . 11 LEU HD21 1 1 3 746 1 1 11 LEU HD22 H -9.638 7.875 -4.749 1.00 . A A . 11 LEU HD22 1 1 3 747 1 1 11 LEU HD23 H -8.902 8.536 -3.289 1.00 . A A . 11 LEU HD23 1 1 3 748 1 1 11 LEU HG H -8.101 6.240 -4.198 1.00 . A A . 11 LEU HG 1 1 3 749 1 1 11 LEU N N -5.796 6.100 -2.747 1.00 . A A . 11 LEU N 1 1 3 750 1 1 11 LEU O O -5.614 8.304 -0.379 1.00 . A A . 11 LEU O 1 1 3 751 1 1 12 VAL C C -6.146 5.188 2.383 1.00 . A A . 12 VAL C 1 1 3 752 1 1 12 VAL CA C -6.203 6.539 1.677 1.00 . A A . 12 VAL CA 1 1 3 753 1 1 12 VAL CB C -7.187 7.456 2.432 1.00 . A A . 12 VAL CB 1 1 3 754 1 1 12 VAL CG1 C -6.698 7.718 3.849 1.00 . A A . 12 VAL CG1 1 1 3 755 1 1 12 VAL CG2 C -7.387 8.764 1.681 1.00 . A A . 12 VAL CG2 1 1 3 756 1 1 12 VAL H H -7.098 5.592 0.009 1.00 . A A . 12 VAL H 1 1 3 757 1 1 12 VAL HA H -5.223 6.993 1.708 1.00 . A A . 12 VAL HA 1 1 3 758 1 1 12 VAL HB H -8.141 6.952 2.493 1.00 . A A . 12 VAL HB 1 1 3 759 1 1 12 VAL HG11 H -7.535 7.686 4.530 1.00 . A A . 12 VAL HG11 1 1 3 760 1 1 12 VAL HG12 H -6.233 8.691 3.895 1.00 . A A . 12 VAL HG12 1 1 3 761 1 1 12 VAL HG13 H -5.978 6.962 4.127 1.00 . A A . 12 VAL HG13 1 1 3 762 1 1 12 VAL HG21 H -6.427 9.216 1.484 1.00 . A A . 12 VAL HG21 1 1 3 763 1 1 12 VAL HG22 H -7.985 9.435 2.281 1.00 . A A . 12 VAL HG22 1 1 3 764 1 1 12 VAL HG23 H -7.893 8.569 0.747 1.00 . A A . 12 VAL HG23 1 1 3 765 1 1 12 VAL N N -6.586 6.383 0.278 1.00 . A A . 12 VAL N 1 1 3 766 1 1 12 VAL O O -7.103 4.782 3.042 1.00 . A A . 12 VAL O 1 1 3 767 1 1 13 ARG C C -3.441 2.648 2.637 1.00 . A A . 13 ARG C 1 1 3 768 1 1 13 ARG CA C -4.844 3.190 2.872 1.00 . A A . 13 ARG CA 1 1 3 769 1 1 13 ARG CB C -5.879 2.197 2.341 1.00 . A A . 13 ARG CB 1 1 3 770 1 1 13 ARG CD C -7.095 0.930 4.140 1.00 . A A . 13 ARG CD 1 1 3 771 1 1 13 ARG CG C -5.947 0.907 3.143 1.00 . A A . 13 ARG CG 1 1 3 772 1 1 13 ARG CZ C -7.382 0.528 6.555 1.00 . A A . 13 ARG CZ 1 1 3 773 1 1 13 ARG H H -4.290 4.870 1.707 1.00 . A A . 13 ARG H 1 1 3 774 1 1 13 ARG HA H -4.991 3.313 3.933 1.00 . A A . 13 ARG HA 1 1 3 775 1 1 13 ARG HB2 H -6.853 2.662 2.362 1.00 . A A . 13 ARG HB2 1 1 3 776 1 1 13 ARG HB3 H -5.630 1.948 1.320 1.00 . A A . 13 ARG HB3 1 1 3 777 1 1 13 ARG HD2 H -7.386 1.955 4.311 1.00 . A A . 13 ARG HD2 1 1 3 778 1 1 13 ARG HD3 H -7.928 0.384 3.722 1.00 . A A . 13 ARG HD3 1 1 3 779 1 1 13 ARG HE H -5.939 -0.265 5.426 1.00 . A A . 13 ARG HE 1 1 3 780 1 1 13 ARG HG2 H -6.089 0.080 2.465 1.00 . A A . 13 ARG HG2 1 1 3 781 1 1 13 ARG HG3 H -5.018 0.779 3.680 1.00 . A A . 13 ARG HG3 1 1 3 782 1 1 13 ARG HH11 H -8.761 1.765 5.743 1.00 . A A . 13 ARG HH11 1 1 3 783 1 1 13 ARG HH12 H -8.939 1.467 7.439 1.00 . A A . 13 ARG HH12 1 1 3 784 1 1 13 ARG HH21 H -6.172 -0.658 7.657 1.00 . A A . 13 ARG HH21 1 1 3 785 1 1 13 ARG HH22 H -7.469 0.092 8.526 1.00 . A A . 13 ARG HH22 1 1 3 786 1 1 13 ARG N N -5.019 4.495 2.243 1.00 . A A . 13 ARG N 1 1 3 787 1 1 13 ARG NE N -6.722 0.324 5.416 1.00 . A A . 13 ARG NE 1 1 3 788 1 1 13 ARG NH1 N -8.448 1.318 6.581 1.00 . A A . 13 ARG NH1 1 1 3 789 1 1 13 ARG NH2 N -6.974 -0.061 7.671 1.00 . A A . 13 ARG NH2 1 1 3 790 1 1 13 ARG O O -3.116 2.202 1.539 1.00 . A A . 13 ARG O 1 1 3 791 1 1 14 ASP C C -1.202 0.770 3.064 1.00 . A A . 14 ASP C 1 1 3 792 1 1 14 ASP CA C -1.247 2.199 3.602 1.00 . A A . 14 ASP CA 1 1 3 793 1 1 14 ASP CB C -0.585 2.265 4.979 1.00 . A A . 14 ASP CB 1 1 3 794 1 1 14 ASP CG C -0.566 3.672 5.541 1.00 . A A . 14 ASP CG 1 1 3 795 1 1 14 ASP H H -2.941 3.057 4.529 1.00 . A A . 14 ASP H 1 1 3 796 1 1 14 ASP HA H -0.707 2.841 2.926 1.00 . A A . 14 ASP HA 1 1 3 797 1 1 14 ASP HB2 H -1.129 1.631 5.663 1.00 . A A . 14 ASP HB2 1 1 3 798 1 1 14 ASP HB3 H 0.433 1.913 4.900 1.00 . A A . 14 ASP HB3 1 1 3 799 1 1 14 ASP N N -2.617 2.689 3.681 1.00 . A A . 14 ASP N 1 1 3 800 1 1 14 ASP O O -1.193 -0.192 3.828 1.00 . A A . 14 ASP O 1 1 3 801 1 1 14 ASP OD1 O -1.619 4.344 5.497 1.00 . A A . 14 ASP OD1 1 1 3 802 1 1 14 ASP OD2 O 0.501 4.104 6.025 1.00 . A A . 14 ASP OD2 1 1 3 803 1 1 15 SER C C 0.158 -1.394 1.411 1.00 . A A . 15 SER C 1 1 3 804 1 1 15 SER CA C -1.140 -0.656 1.085 1.00 . A A . 15 SER CA 1 1 3 805 1 1 15 SER CB C -1.282 -0.485 -0.429 1.00 . A A . 15 SER CB 1 1 3 806 1 1 15 SER H H -1.194 1.456 1.193 1.00 . A A . 15 SER H 1 1 3 807 1 1 15 SER HA H -1.973 -1.236 1.452 1.00 . A A . 15 SER HA 1 1 3 808 1 1 15 SER HB2 H -1.982 0.310 -0.635 1.00 . A A . 15 SER HB2 1 1 3 809 1 1 15 SER HB3 H -0.320 -0.237 -0.853 1.00 . A A . 15 SER HB3 1 1 3 810 1 1 15 SER HG H -1.268 -1.836 -1.848 1.00 . A A . 15 SER HG 1 1 3 811 1 1 15 SER N N -1.179 0.647 1.742 1.00 . A A . 15 SER N 1 1 3 812 1 1 15 SER O O 0.845 -1.058 2.373 1.00 . A A . 15 SER O 1 1 3 813 1 1 15 SER OG O -1.754 -1.676 -1.036 1.00 . A A . 15 SER OG 1 1 3 814 1 1 16 LEU C C 2.883 -2.570 0.051 1.00 . A A . 16 LEU C 1 1 3 815 1 1 16 LEU CA C 1.706 -3.177 0.819 1.00 . A A . 16 LEU CA 1 1 3 816 1 1 16 LEU CB C 1.491 -4.636 0.403 1.00 . A A . 16 LEU CB 1 1 3 817 1 1 16 LEU CD1 C -0.530 -6.055 0.862 1.00 . A A . 16 LEU CD1 1 1 3 818 1 1 16 LEU CD2 C 1.668 -6.644 1.900 1.00 . A A . 16 LEU CD2 1 1 3 819 1 1 16 LEU CG C 0.768 -5.507 1.435 1.00 . A A . 16 LEU CG 1 1 3 820 1 1 16 LEU H H -0.096 -2.627 -0.147 1.00 . A A . 16 LEU H 1 1 3 821 1 1 16 LEU HA H 1.932 -3.146 1.875 1.00 . A A . 16 LEU HA 1 1 3 822 1 1 16 LEU HB2 H 0.917 -4.645 -0.513 1.00 . A A . 16 LEU HB2 1 1 3 823 1 1 16 LEU HB3 H 2.457 -5.077 0.204 1.00 . A A . 16 LEU HB3 1 1 3 824 1 1 16 LEU HD11 H -1.304 -6.007 1.613 1.00 . A A . 16 LEU HD11 1 1 3 825 1 1 16 LEU HD12 H -0.386 -7.082 0.559 1.00 . A A . 16 LEU HD12 1 1 3 826 1 1 16 LEU HD13 H -0.824 -5.466 0.006 1.00 . A A . 16 LEU HD13 1 1 3 827 1 1 16 LEU HD21 H 2.358 -6.276 2.645 1.00 . A A . 16 LEU HD21 1 1 3 828 1 1 16 LEU HD22 H 2.221 -7.033 1.057 1.00 . A A . 16 LEU HD22 1 1 3 829 1 1 16 LEU HD23 H 1.063 -7.430 2.327 1.00 . A A . 16 LEU HD23 1 1 3 830 1 1 16 LEU HG H 0.523 -4.902 2.296 1.00 . A A . 16 LEU HG 1 1 3 831 1 1 16 LEU N N 0.489 -2.401 0.606 1.00 . A A . 16 LEU N 1 1 3 832 1 1 16 LEU O O 3.580 -1.696 0.565 1.00 . A A . 16 LEU O 1 1 3 833 1 1 17 TYR C C 4.288 -3.306 -3.320 1.00 . A A . 17 TYR C 1 1 3 834 1 1 17 TYR CA C 4.192 -2.526 -2.007 1.00 . A A . 17 TYR CA 1 1 3 835 1 1 17 TYR CB C 5.528 -2.612 -1.256 1.00 . A A . 17 TYR CB 1 1 3 836 1 1 17 TYR CD1 C 5.536 -3.567 1.083 1.00 . A A . 17 TYR CD1 1 1 3 837 1 1 17 TYR CD2 C 5.790 -5.074 -0.747 1.00 . A A . 17 TYR CD2 1 1 3 838 1 1 17 TYR CE1 C 5.618 -4.624 1.969 1.00 . A A . 17 TYR CE1 1 1 3 839 1 1 17 TYR CE2 C 5.873 -6.136 0.134 1.00 . A A . 17 TYR CE2 1 1 3 840 1 1 17 TYR CG C 5.620 -3.773 -0.289 1.00 . A A . 17 TYR CG 1 1 3 841 1 1 17 TYR CZ C 5.787 -5.906 1.490 1.00 . A A . 17 TYR CZ 1 1 3 842 1 1 17 TYR H H 2.512 -3.727 -1.542 1.00 . A A . 17 TYR H 1 1 3 843 1 1 17 TYR HA H 3.983 -1.491 -2.229 1.00 . A A . 17 TYR HA 1 1 3 844 1 1 17 TYR HB2 H 6.328 -2.717 -1.974 1.00 . A A . 17 TYR HB2 1 1 3 845 1 1 17 TYR HB3 H 5.675 -1.700 -0.695 1.00 . A A . 17 TYR HB3 1 1 3 846 1 1 17 TYR HD1 H 5.405 -2.563 1.456 1.00 . A A . 17 TYR HD1 1 1 3 847 1 1 17 TYR HD2 H 5.859 -5.252 -1.810 1.00 . A A . 17 TYR HD2 1 1 3 848 1 1 17 TYR HE1 H 5.550 -4.443 3.032 1.00 . A A . 17 TYR HE1 1 1 3 849 1 1 17 TYR HE2 H 6.005 -7.140 -0.242 1.00 . A A . 17 TYR HE2 1 1 3 850 1 1 17 TYR HH H 6.630 -7.503 2.149 1.00 . A A . 17 TYR HH 1 1 3 851 1 1 17 TYR N N 3.100 -3.032 -1.180 1.00 . A A . 17 TYR N 1 1 3 852 1 1 17 TYR O O 4.406 -4.531 -3.311 1.00 . A A . 17 TYR O 1 1 3 853 1 1 17 TYR OH O 5.869 -6.960 2.370 1.00 . A A . 17 TYR OH 1 1 3 854 1 1 18 PRO C C 5.598 -4.088 -5.934 1.00 . A A . 18 PRO C 1 1 3 855 1 1 18 PRO CA C 4.326 -3.256 -5.785 1.00 . A A . 18 PRO CA 1 1 3 856 1 1 18 PRO CB C 4.339 -2.081 -6.769 1.00 . A A . 18 PRO CB 1 1 3 857 1 1 18 PRO CD C 4.101 -1.145 -4.586 1.00 . A A . 18 PRO CD 1 1 3 858 1 1 18 PRO CG C 3.719 -0.950 -6.025 1.00 . A A . 18 PRO CG 1 1 3 859 1 1 18 PRO HA H 3.465 -3.880 -5.975 1.00 . A A . 18 PRO HA 1 1 3 860 1 1 18 PRO HB2 H 5.357 -1.857 -7.052 1.00 . A A . 18 PRO HB2 1 1 3 861 1 1 18 PRO HB3 H 3.764 -2.337 -7.646 1.00 . A A . 18 PRO HB3 1 1 3 862 1 1 18 PRO HD2 H 5.037 -0.650 -4.373 1.00 . A A . 18 PRO HD2 1 1 3 863 1 1 18 PRO HD3 H 3.321 -0.780 -3.935 1.00 . A A . 18 PRO HD3 1 1 3 864 1 1 18 PRO HG2 H 4.107 -0.012 -6.393 1.00 . A A . 18 PRO HG2 1 1 3 865 1 1 18 PRO HG3 H 2.645 -0.982 -6.135 1.00 . A A . 18 PRO HG3 1 1 3 866 1 1 18 PRO N N 4.240 -2.609 -4.471 1.00 . A A . 18 PRO N 1 1 3 867 1 1 18 PRO O O 6.498 -4.014 -5.098 1.00 . A A . 18 PRO O 1 1 3 868 1 1 19 PRO C C 8.109 -4.916 -7.568 1.00 . A A . 19 PRO C 1 1 3 869 1 1 19 PRO CA C 6.863 -5.738 -7.259 1.00 . A A . 19 PRO CA 1 1 3 870 1 1 19 PRO CB C 6.453 -6.569 -8.479 1.00 . A A . 19 PRO CB 1 1 3 871 1 1 19 PRO CD C 4.665 -5.043 -8.055 1.00 . A A . 19 PRO CD 1 1 3 872 1 1 19 PRO CG C 5.398 -5.761 -9.153 1.00 . A A . 19 PRO CG 1 1 3 873 1 1 19 PRO HA H 7.064 -6.393 -6.424 1.00 . A A . 19 PRO HA 1 1 3 874 1 1 19 PRO HB2 H 7.309 -6.717 -9.121 1.00 . A A . 19 PRO HB2 1 1 3 875 1 1 19 PRO HB3 H 6.070 -7.525 -8.154 1.00 . A A . 19 PRO HB3 1 1 3 876 1 1 19 PRO HD2 H 4.322 -4.078 -8.400 1.00 . A A . 19 PRO HD2 1 1 3 877 1 1 19 PRO HD3 H 3.836 -5.637 -7.701 1.00 . A A . 19 PRO HD3 1 1 3 878 1 1 19 PRO HG2 H 5.854 -5.052 -9.827 1.00 . A A . 19 PRO HG2 1 1 3 879 1 1 19 PRO HG3 H 4.724 -6.412 -9.689 1.00 . A A . 19 PRO HG3 1 1 3 880 1 1 19 PRO N N 5.691 -4.893 -7.007 1.00 . A A . 19 PRO N 1 1 3 881 1 1 19 PRO O O 9.183 -5.168 -7.021 1.00 . A A . 19 PRO O 1 1 3 882 1 1 20 ALA C C 8.831 -1.632 -8.386 1.00 . A A . 20 ALA C 1 1 3 883 1 1 20 ALA CA C 9.073 -3.071 -8.830 1.00 . A A . 20 ALA CA 1 1 3 884 1 1 20 ALA CB C 9.297 -3.134 -10.334 1.00 . A A . 20 ALA CB 1 1 3 885 1 1 20 ALA H H 7.079 -3.779 -8.850 1.00 . A A . 20 ALA H 1 1 3 886 1 1 20 ALA HA H 9.963 -3.442 -8.342 1.00 . A A . 20 ALA HA 1 1 3 887 1 1 20 ALA HB1 H 9.118 -4.140 -10.683 1.00 . A A . 20 ALA HB1 1 1 3 888 1 1 20 ALA HB2 H 10.314 -2.850 -10.558 1.00 . A A . 20 ALA HB2 1 1 3 889 1 1 20 ALA HB3 H 8.617 -2.455 -10.827 1.00 . A A . 20 ALA HB3 1 1 3 890 1 1 20 ALA N N 7.960 -3.932 -8.449 1.00 . A A . 20 ALA N 1 1 3 891 1 1 20 ALA O O 8.651 -0.737 -9.212 1.00 . A A . 20 ALA O 1 1 3 892 1 1 21 GLY C C 7.146 0.322 -6.586 1.00 . A A . 21 GLY C 1 1 3 893 1 1 21 GLY CA C 8.605 -0.084 -6.542 1.00 . A A . 21 GLY CA 1 1 3 894 1 1 21 GLY H H 8.975 -2.167 -6.463 1.00 . A A . 21 GLY H 1 1 3 895 1 1 21 GLY HA2 H 8.945 -0.056 -5.517 1.00 . A A . 21 GLY HA2 1 1 3 896 1 1 21 GLY HA3 H 9.182 0.623 -7.120 1.00 . A A . 21 GLY HA3 1 1 3 897 1 1 21 GLY N N 8.827 -1.416 -7.074 1.00 . A A . 21 GLY N 1 1 4 898 1 1 1 ASP C C -3.838 -2.690 -3.042 1.00 . A A . 1 ASP C 1 1 4 899 1 1 1 ASP CA C -2.575 -2.471 -3.870 1.00 . A A . 1 ASP CA 1 1 4 900 1 1 1 ASP CB C -1.509 -3.495 -3.472 1.00 . A A . 1 ASP CB 1 1 4 901 1 1 1 ASP CG C -1.487 -4.696 -4.396 1.00 . A A . 1 ASP CG 1 1 4 902 1 1 1 ASP H1 H -2.859 -0.538 -3.686 1.00 . A A . 1 ASP H1 1 1 4 903 1 1 1 ASP HA H -2.816 -2.603 -4.914 1.00 . A A . 1 ASP HA 1 1 4 904 1 1 1 ASP HB2 H -0.538 -3.024 -3.501 1.00 . A A . 1 ASP HB2 1 1 4 905 1 1 1 ASP HB3 H -1.708 -3.840 -2.467 1.00 . A A . 1 ASP HB3 1 1 4 906 1 1 1 ASP N N -2.065 -1.113 -3.696 1.00 . A A . 1 ASP N 1 1 4 907 1 1 1 ASP O O -4.745 -3.413 -3.454 1.00 . A A . 1 ASP O 1 1 4 908 1 1 1 ASP OD1 O -0.412 -4.991 -4.960 1.00 . A A . 1 ASP OD1 1 1 4 909 1 1 1 ASP OD2 O -2.544 -5.341 -4.557 1.00 . A A . 1 ASP OD2 1 1 4 910 1 1 2 GLY C C -4.849 -3.271 0.051 1.00 . A A . 2 GLY C 1 1 4 911 1 1 2 GLY CA C -5.043 -2.200 -1.003 1.00 . A A . 2 GLY CA 1 1 4 912 1 1 2 GLY H H -3.135 -1.499 -1.596 1.00 . A A . 2 GLY H 1 1 4 913 1 1 2 GLY HA2 H -5.225 -1.255 -0.512 1.00 . A A . 2 GLY HA2 1 1 4 914 1 1 2 GLY HA3 H -5.903 -2.453 -1.604 1.00 . A A . 2 GLY HA3 1 1 4 915 1 1 2 GLY N N -3.888 -2.061 -1.872 1.00 . A A . 2 GLY N 1 1 4 916 1 1 2 GLY O O -5.802 -3.943 0.446 1.00 . A A . 2 GLY O 1 1 4 917 1 1 3 MET C C -1.924 -4.166 2.137 1.00 . A A . 3 MET C 1 1 4 918 1 1 3 MET CA C -3.296 -4.429 1.524 1.00 . A A . 3 MET CA 1 1 4 919 1 1 3 MET CB C -3.337 -5.834 0.919 1.00 . A A . 3 MET CB 1 1 4 920 1 1 3 MET CE C -5.504 -8.678 2.953 1.00 . A A . 3 MET CE 1 1 4 921 1 1 3 MET CG C -3.607 -6.928 1.941 1.00 . A A . 3 MET CG 1 1 4 922 1 1 3 MET H H -2.894 -2.866 0.155 1.00 . A A . 3 MET H 1 1 4 923 1 1 3 MET HA H -4.043 -4.360 2.300 1.00 . A A . 3 MET HA 1 1 4 924 1 1 3 MET HB2 H -4.115 -5.868 0.171 1.00 . A A . 3 MET HB2 1 1 4 925 1 1 3 MET HB3 H -2.387 -6.038 0.448 1.00 . A A . 3 MET HB3 1 1 4 926 1 1 3 MET HE1 H -5.979 -9.639 2.818 1.00 . A A . 3 MET HE1 1 1 4 927 1 1 3 MET HE2 H -6.228 -7.967 3.320 1.00 . A A . 3 MET HE2 1 1 4 928 1 1 3 MET HE3 H -4.698 -8.772 3.666 1.00 . A A . 3 MET HE3 1 1 4 929 1 1 3 MET HG2 H -2.687 -7.460 2.131 1.00 . A A . 3 MET HG2 1 1 4 930 1 1 3 MET HG3 H -3.951 -6.469 2.856 1.00 . A A . 3 MET HG3 1 1 4 931 1 1 3 MET N N -3.612 -3.432 0.508 1.00 . A A . 3 MET N 1 1 4 932 1 1 3 MET O O -0.894 -4.408 1.508 1.00 . A A . 3 MET O 1 1 4 933 1 1 3 MET SD S -4.851 -8.110 1.385 1.00 . A A . 3 MET SD 1 1 4 934 1 1 4 GLY C C -0.802 -2.225 5.027 1.00 . A A . 4 GLY C 1 1 4 935 1 1 4 GLY CA C -0.671 -3.374 4.048 1.00 . A A . 4 GLY CA 1 1 4 936 1 1 4 GLY H H -2.772 -3.492 3.820 1.00 . A A . 4 GLY H 1 1 4 937 1 1 4 GLY HA2 H -0.351 -4.255 4.584 1.00 . A A . 4 GLY HA2 1 1 4 938 1 1 4 GLY HA3 H 0.077 -3.122 3.311 1.00 . A A . 4 GLY HA3 1 1 4 939 1 1 4 GLY N N -1.920 -3.666 3.369 1.00 . A A . 4 GLY N 1 1 4 940 1 1 4 GLY O O -1.907 -1.753 5.294 1.00 . A A . 4 GLY O 1 1 4 941 1 1 5 GLU C C 1.634 0.117 6.455 1.00 . A A . 5 GLU C 1 1 4 942 1 1 5 GLU CA C 0.323 -0.665 6.515 1.00 . A A . 5 GLU CA 1 1 4 943 1 1 5 GLU CB C 0.084 -1.186 7.934 1.00 . A A . 5 GLU CB 1 1 4 944 1 1 5 GLU CD C -0.367 0.153 10.030 1.00 . A A . 5 GLU CD 1 1 4 945 1 1 5 GLU CG C -0.927 -0.367 8.720 1.00 . A A . 5 GLU CG 1 1 4 946 1 1 5 GLU H H 1.179 -2.184 5.311 1.00 . A A . 5 GLU H 1 1 4 947 1 1 5 GLU HA H -0.486 -0.002 6.242 1.00 . A A . 5 GLU HA 1 1 4 948 1 1 5 GLU HB2 H -0.277 -2.202 7.874 1.00 . A A . 5 GLU HB2 1 1 4 949 1 1 5 GLU HB3 H 1.020 -1.177 8.472 1.00 . A A . 5 GLU HB3 1 1 4 950 1 1 5 GLU HG2 H -1.235 0.475 8.119 1.00 . A A . 5 GLU HG2 1 1 4 951 1 1 5 GLU HG3 H -1.785 -0.988 8.934 1.00 . A A . 5 GLU HG3 1 1 4 952 1 1 5 GLU N N 0.327 -1.770 5.563 1.00 . A A . 5 GLU N 1 1 4 953 1 1 5 GLU O O 2.235 0.423 7.485 1.00 . A A . 5 GLU O 1 1 4 954 1 1 5 GLU OE1 O 0.580 -0.467 10.558 1.00 . A A . 5 GLU OE1 1 1 4 955 1 1 5 GLU OE2 O -0.874 1.181 10.526 1.00 . A A . 5 GLU OE2 1 1 4 956 1 1 6 GLU C C 3.003 2.568 4.443 1.00 . A A . 6 GLU C 1 1 4 957 1 1 6 GLU CA C 3.299 1.198 5.045 1.00 . A A . 6 GLU CA 1 1 4 958 1 1 6 GLU CB C 4.257 0.424 4.138 1.00 . A A . 6 GLU CB 1 1 4 959 1 1 6 GLU CD C 5.605 -0.972 5.755 1.00 . A A . 6 GLU CD 1 1 4 960 1 1 6 GLU CG C 4.576 -0.974 4.642 1.00 . A A . 6 GLU CG 1 1 4 961 1 1 6 GLU H H 1.540 0.177 4.459 1.00 . A A . 6 GLU H 1 1 4 962 1 1 6 GLU HA H 3.762 1.335 6.011 1.00 . A A . 6 GLU HA 1 1 4 963 1 1 6 GLU HB2 H 3.816 0.339 3.157 1.00 . A A . 6 GLU HB2 1 1 4 964 1 1 6 GLU HB3 H 5.183 0.974 4.059 1.00 . A A . 6 GLU HB3 1 1 4 965 1 1 6 GLU HG2 H 3.667 -1.424 5.014 1.00 . A A . 6 GLU HG2 1 1 4 966 1 1 6 GLU HG3 H 4.957 -1.562 3.820 1.00 . A A . 6 GLU HG3 1 1 4 967 1 1 6 GLU N N 2.066 0.445 5.242 1.00 . A A . 6 GLU N 1 1 4 968 1 1 6 GLU O O 3.518 3.585 4.908 1.00 . A A . 6 GLU O 1 1 4 969 1 1 6 GLU OE1 O 6.606 -0.235 5.636 1.00 . A A . 6 GLU OE1 1 1 4 970 1 1 6 GLU OE2 O 5.409 -1.707 6.746 1.00 . A A . 6 GLU OE2 1 1 4 971 1 1 7 PHE C C 0.749 3.596 1.668 1.00 . A A . 7 PHE C 1 1 4 972 1 1 7 PHE CA C 1.799 3.836 2.748 1.00 . A A . 7 PHE CA 1 1 4 973 1 1 7 PHE CB C 3.035 4.502 2.139 1.00 . A A . 7 PHE CB 1 1 4 974 1 1 7 PHE CD1 C 4.981 2.982 1.692 1.00 . A A . 7 PHE CD1 1 1 4 975 1 1 7 PHE CD2 C 3.405 3.351 -0.059 1.00 . A A . 7 PHE CD2 1 1 4 976 1 1 7 PHE CE1 C 5.707 2.145 0.867 1.00 . A A . 7 PHE CE1 1 1 4 977 1 1 7 PHE CE2 C 4.127 2.515 -0.890 1.00 . A A . 7 PHE CE2 1 1 4 978 1 1 7 PHE CG C 3.823 3.594 1.239 1.00 . A A . 7 PHE CG 1 1 4 979 1 1 7 PHE CZ C 5.280 1.911 -0.426 1.00 . A A . 7 PHE CZ 1 1 4 980 1 1 7 PHE H H 1.786 1.745 3.085 1.00 . A A . 7 PHE H 1 1 4 981 1 1 7 PHE HA H 1.378 4.491 3.496 1.00 . A A . 7 PHE HA 1 1 4 982 1 1 7 PHE HB2 H 2.725 5.358 1.558 1.00 . A A . 7 PHE HB2 1 1 4 983 1 1 7 PHE HB3 H 3.687 4.830 2.936 1.00 . A A . 7 PHE HB3 1 1 4 984 1 1 7 PHE HD1 H 5.316 3.164 2.703 1.00 . A A . 7 PHE HD1 1 1 4 985 1 1 7 PHE HD2 H 2.504 3.822 -0.423 1.00 . A A . 7 PHE HD2 1 1 4 986 1 1 7 PHE HE1 H 6.608 1.675 1.232 1.00 . A A . 7 PHE HE1 1 1 4 987 1 1 7 PHE HE2 H 3.791 2.334 -1.900 1.00 . A A . 7 PHE HE2 1 1 4 988 1 1 7 PHE HZ H 5.846 1.257 -1.073 1.00 . A A . 7 PHE HZ 1 1 4 989 1 1 7 PHE N N 2.167 2.588 3.408 1.00 . A A . 7 PHE N 1 1 4 990 1 1 7 PHE O O 0.810 2.611 0.932 1.00 . A A . 7 PHE O 1 1 4 991 1 1 8 ILE C C -0.780 4.145 -0.790 1.00 . A A . 8 ILE C 1 1 4 992 1 1 8 ILE CA C -1.299 4.406 0.620 1.00 . A A . 8 ILE CA 1 1 4 993 1 1 8 ILE CB C -2.141 5.693 0.616 1.00 . A A . 8 ILE CB 1 1 4 994 1 1 8 ILE CD1 C -2.039 8.202 0.210 1.00 . A A . 8 ILE CD1 1 1 4 995 1 1 8 ILE CG1 C -1.270 6.900 0.263 1.00 . A A . 8 ILE CG1 1 1 4 996 1 1 8 ILE CG2 C -2.809 5.893 1.968 1.00 . A A . 8 ILE CG2 1 1 4 997 1 1 8 ILE H H -0.215 5.261 2.208 1.00 . A A . 8 ILE H 1 1 4 998 1 1 8 ILE HA H -1.938 3.588 0.915 1.00 . A A . 8 ILE HA 1 1 4 999 1 1 8 ILE HB H -2.911 5.585 -0.124 1.00 . A A . 8 ILE HB 1 1 4 1000 1 1 8 ILE HD11 H -1.354 9.018 0.030 1.00 . A A . 8 ILE HD11 1 1 4 1001 1 1 8 ILE HD12 H -2.547 8.359 1.150 1.00 . A A . 8 ILE HD12 1 1 4 1002 1 1 8 ILE HD13 H -2.765 8.159 -0.589 1.00 . A A . 8 ILE HD13 1 1 4 1003 1 1 8 ILE HG12 H -0.493 7.005 1.006 1.00 . A A . 8 ILE HG12 1 1 4 1004 1 1 8 ILE HG13 H -0.819 6.740 -0.705 1.00 . A A . 8 ILE HG13 1 1 4 1005 1 1 8 ILE HG21 H -2.203 6.548 2.576 1.00 . A A . 8 ILE HG21 1 1 4 1006 1 1 8 ILE HG22 H -2.914 4.938 2.462 1.00 . A A . 8 ILE HG22 1 1 4 1007 1 1 8 ILE HG23 H -3.784 6.334 1.826 1.00 . A A . 8 ILE HG23 1 1 4 1008 1 1 8 ILE N N -0.220 4.504 1.590 1.00 . A A . 8 ILE N 1 1 4 1009 1 1 8 ILE O O 0.225 4.717 -1.212 1.00 . A A . 8 ILE O 1 1 4 1010 1 1 9 GLU C C -1.736 3.921 -3.881 1.00 . A A . 9 GLU C 1 1 4 1011 1 1 9 GLU CA C -1.110 2.944 -2.884 1.00 . A A . 9 GLU CA 1 1 4 1012 1 1 9 GLU CB C -1.548 1.515 -3.212 1.00 . A A . 9 GLU CB 1 1 4 1013 1 1 9 GLU CD C -0.967 -0.692 -4.320 1.00 . A A . 9 GLU CD 1 1 4 1014 1 1 9 GLU CG C -0.542 0.743 -4.053 1.00 . A A . 9 GLU CG 1 1 4 1015 1 1 9 GLU H H -2.279 2.865 -1.123 1.00 . A A . 9 GLU H 1 1 4 1016 1 1 9 GLU HA H -0.035 3.009 -2.961 1.00 . A A . 9 GLU HA 1 1 4 1017 1 1 9 GLU HB2 H -1.698 0.977 -2.288 1.00 . A A . 9 GLU HB2 1 1 4 1018 1 1 9 GLU HB3 H -2.482 1.551 -3.752 1.00 . A A . 9 GLU HB3 1 1 4 1019 1 1 9 GLU HG2 H -0.423 1.247 -5.000 1.00 . A A . 9 GLU HG2 1 1 4 1020 1 1 9 GLU HG3 H 0.405 0.731 -3.533 1.00 . A A . 9 GLU HG3 1 1 4 1021 1 1 9 GLU N N -1.484 3.282 -1.516 1.00 . A A . 9 GLU N 1 1 4 1022 1 1 9 GLU O O -1.660 3.716 -5.093 1.00 . A A . 9 GLU O 1 1 4 1023 1 1 9 GLU OE1 O -0.314 -1.410 -5.078 1.00 . A A . 9 GLU OE1 1 1 4 1024 1 1 10 GLY C C -4.485 6.036 -4.028 1.00 . A A . 10 GLY C 1 1 4 1025 1 1 10 GLY CA C -2.983 5.967 -4.226 1.00 . A A . 10 GLY CA 1 1 4 1026 1 1 10 GLY H H -2.388 5.096 -2.394 1.00 . A A . 10 GLY H 1 1 4 1027 1 1 10 GLY HA2 H -2.558 6.937 -4.014 1.00 . A A . 10 GLY HA2 1 1 4 1028 1 1 10 GLY HA3 H -2.778 5.713 -5.255 1.00 . A A . 10 GLY HA3 1 1 4 1029 1 1 10 GLY N N -2.356 4.982 -3.365 1.00 . A A . 10 GLY N 1 1 4 1030 1 1 10 GLY O O -5.225 6.357 -4.958 1.00 . A A . 10 GLY O 1 1 4 1031 1 1 11 LEU C C -6.600 5.762 -0.996 1.00 . A A . 11 LEU C 1 1 4 1032 1 1 11 LEU CA C -6.364 5.760 -2.504 1.00 . A A . 11 LEU CA 1 1 4 1033 1 1 11 LEU CB C -7.076 4.562 -3.142 1.00 . A A . 11 LEU CB 1 1 4 1034 1 1 11 LEU CD1 C -6.999 2.063 -2.913 1.00 . A A . 11 LEU CD1 1 1 4 1035 1 1 11 LEU CD2 C -5.722 3.188 -4.746 1.00 . A A . 11 LEU CD2 1 1 4 1036 1 1 11 LEU CG C -6.217 3.305 -3.312 1.00 . A A . 11 LEU CG 1 1 4 1037 1 1 11 LEU H H -4.301 5.481 -2.114 1.00 . A A . 11 LEU H 1 1 4 1038 1 1 11 LEU HA H -6.772 6.669 -2.919 1.00 . A A . 11 LEU HA 1 1 4 1039 1 1 11 LEU HB2 H -7.928 4.311 -2.527 1.00 . A A . 11 LEU HB2 1 1 4 1040 1 1 11 LEU HB3 H -7.433 4.861 -4.116 1.00 . A A . 11 LEU HB3 1 1 4 1041 1 1 11 LEU HD11 H -6.703 1.235 -3.540 1.00 . A A . 11 LEU HD11 1 1 4 1042 1 1 11 LEU HD12 H -8.056 2.249 -3.037 1.00 . A A . 11 LEU HD12 1 1 4 1043 1 1 11 LEU HD13 H -6.794 1.825 -1.880 1.00 . A A . 11 LEU HD13 1 1 4 1044 1 1 11 LEU HD21 H -4.713 2.802 -4.749 1.00 . A A . 11 LEU HD21 1 1 4 1045 1 1 11 LEU HD22 H -5.736 4.162 -5.213 1.00 . A A . 11 LEU HD22 1 1 4 1046 1 1 11 LEU HD23 H -6.366 2.516 -5.295 1.00 . A A . 11 LEU HD23 1 1 4 1047 1 1 11 LEU HG H -5.354 3.377 -2.665 1.00 . A A . 11 LEU HG 1 1 4 1048 1 1 11 LEU N N -4.938 5.731 -2.815 1.00 . A A . 11 LEU N 1 1 4 1049 1 1 11 LEU O O -6.952 6.789 -0.415 1.00 . A A . 11 LEU O 1 1 4 1050 1 1 12 VAL C C -5.839 3.282 1.629 1.00 . A A . 12 VAL C 1 1 4 1051 1 1 12 VAL CA C -6.612 4.475 1.071 1.00 . A A . 12 VAL CA 1 1 4 1052 1 1 12 VAL CB C -8.109 4.316 1.409 1.00 . A A . 12 VAL CB 1 1 4 1053 1 1 12 VAL CG1 C -8.667 3.043 0.791 1.00 . A A . 12 VAL CG1 1 1 4 1054 1 1 12 VAL CG2 C -8.328 4.326 2.914 1.00 . A A . 12 VAL CG2 1 1 4 1055 1 1 12 VAL H H -6.136 3.820 -0.884 1.00 . A A . 12 VAL H 1 1 4 1056 1 1 12 VAL HA H -6.252 5.379 1.542 1.00 . A A . 12 VAL HA 1 1 4 1057 1 1 12 VAL HB H -8.642 5.156 0.986 1.00 . A A . 12 VAL HB 1 1 4 1058 1 1 12 VAL HG11 H -8.449 2.204 1.435 1.00 . A A . 12 VAL HG11 1 1 4 1059 1 1 12 VAL HG12 H -8.212 2.883 -0.176 1.00 . A A . 12 VAL HG12 1 1 4 1060 1 1 12 VAL HG13 H -9.736 3.138 0.673 1.00 . A A . 12 VAL HG13 1 1 4 1061 1 1 12 VAL HG21 H -7.694 5.076 3.365 1.00 . A A . 12 VAL HG21 1 1 4 1062 1 1 12 VAL HG22 H -8.082 3.356 3.320 1.00 . A A . 12 VAL HG22 1 1 4 1063 1 1 12 VAL HG23 H -9.362 4.553 3.127 1.00 . A A . 12 VAL HG23 1 1 4 1064 1 1 12 VAL N N -6.412 4.605 -0.368 1.00 . A A . 12 VAL N 1 1 4 1065 1 1 12 VAL O O -5.416 2.403 0.879 1.00 . A A . 12 VAL O 1 1 4 1066 1 1 13 ARG C C -3.456 2.199 3.227 1.00 . A A . 13 ARG C 1 1 4 1067 1 1 13 ARG CA C -4.931 2.179 3.609 1.00 . A A . 13 ARG CA 1 1 4 1068 1 1 13 ARG CB C -5.544 0.822 3.252 1.00 . A A . 13 ARG CB 1 1 4 1069 1 1 13 ARG CD C -5.502 -0.623 5.308 1.00 . A A . 13 ARG CD 1 1 4 1070 1 1 13 ARG CG C -4.874 -0.350 3.951 1.00 . A A . 13 ARG CG 1 1 4 1071 1 1 13 ARG CZ C -7.584 -1.785 4.686 1.00 . A A . 13 ARG CZ 1 1 4 1072 1 1 13 ARG H H -6.012 3.995 3.491 1.00 . A A . 13 ARG H 1 1 4 1073 1 1 13 ARG HA H -5.014 2.331 4.675 1.00 . A A . 13 ARG HA 1 1 4 1074 1 1 13 ARG HB2 H -6.588 0.828 3.526 1.00 . A A . 13 ARG HB2 1 1 4 1075 1 1 13 ARG HB3 H -5.461 0.671 2.186 1.00 . A A . 13 ARG HB3 1 1 4 1076 1 1 13 ARG HD2 H -5.096 -1.543 5.700 1.00 . A A . 13 ARG HD2 1 1 4 1077 1 1 13 ARG HD3 H -5.254 0.191 5.974 1.00 . A A . 13 ARG HD3 1 1 4 1078 1 1 13 ARG HE H -7.492 -0.008 5.591 1.00 . A A . 13 ARG HE 1 1 4 1079 1 1 13 ARG HG2 H -4.978 -1.231 3.335 1.00 . A A . 13 ARG HG2 1 1 4 1080 1 1 13 ARG HG3 H -3.827 -0.125 4.087 1.00 . A A . 13 ARG HG3 1 1 4 1081 1 1 13 ARG HH11 H -5.893 -2.785 4.206 1.00 . A A . 13 ARG HH11 1 1 4 1082 1 1 13 ARG HH12 H -7.371 -3.579 3.779 1.00 . A A . 13 ARG HH12 1 1 4 1083 1 1 13 ARG HH21 H -9.436 -1.052 5.029 1.00 . A A . 13 ARG HH21 1 1 4 1084 1 1 13 ARG HH22 H -9.382 -2.596 4.245 1.00 . A A . 13 ARG HH22 1 1 4 1085 1 1 13 ARG N N -5.655 3.262 2.948 1.00 . A A . 13 ARG N 1 1 4 1086 1 1 13 ARG NE N -6.956 -0.743 5.226 1.00 . A A . 13 ARG NE 1 1 4 1087 1 1 13 ARG NH1 N -6.892 -2.799 4.183 1.00 . A A . 13 ARG NH1 1 1 4 1088 1 1 13 ARG NH2 N -8.910 -1.814 4.651 1.00 . A A . 13 ARG NH2 1 1 4 1089 1 1 13 ARG O O -3.109 2.080 2.053 1.00 . A A . 13 ARG O 1 1 4 1090 1 1 14 ASP C C -0.663 1.098 3.362 1.00 . A A . 14 ASP C 1 1 4 1091 1 1 14 ASP CA C -1.155 2.395 3.998 1.00 . A A . 14 ASP CA 1 1 4 1092 1 1 14 ASP CB C -0.416 2.643 5.315 1.00 . A A . 14 ASP CB 1 1 4 1093 1 1 14 ASP CG C -0.524 4.083 5.775 1.00 . A A . 14 ASP CG 1 1 4 1094 1 1 14 ASP H H -2.930 2.450 5.140 1.00 . A A . 14 ASP H 1 1 4 1095 1 1 14 ASP HA H -0.953 3.212 3.326 1.00 . A A . 14 ASP HA 1 1 4 1096 1 1 14 ASP HB2 H -0.835 2.008 6.081 1.00 . A A . 14 ASP HB2 1 1 4 1097 1 1 14 ASP HB3 H 0.629 2.402 5.185 1.00 . A A . 14 ASP HB3 1 1 4 1098 1 1 14 ASP N N -2.592 2.355 4.227 1.00 . A A . 14 ASP N 1 1 4 1099 1 1 14 ASP O O -0.145 0.220 4.043 1.00 . A A . 14 ASP O 1 1 4 1100 1 1 14 ASP OD1 O -0.881 4.306 6.950 1.00 . A A . 14 ASP OD1 1 1 4 1101 1 1 14 ASP OD2 O -0.250 4.989 4.959 1.00 . A A . 14 ASP OD2 1 1 4 1102 1 1 15 SER C C 1.093 -0.463 1.543 1.00 . A A . 15 SER C 1 1 4 1103 1 1 15 SER CA C -0.395 -0.204 1.325 1.00 . A A . 15 SER CA 1 1 4 1104 1 1 15 SER CB C -0.685 -0.047 -0.170 1.00 . A A . 15 SER CB 1 1 4 1105 1 1 15 SER H H -1.245 1.718 1.560 1.00 . A A . 15 SER H 1 1 4 1106 1 1 15 SER HA H -0.954 -1.045 1.705 1.00 . A A . 15 SER HA 1 1 4 1107 1 1 15 SER HB2 H -1.315 0.817 -0.323 1.00 . A A . 15 SER HB2 1 1 4 1108 1 1 15 SER HB3 H 0.244 0.085 -0.704 1.00 . A A . 15 SER HB3 1 1 4 1109 1 1 15 SER HG H -1.057 -1.352 -1.583 1.00 . A A . 15 SER HG 1 1 4 1110 1 1 15 SER N N -0.826 0.985 2.051 1.00 . A A . 15 SER N 1 1 4 1111 1 1 15 SER O O 1.887 0.473 1.644 1.00 . A A . 15 SER O 1 1 4 1112 1 1 15 SER OG O -1.348 -1.190 -0.683 1.00 . A A . 15 SER OG 1 1 4 1113 1 1 16 LEU C C 3.444 -2.761 0.573 1.00 . A A . 16 LEU C 1 1 4 1114 1 1 16 LEU CA C 2.859 -2.114 1.824 1.00 . A A . 16 LEU CA 1 1 4 1115 1 1 16 LEU CB C 2.980 -3.070 3.013 1.00 . A A . 16 LEU CB 1 1 4 1116 1 1 16 LEU CD1 C 3.242 -5.362 2.024 1.00 . A A . 16 LEU CD1 1 1 4 1117 1 1 16 LEU CD2 C 1.971 -5.056 4.160 1.00 . A A . 16 LEU CD2 1 1 4 1118 1 1 16 LEU CG C 2.325 -4.438 2.815 1.00 . A A . 16 LEU CG 1 1 4 1119 1 1 16 LEU H H 0.788 -2.439 1.529 1.00 . A A . 16 LEU H 1 1 4 1120 1 1 16 LEU HA H 3.416 -1.215 2.040 1.00 . A A . 16 LEU HA 1 1 4 1121 1 1 16 LEU HB2 H 4.030 -3.222 3.219 1.00 . A A . 16 LEU HB2 1 1 4 1122 1 1 16 LEU HB3 H 2.527 -2.600 3.873 1.00 . A A . 16 LEU HB3 1 1 4 1123 1 1 16 LEU HD11 H 4.200 -4.885 1.882 1.00 . A A . 16 LEU HD11 1 1 4 1124 1 1 16 LEU HD12 H 2.798 -5.570 1.062 1.00 . A A . 16 LEU HD12 1 1 4 1125 1 1 16 LEU HD13 H 3.377 -6.287 2.565 1.00 . A A . 16 LEU HD13 1 1 4 1126 1 1 16 LEU HD21 H 1.187 -5.786 4.026 1.00 . A A . 16 LEU HD21 1 1 4 1127 1 1 16 LEU HD22 H 1.632 -4.282 4.833 1.00 . A A . 16 LEU HD22 1 1 4 1128 1 1 16 LEU HD23 H 2.844 -5.537 4.576 1.00 . A A . 16 LEU HD23 1 1 4 1129 1 1 16 LEU HG H 1.411 -4.313 2.253 1.00 . A A . 16 LEU HG 1 1 4 1130 1 1 16 LEU N N 1.465 -1.737 1.616 1.00 . A A . 16 LEU N 1 1 4 1131 1 1 16 LEU O O 4.609 -2.548 0.240 1.00 . A A . 16 LEU O 1 1 4 1132 1 1 17 TYR C C 3.517 -3.217 -2.384 1.00 . A A . 17 TYR C 1 1 4 1133 1 1 17 TYR CA C 3.069 -4.230 -1.330 1.00 . A A . 17 TYR CA 1 1 4 1134 1 1 17 TYR CB C 1.944 -5.102 -1.888 1.00 . A A . 17 TYR CB 1 1 4 1135 1 1 17 TYR CD1 C 2.466 -7.283 -0.728 1.00 . A A . 17 TYR CD1 1 1 4 1136 1 1 17 TYR CD2 C 0.316 -6.312 -0.383 1.00 . A A . 17 TYR CD2 1 1 4 1137 1 1 17 TYR CE1 C 2.127 -8.337 0.099 1.00 . A A . 17 TYR CE1 1 1 4 1138 1 1 17 TYR CE2 C -0.029 -7.362 0.446 1.00 . A A . 17 TYR CE2 1 1 4 1139 1 1 17 TYR CG C 1.568 -6.254 -0.984 1.00 . A A . 17 TYR CG 1 1 4 1140 1 1 17 TYR CZ C 0.879 -8.371 0.684 1.00 . A A . 17 TYR CZ 1 1 4 1141 1 1 17 TYR H H 1.709 -3.684 0.199 1.00 . A A . 17 TYR H 1 1 4 1142 1 1 17 TYR HA H 3.905 -4.860 -1.069 1.00 . A A . 17 TYR HA 1 1 4 1143 1 1 17 TYR HB2 H 1.064 -4.494 -2.034 1.00 . A A . 17 TYR HB2 1 1 4 1144 1 1 17 TYR HB3 H 2.254 -5.513 -2.838 1.00 . A A . 17 TYR HB3 1 1 4 1145 1 1 17 TYR HD1 H 3.443 -7.253 -1.188 1.00 . A A . 17 TYR HD1 1 1 4 1146 1 1 17 TYR HD2 H -0.394 -5.520 -0.572 1.00 . A A . 17 TYR HD2 1 1 4 1147 1 1 17 TYR HE1 H 2.839 -9.127 0.286 1.00 . A A . 17 TYR HE1 1 1 4 1148 1 1 17 TYR HE2 H -1.007 -7.389 0.904 1.00 . A A . 17 TYR HE2 1 1 4 1149 1 1 17 TYR HH H 0.991 -9.323 2.351 1.00 . A A . 17 TYR HH 1 1 4 1150 1 1 17 TYR N N 2.628 -3.552 -0.116 1.00 . A A . 17 TYR N 1 1 4 1151 1 1 17 TYR O O 2.739 -2.356 -2.794 1.00 . A A . 17 TYR O 1 1 4 1152 1 1 17 TYR OH O 0.539 -9.418 1.509 1.00 . A A . 17 TYR OH 1 1 4 1153 1 1 18 PRO C C 4.411 -2.264 -5.068 1.00 . A A . 18 PRO C 1 1 4 1154 1 1 18 PRO CA C 5.320 -2.385 -3.846 1.00 . A A . 18 PRO CA 1 1 4 1155 1 1 18 PRO CB C 6.654 -3.025 -4.232 1.00 . A A . 18 PRO CB 1 1 4 1156 1 1 18 PRO CD C 5.784 -4.297 -2.406 1.00 . A A . 18 PRO CD 1 1 4 1157 1 1 18 PRO CG C 7.060 -3.802 -3.029 1.00 . A A . 18 PRO CG 1 1 4 1158 1 1 18 PRO HA H 5.496 -1.405 -3.429 1.00 . A A . 18 PRO HA 1 1 4 1159 1 1 18 PRO HB2 H 6.514 -3.666 -5.090 1.00 . A A . 18 PRO HB2 1 1 4 1160 1 1 18 PRO HB3 H 7.373 -2.254 -4.465 1.00 . A A . 18 PRO HB3 1 1 4 1161 1 1 18 PRO HD2 H 5.538 -5.280 -2.780 1.00 . A A . 18 PRO HD2 1 1 4 1162 1 1 18 PRO HD3 H 5.872 -4.313 -1.329 1.00 . A A . 18 PRO HD3 1 1 4 1163 1 1 18 PRO HG2 H 7.682 -4.635 -3.323 1.00 . A A . 18 PRO HG2 1 1 4 1164 1 1 18 PRO HG3 H 7.590 -3.162 -2.340 1.00 . A A . 18 PRO HG3 1 1 4 1165 1 1 18 PRO N N 4.782 -3.304 -2.838 1.00 . A A . 18 PRO N 1 1 4 1166 1 1 18 PRO O O 3.806 -3.245 -5.500 1.00 . A A . 18 PRO O 1 1 4 1167 1 1 19 PRO C C 4.018 -1.474 -8.079 1.00 . A A . 19 PRO C 1 1 4 1168 1 1 19 PRO CA C 3.464 -0.810 -6.822 1.00 . A A . 19 PRO CA 1 1 4 1169 1 1 19 PRO CB C 3.487 0.713 -6.970 1.00 . A A . 19 PRO CB 1 1 4 1170 1 1 19 PRO CD C 4.993 0.172 -5.194 1.00 . A A . 19 PRO CD 1 1 4 1171 1 1 19 PRO CG C 4.758 1.139 -6.321 1.00 . A A . 19 PRO CG 1 1 4 1172 1 1 19 PRO HA H 2.450 -1.143 -6.659 1.00 . A A . 19 PRO HA 1 1 4 1173 1 1 19 PRO HB2 H 3.471 0.976 -8.018 1.00 . A A . 19 PRO HB2 1 1 4 1174 1 1 19 PRO HB3 H 2.629 1.139 -6.472 1.00 . A A . 19 PRO HB3 1 1 4 1175 1 1 19 PRO HD2 H 6.050 -0.006 -5.063 1.00 . A A . 19 PRO HD2 1 1 4 1176 1 1 19 PRO HD3 H 4.555 0.544 -4.280 1.00 . A A . 19 PRO HD3 1 1 4 1177 1 1 19 PRO HG2 H 5.569 1.089 -7.032 1.00 . A A . 19 PRO HG2 1 1 4 1178 1 1 19 PRO HG3 H 4.656 2.143 -5.937 1.00 . A A . 19 PRO HG3 1 1 4 1179 1 1 19 PRO N N 4.305 -1.053 -5.645 1.00 . A A . 19 PRO N 1 1 4 1180 1 1 19 PRO O O 3.275 -1.774 -9.013 1.00 . A A . 19 PRO O 1 1 4 1181 1 1 20 ALA C C 6.056 -3.841 -9.069 1.00 . A A . 20 ALA C 1 1 4 1182 1 1 20 ALA CA C 5.980 -2.327 -9.240 1.00 . A A . 20 ALA CA 1 1 4 1183 1 1 20 ALA CB C 7.372 -1.744 -9.436 1.00 . A A . 20 ALA CB 1 1 4 1184 1 1 20 ALA H H 5.869 -1.438 -7.323 1.00 . A A . 20 ALA H 1 1 4 1185 1 1 20 ALA HA H 5.395 -2.103 -10.120 1.00 . A A . 20 ALA HA 1 1 4 1186 1 1 20 ALA HB1 H 7.609 -1.724 -10.489 1.00 . A A . 20 ALA HB1 1 1 4 1187 1 1 20 ALA HB2 H 8.094 -2.354 -8.915 1.00 . A A . 20 ALA HB2 1 1 4 1188 1 1 20 ALA HB3 H 7.399 -0.739 -9.042 1.00 . A A . 20 ALA HB3 1 1 4 1189 1 1 20 ALA N N 5.328 -1.700 -8.096 1.00 . A A . 20 ALA N 1 1 4 1190 1 1 20 ALA O O 7.107 -4.448 -9.276 1.00 . A A . 20 ALA O 1 1 4 1191 1 1 21 GLY C C 3.494 -6.397 -8.234 1.00 . A A . 21 GLY C 1 1 4 1192 1 1 21 GLY CA C 4.896 -5.884 -8.500 1.00 . A A . 21 GLY CA 1 1 4 1193 1 1 21 GLY H H 4.126 -3.913 -8.542 1.00 . A A . 21 GLY H 1 1 4 1194 1 1 21 GLY HA2 H 5.280 -6.365 -9.388 1.00 . A A . 21 GLY HA2 1 1 4 1195 1 1 21 GLY HA3 H 5.526 -6.142 -7.663 1.00 . A A . 21 GLY HA3 1 1 4 1196 1 1 21 GLY N N 4.934 -4.447 -8.691 1.00 . A A . 21 GLY N 1 1 5 1197 1 1 1 ASP C C -5.053 -1.004 -2.999 1.00 . A A . 1 ASP C 1 1 5 1198 1 1 1 ASP CA C -4.167 -0.470 -4.121 1.00 . A A . 1 ASP CA 1 1 5 1199 1 1 1 ASP CB C -3.411 -1.625 -4.786 1.00 . A A . 1 ASP CB 1 1 5 1200 1 1 1 ASP CG C -2.182 -2.051 -4.004 1.00 . A A . 1 ASP CG 1 1 5 1201 1 1 1 ASP H1 H -2.707 0.321 -2.817 1.00 . A A . 1 ASP H1 1 1 5 1202 1 1 1 ASP HA H -4.795 0.008 -4.859 1.00 . A A . 1 ASP HA 1 1 5 1203 1 1 1 ASP HB2 H -4.071 -2.475 -4.870 1.00 . A A . 1 ASP HB2 1 1 5 1204 1 1 1 ASP HB3 H -3.099 -1.319 -5.774 1.00 . A A . 1 ASP HB3 1 1 5 1205 1 1 1 ASP N N -3.231 0.531 -3.618 1.00 . A A . 1 ASP N 1 1 5 1206 1 1 1 ASP O O -6.280 -0.964 -3.091 1.00 . A A . 1 ASP O 1 1 5 1207 1 1 1 ASP OD1 O -2.017 -1.591 -2.855 1.00 . A A . 1 ASP OD1 1 1 5 1208 1 1 1 ASP OD2 O -1.383 -2.846 -4.543 1.00 . A A . 1 ASP OD2 1 1 5 1209 1 1 2 GLY C C -4.308 -2.863 0.115 1.00 . A A . 2 GLY C 1 1 5 1210 1 1 2 GLY CA C -5.172 -2.037 -0.817 1.00 . A A . 2 GLY CA 1 1 5 1211 1 1 2 GLY H H -3.444 -1.508 -1.921 1.00 . A A . 2 GLY H 1 1 5 1212 1 1 2 GLY HA2 H -5.600 -1.216 -0.261 1.00 . A A . 2 GLY HA2 1 1 5 1213 1 1 2 GLY HA3 H -5.971 -2.658 -1.194 1.00 . A A . 2 GLY HA3 1 1 5 1214 1 1 2 GLY N N -4.424 -1.503 -1.940 1.00 . A A . 2 GLY N 1 1 5 1215 1 1 2 GLY O O -3.930 -2.403 1.192 1.00 . A A . 2 GLY O 1 1 5 1216 1 1 3 MET C C -1.821 -4.338 0.822 1.00 . A A . 3 MET C 1 1 5 1217 1 1 3 MET CA C -3.167 -4.980 0.502 1.00 . A A . 3 MET CA 1 1 5 1218 1 1 3 MET CB C -2.952 -6.305 -0.233 1.00 . A A . 3 MET CB 1 1 5 1219 1 1 3 MET CE C -6.459 -6.540 -0.642 1.00 . A A . 3 MET CE 1 1 5 1220 1 1 3 MET CG C -3.946 -7.387 0.161 1.00 . A A . 3 MET CG 1 1 5 1221 1 1 3 MET H H -4.325 -4.394 -1.171 1.00 . A A . 3 MET H 1 1 5 1222 1 1 3 MET HA H -3.690 -5.172 1.427 1.00 . A A . 3 MET HA 1 1 5 1223 1 1 3 MET HB2 H -3.042 -6.133 -1.295 1.00 . A A . 3 MET HB2 1 1 5 1224 1 1 3 MET HB3 H -1.957 -6.666 -0.018 1.00 . A A . 3 MET HB3 1 1 5 1225 1 1 3 MET HE1 H -7.422 -7.027 -0.687 1.00 . A A . 3 MET HE1 1 1 5 1226 1 1 3 MET HE2 H -6.451 -5.697 -1.317 1.00 . A A . 3 MET HE2 1 1 5 1227 1 1 3 MET HE3 H -6.277 -6.195 0.366 1.00 . A A . 3 MET HE3 1 1 5 1228 1 1 3 MET HG2 H -3.404 -8.302 0.348 1.00 . A A . 3 MET HG2 1 1 5 1229 1 1 3 MET HG3 H -4.453 -7.080 1.064 1.00 . A A . 3 MET HG3 1 1 5 1230 1 1 3 MET N N -3.994 -4.085 -0.302 1.00 . A A . 3 MET N 1 1 5 1231 1 1 3 MET O O -1.017 -4.080 -0.074 1.00 . A A . 3 MET O 1 1 5 1232 1 1 3 MET SD S -5.180 -7.699 -1.117 1.00 . A A . 3 MET SD 1 1 5 1233 1 1 4 GLY C C -0.382 -2.938 3.936 1.00 . A A . 4 GLY C 1 1 5 1234 1 1 4 GLY CA C -0.330 -3.473 2.518 1.00 . A A . 4 GLY CA 1 1 5 1235 1 1 4 GLY H H -2.259 -4.309 2.776 1.00 . A A . 4 GLY H 1 1 5 1236 1 1 4 GLY HA2 H 0.453 -4.212 2.453 1.00 . A A . 4 GLY HA2 1 1 5 1237 1 1 4 GLY HA3 H -0.100 -2.660 1.846 1.00 . A A . 4 GLY HA3 1 1 5 1238 1 1 4 GLY N N -1.581 -4.082 2.105 1.00 . A A . 4 GLY N 1 1 5 1239 1 1 4 GLY O O -1.298 -3.259 4.693 1.00 . A A . 4 GLY O 1 1 5 1240 1 1 5 GLU C C 1.834 -0.578 5.778 1.00 . A A . 5 GLU C 1 1 5 1241 1 1 5 GLU CA C 0.659 -1.545 5.638 1.00 . A A . 5 GLU CA 1 1 5 1242 1 1 5 GLU CB C 0.770 -2.655 6.685 1.00 . A A . 5 GLU CB 1 1 5 1243 1 1 5 GLU CD C 2.184 -4.533 7.610 1.00 . A A . 5 GLU CD 1 1 5 1244 1 1 5 GLU CG C 1.924 -3.613 6.434 1.00 . A A . 5 GLU CG 1 1 5 1245 1 1 5 GLU H H 1.307 -1.900 3.652 1.00 . A A . 5 GLU H 1 1 5 1246 1 1 5 GLU HA H -0.259 -1.000 5.799 1.00 . A A . 5 GLU HA 1 1 5 1247 1 1 5 GLU HB2 H 0.909 -2.205 7.657 1.00 . A A . 5 GLU HB2 1 1 5 1248 1 1 5 GLU HB3 H -0.148 -3.223 6.689 1.00 . A A . 5 GLU HB3 1 1 5 1249 1 1 5 GLU HG2 H 1.692 -4.216 5.569 1.00 . A A . 5 GLU HG2 1 1 5 1250 1 1 5 GLU HG3 H 2.817 -3.037 6.241 1.00 . A A . 5 GLU HG3 1 1 5 1251 1 1 5 GLU N N 0.603 -2.120 4.298 1.00 . A A . 5 GLU N 1 1 5 1252 1 1 5 GLU O O 2.673 -0.727 6.667 1.00 . A A . 5 GLU O 1 1 5 1253 1 1 5 GLU OE1 O 3.187 -4.318 8.322 1.00 . A A . 5 GLU OE1 1 1 5 1254 1 1 5 GLU OE2 O 1.385 -5.470 7.819 1.00 . A A . 5 GLU OE2 1 1 5 1255 1 1 6 GLU C C 2.374 2.820 4.991 1.00 . A A . 6 GLU C 1 1 5 1256 1 1 6 GLU CA C 2.953 1.410 4.926 1.00 . A A . 6 GLU CA 1 1 5 1257 1 1 6 GLU CB C 3.850 1.268 3.694 1.00 . A A . 6 GLU CB 1 1 5 1258 1 1 6 GLU CD C 5.723 -0.341 4.225 1.00 . A A . 6 GLU CD 1 1 5 1259 1 1 6 GLU CG C 4.404 -0.134 3.506 1.00 . A A . 6 GLU CG 1 1 5 1260 1 1 6 GLU H H 1.187 0.484 4.213 1.00 . A A . 6 GLU H 1 1 5 1261 1 1 6 GLU HA H 3.544 1.236 5.813 1.00 . A A . 6 GLU HA 1 1 5 1262 1 1 6 GLU HB2 H 3.280 1.529 2.815 1.00 . A A . 6 GLU HB2 1 1 5 1263 1 1 6 GLU HB3 H 4.681 1.951 3.788 1.00 . A A . 6 GLU HB3 1 1 5 1264 1 1 6 GLU HG2 H 3.688 -0.845 3.890 1.00 . A A . 6 GLU HG2 1 1 5 1265 1 1 6 GLU HG3 H 4.555 -0.310 2.451 1.00 . A A . 6 GLU HG3 1 1 5 1266 1 1 6 GLU N N 1.885 0.416 4.898 1.00 . A A . 6 GLU N 1 1 5 1267 1 1 6 GLU O O 2.710 3.598 5.884 1.00 . A A . 6 GLU O 1 1 5 1268 1 1 6 GLU OE1 O 5.885 -1.393 4.878 1.00 . A A . 6 GLU OE1 1 1 5 1269 1 1 6 GLU OE2 O 6.595 0.549 4.135 1.00 . A A . 6 GLU OE2 1 1 5 1270 1 1 7 PHE C C -0.167 4.532 2.885 1.00 . A A . 7 PHE C 1 1 5 1271 1 1 7 PHE CA C 0.869 4.455 4.001 1.00 . A A . 7 PHE CA 1 1 5 1272 1 1 7 PHE CB C 1.923 5.548 3.815 1.00 . A A . 7 PHE CB 1 1 5 1273 1 1 7 PHE CD1 C 2.468 5.350 1.374 1.00 . A A . 7 PHE CD1 1 1 5 1274 1 1 7 PHE CD2 C 4.201 4.938 2.958 1.00 . A A . 7 PHE CD2 1 1 5 1275 1 1 7 PHE CE1 C 3.349 5.098 0.339 1.00 . A A . 7 PHE CE1 1 1 5 1276 1 1 7 PHE CE2 C 5.087 4.685 1.928 1.00 . A A . 7 PHE CE2 1 1 5 1277 1 1 7 PHE CG C 2.883 5.273 2.693 1.00 . A A . 7 PHE CG 1 1 5 1278 1 1 7 PHE CZ C 4.660 4.765 0.617 1.00 . A A . 7 PHE CZ 1 1 5 1279 1 1 7 PHE H H 1.266 2.476 3.361 1.00 . A A . 7 PHE H 1 1 5 1280 1 1 7 PHE HA H 0.367 4.608 4.943 1.00 . A A . 7 PHE HA 1 1 5 1281 1 1 7 PHE HB2 H 1.428 6.484 3.605 1.00 . A A . 7 PHE HB2 1 1 5 1282 1 1 7 PHE HB3 H 2.494 5.645 4.726 1.00 . A A . 7 PHE HB3 1 1 5 1283 1 1 7 PHE HD1 H 1.443 5.611 1.156 1.00 . A A . 7 PHE HD1 1 1 5 1284 1 1 7 PHE HD2 H 4.536 4.875 3.983 1.00 . A A . 7 PHE HD2 1 1 5 1285 1 1 7 PHE HE1 H 3.012 5.161 -0.685 1.00 . A A . 7 PHE HE1 1 1 5 1286 1 1 7 PHE HE2 H 6.112 4.424 2.148 1.00 . A A . 7 PHE HE2 1 1 5 1287 1 1 7 PHE HZ H 5.351 4.567 -0.190 1.00 . A A . 7 PHE HZ 1 1 5 1288 1 1 7 PHE N N 1.498 3.140 4.044 1.00 . A A . 7 PHE N 1 1 5 1289 1 1 7 PHE O O -0.222 3.668 2.012 1.00 . A A . 7 PHE O 1 1 5 1290 1 1 8 ILE C C -1.523 5.557 0.515 1.00 . A A . 8 ILE C 1 1 5 1291 1 1 8 ILE CA C -2.035 5.778 1.936 1.00 . A A . 8 ILE CA 1 1 5 1292 1 1 8 ILE CB C -2.625 7.195 2.042 1.00 . A A . 8 ILE CB 1 1 5 1293 1 1 8 ILE CD1 C -1.098 8.703 3.465 1.00 . A A . 8 ILE CD1 1 1 5 1294 1 1 8 ILE CG1 C -1.502 8.246 2.074 1.00 . A A . 8 ILE CG1 1 1 5 1295 1 1 8 ILE CG2 C -3.530 7.306 3.263 1.00 . A A . 8 ILE CG2 1 1 5 1296 1 1 8 ILE H H -0.899 6.226 3.649 1.00 . A A . 8 ILE H 1 1 5 1297 1 1 8 ILE HA H -2.823 5.069 2.136 1.00 . A A . 8 ILE HA 1 1 5 1298 1 1 8 ILE HB H -3.231 7.362 1.171 1.00 . A A . 8 ILE HB 1 1 5 1299 1 1 8 ILE HD11 H -1.597 9.632 3.696 1.00 . A A . 8 ILE HD11 1 1 5 1300 1 1 8 ILE HD12 H -0.029 8.851 3.498 1.00 . A A . 8 ILE HD12 1 1 5 1301 1 1 8 ILE HD13 H -1.379 7.954 4.190 1.00 . A A . 8 ILE HD13 1 1 5 1302 1 1 8 ILE HG12 H -0.625 7.835 1.599 1.00 . A A . 8 ILE HG12 1 1 5 1303 1 1 8 ILE HG13 H -1.824 9.117 1.521 1.00 . A A . 8 ILE HG13 1 1 5 1304 1 1 8 ILE HG21 H -4.295 6.545 3.215 1.00 . A A . 8 ILE HG21 1 1 5 1305 1 1 8 ILE HG22 H -3.993 8.281 3.281 1.00 . A A . 8 ILE HG22 1 1 5 1306 1 1 8 ILE HG23 H -2.943 7.170 4.160 1.00 . A A . 8 ILE HG23 1 1 5 1307 1 1 8 ILE N N -0.991 5.575 2.928 1.00 . A A . 8 ILE N 1 1 5 1308 1 1 8 ILE O O -0.572 6.205 0.078 1.00 . A A . 8 ILE O 1 1 5 1309 1 1 9 GLU C C -2.079 5.517 -2.491 1.00 . A A . 9 GLU C 1 1 5 1310 1 1 9 GLU CA C -1.781 4.333 -1.574 1.00 . A A . 9 GLU CA 1 1 5 1311 1 1 9 GLU CB C -2.519 3.086 -2.069 1.00 . A A . 9 GLU CB 1 1 5 1312 1 1 9 GLU CD C -3.195 1.764 -4.113 1.00 . A A . 9 GLU CD 1 1 5 1313 1 1 9 GLU CG C -2.174 2.702 -3.498 1.00 . A A . 9 GLU CG 1 1 5 1314 1 1 9 GLU H H -2.917 4.157 0.203 1.00 . A A . 9 GLU H 1 1 5 1315 1 1 9 GLU HA H -0.719 4.141 -1.586 1.00 . A A . 9 GLU HA 1 1 5 1316 1 1 9 GLU HB2 H -2.271 2.256 -1.427 1.00 . A A . 9 GLU HB2 1 1 5 1317 1 1 9 GLU HB3 H -3.583 3.263 -2.014 1.00 . A A . 9 GLU HB3 1 1 5 1318 1 1 9 GLU HG2 H -2.125 3.599 -4.097 1.00 . A A . 9 GLU HG2 1 1 5 1319 1 1 9 GLU HG3 H -1.210 2.214 -3.503 1.00 . A A . 9 GLU HG3 1 1 5 1320 1 1 9 GLU N N -2.165 4.638 -0.201 1.00 . A A . 9 GLU N 1 1 5 1321 1 1 9 GLU O O -1.180 6.278 -2.850 1.00 . A A . 9 GLU O 1 1 5 1322 1 1 9 GLU OE1 O -3.938 2.145 -5.017 1.00 . A A . 9 GLU OE1 1 1 5 1323 1 1 10 GLY C C -5.082 7.364 -3.338 1.00 . A A . 10 GLY C 1 1 5 1324 1 1 10 GLY CA C -3.743 6.762 -3.729 1.00 . A A . 10 GLY CA 1 1 5 1325 1 1 10 GLY H H -4.019 5.032 -2.543 1.00 . A A . 10 GLY H 1 1 5 1326 1 1 10 GLY HA2 H -2.988 7.533 -3.684 1.00 . A A . 10 GLY HA2 1 1 5 1327 1 1 10 GLY HA3 H -3.808 6.397 -4.743 1.00 . A A . 10 GLY HA3 1 1 5 1328 1 1 10 GLY N N -3.346 5.668 -2.862 1.00 . A A . 10 GLY N 1 1 5 1329 1 1 10 GLY O O -5.628 8.194 -4.064 1.00 . A A . 10 GLY O 1 1 5 1330 1 1 11 LEU C C -6.922 7.488 -0.183 1.00 . A A . 11 LEU C 1 1 5 1331 1 1 11 LEU CA C -6.892 7.453 -1.708 1.00 . A A . 11 LEU CA 1 1 5 1332 1 1 11 LEU CB C -8.039 6.585 -2.231 1.00 . A A . 11 LEU CB 1 1 5 1333 1 1 11 LEU CD1 C -9.046 5.252 -4.098 1.00 . A A . 11 LEU CD1 1 1 5 1334 1 1 11 LEU CD2 C -8.242 7.580 -4.524 1.00 . A A . 11 LEU CD2 1 1 5 1335 1 1 11 LEU CG C -8.008 6.301 -3.734 1.00 . A A . 11 LEU CG 1 1 5 1336 1 1 11 LEU H H -5.131 6.287 -1.651 1.00 . A A . 11 LEU H 1 1 5 1337 1 1 11 LEU HA H -7.013 8.459 -2.083 1.00 . A A . 11 LEU HA 1 1 5 1338 1 1 11 LEU HB2 H -8.013 5.641 -1.708 1.00 . A A . 11 LEU HB2 1 1 5 1339 1 1 11 LEU HB3 H -8.970 7.080 -2.001 1.00 . A A . 11 LEU HB3 1 1 5 1340 1 1 11 LEU HD11 H -9.997 5.521 -3.665 1.00 . A A . 11 LEU HD11 1 1 5 1341 1 1 11 LEU HD12 H -8.735 4.290 -3.716 1.00 . A A . 11 LEU HD12 1 1 5 1342 1 1 11 LEU HD13 H -9.142 5.198 -5.173 1.00 . A A . 11 LEU HD13 1 1 5 1343 1 1 11 LEU HD21 H -7.635 7.568 -5.417 1.00 . A A . 11 LEU HD21 1 1 5 1344 1 1 11 LEU HD22 H -7.973 8.433 -3.917 1.00 . A A . 11 LEU HD22 1 1 5 1345 1 1 11 LEU HD23 H -9.284 7.648 -4.799 1.00 . A A . 11 LEU HD23 1 1 5 1346 1 1 11 LEU HG H -7.035 5.915 -4.002 1.00 . A A . 11 LEU HG 1 1 5 1347 1 1 11 LEU N N -5.612 6.948 -2.189 1.00 . A A . 11 LEU N 1 1 5 1348 1 1 11 LEU O O -7.020 8.556 0.421 1.00 . A A . 11 LEU O 1 1 5 1349 1 1 12 VAL C C -6.725 4.756 2.343 1.00 . A A . 12 VAL C 1 1 5 1350 1 1 12 VAL CA C -6.853 6.209 1.889 1.00 . A A . 12 VAL CA 1 1 5 1351 1 1 12 VAL CB C -8.143 6.816 2.478 1.00 . A A . 12 VAL CB 1 1 5 1352 1 1 12 VAL CG1 C -9.371 6.118 1.915 1.00 . A A . 12 VAL CG1 1 1 5 1353 1 1 12 VAL CG2 C -8.128 6.742 3.999 1.00 . A A . 12 VAL CG2 1 1 5 1354 1 1 12 VAL H H -6.759 5.495 -0.102 1.00 . A A . 12 VAL H 1 1 5 1355 1 1 12 VAL HA H -6.011 6.769 2.270 1.00 . A A . 12 VAL HA 1 1 5 1356 1 1 12 VAL HB H -8.188 7.857 2.192 1.00 . A A . 12 VAL HB 1 1 5 1357 1 1 12 VAL HG11 H -9.660 5.312 2.573 1.00 . A A . 12 VAL HG11 1 1 5 1358 1 1 12 VAL HG12 H -9.142 5.720 0.937 1.00 . A A . 12 VAL HG12 1 1 5 1359 1 1 12 VAL HG13 H -10.182 6.827 1.834 1.00 . A A . 12 VAL HG13 1 1 5 1360 1 1 12 VAL HG21 H -7.113 6.608 4.343 1.00 . A A . 12 VAL HG21 1 1 5 1361 1 1 12 VAL HG22 H -8.732 5.909 4.324 1.00 . A A . 12 VAL HG22 1 1 5 1362 1 1 12 VAL HG23 H -8.528 7.658 4.407 1.00 . A A . 12 VAL HG23 1 1 5 1363 1 1 12 VAL N N -6.836 6.312 0.434 1.00 . A A . 12 VAL N 1 1 5 1364 1 1 12 VAL O O -7.725 4.081 2.590 1.00 . A A . 12 VAL O 1 1 5 1365 1 1 13 ARG C C -3.733 2.633 2.976 1.00 . A A . 13 ARG C 1 1 5 1366 1 1 13 ARG CA C -5.230 2.910 2.883 1.00 . A A . 13 ARG CA 1 1 5 1367 1 1 13 ARG CB C -5.883 1.918 1.918 1.00 . A A . 13 ARG CB 1 1 5 1368 1 1 13 ARG CD C -6.952 -0.342 2.181 1.00 . A A . 13 ARG CD 1 1 5 1369 1 1 13 ARG CG C -5.669 0.463 2.307 1.00 . A A . 13 ARG CG 1 1 5 1370 1 1 13 ARG CZ C -7.619 -2.581 1.396 1.00 . A A . 13 ARG CZ 1 1 5 1371 1 1 13 ARG H H -4.731 4.867 2.247 1.00 . A A . 13 ARG H 1 1 5 1372 1 1 13 ARG HA H -5.665 2.783 3.862 1.00 . A A . 13 ARG HA 1 1 5 1373 1 1 13 ARG HB2 H -6.945 2.110 1.888 1.00 . A A . 13 ARG HB2 1 1 5 1374 1 1 13 ARG HB3 H -5.470 2.069 0.932 1.00 . A A . 13 ARG HB3 1 1 5 1375 1 1 13 ARG HD2 H -7.483 -0.299 3.121 1.00 . A A . 13 ARG HD2 1 1 5 1376 1 1 13 ARG HD3 H -7.562 0.095 1.404 1.00 . A A . 13 ARG HD3 1 1 5 1377 1 1 13 ARG HE H -5.776 -2.071 1.971 1.00 . A A . 13 ARG HE 1 1 5 1378 1 1 13 ARG HG2 H -4.921 0.033 1.659 1.00 . A A . 13 ARG HG2 1 1 5 1379 1 1 13 ARG HG3 H -5.327 0.422 3.331 1.00 . A A . 13 ARG HG3 1 1 5 1380 1 1 13 ARG HH11 H -9.117 -1.222 1.426 1.00 . A A . 13 ARG HH11 1 1 5 1381 1 1 13 ARG HH12 H -9.560 -2.803 0.878 1.00 . A A . 13 ARG HH12 1 1 5 1382 1 1 13 ARG HH21 H -6.357 -4.153 1.250 1.00 . A A . 13 ARG HH21 1 1 5 1383 1 1 13 ARG HH22 H -7.994 -4.468 0.778 1.00 . A A . 13 ARG HH22 1 1 5 1384 1 1 13 ARG N N -5.488 4.281 2.455 1.00 . A A . 13 ARG N 1 1 5 1385 1 1 13 ARG NE N -6.691 -1.741 1.849 1.00 . A A . 13 ARG NE 1 1 5 1386 1 1 13 ARG NH1 N -8.867 -2.168 1.219 1.00 . A A . 13 ARG NH1 1 1 5 1387 1 1 13 ARG NH2 N -7.297 -3.837 1.119 1.00 . A A . 13 ARG NH2 1 1 5 1388 1 1 13 ARG O O -2.993 2.837 2.013 1.00 . A A . 13 ARG O 1 1 5 1389 1 1 14 ASP C C -1.405 0.791 3.377 1.00 . A A . 14 ASP C 1 1 5 1390 1 1 14 ASP CA C -1.890 1.847 4.366 1.00 . A A . 14 ASP CA 1 1 5 1391 1 1 14 ASP CB C -1.678 1.357 5.800 1.00 . A A . 14 ASP CB 1 1 5 1392 1 1 14 ASP CG C -2.701 0.317 6.215 1.00 . A A . 14 ASP CG 1 1 5 1393 1 1 14 ASP H H -3.937 2.019 4.868 1.00 . A A . 14 ASP H 1 1 5 1394 1 1 14 ASP HA H -1.320 2.752 4.216 1.00 . A A . 14 ASP HA 1 1 5 1395 1 1 14 ASP HB2 H -0.694 0.920 5.883 1.00 . A A . 14 ASP HB2 1 1 5 1396 1 1 14 ASP HB3 H -1.752 2.198 6.475 1.00 . A A . 14 ASP HB3 1 1 5 1397 1 1 14 ASP N N -3.296 2.161 4.141 1.00 . A A . 14 ASP N 1 1 5 1398 1 1 14 ASP O O -1.402 -0.403 3.676 1.00 . A A . 14 ASP O 1 1 5 1399 1 1 14 ASP OD1 O -2.291 -0.778 6.654 1.00 . A A . 14 ASP OD1 1 1 5 1400 1 1 14 ASP OD2 O -3.913 0.598 6.103 1.00 . A A . 14 ASP OD2 1 1 5 1401 1 1 15 SER C C 0.867 -0.197 1.496 1.00 . A A . 15 SER C 1 1 5 1402 1 1 15 SER CA C -0.513 0.353 1.151 1.00 . A A . 15 SER CA 1 1 5 1403 1 1 15 SER CB C -0.454 1.096 -0.183 1.00 . A A . 15 SER CB 1 1 5 1404 1 1 15 SER H H -1.031 2.208 2.024 1.00 . A A . 15 SER H 1 1 5 1405 1 1 15 SER HA H -1.207 -0.469 1.065 1.00 . A A . 15 SER HA 1 1 5 1406 1 1 15 SER HB2 H -0.926 2.061 -0.073 1.00 . A A . 15 SER HB2 1 1 5 1407 1 1 15 SER HB3 H 0.578 1.232 -0.473 1.00 . A A . 15 SER HB3 1 1 5 1408 1 1 15 SER HG H -2.028 0.199 -0.929 1.00 . A A . 15 SER HG 1 1 5 1409 1 1 15 SER N N -0.999 1.245 2.197 1.00 . A A . 15 SER N 1 1 5 1410 1 1 15 SER O O 1.514 0.267 2.430 1.00 . A A . 15 SER O 1 1 5 1411 1 1 15 SER OG O -1.123 0.372 -1.201 1.00 . A A . 15 SER OG 1 1 5 1412 1 1 16 LEU C C 3.600 -1.366 -0.143 1.00 . A A . 16 LEU C 1 1 5 1413 1 1 16 LEU CA C 2.620 -1.792 0.947 1.00 . A A . 16 LEU CA 1 1 5 1414 1 1 16 LEU CB C 2.499 -3.319 0.980 1.00 . A A . 16 LEU CB 1 1 5 1415 1 1 16 LEU CD1 C 2.640 -5.471 2.256 1.00 . A A . 16 LEU CD1 1 1 5 1416 1 1 16 LEU CD2 C 4.320 -3.664 2.667 1.00 . A A . 16 LEU CD2 1 1 5 1417 1 1 16 LEU CG C 2.874 -3.970 2.312 1.00 . A A . 16 LEU CG 1 1 5 1418 1 1 16 LEU H H 0.753 -1.509 -0.008 1.00 . A A . 16 LEU H 1 1 5 1419 1 1 16 LEU HA H 2.989 -1.447 1.902 1.00 . A A . 16 LEU HA 1 1 5 1420 1 1 16 LEU HB2 H 1.477 -3.582 0.750 1.00 . A A . 16 LEU HB2 1 1 5 1421 1 1 16 LEU HB3 H 3.140 -3.729 0.213 1.00 . A A . 16 LEU HB3 1 1 5 1422 1 1 16 LEU HD11 H 3.395 -5.930 1.635 1.00 . A A . 16 LEU HD11 1 1 5 1423 1 1 16 LEU HD12 H 1.663 -5.668 1.839 1.00 . A A . 16 LEU HD12 1 1 5 1424 1 1 16 LEU HD13 H 2.696 -5.882 3.253 1.00 . A A . 16 LEU HD13 1 1 5 1425 1 1 16 LEU HD21 H 4.534 -2.629 2.447 1.00 . A A . 16 LEU HD21 1 1 5 1426 1 1 16 LEU HD22 H 4.974 -4.298 2.087 1.00 . A A . 16 LEU HD22 1 1 5 1427 1 1 16 LEU HD23 H 4.480 -3.849 3.718 1.00 . A A . 16 LEU HD23 1 1 5 1428 1 1 16 LEU HG H 2.246 -3.565 3.091 1.00 . A A . 16 LEU HG 1 1 5 1429 1 1 16 LEU N N 1.313 -1.185 0.728 1.00 . A A . 16 LEU N 1 1 5 1430 1 1 16 LEU O O 3.328 -0.438 -0.905 1.00 . A A . 16 LEU O 1 1 5 1431 1 1 17 TYR C C 5.345 -2.278 -2.586 1.00 . A A . 17 TYR C 1 1 5 1432 1 1 17 TYR CA C 5.751 -1.736 -1.216 1.00 . A A . 17 TYR CA 1 1 5 1433 1 1 17 TYR CB C 7.108 -2.315 -0.806 1.00 . A A . 17 TYR CB 1 1 5 1434 1 1 17 TYR CD1 C 6.773 -4.794 -1.155 1.00 . A A . 17 TYR CD1 1 1 5 1435 1 1 17 TYR CD2 C 7.232 -4.018 1.052 1.00 . A A . 17 TYR CD2 1 1 5 1436 1 1 17 TYR CE1 C 6.707 -6.093 -0.688 1.00 . A A . 17 TYR CE1 1 1 5 1437 1 1 17 TYR CE2 C 7.167 -5.314 1.526 1.00 . A A . 17 TYR CE2 1 1 5 1438 1 1 17 TYR CG C 7.036 -3.735 -0.294 1.00 . A A . 17 TYR CG 1 1 5 1439 1 1 17 TYR CZ C 6.905 -6.348 0.652 1.00 . A A . 17 TYR CZ 1 1 5 1440 1 1 17 TYR H H 4.897 -2.779 0.419 1.00 . A A . 17 TYR H 1 1 5 1441 1 1 17 TYR HA H 5.832 -0.662 -1.275 1.00 . A A . 17 TYR HA 1 1 5 1442 1 1 17 TYR HB2 H 7.767 -2.305 -1.661 1.00 . A A . 17 TYR HB2 1 1 5 1443 1 1 17 TYR HB3 H 7.531 -1.700 -0.025 1.00 . A A . 17 TYR HB3 1 1 5 1444 1 1 17 TYR HD1 H 6.619 -4.591 -2.204 1.00 . A A . 17 TYR HD1 1 1 5 1445 1 1 17 TYR HD2 H 7.436 -3.206 1.735 1.00 . A A . 17 TYR HD2 1 1 5 1446 1 1 17 TYR HE1 H 6.501 -6.902 -1.373 1.00 . A A . 17 TYR HE1 1 1 5 1447 1 1 17 TYR HE2 H 7.322 -5.513 2.577 1.00 . A A . 17 TYR HE2 1 1 5 1448 1 1 17 TYR HH H 7.626 -8.119 0.845 1.00 . A A . 17 TYR HH 1 1 5 1449 1 1 17 TYR N N 4.737 -2.049 -0.214 1.00 . A A . 17 TYR N 1 1 5 1450 1 1 17 TYR O O 4.807 -3.380 -2.690 1.00 . A A . 17 TYR O 1 1 5 1451 1 1 17 TYR OH O 6.841 -7.640 1.120 1.00 . A A . 17 TYR OH 1 1 5 1452 1 1 18 PRO C C 5.869 -3.264 -5.401 1.00 . A A . 18 PRO C 1 1 5 1453 1 1 18 PRO CA C 5.249 -1.920 -5.025 1.00 . A A . 18 PRO CA 1 1 5 1454 1 1 18 PRO CB C 5.832 -0.804 -5.898 1.00 . A A . 18 PRO CB 1 1 5 1455 1 1 18 PRO CD C 6.230 -0.177 -3.630 1.00 . A A . 18 PRO CD 1 1 5 1456 1 1 18 PRO CG C 5.936 0.375 -4.996 1.00 . A A . 18 PRO CG 1 1 5 1457 1 1 18 PRO HA H 4.179 -1.965 -5.164 1.00 . A A . 18 PRO HA 1 1 5 1458 1 1 18 PRO HB2 H 6.802 -1.105 -6.269 1.00 . A A . 18 PRO HB2 1 1 5 1459 1 1 18 PRO HB3 H 5.169 -0.608 -6.728 1.00 . A A . 18 PRO HB3 1 1 5 1460 1 1 18 PRO HD2 H 7.296 -0.261 -3.478 1.00 . A A . 18 PRO HD2 1 1 5 1461 1 1 18 PRO HD3 H 5.786 0.446 -2.868 1.00 . A A . 18 PRO HD3 1 1 5 1462 1 1 18 PRO HG2 H 6.740 1.018 -5.322 1.00 . A A . 18 PRO HG2 1 1 5 1463 1 1 18 PRO HG3 H 5.001 0.915 -4.988 1.00 . A A . 18 PRO HG3 1 1 5 1464 1 1 18 PRO N N 5.595 -1.507 -3.660 1.00 . A A . 18 PRO N 1 1 5 1465 1 1 18 PRO O O 7.079 -3.360 -5.607 1.00 . A A . 18 PRO O 1 1 5 1466 1 1 19 PRO C C 5.958 -5.756 -7.315 1.00 . A A . 19 PRO C 1 1 5 1467 1 1 19 PRO CA C 5.532 -5.665 -5.853 1.00 . A A . 19 PRO CA 1 1 5 1468 1 1 19 PRO CB C 4.320 -6.561 -5.593 1.00 . A A . 19 PRO CB 1 1 5 1469 1 1 19 PRO CD C 3.590 -4.309 -5.270 1.00 . A A . 19 PRO CD 1 1 5 1470 1 1 19 PRO CG C 3.144 -5.661 -5.753 1.00 . A A . 19 PRO CG 1 1 5 1471 1 1 19 PRO HA H 6.352 -5.970 -5.220 1.00 . A A . 19 PRO HA 1 1 5 1472 1 1 19 PRO HB2 H 4.304 -7.367 -6.312 1.00 . A A . 19 PRO HB2 1 1 5 1473 1 1 19 PRO HB3 H 4.374 -6.964 -4.593 1.00 . A A . 19 PRO HB3 1 1 5 1474 1 1 19 PRO HD2 H 3.119 -3.528 -5.849 1.00 . A A . 19 PRO HD2 1 1 5 1475 1 1 19 PRO HD3 H 3.366 -4.190 -4.221 1.00 . A A . 19 PRO HD3 1 1 5 1476 1 1 19 PRO HG2 H 2.858 -5.613 -6.794 1.00 . A A . 19 PRO HG2 1 1 5 1477 1 1 19 PRO HG3 H 2.322 -6.021 -5.153 1.00 . A A . 19 PRO HG3 1 1 5 1478 1 1 19 PRO N N 5.048 -4.327 -5.498 1.00 . A A . 19 PRO N 1 1 5 1479 1 1 19 PRO O O 5.330 -5.165 -8.193 1.00 . A A . 19 PRO O 1 1 5 1480 1 1 20 ALA C C 6.964 -7.918 -9.578 1.00 . A A . 20 ALA C 1 1 5 1481 1 1 20 ALA CA C 7.542 -6.667 -8.923 1.00 . A A . 20 ALA CA 1 1 5 1482 1 1 20 ALA CB C 9.062 -6.729 -8.908 1.00 . A A . 20 ALA CB 1 1 5 1483 1 1 20 ALA H H 7.490 -6.945 -6.826 1.00 . A A . 20 ALA H 1 1 5 1484 1 1 20 ALA HA H 7.246 -5.802 -9.500 1.00 . A A . 20 ALA HA 1 1 5 1485 1 1 20 ALA HB1 H 9.453 -6.176 -9.749 1.00 . A A . 20 ALA HB1 1 1 5 1486 1 1 20 ALA HB2 H 9.381 -7.759 -8.974 1.00 . A A . 20 ALA HB2 1 1 5 1487 1 1 20 ALA HB3 H 9.430 -6.297 -7.990 1.00 . A A . 20 ALA HB3 1 1 5 1488 1 1 20 ALA N N 7.031 -6.499 -7.568 1.00 . A A . 20 ALA N 1 1 5 1489 1 1 20 ALA O O 7.695 -8.727 -10.149 1.00 . A A . 20 ALA O 1 1 5 1490 1 1 21 GLY C C 3.654 -9.524 -9.439 1.00 . A A . 21 GLY C 1 1 5 1491 1 1 21 GLY CA C 4.994 -9.223 -10.082 1.00 . A A . 21 GLY CA 1 1 5 1492 1 1 21 GLY H H 5.113 -7.392 -9.026 1.00 . A A . 21 GLY H 1 1 5 1493 1 1 21 GLY HA2 H 4.842 -9.038 -11.135 1.00 . A A . 21 GLY HA2 1 1 5 1494 1 1 21 GLY HA3 H 5.637 -10.084 -9.967 1.00 . A A . 21 GLY HA3 1 1 5 1495 1 1 21 GLY N N 5.646 -8.069 -9.493 1.00 . A A . 21 GLY N 1 1 6 1496 1 1 1 ASP C C -4.174 -1.517 -3.443 1.00 . A A . 1 ASP C 1 1 6 1497 1 1 1 ASP CA C -2.959 -1.447 -4.363 1.00 . A A . 1 ASP CA 1 1 6 1498 1 1 1 ASP CB C -2.251 -2.803 -4.395 1.00 . A A . 1 ASP CB 1 1 6 1499 1 1 1 ASP CG C -3.080 -3.872 -5.079 1.00 . A A . 1 ASP CG 1 1 6 1500 1 1 1 ASP H1 H -2.101 -0.204 -2.972 1.00 . A A . 1 ASP H1 1 1 6 1501 1 1 1 ASP HA H -3.292 -1.201 -5.360 1.00 . A A . 1 ASP HA 1 1 6 1502 1 1 1 ASP HB2 H -1.318 -2.702 -4.929 1.00 . A A . 1 ASP HB2 1 1 6 1503 1 1 1 ASP HB3 H -2.049 -3.121 -3.383 1.00 . A A . 1 ASP HB3 1 1 6 1504 1 1 1 ASP N N -2.036 -0.404 -3.929 1.00 . A A . 1 ASP N 1 1 6 1505 1 1 1 ASP O O -5.291 -1.195 -3.849 1.00 . A A . 1 ASP O 1 1 6 1506 1 1 1 ASP OD1 O -2.805 -5.070 -4.858 1.00 . A A . 1 ASP OD1 1 1 6 1507 1 1 1 ASP OD2 O -4.007 -3.511 -5.836 1.00 . A A . 1 ASP OD2 1 1 6 1508 1 1 2 GLY C C -4.555 -2.433 0.138 1.00 . A A . 2 GLY C 1 1 6 1509 1 1 2 GLY CA C -5.036 -2.043 -1.246 1.00 . A A . 2 GLY CA 1 1 6 1510 1 1 2 GLY H H -3.038 -2.182 -1.935 1.00 . A A . 2 GLY H 1 1 6 1511 1 1 2 GLY HA2 H -5.539 -1.089 -1.185 1.00 . A A . 2 GLY HA2 1 1 6 1512 1 1 2 GLY HA3 H -5.738 -2.786 -1.594 1.00 . A A . 2 GLY HA3 1 1 6 1513 1 1 2 GLY N N -3.949 -1.939 -2.203 1.00 . A A . 2 GLY N 1 1 6 1514 1 1 2 GLY O O -4.176 -1.575 0.935 1.00 . A A . 2 GLY O 1 1 6 1515 1 1 3 MET C C -2.712 -3.780 2.034 1.00 . A A . 3 MET C 1 1 6 1516 1 1 3 MET CA C -4.134 -4.235 1.723 1.00 . A A . 3 MET CA 1 1 6 1517 1 1 3 MET CB C -4.212 -5.763 1.755 1.00 . A A . 3 MET CB 1 1 6 1518 1 1 3 MET CE C -6.192 -7.582 4.861 1.00 . A A . 3 MET CE 1 1 6 1519 1 1 3 MET CG C -4.401 -6.334 3.151 1.00 . A A . 3 MET CG 1 1 6 1520 1 1 3 MET H H -4.885 -4.367 -0.253 1.00 . A A . 3 MET H 1 1 6 1521 1 1 3 MET HA H -4.799 -3.835 2.474 1.00 . A A . 3 MET HA 1 1 6 1522 1 1 3 MET HB2 H -5.042 -6.083 1.142 1.00 . A A . 3 MET HB2 1 1 6 1523 1 1 3 MET HB3 H -3.297 -6.167 1.345 1.00 . A A . 3 MET HB3 1 1 6 1524 1 1 3 MET HE1 H -7.143 -7.071 4.850 1.00 . A A . 3 MET HE1 1 1 6 1525 1 1 3 MET HE2 H -5.491 -7.026 5.466 1.00 . A A . 3 MET HE2 1 1 6 1526 1 1 3 MET HE3 H -6.319 -8.571 5.275 1.00 . A A . 3 MET HE3 1 1 6 1527 1 1 3 MET HG2 H -3.446 -6.680 3.517 1.00 . A A . 3 MET HG2 1 1 6 1528 1 1 3 MET HG3 H -4.771 -5.552 3.798 1.00 . A A . 3 MET HG3 1 1 6 1529 1 1 3 MET N N -4.572 -3.732 0.425 1.00 . A A . 3 MET N 1 1 6 1530 1 1 3 MET O O -2.039 -3.191 1.188 1.00 . A A . 3 MET O 1 1 6 1531 1 1 3 MET SD S -5.565 -7.711 3.188 1.00 . A A . 3 MET SD 1 1 6 1532 1 1 4 GLY C C -0.929 -2.572 4.708 1.00 . A A . 4 GLY C 1 1 6 1533 1 1 4 GLY CA C -0.922 -3.662 3.655 1.00 . A A . 4 GLY CA 1 1 6 1534 1 1 4 GLY H H -2.842 -4.524 3.888 1.00 . A A . 4 GLY H 1 1 6 1535 1 1 4 GLY HA2 H -0.409 -4.526 4.050 1.00 . A A . 4 GLY HA2 1 1 6 1536 1 1 4 GLY HA3 H -0.388 -3.304 2.787 1.00 . A A . 4 GLY HA3 1 1 6 1537 1 1 4 GLY N N -2.261 -4.054 3.254 1.00 . A A . 4 GLY N 1 1 6 1538 1 1 4 GLY O O -1.991 -2.099 5.112 1.00 . A A . 4 GLY O 1 1 6 1539 1 1 5 GLU C C 1.715 -0.390 6.020 1.00 . A A . 5 GLU C 1 1 6 1540 1 1 5 GLU CA C 0.383 -1.125 6.160 1.00 . A A . 5 GLU CA 1 1 6 1541 1 1 5 GLU CB C 0.251 -1.721 7.564 1.00 . A A . 5 GLU CB 1 1 6 1542 1 1 5 GLU CD C -1.480 -2.839 9.027 1.00 . A A . 5 GLU CD 1 1 6 1543 1 1 5 GLU CG C -1.164 -1.667 8.118 1.00 . A A . 5 GLU CG 1 1 6 1544 1 1 5 GLU H H 1.069 -2.583 4.788 1.00 . A A . 5 GLU H 1 1 6 1545 1 1 5 GLU HA H -0.420 -0.417 6.001 1.00 . A A . 5 GLU HA 1 1 6 1546 1 1 5 GLU HB2 H 0.563 -2.754 7.535 1.00 . A A . 5 GLU HB2 1 1 6 1547 1 1 5 GLU HB3 H 0.897 -1.178 8.237 1.00 . A A . 5 GLU HB3 1 1 6 1548 1 1 5 GLU HG2 H -1.283 -0.753 8.681 1.00 . A A . 5 GLU HG2 1 1 6 1549 1 1 5 GLU HG3 H -1.861 -1.673 7.292 1.00 . A A . 5 GLU HG3 1 1 6 1550 1 1 5 GLU N N 0.258 -2.170 5.151 1.00 . A A . 5 GLU N 1 1 6 1551 1 1 5 GLU O O 2.482 -0.283 6.977 1.00 . A A . 5 GLU O 1 1 6 1552 1 1 5 GLU OE1 O -1.768 -2.604 10.219 1.00 . A A . 5 GLU OE1 1 1 6 1553 1 1 5 GLU OE2 O -1.440 -3.991 8.546 1.00 . A A . 5 GLU OE2 1 1 6 1554 1 1 6 GLU C C 2.923 2.314 4.248 1.00 . A A . 6 GLU C 1 1 6 1555 1 1 6 GLU CA C 3.216 0.849 4.556 1.00 . A A . 6 GLU CA 1 1 6 1556 1 1 6 GLU CB C 3.980 0.208 3.395 1.00 . A A . 6 GLU CB 1 1 6 1557 1 1 6 GLU CD C 5.675 -1.187 4.648 1.00 . A A . 6 GLU CD 1 1 6 1558 1 1 6 GLU CG C 5.452 -0.030 3.693 1.00 . A A . 6 GLU CG 1 1 6 1559 1 1 6 GLU H H 1.329 0.005 4.098 1.00 . A A . 6 GLU H 1 1 6 1560 1 1 6 GLU HA H 3.825 0.798 5.447 1.00 . A A . 6 GLU HA 1 1 6 1561 1 1 6 GLU HB2 H 3.525 -0.743 3.162 1.00 . A A . 6 GLU HB2 1 1 6 1562 1 1 6 GLU HB3 H 3.909 0.852 2.531 1.00 . A A . 6 GLU HB3 1 1 6 1563 1 1 6 GLU HG2 H 5.964 -0.244 2.767 1.00 . A A . 6 GLU HG2 1 1 6 1564 1 1 6 GLU HG3 H 5.866 0.866 4.133 1.00 . A A . 6 GLU HG3 1 1 6 1565 1 1 6 GLU N N 1.980 0.120 4.821 1.00 . A A . 6 GLU N 1 1 6 1566 1 1 6 GLU O O 3.425 3.211 4.926 1.00 . A A . 6 GLU O 1 1 6 1567 1 1 6 GLU OE1 O 5.367 -2.337 4.270 1.00 . A A . 6 GLU OE1 1 1 6 1568 1 1 6 GLU OE2 O 6.159 -0.943 5.774 1.00 . A A . 6 GLU OE2 1 1 6 1569 1 1 7 PHE C C 0.647 3.943 1.797 1.00 . A A . 7 PHE C 1 1 6 1570 1 1 7 PHE CA C 1.752 3.919 2.846 1.00 . A A . 7 PHE CA 1 1 6 1571 1 1 7 PHE CB C 2.984 4.662 2.327 1.00 . A A . 7 PHE CB 1 1 6 1572 1 1 7 PHE CD1 C 4.847 3.092 1.728 1.00 . A A . 7 PHE CD1 1 1 6 1573 1 1 7 PHE CD2 C 3.457 3.922 -0.023 1.00 . A A . 7 PHE CD2 1 1 6 1574 1 1 7 PHE CE1 C 5.579 2.366 0.807 1.00 . A A . 7 PHE CE1 1 1 6 1575 1 1 7 PHE CE2 C 4.186 3.199 -0.949 1.00 . A A . 7 PHE CE2 1 1 6 1576 1 1 7 PHE CG C 3.779 3.876 1.323 1.00 . A A . 7 PHE CG 1 1 6 1577 1 1 7 PHE CZ C 5.248 2.420 -0.533 1.00 . A A . 7 PHE CZ 1 1 6 1578 1 1 7 PHE H H 1.730 1.803 2.721 1.00 . A A . 7 PHE H 1 1 6 1579 1 1 7 PHE HA H 1.390 4.417 3.730 1.00 . A A . 7 PHE HA 1 1 6 1580 1 1 7 PHE HB2 H 2.669 5.581 1.855 1.00 . A A . 7 PHE HB2 1 1 6 1581 1 1 7 PHE HB3 H 3.633 4.894 3.159 1.00 . A A . 7 PHE HB3 1 1 6 1582 1 1 7 PHE HD1 H 5.106 3.049 2.776 1.00 . A A . 7 PHE HD1 1 1 6 1583 1 1 7 PHE HD2 H 2.626 4.530 -0.349 1.00 . A A . 7 PHE HD2 1 1 6 1584 1 1 7 PHE HE1 H 6.410 1.759 1.135 1.00 . A A . 7 PHE HE1 1 1 6 1585 1 1 7 PHE HE2 H 3.925 3.243 -1.996 1.00 . A A . 7 PHE HE2 1 1 6 1586 1 1 7 PHE HZ H 5.819 1.854 -1.254 1.00 . A A . 7 PHE HZ 1 1 6 1587 1 1 7 PHE N N 2.105 2.555 3.226 1.00 . A A . 7 PHE N 1 1 6 1588 1 1 7 PHE O O 0.418 2.961 1.091 1.00 . A A . 7 PHE O 1 1 6 1589 1 1 8 ILE C C -0.688 4.968 -0.662 1.00 . A A . 8 ILE C 1 1 6 1590 1 1 8 ILE CA C -1.138 5.249 0.766 1.00 . A A . 8 ILE CA 1 1 6 1591 1 1 8 ILE CB C -1.734 6.674 0.826 1.00 . A A . 8 ILE CB 1 1 6 1592 1 1 8 ILE CD1 C -2.397 6.166 3.239 1.00 . A A . 8 ILE CD1 1 1 6 1593 1 1 8 ILE CG1 C -1.821 7.178 2.271 1.00 . A A . 8 ILE CG1 1 1 6 1594 1 1 8 ILE CG2 C -3.109 6.697 0.175 1.00 . A A . 8 ILE CG2 1 1 6 1595 1 1 8 ILE H H 0.191 5.817 2.312 1.00 . A A . 8 ILE H 1 1 6 1596 1 1 8 ILE HA H -1.916 4.548 1.030 1.00 . A A . 8 ILE HA 1 1 6 1597 1 1 8 ILE HB H -1.089 7.331 0.262 1.00 . A A . 8 ILE HB 1 1 6 1598 1 1 8 ILE HD11 H -3.182 6.629 3.819 1.00 . A A . 8 ILE HD11 1 1 6 1599 1 1 8 ILE HD12 H -1.618 5.818 3.902 1.00 . A A . 8 ILE HD12 1 1 6 1600 1 1 8 ILE HD13 H -2.802 5.331 2.688 1.00 . A A . 8 ILE HD13 1 1 6 1601 1 1 8 ILE HG12 H -0.831 7.437 2.615 1.00 . A A . 8 ILE HG12 1 1 6 1602 1 1 8 ILE HG13 H -2.447 8.058 2.300 1.00 . A A . 8 ILE HG13 1 1 6 1603 1 1 8 ILE HG21 H -3.624 5.771 0.387 1.00 . A A . 8 ILE HG21 1 1 6 1604 1 1 8 ILE HG22 H -3.000 6.812 -0.893 1.00 . A A . 8 ILE HG22 1 1 6 1605 1 1 8 ILE HG23 H -3.680 7.525 0.569 1.00 . A A . 8 ILE HG23 1 1 6 1606 1 1 8 ILE N N -0.042 5.078 1.714 1.00 . A A . 8 ILE N 1 1 6 1607 1 1 8 ILE O O 0.177 5.658 -1.200 1.00 . A A . 8 ILE O 1 1 6 1608 1 1 9 GLU C C -1.846 4.311 -3.641 1.00 . A A . 9 GLU C 1 1 6 1609 1 1 9 GLU CA C -0.954 3.578 -2.641 1.00 . A A . 9 GLU CA 1 1 6 1610 1 1 9 GLU CB C -1.093 2.066 -2.818 1.00 . A A . 9 GLU CB 1 1 6 1611 1 1 9 GLU CD C -1.605 0.538 -4.762 1.00 . A A . 9 GLU CD 1 1 6 1612 1 1 9 GLU CG C -0.649 1.561 -4.179 1.00 . A A . 9 GLU CG 1 1 6 1613 1 1 9 GLU H H -1.970 3.440 -0.790 1.00 . A A . 9 GLU H 1 1 6 1614 1 1 9 GLU HA H 0.072 3.859 -2.821 1.00 . A A . 9 GLU HA 1 1 6 1615 1 1 9 GLU HB2 H -0.493 1.576 -2.070 1.00 . A A . 9 GLU HB2 1 1 6 1616 1 1 9 GLU HB3 H -2.128 1.791 -2.675 1.00 . A A . 9 GLU HB3 1 1 6 1617 1 1 9 GLU HG2 H -0.584 2.398 -4.855 1.00 . A A . 9 GLU HG2 1 1 6 1618 1 1 9 GLU HG3 H 0.324 1.105 -4.076 1.00 . A A . 9 GLU HG3 1 1 6 1619 1 1 9 GLU N N -1.286 3.951 -1.272 1.00 . A A . 9 GLU N 1 1 6 1620 1 1 9 GLU O O -1.543 4.365 -4.833 1.00 . A A . 9 GLU O 1 1 6 1621 1 1 9 GLU OE1 O -1.948 0.596 -5.943 1.00 . A A . 9 GLU OE1 1 1 6 1622 1 1 10 GLY C C -5.273 5.634 -3.478 1.00 . A A . 10 GLY C 1 1 6 1623 1 1 10 GLY CA C -3.856 5.598 -4.017 1.00 . A A . 10 GLY CA 1 1 6 1624 1 1 10 GLY H H -3.136 4.807 -2.192 1.00 . A A . 10 GLY H 1 1 6 1625 1 1 10 GLY HA2 H -3.500 6.612 -4.130 1.00 . A A . 10 GLY HA2 1 1 6 1626 1 1 10 GLY HA3 H -3.864 5.122 -4.987 1.00 . A A . 10 GLY HA3 1 1 6 1627 1 1 10 GLY N N -2.944 4.877 -3.150 1.00 . A A . 10 GLY N 1 1 6 1628 1 1 10 GLY O O -6.074 6.478 -3.881 1.00 . A A . 10 GLY O 1 1 6 1629 1 1 11 LEU C C -6.982 5.397 -0.653 1.00 . A A . 11 LEU C 1 1 6 1630 1 1 11 LEU CA C -6.925 4.652 -1.985 1.00 . A A . 11 LEU CA 1 1 6 1631 1 1 11 LEU CB C -7.356 3.195 -1.792 1.00 . A A . 11 LEU CB 1 1 6 1632 1 1 11 LEU CD1 C -7.322 0.809 -2.558 1.00 . A A . 11 LEU CD1 1 1 6 1633 1 1 11 LEU CD2 C -7.414 2.658 -4.239 1.00 . A A . 11 LEU CD2 1 1 6 1634 1 1 11 LEU CG C -6.883 2.229 -2.879 1.00 . A A . 11 LEU CG 1 1 6 1635 1 1 11 LEU H H -4.912 4.065 -2.287 1.00 . A A . 11 LEU H 1 1 6 1636 1 1 11 LEU HA H -7.607 5.128 -2.674 1.00 . A A . 11 LEU HA 1 1 6 1637 1 1 11 LEU HB2 H -6.975 2.850 -0.843 1.00 . A A . 11 LEU HB2 1 1 6 1638 1 1 11 LEU HB3 H -8.435 3.163 -1.760 1.00 . A A . 11 LEU HB3 1 1 6 1639 1 1 11 LEU HD11 H -6.726 0.424 -1.743 1.00 . A A . 11 LEU HD11 1 1 6 1640 1 1 11 LEU HD12 H -7.187 0.185 -3.429 1.00 . A A . 11 LEU HD12 1 1 6 1641 1 1 11 LEU HD13 H -8.363 0.810 -2.273 1.00 . A A . 11 LEU HD13 1 1 6 1642 1 1 11 LEU HD21 H -6.659 2.481 -4.992 1.00 . A A . 11 LEU HD21 1 1 6 1643 1 1 11 LEU HD22 H -7.658 3.710 -4.215 1.00 . A A . 11 LEU HD22 1 1 6 1644 1 1 11 LEU HD23 H -8.300 2.088 -4.476 1.00 . A A . 11 LEU HD23 1 1 6 1645 1 1 11 LEU HG H -5.804 2.244 -2.920 1.00 . A A . 11 LEU HG 1 1 6 1646 1 1 11 LEU N N -5.589 4.716 -2.569 1.00 . A A . 11 LEU N 1 1 6 1647 1 1 11 LEU O O -7.572 6.473 -0.562 1.00 . A A . 11 LEU O 1 1 6 1648 1 1 12 VAL C C -5.574 4.569 2.696 1.00 . A A . 12 VAL C 1 1 6 1649 1 1 12 VAL CA C -6.352 5.430 1.706 1.00 . A A . 12 VAL CA 1 1 6 1650 1 1 12 VAL CB C -7.778 5.654 2.258 1.00 . A A . 12 VAL CB 1 1 6 1651 1 1 12 VAL CG1 C -8.251 7.071 1.970 1.00 . A A . 12 VAL CG1 1 1 6 1652 1 1 12 VAL CG2 C -8.752 4.632 1.684 1.00 . A A . 12 VAL CG2 1 1 6 1653 1 1 12 VAL H H -5.913 3.962 0.243 1.00 . A A . 12 VAL H 1 1 6 1654 1 1 12 VAL HA H -5.866 6.392 1.623 1.00 . A A . 12 VAL HA 1 1 6 1655 1 1 12 VAL HB H -7.749 5.524 3.330 1.00 . A A . 12 VAL HB 1 1 6 1656 1 1 12 VAL HG11 H -8.923 7.062 1.125 1.00 . A A . 12 VAL HG11 1 1 6 1657 1 1 12 VAL HG12 H -7.399 7.696 1.747 1.00 . A A . 12 VAL HG12 1 1 6 1658 1 1 12 VAL HG13 H -8.766 7.460 2.836 1.00 . A A . 12 VAL HG13 1 1 6 1659 1 1 12 VAL HG21 H -8.278 3.662 1.653 1.00 . A A . 12 VAL HG21 1 1 6 1660 1 1 12 VAL HG22 H -9.035 4.926 0.685 1.00 . A A . 12 VAL HG22 1 1 6 1661 1 1 12 VAL HG23 H -9.632 4.584 2.308 1.00 . A A . 12 VAL HG23 1 1 6 1662 1 1 12 VAL N N -6.368 4.819 0.378 1.00 . A A . 12 VAL N 1 1 6 1663 1 1 12 VAL O O -4.864 5.086 3.558 1.00 . A A . 12 VAL O 1 1 6 1664 1 1 13 ARG C C -3.545 2.237 3.114 1.00 . A A . 13 ARG C 1 1 6 1665 1 1 13 ARG CA C -5.029 2.322 3.455 1.00 . A A . 13 ARG CA 1 1 6 1666 1 1 13 ARG CB C -5.665 0.934 3.358 1.00 . A A . 13 ARG CB 1 1 6 1667 1 1 13 ARG CD C -5.045 -1.210 4.530 1.00 . A A . 13 ARG CD 1 1 6 1668 1 1 13 ARG CG C -5.669 0.171 4.674 1.00 . A A . 13 ARG CG 1 1 6 1669 1 1 13 ARG CZ C -6.924 -2.722 4.024 1.00 . A A . 13 ARG CZ 1 1 6 1670 1 1 13 ARG H H -6.299 2.902 1.865 1.00 . A A . 13 ARG H 1 1 6 1671 1 1 13 ARG HA H -5.133 2.685 4.466 1.00 . A A . 13 ARG HA 1 1 6 1672 1 1 13 ARG HB2 H -6.688 1.043 3.027 1.00 . A A . 13 ARG HB2 1 1 6 1673 1 1 13 ARG HB3 H -5.121 0.352 2.629 1.00 . A A . 13 ARG HB3 1 1 6 1674 1 1 13 ARG HD2 H -4.714 -1.339 3.510 1.00 . A A . 13 ARG HD2 1 1 6 1675 1 1 13 ARG HD3 H -4.196 -1.277 5.194 1.00 . A A . 13 ARG HD3 1 1 6 1676 1 1 13 ARG HE H -5.924 -2.678 5.750 1.00 . A A . 13 ARG HE 1 1 6 1677 1 1 13 ARG HG2 H -5.107 0.733 5.405 1.00 . A A . 13 ARG HG2 1 1 6 1678 1 1 13 ARG HG3 H -6.690 0.061 5.010 1.00 . A A . 13 ARG HG3 1 1 6 1679 1 1 13 ARG HH11 H -6.435 -1.463 2.519 1.00 . A A . 13 ARG HH11 1 1 6 1680 1 1 13 ARG HH12 H -7.749 -2.540 2.187 1.00 . A A . 13 ARG HH12 1 1 6 1681 1 1 13 ARG HH21 H -7.652 -4.096 5.316 1.00 . A A . 13 ARG HH21 1 1 6 1682 1 1 13 ARG HH22 H -8.441 -4.034 3.775 1.00 . A A . 13 ARG HH22 1 1 6 1683 1 1 13 ARG N N -5.716 3.254 2.569 1.00 . A A . 13 ARG N 1 1 6 1684 1 1 13 ARG NE N -5.990 -2.275 4.860 1.00 . A A . 13 ARG NE 1 1 6 1685 1 1 13 ARG NH1 N -7.046 -2.198 2.810 1.00 . A A . 13 ARG NH1 1 1 6 1686 1 1 13 ARG NH2 N -7.739 -3.697 4.402 1.00 . A A . 13 ARG NH2 1 1 6 1687 1 1 13 ARG O O -3.176 2.097 1.949 1.00 . A A . 13 ARG O 1 1 6 1688 1 1 14 ASP C C -0.861 0.943 3.272 1.00 . A A . 14 ASP C 1 1 6 1689 1 1 14 ASP CA C -1.256 2.252 3.948 1.00 . A A . 14 ASP CA 1 1 6 1690 1 1 14 ASP CB C -0.536 2.384 5.292 1.00 . A A . 14 ASP CB 1 1 6 1691 1 1 14 ASP CG C -0.684 3.767 5.895 1.00 . A A . 14 ASP CG 1 1 6 1692 1 1 14 ASP H H -3.054 2.434 5.044 1.00 . A A . 14 ASP H 1 1 6 1693 1 1 14 ASP HA H -0.968 3.074 3.314 1.00 . A A . 14 ASP HA 1 1 6 1694 1 1 14 ASP HB2 H -0.946 1.664 5.985 1.00 . A A . 14 ASP HB2 1 1 6 1695 1 1 14 ASP HB3 H 0.516 2.182 5.150 1.00 . A A . 14 ASP HB3 1 1 6 1696 1 1 14 ASP N N -2.699 2.322 4.139 1.00 . A A . 14 ASP N 1 1 6 1697 1 1 14 ASP O O -0.502 -0.024 3.932 1.00 . A A . 14 ASP O 1 1 6 1698 1 1 14 ASP OD1 O -1.706 4.015 6.568 1.00 . A A . 14 ASP OD1 1 1 6 1699 1 1 14 ASP OD2 O 0.224 4.601 5.696 1.00 . A A . 14 ASP OD2 1 1 6 1700 1 1 15 SER C C 0.793 -0.794 1.560 1.00 . A A . 15 SER C 1 1 6 1701 1 1 15 SER CA C -0.588 -0.270 1.181 1.00 . A A . 15 SER CA 1 1 6 1702 1 1 15 SER CB C -0.627 0.047 -0.310 1.00 . A A . 15 SER CB 1 1 6 1703 1 1 15 SER H H -1.229 1.721 1.477 1.00 . A A . 15 SER H 1 1 6 1704 1 1 15 SER HA H -1.323 -1.029 1.397 1.00 . A A . 15 SER HA 1 1 6 1705 1 1 15 SER HB2 H -1.389 0.788 -0.497 1.00 . A A . 15 SER HB2 1 1 6 1706 1 1 15 SER HB3 H 0.335 0.434 -0.617 1.00 . A A . 15 SER HB3 1 1 6 1707 1 1 15 SER HG H -0.228 -1.247 -1.727 1.00 . A A . 15 SER HG 1 1 6 1708 1 1 15 SER N N -0.933 0.920 1.949 1.00 . A A . 15 SER N 1 1 6 1709 1 1 15 SER O O 1.534 -0.142 2.293 1.00 . A A . 15 SER O 1 1 6 1710 1 1 15 SER OG O -0.919 -1.111 -1.073 1.00 . A A . 15 SER OG 1 1 6 1711 1 1 16 LEU C C 3.494 -2.049 0.389 1.00 . A A . 16 LEU C 1 1 6 1712 1 1 16 LEU CA C 2.424 -2.588 1.334 1.00 . A A . 16 LEU CA 1 1 6 1713 1 1 16 LEU CB C 2.331 -4.110 1.205 1.00 . A A . 16 LEU CB 1 1 6 1714 1 1 16 LEU CD1 C 1.093 -6.042 2.220 1.00 . A A . 16 LEU CD1 1 1 6 1715 1 1 16 LEU CD2 C 3.271 -5.299 3.202 1.00 . A A . 16 LEU CD2 1 1 6 1716 1 1 16 LEU CG C 1.997 -4.851 2.501 1.00 . A A . 16 LEU CG 1 1 6 1717 1 1 16 LEU H H 0.496 -2.445 0.472 1.00 . A A . 16 LEU H 1 1 6 1718 1 1 16 LEU HA H 2.696 -2.337 2.348 1.00 . A A . 16 LEU HA 1 1 6 1719 1 1 16 LEU HB2 H 1.570 -4.342 0.474 1.00 . A A . 16 LEU HB2 1 1 6 1720 1 1 16 LEU HB3 H 3.279 -4.479 0.841 1.00 . A A . 16 LEU HB3 1 1 6 1721 1 1 16 LEU HD11 H 0.696 -6.421 3.150 1.00 . A A . 16 LEU HD11 1 1 6 1722 1 1 16 LEU HD12 H 1.663 -6.818 1.729 1.00 . A A . 16 LEU HD12 1 1 6 1723 1 1 16 LEU HD13 H 0.280 -5.734 1.580 1.00 . A A . 16 LEU HD13 1 1 6 1724 1 1 16 LEU HD21 H 4.019 -4.525 3.119 1.00 . A A . 16 LEU HD21 1 1 6 1725 1 1 16 LEU HD22 H 3.636 -6.205 2.740 1.00 . A A . 16 LEU HD22 1 1 6 1726 1 1 16 LEU HD23 H 3.061 -5.487 4.245 1.00 . A A . 16 LEU HD23 1 1 6 1727 1 1 16 LEU HG H 1.468 -4.182 3.164 1.00 . A A . 16 LEU HG 1 1 6 1728 1 1 16 LEU N N 1.131 -1.975 1.052 1.00 . A A . 16 LEU N 1 1 6 1729 1 1 16 LEU O O 4.609 -1.738 0.809 1.00 . A A . 16 LEU O 1 1 6 1730 1 1 17 TYR C C 3.397 -1.354 -3.265 1.00 . A A . 17 TYR C 1 1 6 1731 1 1 17 TYR CA C 4.076 -1.439 -1.896 1.00 . A A . 17 TYR CA 1 1 6 1732 1 1 17 TYR CB C 5.318 -2.336 -1.982 1.00 . A A . 17 TYR CB 1 1 6 1733 1 1 17 TYR CD1 C 4.162 -4.582 -2.098 1.00 . A A . 17 TYR CD1 1 1 6 1734 1 1 17 TYR CD2 C 5.823 -4.257 -0.419 1.00 . A A . 17 TYR CD2 1 1 6 1735 1 1 17 TYR CE1 C 3.957 -5.873 -1.651 1.00 . A A . 17 TYR CE1 1 1 6 1736 1 1 17 TYR CE2 C 5.624 -5.548 0.033 1.00 . A A . 17 TYR CE2 1 1 6 1737 1 1 17 TYR CG C 5.096 -3.752 -1.491 1.00 . A A . 17 TYR CG 1 1 6 1738 1 1 17 TYR CZ C 4.690 -6.352 -0.586 1.00 . A A . 17 TYR CZ 1 1 6 1739 1 1 17 TYR H H 2.243 -2.204 -1.162 1.00 . A A . 17 TYR H 1 1 6 1740 1 1 17 TYR HA H 4.381 -0.449 -1.595 1.00 . A A . 17 TYR HA 1 1 6 1741 1 1 17 TYR HB2 H 5.640 -2.393 -3.011 1.00 . A A . 17 TYR HB2 1 1 6 1742 1 1 17 TYR HB3 H 6.108 -1.899 -1.389 1.00 . A A . 17 TYR HB3 1 1 6 1743 1 1 17 TYR HD1 H 3.589 -4.205 -2.932 1.00 . A A . 17 TYR HD1 1 1 6 1744 1 1 17 TYR HD2 H 6.553 -3.625 0.064 1.00 . A A . 17 TYR HD2 1 1 6 1745 1 1 17 TYR HE1 H 3.226 -6.503 -2.137 1.00 . A A . 17 TYR HE1 1 1 6 1746 1 1 17 TYR HE2 H 6.199 -5.922 0.867 1.00 . A A . 17 TYR HE2 1 1 6 1747 1 1 17 TYR HH H 3.549 -7.799 -0.039 1.00 . A A . 17 TYR HH 1 1 6 1748 1 1 17 TYR N N 3.147 -1.941 -0.889 1.00 . A A . 17 TYR N 1 1 6 1749 1 1 17 TYR O O 2.759 -2.309 -3.706 1.00 . A A . 17 TYR O 1 1 6 1750 1 1 17 TYR OH O 4.490 -7.637 -0.139 1.00 . A A . 17 TYR OH 1 1 6 1751 1 1 18 PRO C C 3.375 -1.062 -6.295 1.00 . A A . 18 PRO C 1 1 6 1752 1 1 18 PRO CA C 2.912 -0.018 -5.279 1.00 . A A . 18 PRO CA 1 1 6 1753 1 1 18 PRO CB C 3.371 1.381 -5.704 1.00 . A A . 18 PRO CB 1 1 6 1754 1 1 18 PRO CD C 4.262 0.989 -3.518 1.00 . A A . 18 PRO CD 1 1 6 1755 1 1 18 PRO CG C 3.760 2.065 -4.439 1.00 . A A . 18 PRO CG 1 1 6 1756 1 1 18 PRO HA H 1.834 -0.040 -5.217 1.00 . A A . 18 PRO HA 1 1 6 1757 1 1 18 PRO HB2 H 4.207 1.298 -6.383 1.00 . A A . 18 PRO HB2 1 1 6 1758 1 1 18 PRO HB3 H 2.556 1.895 -6.192 1.00 . A A . 18 PRO HB3 1 1 6 1759 1 1 18 PRO HD2 H 5.326 0.852 -3.640 1.00 . A A . 18 PRO HD2 1 1 6 1760 1 1 18 PRO HD3 H 4.026 1.231 -2.492 1.00 . A A . 18 PRO HD3 1 1 6 1761 1 1 18 PRO HG2 H 4.543 2.783 -4.636 1.00 . A A . 18 PRO HG2 1 1 6 1762 1 1 18 PRO HG3 H 2.900 2.555 -4.007 1.00 . A A . 18 PRO HG3 1 1 6 1763 1 1 18 PRO N N 3.523 -0.207 -3.959 1.00 . A A . 18 PRO N 1 1 6 1764 1 1 18 PRO O O 2.557 -1.650 -7.003 1.00 . A A . 18 PRO O 1 1 6 1765 1 1 19 PRO C C 5.171 -3.713 -6.795 1.00 . A A . 19 PRO C 1 1 6 1766 1 1 19 PRO CA C 5.249 -2.285 -7.326 1.00 . A A . 19 PRO CA 1 1 6 1767 1 1 19 PRO CB C 6.702 -1.839 -7.457 1.00 . A A . 19 PRO CB 1 1 6 1768 1 1 19 PRO CD C 5.756 -0.658 -5.588 1.00 . A A . 19 PRO CD 1 1 6 1769 1 1 19 PRO CG C 7.034 -1.254 -6.127 1.00 . A A . 19 PRO CG 1 1 6 1770 1 1 19 PRO HA H 4.762 -2.230 -8.289 1.00 . A A . 19 PRO HA 1 1 6 1771 1 1 19 PRO HB2 H 7.325 -2.692 -7.684 1.00 . A A . 19 PRO HB2 1 1 6 1772 1 1 19 PRO HB3 H 6.787 -1.104 -8.243 1.00 . A A . 19 PRO HB3 1 1 6 1773 1 1 19 PRO HD2 H 5.646 -0.894 -4.541 1.00 . A A . 19 PRO HD2 1 1 6 1774 1 1 19 PRO HD3 H 5.750 0.410 -5.737 1.00 . A A . 19 PRO HD3 1 1 6 1775 1 1 19 PRO HG2 H 7.391 -2.030 -5.466 1.00 . A A . 19 PRO HG2 1 1 6 1776 1 1 19 PRO HG3 H 7.784 -0.486 -6.243 1.00 . A A . 19 PRO HG3 1 1 6 1777 1 1 19 PRO N N 4.696 -1.309 -6.387 1.00 . A A . 19 PRO N 1 1 6 1778 1 1 19 PRO O O 5.569 -3.987 -5.662 1.00 . A A . 19 PRO O 1 1 6 1779 1 1 20 ALA C C 5.743 -6.827 -7.677 1.00 . A A . 20 ALA C 1 1 6 1780 1 1 20 ALA CA C 4.527 -6.018 -7.234 1.00 . A A . 20 ALA CA 1 1 6 1781 1 1 20 ALA CB C 3.254 -6.609 -7.822 1.00 . A A . 20 ALA CB 1 1 6 1782 1 1 20 ALA H H 4.358 -4.338 -8.510 1.00 . A A . 20 ALA H 1 1 6 1783 1 1 20 ALA HA H 4.451 -6.061 -6.157 1.00 . A A . 20 ALA HA 1 1 6 1784 1 1 20 ALA HB1 H 3.336 -7.686 -7.849 1.00 . A A . 20 ALA HB1 1 1 6 1785 1 1 20 ALA HB2 H 3.112 -6.234 -8.825 1.00 . A A . 20 ALA HB2 1 1 6 1786 1 1 20 ALA HB3 H 2.410 -6.327 -7.210 1.00 . A A . 20 ALA HB3 1 1 6 1787 1 1 20 ALA N N 4.657 -4.618 -7.620 1.00 . A A . 20 ALA N 1 1 6 1788 1 1 20 ALA O O 5.610 -7.858 -8.335 1.00 . A A . 20 ALA O 1 1 6 1789 1 1 21 GLY C C 9.369 -6.484 -6.971 1.00 . A A . 21 GLY C 1 1 6 1790 1 1 21 GLY CA C 8.150 -7.042 -7.679 1.00 . A A . 21 GLY CA 1 1 6 1791 1 1 21 GLY H H 6.974 -5.524 -6.786 1.00 . A A . 21 GLY H 1 1 6 1792 1 1 21 GLY HA2 H 8.048 -8.088 -7.428 1.00 . A A . 21 GLY HA2 1 1 6 1793 1 1 21 GLY HA3 H 8.294 -6.952 -8.745 1.00 . A A . 21 GLY HA3 1 1 6 1794 1 1 21 GLY N N 6.929 -6.351 -7.310 1.00 . A A . 21 GLY N 1 1 7 1795 1 1 1 ASP C C -6.679 -3.069 -1.562 1.00 . A A . 1 ASP C 1 1 7 1796 1 1 1 ASP CA C -5.886 -2.334 -2.638 1.00 . A A . 1 ASP CA 1 1 7 1797 1 1 1 ASP CB C -4.980 -3.318 -3.381 1.00 . A A . 1 ASP CB 1 1 7 1798 1 1 1 ASP CG C -4.383 -2.719 -4.639 1.00 . A A . 1 ASP CG 1 1 7 1799 1 1 1 ASP H1 H -4.276 -1.633 -1.675 1.00 . A A . 1 ASP H1 1 1 7 1800 1 1 1 ASP HA H -6.578 -1.895 -3.342 1.00 . A A . 1 ASP HA 1 1 7 1801 1 1 1 ASP HB2 H -4.172 -3.616 -2.729 1.00 . A A . 1 ASP HB2 1 1 7 1802 1 1 1 ASP HB3 H -5.555 -4.190 -3.656 1.00 . A A . 1 ASP HB3 1 1 7 1803 1 1 1 ASP N N -5.094 -1.255 -2.058 1.00 . A A . 1 ASP N 1 1 7 1804 1 1 1 ASP O O -7.859 -3.370 -1.743 1.00 . A A . 1 ASP O 1 1 7 1805 1 1 1 ASP OD1 O -3.668 -1.701 -4.531 1.00 . A A . 1 ASP OD1 1 1 7 1806 1 1 1 ASP OD2 O -4.629 -3.269 -5.733 1.00 . A A . 1 ASP OD2 1 1 7 1807 1 1 2 GLY C C -5.864 -4.043 1.924 1.00 . A A . 2 GLY C 1 1 7 1808 1 1 2 GLY CA C -6.682 -4.053 0.647 1.00 . A A . 2 GLY CA 1 1 7 1809 1 1 2 GLY H H -5.083 -3.091 -0.354 1.00 . A A . 2 GLY H 1 1 7 1810 1 1 2 GLY HA2 H -7.634 -3.580 0.838 1.00 . A A . 2 GLY HA2 1 1 7 1811 1 1 2 GLY HA3 H -6.854 -5.077 0.351 1.00 . A A . 2 GLY HA3 1 1 7 1812 1 1 2 GLY N N -6.023 -3.355 -0.442 1.00 . A A . 2 GLY N 1 1 7 1813 1 1 2 GLY O O -5.889 -3.069 2.677 1.00 . A A . 2 GLY O 1 1 7 1814 1 1 3 MET C C -2.971 -4.537 3.164 1.00 . A A . 3 MET C 1 1 7 1815 1 1 3 MET CA C -4.311 -5.240 3.363 1.00 . A A . 3 MET CA 1 1 7 1816 1 1 3 MET CB C -4.088 -6.713 3.717 1.00 . A A . 3 MET CB 1 1 7 1817 1 1 3 MET CE C -5.901 -5.713 7.074 1.00 . A A . 3 MET CE 1 1 7 1818 1 1 3 MET CG C -4.383 -7.039 5.172 1.00 . A A . 3 MET CG 1 1 7 1819 1 1 3 MET H H -5.160 -5.873 1.531 1.00 . A A . 3 MET H 1 1 7 1820 1 1 3 MET HA H -4.837 -4.761 4.175 1.00 . A A . 3 MET HA 1 1 7 1821 1 1 3 MET HB2 H -4.730 -7.321 3.097 1.00 . A A . 3 MET HB2 1 1 7 1822 1 1 3 MET HB3 H -3.058 -6.970 3.515 1.00 . A A . 3 MET HB3 1 1 7 1823 1 1 3 MET HE1 H -6.774 -5.805 7.703 1.00 . A A . 3 MET HE1 1 1 7 1824 1 1 3 MET HE2 H -5.779 -4.682 6.775 1.00 . A A . 3 MET HE2 1 1 7 1825 1 1 3 MET HE3 H -5.027 -6.035 7.621 1.00 . A A . 3 MET HE3 1 1 7 1826 1 1 3 MET HG2 H -4.159 -8.080 5.347 1.00 . A A . 3 MET HG2 1 1 7 1827 1 1 3 MET HG3 H -3.750 -6.427 5.799 1.00 . A A . 3 MET HG3 1 1 7 1828 1 1 3 MET N N -5.139 -5.129 2.168 1.00 . A A . 3 MET N 1 1 7 1829 1 1 3 MET O O -2.796 -3.772 2.216 1.00 . A A . 3 MET O 1 1 7 1830 1 1 3 MET SD S -6.103 -6.736 5.618 1.00 . A A . 3 MET SD 1 1 7 1831 1 1 4 GLY C C -0.545 -3.042 4.951 1.00 . A A . 4 GLY C 1 1 7 1832 1 1 4 GLY CA C -0.720 -4.182 3.969 1.00 . A A . 4 GLY CA 1 1 7 1833 1 1 4 GLY H H -2.226 -5.417 4.800 1.00 . A A . 4 GLY H 1 1 7 1834 1 1 4 GLY HA2 H 0.035 -4.929 4.163 1.00 . A A . 4 GLY HA2 1 1 7 1835 1 1 4 GLY HA3 H -0.586 -3.801 2.968 1.00 . A A . 4 GLY HA3 1 1 7 1836 1 1 4 GLY N N -2.029 -4.800 4.065 1.00 . A A . 4 GLY N 1 1 7 1837 1 1 4 GLY O O -1.449 -2.742 5.730 1.00 . A A . 4 GLY O 1 1 7 1838 1 1 5 GLU C C 2.170 -0.546 5.378 1.00 . A A . 5 GLU C 1 1 7 1839 1 1 5 GLU CA C 0.902 -1.284 5.803 1.00 . A A . 5 GLU CA 1 1 7 1840 1 1 5 GLU CB C 1.040 -1.776 7.246 1.00 . A A . 5 GLU CB 1 1 7 1841 1 1 5 GLU CD C 1.038 -4.279 7.595 1.00 . A A . 5 GLU CD 1 1 7 1842 1 1 5 GLU CG C 1.880 -3.036 7.382 1.00 . A A . 5 GLU CG 1 1 7 1843 1 1 5 GLU H H 1.301 -2.684 4.266 1.00 . A A . 5 GLU H 1 1 7 1844 1 1 5 GLU HA H 0.067 -0.602 5.744 1.00 . A A . 5 GLU HA 1 1 7 1845 1 1 5 GLU HB2 H 1.500 -0.997 7.837 1.00 . A A . 5 GLU HB2 1 1 7 1846 1 1 5 GLU HB3 H 0.056 -1.981 7.640 1.00 . A A . 5 GLU HB3 1 1 7 1847 1 1 5 GLU HG2 H 2.462 -3.164 6.481 1.00 . A A . 5 GLU HG2 1 1 7 1848 1 1 5 GLU HG3 H 2.545 -2.920 8.225 1.00 . A A . 5 GLU HG3 1 1 7 1849 1 1 5 GLU N N 0.619 -2.401 4.912 1.00 . A A . 5 GLU N 1 1 7 1850 1 1 5 GLU O O 3.055 -0.288 6.195 1.00 . A A . 5 GLU O 1 1 7 1851 1 1 5 GLU OE1 O 1.258 -5.276 6.876 1.00 . A A . 5 GLU OE1 1 1 7 1852 1 1 5 GLU OE2 O 0.159 -4.255 8.482 1.00 . A A . 5 GLU OE2 1 1 7 1853 1 1 6 GLU C C 3.071 1.966 3.280 1.00 . A A . 6 GLU C 1 1 7 1854 1 1 6 GLU CA C 3.407 0.503 3.562 1.00 . A A . 6 GLU CA 1 1 7 1855 1 1 6 GLU CB C 3.905 -0.177 2.284 1.00 . A A . 6 GLU CB 1 1 7 1856 1 1 6 GLU CD C 5.710 -0.290 0.521 1.00 . A A . 6 GLU CD 1 1 7 1857 1 1 6 GLU CG C 5.315 0.231 1.889 1.00 . A A . 6 GLU CG 1 1 7 1858 1 1 6 GLU H H 1.512 -0.441 3.492 1.00 . A A . 6 GLU H 1 1 7 1859 1 1 6 GLU HA H 4.189 0.464 4.305 1.00 . A A . 6 GLU HA 1 1 7 1860 1 1 6 GLU HB2 H 3.891 -1.247 2.431 1.00 . A A . 6 GLU HB2 1 1 7 1861 1 1 6 GLU HB3 H 3.240 0.075 1.472 1.00 . A A . 6 GLU HB3 1 1 7 1862 1 1 6 GLU HG2 H 5.374 1.309 1.876 1.00 . A A . 6 GLU HG2 1 1 7 1863 1 1 6 GLU HG3 H 6.007 -0.159 2.621 1.00 . A A . 6 GLU HG3 1 1 7 1864 1 1 6 GLU N N 2.250 -0.207 4.095 1.00 . A A . 6 GLU N 1 1 7 1865 1 1 6 GLU O O 3.565 2.866 3.960 1.00 . A A . 6 GLU O 1 1 7 1866 1 1 6 GLU OE1 O 6.926 -0.411 0.260 1.00 . A A . 6 GLU OE1 1 1 7 1867 1 1 6 GLU OE2 O 4.805 -0.578 -0.289 1.00 . A A . 6 GLU OE2 1 1 7 1868 1 1 7 PHE C C 0.600 3.541 1.007 1.00 . A A . 7 PHE C 1 1 7 1869 1 1 7 PHE CA C 1.829 3.556 1.912 1.00 . A A . 7 PHE CA 1 1 7 1870 1 1 7 PHE CB C 2.983 4.281 1.217 1.00 . A A . 7 PHE CB 1 1 7 1871 1 1 7 PHE CD1 C 2.810 3.361 -1.109 1.00 . A A . 7 PHE CD1 1 1 7 1872 1 1 7 PHE CD2 C 4.826 2.988 0.108 1.00 . A A . 7 PHE CD2 1 1 7 1873 1 1 7 PHE CE1 C 3.329 2.669 -2.187 1.00 . A A . 7 PHE CE1 1 1 7 1874 1 1 7 PHE CE2 C 5.351 2.295 -0.966 1.00 . A A . 7 PHE CE2 1 1 7 1875 1 1 7 PHE CG C 3.551 3.528 0.049 1.00 . A A . 7 PHE CG 1 1 7 1876 1 1 7 PHE CZ C 4.601 2.135 -2.116 1.00 . A A . 7 PHE CZ 1 1 7 1877 1 1 7 PHE H H 1.865 1.442 1.771 1.00 . A A . 7 PHE H 1 1 7 1878 1 1 7 PHE HA H 1.582 4.082 2.822 1.00 . A A . 7 PHE HA 1 1 7 1879 1 1 7 PHE HB2 H 2.633 5.237 0.857 1.00 . A A . 7 PHE HB2 1 1 7 1880 1 1 7 PHE HB3 H 3.780 4.441 1.930 1.00 . A A . 7 PHE HB3 1 1 7 1881 1 1 7 PHE HD1 H 1.816 3.778 -1.166 1.00 . A A . 7 PHE HD1 1 1 7 1882 1 1 7 PHE HD2 H 5.413 3.112 1.006 1.00 . A A . 7 PHE HD2 1 1 7 1883 1 1 7 PHE HE1 H 2.740 2.545 -3.084 1.00 . A A . 7 PHE HE1 1 1 7 1884 1 1 7 PHE HE2 H 6.345 1.879 -0.908 1.00 . A A . 7 PHE HE2 1 1 7 1885 1 1 7 PHE HZ H 5.008 1.594 -2.957 1.00 . A A . 7 PHE HZ 1 1 7 1886 1 1 7 PHE N N 2.228 2.199 2.277 1.00 . A A . 7 PHE N 1 1 7 1887 1 1 7 PHE O O 0.167 2.483 0.552 1.00 . A A . 7 PHE O 1 1 7 1888 1 1 8 ILE C C -1.057 3.977 -1.337 1.00 . A A . 8 ILE C 1 1 7 1889 1 1 8 ILE CA C -1.147 4.855 -0.091 1.00 . A A . 8 ILE CA 1 1 7 1890 1 1 8 ILE CB C -1.366 6.318 -0.525 1.00 . A A . 8 ILE CB 1 1 7 1891 1 1 8 ILE CD1 C 0.016 7.964 0.836 1.00 . A A . 8 ILE CD1 1 1 7 1892 1 1 8 ILE CG1 C -1.308 7.247 0.689 1.00 . A A . 8 ILE CG1 1 1 7 1893 1 1 8 ILE CG2 C -2.697 6.465 -1.250 1.00 . A A . 8 ILE CG2 1 1 7 1894 1 1 8 ILE H H 0.433 5.528 1.152 1.00 . A A . 8 ILE H 1 1 7 1895 1 1 8 ILE HA H -2.003 4.545 0.491 1.00 . A A . 8 ILE HA 1 1 7 1896 1 1 8 ILE HB H -0.579 6.587 -1.213 1.00 . A A . 8 ILE HB 1 1 7 1897 1 1 8 ILE HD11 H 0.799 7.367 0.391 1.00 . A A . 8 ILE HD11 1 1 7 1898 1 1 8 ILE HD12 H 0.230 8.114 1.884 1.00 . A A . 8 ILE HD12 1 1 7 1899 1 1 8 ILE HD13 H -0.035 8.920 0.337 1.00 . A A . 8 ILE HD13 1 1 7 1900 1 1 8 ILE HG12 H -2.081 7.995 0.601 1.00 . A A . 8 ILE HG12 1 1 7 1901 1 1 8 ILE HG13 H -1.474 6.668 1.586 1.00 . A A . 8 ILE HG13 1 1 7 1902 1 1 8 ILE HG21 H -3.420 5.790 -0.817 1.00 . A A . 8 ILE HG21 1 1 7 1903 1 1 8 ILE HG22 H -2.565 6.230 -2.295 1.00 . A A . 8 ILE HG22 1 1 7 1904 1 1 8 ILE HG23 H -3.050 7.481 -1.152 1.00 . A A . 8 ILE HG23 1 1 7 1905 1 1 8 ILE N N 0.040 4.723 0.755 1.00 . A A . 8 ILE N 1 1 7 1906 1 1 8 ILE O O -0.144 4.125 -2.149 1.00 . A A . 8 ILE O 1 1 7 1907 1 1 9 GLU C C -2.785 2.791 -3.803 1.00 . A A . 9 GLU C 1 1 7 1908 1 1 9 GLU CA C -2.046 2.160 -2.625 1.00 . A A . 9 GLU CA 1 1 7 1909 1 1 9 GLU CB C -2.716 0.841 -2.236 1.00 . A A . 9 GLU CB 1 1 7 1910 1 1 9 GLU CD C -5.055 -0.045 -2.607 1.00 . A A . 9 GLU CD 1 1 7 1911 1 1 9 GLU CG C -4.192 0.983 -1.900 1.00 . A A . 9 GLU CG 1 1 7 1912 1 1 9 GLU H H -2.713 2.995 -0.798 1.00 . A A . 9 GLU H 1 1 7 1913 1 1 9 GLU HA H -1.026 1.961 -2.920 1.00 . A A . 9 GLU HA 1 1 7 1914 1 1 9 GLU HB2 H -2.621 0.146 -3.057 1.00 . A A . 9 GLU HB2 1 1 7 1915 1 1 9 GLU HB3 H -2.211 0.436 -1.372 1.00 . A A . 9 GLU HB3 1 1 7 1916 1 1 9 GLU HG2 H -4.318 0.862 -0.835 1.00 . A A . 9 GLU HG2 1 1 7 1917 1 1 9 GLU HG3 H -4.521 1.970 -2.191 1.00 . A A . 9 GLU HG3 1 1 7 1918 1 1 9 GLU N N -2.013 3.063 -1.480 1.00 . A A . 9 GLU N 1 1 7 1919 1 1 9 GLU O O -3.642 2.158 -4.421 1.00 . A A . 9 GLU O 1 1 7 1920 1 1 9 GLU OE1 O -5.675 0.247 -3.630 1.00 . A A . 9 GLU OE1 1 1 7 1921 1 1 10 GLY C C -4.294 5.545 -4.772 1.00 . A A . 10 GLY C 1 1 7 1922 1 1 10 GLY CA C -3.093 4.730 -5.213 1.00 . A A . 10 GLY CA 1 1 7 1923 1 1 10 GLY H H -1.761 4.497 -3.586 1.00 . A A . 10 GLY H 1 1 7 1924 1 1 10 GLY HA2 H -2.375 5.390 -5.677 1.00 . A A . 10 GLY HA2 1 1 7 1925 1 1 10 GLY HA3 H -3.416 4.000 -5.940 1.00 . A A . 10 GLY HA3 1 1 7 1926 1 1 10 GLY N N -2.450 4.041 -4.110 1.00 . A A . 10 GLY N 1 1 7 1927 1 1 10 GLY O O -4.646 6.536 -5.412 1.00 . A A . 10 GLY O 1 1 7 1928 1 1 11 LEU C C -5.864 6.288 -1.716 1.00 . A A . 11 LEU C 1 1 7 1929 1 1 11 LEU CA C -6.093 5.835 -3.157 1.00 . A A . 11 LEU CA 1 1 7 1930 1 1 11 LEU CB C -7.342 4.949 -3.246 1.00 . A A . 11 LEU CB 1 1 7 1931 1 1 11 LEU CD1 C -8.202 2.751 -2.394 1.00 . A A . 11 LEU CD1 1 1 7 1932 1 1 11 LEU CD2 C -6.940 2.846 -4.550 1.00 . A A . 11 LEU CD2 1 1 7 1933 1 1 11 LEU CG C -7.084 3.442 -3.158 1.00 . A A . 11 LEU CG 1 1 7 1934 1 1 11 LEU H H -4.599 4.336 -3.207 1.00 . A A . 11 LEU H 1 1 7 1935 1 1 11 LEU HA H -6.245 6.711 -3.771 1.00 . A A . 11 LEU HA 1 1 7 1936 1 1 11 LEU HB2 H -8.010 5.226 -2.444 1.00 . A A . 11 LEU HB2 1 1 7 1937 1 1 11 LEU HB3 H -7.833 5.152 -4.186 1.00 . A A . 11 LEU HB3 1 1 7 1938 1 1 11 LEU HD11 H -7.823 1.849 -1.938 1.00 . A A . 11 LEU HD11 1 1 7 1939 1 1 11 LEU HD12 H -9.003 2.502 -3.075 1.00 . A A . 11 LEU HD12 1 1 7 1940 1 1 11 LEU HD13 H -8.576 3.413 -1.626 1.00 . A A . 11 LEU HD13 1 1 7 1941 1 1 11 LEU HD21 H -7.125 1.783 -4.507 1.00 . A A . 11 LEU HD21 1 1 7 1942 1 1 11 LEU HD22 H -5.939 3.023 -4.916 1.00 . A A . 11 LEU HD22 1 1 7 1943 1 1 11 LEU HD23 H -7.654 3.309 -5.216 1.00 . A A . 11 LEU HD23 1 1 7 1944 1 1 11 LEU HG H -6.160 3.272 -2.623 1.00 . A A . 11 LEU HG 1 1 7 1945 1 1 11 LEU N N -4.925 5.131 -3.677 1.00 . A A . 11 LEU N 1 1 7 1946 1 1 11 LEU O O -5.425 7.414 -1.477 1.00 . A A . 11 LEU O 1 1 7 1947 1 1 12 VAL C C -5.850 4.473 1.501 1.00 . A A . 12 VAL C 1 1 7 1948 1 1 12 VAL CA C -5.986 5.736 0.656 1.00 . A A . 12 VAL CA 1 1 7 1949 1 1 12 VAL CB C -7.166 6.569 1.200 1.00 . A A . 12 VAL CB 1 1 7 1950 1 1 12 VAL CG1 C -6.920 6.967 2.648 1.00 . A A . 12 VAL CG1 1 1 7 1951 1 1 12 VAL CG2 C -7.402 7.800 0.339 1.00 . A A . 12 VAL CG2 1 1 7 1952 1 1 12 VAL H H -6.507 4.529 -1.003 1.00 . A A . 12 VAL H 1 1 7 1953 1 1 12 VAL HA H -5.084 6.322 0.754 1.00 . A A . 12 VAL HA 1 1 7 1954 1 1 12 VAL HB H -8.056 5.958 1.165 1.00 . A A . 12 VAL HB 1 1 7 1955 1 1 12 VAL HG11 H -5.857 7.029 2.829 1.00 . A A . 12 VAL HG11 1 1 7 1956 1 1 12 VAL HG12 H -7.353 6.225 3.303 1.00 . A A . 12 VAL HG12 1 1 7 1957 1 1 12 VAL HG13 H -7.375 7.927 2.841 1.00 . A A . 12 VAL HG13 1 1 7 1958 1 1 12 VAL HG21 H -6.480 8.354 0.243 1.00 . A A . 12 VAL HG21 1 1 7 1959 1 1 12 VAL HG22 H -8.151 8.425 0.801 1.00 . A A . 12 VAL HG22 1 1 7 1960 1 1 12 VAL HG23 H -7.742 7.495 -0.640 1.00 . A A . 12 VAL HG23 1 1 7 1961 1 1 12 VAL N N -6.162 5.412 -0.756 1.00 . A A . 12 VAL N 1 1 7 1962 1 1 12 VAL O O -6.819 4.018 2.110 1.00 . A A . 12 VAL O 1 1 7 1963 1 1 13 ARG C C -2.938 2.282 2.239 1.00 . A A . 13 ARG C 1 1 7 1964 1 1 13 ARG CA C -4.394 2.711 2.330 1.00 . A A . 13 ARG CA 1 1 7 1965 1 1 13 ARG CB C -5.301 1.566 1.874 1.00 . A A . 13 ARG CB 1 1 7 1966 1 1 13 ARG CD C -5.195 0.417 4.110 1.00 . A A . 13 ARG CD 1 1 7 1967 1 1 13 ARG CG C -5.038 0.257 2.606 1.00 . A A . 13 ARG CG 1 1 7 1968 1 1 13 ARG CZ C -7.617 0.806 4.348 1.00 . A A . 13 ARG CZ 1 1 7 1969 1 1 13 ARG H H -3.908 4.325 1.047 1.00 . A A . 13 ARG H 1 1 7 1970 1 1 13 ARG HA H -4.616 2.939 3.359 1.00 . A A . 13 ARG HA 1 1 7 1971 1 1 13 ARG HB2 H -6.330 1.847 2.040 1.00 . A A . 13 ARG HB2 1 1 7 1972 1 1 13 ARG HB3 H -5.149 1.400 0.819 1.00 . A A . 13 ARG HB3 1 1 7 1973 1 1 13 ARG HD2 H -5.304 -0.562 4.553 1.00 . A A . 13 ARG HD2 1 1 7 1974 1 1 13 ARG HD3 H -4.307 0.891 4.502 1.00 . A A . 13 ARG HD3 1 1 7 1975 1 1 13 ARG HE H -6.196 2.132 4.799 1.00 . A A . 13 ARG HE 1 1 7 1976 1 1 13 ARG HG2 H -5.738 -0.487 2.259 1.00 . A A . 13 ARG HG2 1 1 7 1977 1 1 13 ARG HG3 H -4.030 -0.067 2.392 1.00 . A A . 13 ARG HG3 1 1 7 1978 1 1 13 ARG HH11 H -7.128 -1.021 3.629 1.00 . A A . 13 ARG HH11 1 1 7 1979 1 1 13 ARG HH12 H -8.825 -0.724 3.810 1.00 . A A . 13 ARG HH12 1 1 7 1980 1 1 13 ARG HH21 H -8.427 2.524 5.038 1.00 . A A . 13 ARG HH21 1 1 7 1981 1 1 13 ARG HH22 H -9.562 1.288 4.609 1.00 . A A . 13 ARG HH22 1 1 7 1982 1 1 13 ARG N N -4.645 3.915 1.546 1.00 . A A . 13 ARG N 1 1 7 1983 1 1 13 ARG NE N -6.360 1.227 4.461 1.00 . A A . 13 ARG NE 1 1 7 1984 1 1 13 ARG NH1 N -7.878 -0.413 3.892 1.00 . A A . 13 ARG NH1 1 1 7 1985 1 1 13 ARG NH2 N -8.617 1.605 4.693 1.00 . A A . 13 ARG NH2 1 1 7 1986 1 1 13 ARG O O -2.383 2.146 1.149 1.00 . A A . 13 ARG O 1 1 7 1987 1 1 14 ASP C C -0.781 0.251 2.833 1.00 . A A . 14 ASP C 1 1 7 1988 1 1 14 ASP CA C -0.944 1.632 3.463 1.00 . A A . 14 ASP CA 1 1 7 1989 1 1 14 ASP CB C -0.465 1.615 4.914 1.00 . A A . 14 ASP CB 1 1 7 1990 1 1 14 ASP CG C -0.483 2.994 5.544 1.00 . A A . 14 ASP CG 1 1 7 1991 1 1 14 ASP H H -2.833 2.180 4.230 1.00 . A A . 14 ASP H 1 1 7 1992 1 1 14 ASP HA H -0.352 2.341 2.906 1.00 . A A . 14 ASP HA 1 1 7 1993 1 1 14 ASP HB2 H -1.107 0.967 5.492 1.00 . A A . 14 ASP HB2 1 1 7 1994 1 1 14 ASP HB3 H 0.546 1.237 4.948 1.00 . A A . 14 ASP HB3 1 1 7 1995 1 1 14 ASP N N -2.331 2.059 3.398 1.00 . A A . 14 ASP N 1 1 7 1996 1 1 14 ASP O O -0.861 -0.769 3.515 1.00 . A A . 14 ASP O 1 1 7 1997 1 1 14 ASP OD1 O -1.220 3.867 5.040 1.00 . A A . 14 ASP OD1 1 1 7 1998 1 1 14 ASP OD2 O 0.240 3.200 6.542 1.00 . A A . 14 ASP OD2 1 1 7 1999 1 1 15 SER C C 0.711 -1.872 1.353 1.00 . A A . 15 SER C 1 1 7 2000 1 1 15 SER CA C -0.398 -0.999 0.763 1.00 . A A . 15 SER CA 1 1 7 2001 1 1 15 SER CB C -0.088 -0.676 -0.701 1.00 . A A . 15 SER CB 1 1 7 2002 1 1 15 SER H H -0.528 1.093 1.047 1.00 . A A . 15 SER H 1 1 7 2003 1 1 15 SER HA H -1.330 -1.543 0.810 1.00 . A A . 15 SER HA 1 1 7 2004 1 1 15 SER HB2 H -0.298 0.365 -0.890 1.00 . A A . 15 SER HB2 1 1 7 2005 1 1 15 SER HB3 H 0.956 -0.874 -0.899 1.00 . A A . 15 SER HB3 1 1 7 2006 1 1 15 SER HG H -1.775 -1.510 -1.247 1.00 . A A . 15 SER HG 1 1 7 2007 1 1 15 SER N N -0.566 0.240 1.522 1.00 . A A . 15 SER N 1 1 7 2008 1 1 15 SER O O 1.099 -1.704 2.505 1.00 . A A . 15 SER O 1 1 7 2009 1 1 15 SER OG O -0.874 -1.466 -1.577 1.00 . A A . 15 SER OG 1 1 7 2010 1 1 16 LEU C C 3.202 -4.122 -0.123 1.00 . A A . 16 LEU C 1 1 7 2011 1 1 16 LEU CA C 2.273 -3.708 1.019 1.00 . A A . 16 LEU CA 1 1 7 2012 1 1 16 LEU CB C 1.667 -4.953 1.672 1.00 . A A . 16 LEU CB 1 1 7 2013 1 1 16 LEU CD1 C 0.378 -5.822 -0.296 1.00 . A A . 16 LEU CD1 1 1 7 2014 1 1 16 LEU CD2 C -0.322 -6.439 2.028 1.00 . A A . 16 LEU CD2 1 1 7 2015 1 1 16 LEU CG C 0.286 -5.355 1.149 1.00 . A A . 16 LEU CG 1 1 7 2016 1 1 16 LEU H H 0.866 -2.908 -0.351 1.00 . A A . 16 LEU H 1 1 7 2017 1 1 16 LEU HA H 2.852 -3.176 1.758 1.00 . A A . 16 LEU HA 1 1 7 2018 1 1 16 LEU HB2 H 2.344 -5.781 1.516 1.00 . A A . 16 LEU HB2 1 1 7 2019 1 1 16 LEU HB3 H 1.585 -4.772 2.734 1.00 . A A . 16 LEU HB3 1 1 7 2020 1 1 16 LEU HD11 H 1.402 -6.073 -0.530 1.00 . A A . 16 LEU HD11 1 1 7 2021 1 1 16 LEU HD12 H 0.042 -5.032 -0.952 1.00 . A A . 16 LEU HD12 1 1 7 2022 1 1 16 LEU HD13 H -0.247 -6.693 -0.434 1.00 . A A . 16 LEU HD13 1 1 7 2023 1 1 16 LEU HD21 H 0.219 -6.492 2.962 1.00 . A A . 16 LEU HD21 1 1 7 2024 1 1 16 LEU HD22 H -0.259 -7.391 1.522 1.00 . A A . 16 LEU HD22 1 1 7 2025 1 1 16 LEU HD23 H -1.358 -6.204 2.225 1.00 . A A . 16 LEU HD23 1 1 7 2026 1 1 16 LEU HG H -0.365 -4.493 1.179 1.00 . A A . 16 LEU HG 1 1 7 2027 1 1 16 LEU N N 1.215 -2.812 0.558 1.00 . A A . 16 LEU N 1 1 7 2028 1 1 16 LEU O O 4.393 -4.350 0.093 1.00 . A A . 16 LEU O 1 1 7 2029 1 1 17 TYR C C 4.791 -3.910 -2.542 1.00 . A A . 17 TYR C 1 1 7 2030 1 1 17 TYR CA C 3.437 -4.623 -2.504 1.00 . A A . 17 TYR CA 1 1 7 2031 1 1 17 TYR CB C 2.659 -4.324 -3.786 1.00 . A A . 17 TYR CB 1 1 7 2032 1 1 17 TYR CD1 C 0.223 -4.650 -4.363 1.00 . A A . 17 TYR CD1 1 1 7 2033 1 1 17 TYR CD2 C 1.501 -6.566 -3.746 1.00 . A A . 17 TYR CD2 1 1 7 2034 1 1 17 TYR CE1 C -0.896 -5.445 -4.529 1.00 . A A . 17 TYR CE1 1 1 7 2035 1 1 17 TYR CE2 C 0.387 -7.367 -3.910 1.00 . A A . 17 TYR CE2 1 1 7 2036 1 1 17 TYR CG C 1.438 -5.196 -3.969 1.00 . A A . 17 TYR CG 1 1 7 2037 1 1 17 TYR CZ C -0.808 -6.802 -4.302 1.00 . A A . 17 TYR CZ 1 1 7 2038 1 1 17 TYR H H 1.700 -4.041 -1.443 1.00 . A A . 17 TYR H 1 1 7 2039 1 1 17 TYR HA H 3.604 -5.687 -2.440 1.00 . A A . 17 TYR HA 1 1 7 2040 1 1 17 TYR HB2 H 2.332 -3.295 -3.768 1.00 . A A . 17 TYR HB2 1 1 7 2041 1 1 17 TYR HB3 H 3.307 -4.476 -4.636 1.00 . A A . 17 TYR HB3 1 1 7 2042 1 1 17 TYR HD1 H 0.158 -3.587 -4.540 1.00 . A A . 17 TYR HD1 1 1 7 2043 1 1 17 TYR HD2 H 2.438 -7.005 -3.439 1.00 . A A . 17 TYR HD2 1 1 7 2044 1 1 17 TYR HE1 H -1.832 -5.002 -4.836 1.00 . A A . 17 TYR HE1 1 1 7 2045 1 1 17 TYR HE2 H 0.456 -8.430 -3.732 1.00 . A A . 17 TYR HE2 1 1 7 2046 1 1 17 TYR HH H -1.667 -8.413 -4.905 1.00 . A A . 17 TYR HH 1 1 7 2047 1 1 17 TYR N N 2.655 -4.227 -1.333 1.00 . A A . 17 TYR N 1 1 7 2048 1 1 17 TYR O O 4.858 -2.686 -2.431 1.00 . A A . 17 TYR O 1 1 7 2049 1 1 17 TYR OH O -1.919 -7.596 -4.467 1.00 . A A . 17 TYR OH 1 1 7 2050 1 1 18 PRO C C 7.383 -2.998 -3.798 1.00 . A A . 18 PRO C 1 1 7 2051 1 1 18 PRO CA C 7.244 -4.102 -2.749 1.00 . A A . 18 PRO CA 1 1 7 2052 1 1 18 PRO CB C 8.129 -5.298 -3.109 1.00 . A A . 18 PRO CB 1 1 7 2053 1 1 18 PRO CD C 5.908 -6.140 -2.838 1.00 . A A . 18 PRO CD 1 1 7 2054 1 1 18 PRO CG C 7.359 -6.491 -2.662 1.00 . A A . 18 PRO CG 1 1 7 2055 1 1 18 PRO HA H 7.540 -3.713 -1.785 1.00 . A A . 18 PRO HA 1 1 7 2056 1 1 18 PRO HB2 H 8.302 -5.314 -4.175 1.00 . A A . 18 PRO HB2 1 1 7 2057 1 1 18 PRO HB3 H 9.071 -5.220 -2.588 1.00 . A A . 18 PRO HB3 1 1 7 2058 1 1 18 PRO HD2 H 5.564 -6.438 -3.817 1.00 . A A . 18 PRO HD2 1 1 7 2059 1 1 18 PRO HD3 H 5.311 -6.606 -2.068 1.00 . A A . 18 PRO HD3 1 1 7 2060 1 1 18 PRO HG2 H 7.615 -7.344 -3.273 1.00 . A A . 18 PRO HG2 1 1 7 2061 1 1 18 PRO HG3 H 7.571 -6.697 -1.623 1.00 . A A . 18 PRO HG3 1 1 7 2062 1 1 18 PRO N N 5.893 -4.670 -2.699 1.00 . A A . 18 PRO N 1 1 7 2063 1 1 18 PRO O O 7.912 -1.926 -3.506 1.00 . A A . 18 PRO O 1 1 7 2064 1 1 19 PRO C C 6.046 -1.078 -5.905 1.00 . A A . 19 PRO C 1 1 7 2065 1 1 19 PRO CA C 7.006 -2.244 -6.112 1.00 . A A . 19 PRO CA 1 1 7 2066 1 1 19 PRO CB C 6.627 -3.034 -7.364 1.00 . A A . 19 PRO CB 1 1 7 2067 1 1 19 PRO CD C 6.266 -4.485 -5.495 1.00 . A A . 19 PRO CD 1 1 7 2068 1 1 19 PRO CG C 5.758 -4.136 -6.868 1.00 . A A . 19 PRO CG 1 1 7 2069 1 1 19 PRO HA H 8.012 -1.864 -6.213 1.00 . A A . 19 PRO HA 1 1 7 2070 1 1 19 PRO HB2 H 6.097 -2.391 -8.052 1.00 . A A . 19 PRO HB2 1 1 7 2071 1 1 19 PRO HB3 H 7.519 -3.418 -7.836 1.00 . A A . 19 PRO HB3 1 1 7 2072 1 1 19 PRO HD2 H 5.442 -4.750 -4.851 1.00 . A A . 19 PRO HD2 1 1 7 2073 1 1 19 PRO HD3 H 6.978 -5.293 -5.552 1.00 . A A . 19 PRO HD3 1 1 7 2074 1 1 19 PRO HG2 H 4.733 -3.799 -6.814 1.00 . A A . 19 PRO HG2 1 1 7 2075 1 1 19 PRO HG3 H 5.838 -4.990 -7.524 1.00 . A A . 19 PRO HG3 1 1 7 2076 1 1 19 PRO N N 6.915 -3.238 -5.039 1.00 . A A . 19 PRO N 1 1 7 2077 1 1 19 PRO O O 4.829 -1.262 -5.864 1.00 . A A . 19 PRO O 1 1 7 2078 1 1 20 ALA C C 5.213 1.817 -6.891 1.00 . A A . 20 ALA C 1 1 7 2079 1 1 20 ALA CA C 5.797 1.320 -5.572 1.00 . A A . 20 ALA CA 1 1 7 2080 1 1 20 ALA CB C 6.633 2.410 -4.918 1.00 . A A . 20 ALA CB 1 1 7 2081 1 1 20 ALA H H 7.577 0.204 -5.816 1.00 . A A . 20 ALA H 1 1 7 2082 1 1 20 ALA HA H 4.987 1.069 -4.903 1.00 . A A . 20 ALA HA 1 1 7 2083 1 1 20 ALA HB1 H 6.668 2.245 -3.851 1.00 . A A . 20 ALA HB1 1 1 7 2084 1 1 20 ALA HB2 H 6.189 3.374 -5.120 1.00 . A A . 20 ALA HB2 1 1 7 2085 1 1 20 ALA HB3 H 7.635 2.384 -5.319 1.00 . A A . 20 ALA HB3 1 1 7 2086 1 1 20 ALA N N 6.602 0.122 -5.775 1.00 . A A . 20 ALA N 1 1 7 2087 1 1 20 ALA O O 5.684 2.803 -7.457 1.00 . A A . 20 ALA O 1 1 7 2088 1 1 21 GLY C C 4.522 1.495 -9.791 1.00 . A A . 21 GLY C 1 1 7 2089 1 1 21 GLY CA C 3.555 1.513 -8.623 1.00 . A A . 21 GLY CA 1 1 7 2090 1 1 21 GLY H H 3.853 0.349 -6.880 1.00 . A A . 21 GLY H 1 1 7 2091 1 1 21 GLY HA2 H 2.744 0.831 -8.830 1.00 . A A . 21 GLY HA2 1 1 7 2092 1 1 21 GLY HA3 H 3.154 2.510 -8.518 1.00 . A A . 21 GLY HA3 1 1 7 2093 1 1 21 GLY N N 4.186 1.127 -7.374 1.00 . A A . 21 GLY N 1 1 8 2094 1 1 1 ASP C C -4.555 -1.710 -2.562 1.00 . A A . 1 ASP C 1 1 8 2095 1 1 1 ASP CA C -3.547 -1.497 -3.689 1.00 . A A . 1 ASP CA 1 1 8 2096 1 1 1 ASP CB C -2.496 -2.608 -3.667 1.00 . A A . 1 ASP CB 1 1 8 2097 1 1 1 ASP CG C -2.733 -3.650 -4.743 1.00 . A A . 1 ASP CG 1 1 8 2098 1 1 1 ASP H1 H -2.052 -0.181 -4.060 1.00 . A A . 1 ASP H1 1 1 8 2099 1 1 1 ASP HA H -4.070 -1.528 -4.633 1.00 . A A . 1 ASP HA 1 1 8 2100 1 1 1 ASP HB2 H -1.519 -2.175 -3.822 1.00 . A A . 1 ASP HB2 1 1 8 2101 1 1 1 ASP HB3 H -2.518 -3.099 -2.705 1.00 . A A . 1 ASP HB3 1 1 8 2102 1 1 1 ASP N N -2.905 -0.190 -3.578 1.00 . A A . 1 ASP N 1 1 8 2103 1 1 1 ASP O O -5.764 -1.729 -2.792 1.00 . A A . 1 ASP O 1 1 8 2104 1 1 1 ASP OD1 O -3.029 -3.260 -5.892 1.00 . A A . 1 ASP OD1 1 1 8 2105 1 1 1 ASP OD2 O -2.624 -4.856 -4.436 1.00 . A A . 1 ASP OD2 1 1 8 2106 1 1 2 GLY C C -4.226 -2.837 0.917 1.00 . A A . 2 GLY C 1 1 8 2107 1 1 2 GLY CA C -4.915 -2.081 -0.201 1.00 . A A . 2 GLY CA 1 1 8 2108 1 1 2 GLY H H -3.075 -1.846 -1.222 1.00 . A A . 2 GLY H 1 1 8 2109 1 1 2 GLY HA2 H -5.237 -1.121 0.174 1.00 . A A . 2 GLY HA2 1 1 8 2110 1 1 2 GLY HA3 H -5.782 -2.641 -0.518 1.00 . A A . 2 GLY HA3 1 1 8 2111 1 1 2 GLY N N -4.047 -1.871 -1.345 1.00 . A A . 2 GLY N 1 1 8 2112 1 1 2 GLY O O -3.944 -2.274 1.975 1.00 . A A . 2 GLY O 1 1 8 2113 1 1 3 MET C C -1.931 -4.376 2.056 1.00 . A A . 3 MET C 1 1 8 2114 1 1 3 MET CA C -3.291 -4.953 1.677 1.00 . A A . 3 MET CA 1 1 8 2115 1 1 3 MET CB C -3.122 -6.377 1.144 1.00 . A A . 3 MET CB 1 1 8 2116 1 1 3 MET CE C -3.497 -8.959 -1.002 1.00 . A A . 3 MET CE 1 1 8 2117 1 1 3 MET CG C -2.608 -6.434 -0.286 1.00 . A A . 3 MET CG 1 1 8 2118 1 1 3 MET H H -4.201 -4.507 -0.181 1.00 . A A . 3 MET H 1 1 8 2119 1 1 3 MET HA H -3.916 -4.979 2.557 1.00 . A A . 3 MET HA 1 1 8 2120 1 1 3 MET HB2 H -2.423 -6.905 1.776 1.00 . A A . 3 MET HB2 1 1 8 2121 1 1 3 MET HB3 H -4.077 -6.878 1.181 1.00 . A A . 3 MET HB3 1 1 8 2122 1 1 3 MET HE1 H -4.206 -8.708 -0.226 1.00 . A A . 3 MET HE1 1 1 8 2123 1 1 3 MET HE2 H -3.299 -10.020 -0.979 1.00 . A A . 3 MET HE2 1 1 8 2124 1 1 3 MET HE3 H -3.907 -8.691 -1.965 1.00 . A A . 3 MET HE3 1 1 8 2125 1 1 3 MET HG2 H -3.418 -6.185 -0.955 1.00 . A A . 3 MET HG2 1 1 8 2126 1 1 3 MET HG3 H -1.815 -5.709 -0.398 1.00 . A A . 3 MET HG3 1 1 8 2127 1 1 3 MET N N -3.952 -4.116 0.682 1.00 . A A . 3 MET N 1 1 8 2128 1 1 3 MET O O -1.147 -3.989 1.190 1.00 . A A . 3 MET O 1 1 8 2129 1 1 3 MET SD S -1.972 -8.061 -0.731 1.00 . A A . 3 MET SD 1 1 8 2130 1 1 4 GLY C C -0.555 -2.846 4.997 1.00 . A A . 4 GLY C 1 1 8 2131 1 1 4 GLY CA C -0.390 -3.793 3.826 1.00 . A A . 4 GLY CA 1 1 8 2132 1 1 4 GLY H H -2.320 -4.647 4.000 1.00 . A A . 4 GLY H 1 1 8 2133 1 1 4 GLY HA2 H 0.241 -4.615 4.128 1.00 . A A . 4 GLY HA2 1 1 8 2134 1 1 4 GLY HA3 H 0.090 -3.265 3.015 1.00 . A A . 4 GLY HA3 1 1 8 2135 1 1 4 GLY N N -1.657 -4.323 3.356 1.00 . A A . 4 GLY N 1 1 8 2136 1 1 4 GLY O O -1.603 -2.821 5.642 1.00 . A A . 4 GLY O 1 1 8 2137 1 1 5 GLU C C 1.709 -0.248 6.386 1.00 . A A . 5 GLU C 1 1 8 2138 1 1 5 GLU CA C 0.453 -1.113 6.377 1.00 . A A . 5 GLU CA 1 1 8 2139 1 1 5 GLU CB C 0.320 -1.851 7.711 1.00 . A A . 5 GLU CB 1 1 8 2140 1 1 5 GLU CD C 1.991 -2.625 9.442 1.00 . A A . 5 GLU CD 1 1 8 2141 1 1 5 GLU CG C 1.494 -2.768 8.017 1.00 . A A . 5 GLU CG 1 1 8 2142 1 1 5 GLU H H 1.293 -2.134 4.724 1.00 . A A . 5 GLU H 1 1 8 2143 1 1 5 GLU HA H -0.408 -0.477 6.241 1.00 . A A . 5 GLU HA 1 1 8 2144 1 1 5 GLU HB2 H 0.242 -1.123 8.506 1.00 . A A . 5 GLU HB2 1 1 8 2145 1 1 5 GLU HB3 H -0.580 -2.448 7.691 1.00 . A A . 5 GLU HB3 1 1 8 2146 1 1 5 GLU HG2 H 1.185 -3.790 7.861 1.00 . A A . 5 GLU HG2 1 1 8 2147 1 1 5 GLU HG3 H 2.304 -2.530 7.343 1.00 . A A . 5 GLU HG3 1 1 8 2148 1 1 5 GLU N N 0.485 -2.066 5.274 1.00 . A A . 5 GLU N 1 1 8 2149 1 1 5 GLU O O 2.222 0.108 7.446 1.00 . A A . 5 GLU O 1 1 8 2150 1 1 5 GLU OE1 O 1.175 -2.284 10.324 1.00 . A A . 5 GLU OE1 1 1 8 2151 1 1 5 GLU OE2 O 3.196 -2.857 9.677 1.00 . A A . 5 GLU OE2 1 1 8 2152 1 1 6 GLU C C 3.031 2.345 4.692 1.00 . A A . 6 GLU C 1 1 8 2153 1 1 6 GLU CA C 3.395 0.913 5.069 1.00 . A A . 6 GLU CA 1 1 8 2154 1 1 6 GLU CB C 4.342 0.321 4.021 1.00 . A A . 6 GLU CB 1 1 8 2155 1 1 6 GLU CD C 6.516 1.580 4.282 1.00 . A A . 6 GLU CD 1 1 8 2156 1 1 6 GLU CG C 5.791 0.262 4.476 1.00 . A A . 6 GLU CG 1 1 8 2157 1 1 6 GLU H H 1.746 -0.225 4.387 1.00 . A A . 6 GLU H 1 1 8 2158 1 1 6 GLU HA H 3.894 0.921 6.026 1.00 . A A . 6 GLU HA 1 1 8 2159 1 1 6 GLU HB2 H 4.020 -0.683 3.786 1.00 . A A . 6 GLU HB2 1 1 8 2160 1 1 6 GLU HB3 H 4.293 0.922 3.125 1.00 . A A . 6 GLU HB3 1 1 8 2161 1 1 6 GLU HG2 H 5.816 0.006 5.524 1.00 . A A . 6 GLU HG2 1 1 8 2162 1 1 6 GLU HG3 H 6.303 -0.500 3.907 1.00 . A A . 6 GLU HG3 1 1 8 2163 1 1 6 GLU N N 2.199 0.088 5.197 1.00 . A A . 6 GLU N 1 1 8 2164 1 1 6 GLU O O 3.523 3.299 5.295 1.00 . A A . 6 GLU O 1 1 8 2165 1 1 6 GLU OE1 O 7.125 2.071 5.255 1.00 . A A . 6 GLU OE1 1 1 8 2166 1 1 6 GLU OE2 O 6.474 2.120 3.156 1.00 . A A . 6 GLU OE2 1 1 8 2167 1 1 7 PHE C C 0.700 3.693 2.124 1.00 . A A . 7 PHE C 1 1 8 2168 1 1 7 PHE CA C 1.743 3.805 3.232 1.00 . A A . 7 PHE CA 1 1 8 2169 1 1 7 PHE CB C 2.948 4.617 2.743 1.00 . A A . 7 PHE CB 1 1 8 2170 1 1 7 PHE CD1 C 4.042 5.005 0.517 1.00 . A A . 7 PHE CD1 1 1 8 2171 1 1 7 PHE CD2 C 3.644 2.754 1.195 1.00 . A A . 7 PHE CD2 1 1 8 2172 1 1 7 PHE CE1 C 4.606 4.552 -0.661 1.00 . A A . 7 PHE CE1 1 1 8 2173 1 1 7 PHE CE2 C 4.205 2.297 0.020 1.00 . A A . 7 PHE CE2 1 1 8 2174 1 1 7 PHE CG C 3.555 4.113 1.459 1.00 . A A . 7 PHE CG 1 1 8 2175 1 1 7 PHE CZ C 4.687 3.196 -0.909 1.00 . A A . 7 PHE CZ 1 1 8 2176 1 1 7 PHE H H 1.813 1.690 3.248 1.00 . A A . 7 PHE H 1 1 8 2177 1 1 7 PHE HA H 1.297 4.316 4.072 1.00 . A A . 7 PHE HA 1 1 8 2178 1 1 7 PHE HB2 H 2.640 5.639 2.581 1.00 . A A . 7 PHE HB2 1 1 8 2179 1 1 7 PHE HB3 H 3.716 4.597 3.503 1.00 . A A . 7 PHE HB3 1 1 8 2180 1 1 7 PHE HD1 H 3.980 6.066 0.710 1.00 . A A . 7 PHE HD1 1 1 8 2181 1 1 7 PHE HD2 H 3.269 2.047 1.917 1.00 . A A . 7 PHE HD2 1 1 8 2182 1 1 7 PHE HE1 H 4.982 5.258 -1.387 1.00 . A A . 7 PHE HE1 1 1 8 2183 1 1 7 PHE HE2 H 4.267 1.236 -0.172 1.00 . A A . 7 PHE HE2 1 1 8 2184 1 1 7 PHE HZ H 5.127 2.839 -1.827 1.00 . A A . 7 PHE HZ 1 1 8 2185 1 1 7 PHE N N 2.169 2.488 3.690 1.00 . A A . 7 PHE N 1 1 8 2186 1 1 7 PHE O O 0.657 2.704 1.392 1.00 . A A . 7 PHE O 1 1 8 2187 1 1 8 ILE C C -0.626 4.559 -0.400 1.00 . A A . 8 ILE C 1 1 8 2188 1 1 8 ILE CA C -1.194 4.744 1.005 1.00 . A A . 8 ILE CA 1 1 8 2189 1 1 8 ILE CB C -1.979 6.072 1.060 1.00 . A A . 8 ILE CB 1 1 8 2190 1 1 8 ILE CD1 C -3.338 7.578 2.599 1.00 . A A . 8 ILE CD1 1 1 8 2191 1 1 8 ILE CG1 C -2.568 6.283 2.456 1.00 . A A . 8 ILE CG1 1 1 8 2192 1 1 8 ILE CG2 C -3.079 6.092 0.007 1.00 . A A . 8 ILE CG2 1 1 8 2193 1 1 8 ILE H H -0.054 5.471 2.632 1.00 . A A . 8 ILE H 1 1 8 2194 1 1 8 ILE HA H -1.880 3.937 1.215 1.00 . A A . 8 ILE HA 1 1 8 2195 1 1 8 ILE HB H -1.294 6.877 0.842 1.00 . A A . 8 ILE HB 1 1 8 2196 1 1 8 ILE HD11 H -4.262 7.390 3.126 1.00 . A A . 8 ILE HD11 1 1 8 2197 1 1 8 ILE HD12 H -3.557 7.976 1.620 1.00 . A A . 8 ILE HD12 1 1 8 2198 1 1 8 ILE HD13 H -2.746 8.290 3.154 1.00 . A A . 8 ILE HD13 1 1 8 2199 1 1 8 ILE HG12 H -3.242 5.470 2.682 1.00 . A A . 8 ILE HG12 1 1 8 2200 1 1 8 ILE HG13 H -1.767 6.291 3.181 1.00 . A A . 8 ILE HG13 1 1 8 2201 1 1 8 ILE HG21 H -3.319 5.079 -0.282 1.00 . A A . 8 ILE HG21 1 1 8 2202 1 1 8 ILE HG22 H -2.739 6.641 -0.859 1.00 . A A . 8 ILE HG22 1 1 8 2203 1 1 8 ILE HG23 H -3.959 6.568 0.412 1.00 . A A . 8 ILE HG23 1 1 8 2204 1 1 8 ILE N N -0.142 4.715 2.014 1.00 . A A . 8 ILE N 1 1 8 2205 1 1 8 ILE O O 0.230 5.326 -0.841 1.00 . A A . 8 ILE O 1 1 8 2206 1 1 9 GLU C C -0.963 4.458 -3.374 1.00 . A A . 9 GLU C 1 1 8 2207 1 1 9 GLU CA C -0.673 3.268 -2.463 1.00 . A A . 9 GLU CA 1 1 8 2208 1 1 9 GLU CB C -1.364 2.011 -3.005 1.00 . A A . 9 GLU CB 1 1 8 2209 1 1 9 GLU CD C -3.613 0.933 -3.487 1.00 . A A . 9 GLU CD 1 1 8 2210 1 1 9 GLU CG C -2.825 2.227 -3.378 1.00 . A A . 9 GLU CG 1 1 8 2211 1 1 9 GLU H H -1.808 2.974 -0.701 1.00 . A A . 9 GLU H 1 1 8 2212 1 1 9 GLU HA H 0.392 3.101 -2.436 1.00 . A A . 9 GLU HA 1 1 8 2213 1 1 9 GLU HB2 H -0.836 1.676 -3.885 1.00 . A A . 9 GLU HB2 1 1 8 2214 1 1 9 GLU HB3 H -1.318 1.237 -2.253 1.00 . A A . 9 GLU HB3 1 1 8 2215 1 1 9 GLU HG2 H -3.286 2.846 -2.624 1.00 . A A . 9 GLU HG2 1 1 8 2216 1 1 9 GLU HG3 H -2.865 2.735 -4.331 1.00 . A A . 9 GLU HG3 1 1 8 2217 1 1 9 GLU N N -1.120 3.544 -1.103 1.00 . A A . 9 GLU N 1 1 8 2218 1 1 9 GLU O O -0.314 4.643 -4.404 1.00 . A A . 9 GLU O 1 1 8 2219 1 1 9 GLU OE1 O -4.844 0.946 -3.491 1.00 . A A . 9 GLU OE1 1 1 8 2220 1 1 10 GLY C C -3.755 6.847 -3.469 1.00 . A A . 10 GLY C 1 1 8 2221 1 1 10 GLY CA C -2.332 6.417 -3.762 1.00 . A A . 10 GLY CA 1 1 8 2222 1 1 10 GLY H H -2.433 5.050 -2.156 1.00 . A A . 10 GLY H 1 1 8 2223 1 1 10 GLY HA2 H -1.662 7.232 -3.528 1.00 . A A . 10 GLY HA2 1 1 8 2224 1 1 10 GLY HA3 H -2.246 6.181 -4.812 1.00 . A A . 10 GLY HA3 1 1 8 2225 1 1 10 GLY N N -1.951 5.256 -2.984 1.00 . A A . 10 GLY N 1 1 8 2226 1 1 10 GLY O O -4.102 8.019 -3.615 1.00 . A A . 10 GLY O 1 1 8 2227 1 1 11 LEU C C -6.429 5.334 -1.530 1.00 . A A . 11 LEU C 1 1 8 2228 1 1 11 LEU CA C -5.975 6.163 -2.729 1.00 . A A . 11 LEU CA 1 1 8 2229 1 1 11 LEU CB C -6.867 5.865 -3.937 1.00 . A A . 11 LEU CB 1 1 8 2230 1 1 11 LEU CD1 C -6.964 5.564 -6.423 1.00 . A A . 11 LEU CD1 1 1 8 2231 1 1 11 LEU CD2 C -6.531 7.830 -5.457 1.00 . A A . 11 LEU CD2 1 1 8 2232 1 1 11 LEU CG C -6.314 6.334 -5.284 1.00 . A A . 11 LEU CG 1 1 8 2233 1 1 11 LEU H H -4.237 4.976 -2.954 1.00 . A A . 11 LEU H 1 1 8 2234 1 1 11 LEU HA H -6.059 7.211 -2.480 1.00 . A A . 11 LEU HA 1 1 8 2235 1 1 11 LEU HB2 H -7.023 4.797 -3.986 1.00 . A A . 11 LEU HB2 1 1 8 2236 1 1 11 LEU HB3 H -7.822 6.344 -3.779 1.00 . A A . 11 LEU HB3 1 1 8 2237 1 1 11 LEU HD11 H -7.776 6.144 -6.833 1.00 . A A . 11 LEU HD11 1 1 8 2238 1 1 11 LEU HD12 H -7.344 4.624 -6.051 1.00 . A A . 11 LEU HD12 1 1 8 2239 1 1 11 LEU HD13 H -6.231 5.375 -7.194 1.00 . A A . 11 LEU HD13 1 1 8 2240 1 1 11 LEU HD21 H -5.624 8.357 -5.201 1.00 . A A . 11 LEU HD21 1 1 8 2241 1 1 11 LEU HD22 H -7.331 8.156 -4.808 1.00 . A A . 11 LEU HD22 1 1 8 2242 1 1 11 LEU HD23 H -6.792 8.041 -6.483 1.00 . A A . 11 LEU HD23 1 1 8 2243 1 1 11 LEU HG H -5.252 6.143 -5.316 1.00 . A A . 11 LEU HG 1 1 8 2244 1 1 11 LEU N N -4.579 5.890 -3.051 1.00 . A A . 11 LEU N 1 1 8 2245 1 1 11 LEU O O -7.070 5.848 -0.614 1.00 . A A . 11 LEU O 1 1 8 2246 1 1 12 VAL C C -5.707 3.497 0.827 1.00 . A A . 12 VAL C 1 1 8 2247 1 1 12 VAL CA C -6.460 3.144 -0.460 1.00 . A A . 12 VAL CA 1 1 8 2248 1 1 12 VAL CB C -6.194 1.670 -0.855 1.00 . A A . 12 VAL CB 1 1 8 2249 1 1 12 VAL CG1 C -4.776 1.240 -0.498 1.00 . A A . 12 VAL CG1 1 1 8 2250 1 1 12 VAL CG2 C -7.221 0.747 -0.214 1.00 . A A . 12 VAL CG2 1 1 8 2251 1 1 12 VAL H H -5.579 3.697 -2.302 1.00 . A A . 12 VAL H 1 1 8 2252 1 1 12 VAL HA H -7.520 3.260 -0.283 1.00 . A A . 12 VAL HA 1 1 8 2253 1 1 12 VAL HB H -6.302 1.590 -1.927 1.00 . A A . 12 VAL HB 1 1 8 2254 1 1 12 VAL HG11 H -4.111 2.085 -0.587 1.00 . A A . 12 VAL HG11 1 1 8 2255 1 1 12 VAL HG12 H -4.457 0.457 -1.170 1.00 . A A . 12 VAL HG12 1 1 8 2256 1 1 12 VAL HG13 H -4.757 0.872 0.517 1.00 . A A . 12 VAL HG13 1 1 8 2257 1 1 12 VAL HG21 H -6.752 0.177 0.575 1.00 . A A . 12 VAL HG21 1 1 8 2258 1 1 12 VAL HG22 H -7.614 0.072 -0.960 1.00 . A A . 12 VAL HG22 1 1 8 2259 1 1 12 VAL HG23 H -8.028 1.335 0.199 1.00 . A A . 12 VAL HG23 1 1 8 2260 1 1 12 VAL N N -6.090 4.048 -1.544 1.00 . A A . 12 VAL N 1 1 8 2261 1 1 12 VAL O O -5.130 4.578 0.937 1.00 . A A . 12 VAL O 1 1 8 2262 1 1 13 ARG C C -3.572 2.392 2.986 1.00 . A A . 13 ARG C 1 1 8 2263 1 1 13 ARG CA C -5.035 2.816 3.067 1.00 . A A . 13 ARG CA 1 1 8 2264 1 1 13 ARG CB C -5.741 2.055 4.192 1.00 . A A . 13 ARG CB 1 1 8 2265 1 1 13 ARG CD C -7.070 -0.035 3.755 1.00 . A A . 13 ARG CD 1 1 8 2266 1 1 13 ARG CG C -5.692 0.544 4.032 1.00 . A A . 13 ARG CG 1 1 8 2267 1 1 13 ARG CZ C -8.387 -1.979 4.505 1.00 . A A . 13 ARG CZ 1 1 8 2268 1 1 13 ARG H H -6.194 1.744 1.659 1.00 . A A . 13 ARG H 1 1 8 2269 1 1 13 ARG HA H -5.077 3.873 3.278 1.00 . A A . 13 ARG HA 1 1 8 2270 1 1 13 ARG HB2 H -5.275 2.311 5.132 1.00 . A A . 13 ARG HB2 1 1 8 2271 1 1 13 ARG HB3 H -6.777 2.360 4.221 1.00 . A A . 13 ARG HB3 1 1 8 2272 1 1 13 ARG HD2 H -7.812 0.602 4.214 1.00 . A A . 13 ARG HD2 1 1 8 2273 1 1 13 ARG HD3 H -7.229 -0.059 2.687 1.00 . A A . 13 ARG HD3 1 1 8 2274 1 1 13 ARG HE H -6.393 -1.884 4.490 1.00 . A A . 13 ARG HE 1 1 8 2275 1 1 13 ARG HG2 H -5.039 0.300 3.207 1.00 . A A . 13 ARG HG2 1 1 8 2276 1 1 13 ARG HG3 H -5.304 0.108 4.941 1.00 . A A . 13 ARG HG3 1 1 8 2277 1 1 13 ARG HH11 H -9.496 -0.407 3.882 1.00 . A A . 13 ARG HH11 1 1 8 2278 1 1 13 ARG HH12 H -10.397 -1.787 4.411 1.00 . A A . 13 ARG HH12 1 1 8 2279 1 1 13 ARG HH21 H -7.576 -3.701 5.185 1.00 . A A . 13 ARG HH21 1 1 8 2280 1 1 13 ARG HH22 H -9.308 -3.658 5.151 1.00 . A A . 13 ARG HH22 1 1 8 2281 1 1 13 ARG N N -5.718 2.587 1.798 1.00 . A A . 13 ARG N 1 1 8 2282 1 1 13 ARG NE N -7.214 -1.388 4.287 1.00 . A A . 13 ARG NE 1 1 8 2283 1 1 13 ARG NH1 N -9.519 -1.338 4.245 1.00 . A A . 13 ARG NH1 1 1 8 2284 1 1 13 ARG NH2 N -8.427 -3.214 4.987 1.00 . A A . 13 ARG NH2 1 1 8 2285 1 1 13 ARG O O -3.066 2.080 1.909 1.00 . A A . 13 ARG O 1 1 8 2286 1 1 14 ASP C C -1.224 0.694 3.480 1.00 . A A . 14 ASP C 1 1 8 2287 1 1 14 ASP CA C -1.486 2.015 4.201 1.00 . A A . 14 ASP CA 1 1 8 2288 1 1 14 ASP CB C -1.037 1.907 5.660 1.00 . A A . 14 ASP CB 1 1 8 2289 1 1 14 ASP CG C -0.934 3.261 6.335 1.00 . A A . 14 ASP CG 1 1 8 2290 1 1 14 ASP H H -3.354 2.657 4.957 1.00 . A A . 14 ASP H 1 1 8 2291 1 1 14 ASP HA H -0.915 2.792 3.718 1.00 . A A . 14 ASP HA 1 1 8 2292 1 1 14 ASP HB2 H -1.750 1.307 6.206 1.00 . A A . 14 ASP HB2 1 1 8 2293 1 1 14 ASP HB3 H -0.068 1.431 5.698 1.00 . A A . 14 ASP HB3 1 1 8 2294 1 1 14 ASP N N -2.895 2.392 4.134 1.00 . A A . 14 ASP N 1 1 8 2295 1 1 14 ASP O O -1.323 -0.380 4.074 1.00 . A A . 14 ASP O 1 1 8 2296 1 1 14 ASP OD1 O 0.144 3.886 6.249 1.00 . A A . 14 ASP OD1 1 1 8 2297 1 1 14 ASP OD2 O -1.931 3.695 6.949 1.00 . A A . 14 ASP OD2 1 1 8 2298 1 1 15 SER C C 0.677 -1.084 1.864 1.00 . A A . 15 SER C 1 1 8 2299 1 1 15 SER CA C -0.605 -0.402 1.394 1.00 . A A . 15 SER CA 1 1 8 2300 1 1 15 SER CB C -0.485 -0.026 -0.084 1.00 . A A . 15 SER CB 1 1 8 2301 1 1 15 SER H H -0.823 1.669 1.782 1.00 . A A . 15 SER H 1 1 8 2302 1 1 15 SER HA H -1.430 -1.088 1.517 1.00 . A A . 15 SER HA 1 1 8 2303 1 1 15 SER HB2 H -1.028 0.890 -0.265 1.00 . A A . 15 SER HB2 1 1 8 2304 1 1 15 SER HB3 H 0.556 0.117 -0.333 1.00 . A A . 15 SER HB3 1 1 8 2305 1 1 15 SER HG H -0.316 -1.419 -1.451 1.00 . A A . 15 SER HG 1 1 8 2306 1 1 15 SER N N -0.886 0.784 2.198 1.00 . A A . 15 SER N 1 1 8 2307 1 1 15 SER O O 1.217 -0.750 2.918 1.00 . A A . 15 SER O 1 1 8 2308 1 1 15 SER OG O -1.018 -1.043 -0.914 1.00 . A A . 15 SER OG 1 1 8 2309 1 1 16 LEU C C 3.441 -2.582 0.332 1.00 . A A . 16 LEU C 1 1 8 2310 1 1 16 LEU CA C 2.380 -2.765 1.414 1.00 . A A . 16 LEU CA 1 1 8 2311 1 1 16 LEU CB C 2.076 -4.254 1.606 1.00 . A A . 16 LEU CB 1 1 8 2312 1 1 16 LEU CD1 C 1.953 -6.171 3.216 1.00 . A A . 16 LEU CD1 1 1 8 2313 1 1 16 LEU CD2 C 4.161 -5.125 2.691 1.00 . A A . 16 LEU CD2 1 1 8 2314 1 1 16 LEU CG C 2.671 -4.877 2.870 1.00 . A A . 16 LEU CG 1 1 8 2315 1 1 16 LEU H H 0.686 -2.261 0.247 1.00 . A A . 16 LEU H 1 1 8 2316 1 1 16 LEU HA H 2.757 -2.362 2.342 1.00 . A A . 16 LEU HA 1 1 8 2317 1 1 16 LEU HB2 H 1.004 -4.379 1.640 1.00 . A A . 16 LEU HB2 1 1 8 2318 1 1 16 LEU HB3 H 2.457 -4.794 0.753 1.00 . A A . 16 LEU HB3 1 1 8 2319 1 1 16 LEU HD11 H 0.970 -6.168 2.769 1.00 . A A . 16 LEU HD11 1 1 8 2320 1 1 16 LEU HD12 H 1.860 -6.256 4.289 1.00 . A A . 16 LEU HD12 1 1 8 2321 1 1 16 LEU HD13 H 2.518 -7.009 2.837 1.00 . A A . 16 LEU HD13 1 1 8 2322 1 1 16 LEU HD21 H 4.321 -6.147 2.379 1.00 . A A . 16 LEU HD21 1 1 8 2323 1 1 16 LEU HD22 H 4.670 -4.951 3.627 1.00 . A A . 16 LEU HD22 1 1 8 2324 1 1 16 LEU HD23 H 4.550 -4.454 1.940 1.00 . A A . 16 LEU HD23 1 1 8 2325 1 1 16 LEU HG H 2.542 -4.192 3.695 1.00 . A A . 16 LEU HG 1 1 8 2326 1 1 16 LEU N N 1.160 -2.039 1.075 1.00 . A A . 16 LEU N 1 1 8 2327 1 1 16 LEU O O 4.124 -3.533 -0.050 1.00 . A A . 16 LEU O 1 1 8 2328 1 1 17 TYR C C 4.576 -2.090 -2.292 1.00 . A A . 17 TYR C 1 1 8 2329 1 1 17 TYR CA C 4.549 -1.024 -1.196 1.00 . A A . 17 TYR CA 1 1 8 2330 1 1 17 TYR CB C 5.946 -0.856 -0.588 1.00 . A A . 17 TYR CB 1 1 8 2331 1 1 17 TYR CD1 C 6.015 -1.899 1.710 1.00 . A A . 17 TYR CD1 1 1 8 2332 1 1 17 TYR CD2 C 7.038 -3.079 -0.091 1.00 . A A . 17 TYR CD2 1 1 8 2333 1 1 17 TYR CE1 C 6.374 -2.910 2.581 1.00 . A A . 17 TYR CE1 1 1 8 2334 1 1 17 TYR CE2 C 7.400 -4.094 0.773 1.00 . A A . 17 TYR CE2 1 1 8 2335 1 1 17 TYR CG C 6.340 -1.966 0.361 1.00 . A A . 17 TYR CG 1 1 8 2336 1 1 17 TYR CZ C 7.066 -4.005 2.108 1.00 . A A . 17 TYR CZ 1 1 8 2337 1 1 17 TYR H H 2.997 -0.638 0.194 1.00 . A A . 17 TYR H 1 1 8 2338 1 1 17 TYR HA H 4.250 -0.086 -1.640 1.00 . A A . 17 TYR HA 1 1 8 2339 1 1 17 TYR HB2 H 6.675 -0.829 -1.384 1.00 . A A . 17 TYR HB2 1 1 8 2340 1 1 17 TYR HB3 H 5.982 0.076 -0.043 1.00 . A A . 17 TYR HB3 1 1 8 2341 1 1 17 TYR HD1 H 5.472 -1.041 2.078 1.00 . A A . 17 TYR HD1 1 1 8 2342 1 1 17 TYR HD2 H 7.299 -3.145 -1.137 1.00 . A A . 17 TYR HD2 1 1 8 2343 1 1 17 TYR HE1 H 6.112 -2.840 3.627 1.00 . A A . 17 TYR HE1 1 1 8 2344 1 1 17 TYR HE2 H 7.942 -4.951 0.402 1.00 . A A . 17 TYR HE2 1 1 8 2345 1 1 17 TYR HH H 6.770 -5.715 2.936 1.00 . A A . 17 TYR HH 1 1 8 2346 1 1 17 TYR N N 3.573 -1.350 -0.155 1.00 . A A . 17 TYR N 1 1 8 2347 1 1 17 TYR O O 5.595 -2.746 -2.509 1.00 . A A . 17 TYR O 1 1 8 2348 1 1 17 TYR OH O 7.425 -5.014 2.972 1.00 . A A . 17 TYR OH 1 1 8 2349 1 1 18 PRO C C 4.472 -3.117 -5.106 1.00 . A A . 18 PRO C 1 1 8 2350 1 1 18 PRO CA C 3.350 -3.265 -4.080 1.00 . A A . 18 PRO CA 1 1 8 2351 1 1 18 PRO CB C 1.995 -2.956 -4.723 1.00 . A A . 18 PRO CB 1 1 8 2352 1 1 18 PRO CD C 2.188 -1.535 -2.811 1.00 . A A . 18 PRO CD 1 1 8 2353 1 1 18 PRO CG C 1.202 -2.308 -3.642 1.00 . A A . 18 PRO CG 1 1 8 2354 1 1 18 PRO HA H 3.345 -4.273 -3.692 1.00 . A A . 18 PRO HA 1 1 8 2355 1 1 18 PRO HB2 H 2.136 -2.293 -5.564 1.00 . A A . 18 PRO HB2 1 1 8 2356 1 1 18 PRO HB3 H 1.533 -3.874 -5.054 1.00 . A A . 18 PRO HB3 1 1 8 2357 1 1 18 PRO HD2 H 2.276 -0.522 -3.176 1.00 . A A . 18 PRO HD2 1 1 8 2358 1 1 18 PRO HD3 H 1.892 -1.540 -1.773 1.00 . A A . 18 PRO HD3 1 1 8 2359 1 1 18 PRO HG2 H 0.470 -1.641 -4.074 1.00 . A A . 18 PRO HG2 1 1 8 2360 1 1 18 PRO HG3 H 0.715 -3.062 -3.041 1.00 . A A . 18 PRO HG3 1 1 8 2361 1 1 18 PRO N N 3.449 -2.276 -3.002 1.00 . A A . 18 PRO N 1 1 8 2362 1 1 18 PRO O O 4.469 -2.181 -5.906 1.00 . A A . 18 PRO O 1 1 8 2363 1 1 19 PRO C C 6.144 -4.231 -7.479 1.00 . A A . 19 PRO C 1 1 8 2364 1 1 19 PRO CA C 6.580 -3.997 -6.036 1.00 . A A . 19 PRO CA 1 1 8 2365 1 1 19 PRO CB C 7.489 -5.134 -5.561 1.00 . A A . 19 PRO CB 1 1 8 2366 1 1 19 PRO CD C 5.540 -5.191 -4.181 1.00 . A A . 19 PRO CD 1 1 8 2367 1 1 19 PRO CG C 6.589 -6.058 -4.816 1.00 . A A . 19 PRO CG 1 1 8 2368 1 1 19 PRO HA H 7.110 -3.058 -5.972 1.00 . A A . 19 PRO HA 1 1 8 2369 1 1 19 PRO HB2 H 7.937 -5.621 -6.415 1.00 . A A . 19 PRO HB2 1 1 8 2370 1 1 19 PRO HB3 H 8.262 -4.736 -4.920 1.00 . A A . 19 PRO HB3 1 1 8 2371 1 1 19 PRO HD2 H 4.598 -5.716 -4.129 1.00 . A A . 19 PRO HD2 1 1 8 2372 1 1 19 PRO HD3 H 5.854 -4.876 -3.197 1.00 . A A . 19 PRO HD3 1 1 8 2373 1 1 19 PRO HG2 H 6.133 -6.758 -5.501 1.00 . A A . 19 PRO HG2 1 1 8 2374 1 1 19 PRO HG3 H 7.149 -6.585 -4.058 1.00 . A A . 19 PRO HG3 1 1 8 2375 1 1 19 PRO N N 5.452 -4.039 -5.098 1.00 . A A . 19 PRO N 1 1 8 2376 1 1 19 PRO O O 6.821 -3.812 -8.417 1.00 . A A . 19 PRO O 1 1 8 2377 1 1 20 ALA C C 3.434 -4.164 -9.388 1.00 . A A . 20 ALA C 1 1 8 2378 1 1 20 ALA CA C 4.484 -5.190 -8.978 1.00 . A A . 20 ALA CA 1 1 8 2379 1 1 20 ALA CB C 3.899 -6.594 -9.021 1.00 . A A . 20 ALA CB 1 1 8 2380 1 1 20 ALA H H 4.513 -5.211 -6.863 1.00 . A A . 20 ALA H 1 1 8 2381 1 1 20 ALA HA H 5.307 -5.147 -9.677 1.00 . A A . 20 ALA HA 1 1 8 2382 1 1 20 ALA HB1 H 3.733 -6.883 -10.048 1.00 . A A . 20 ALA HB1 1 1 8 2383 1 1 20 ALA HB2 H 2.962 -6.610 -8.486 1.00 . A A . 20 ALA HB2 1 1 8 2384 1 1 20 ALA HB3 H 4.589 -7.286 -8.560 1.00 . A A . 20 ALA HB3 1 1 8 2385 1 1 20 ALA N N 5.009 -4.902 -7.649 1.00 . A A . 20 ALA N 1 1 8 2386 1 1 20 ALA O O 2.426 -4.505 -10.007 1.00 . A A . 20 ALA O 1 1 8 2387 1 1 21 GLY C C 3.414 -0.681 -10.075 1.00 . A A . 21 GLY C 1 1 8 2388 1 1 21 GLY CA C 2.742 -1.846 -9.376 1.00 . A A . 21 GLY CA 1 1 8 2389 1 1 21 GLY H H 4.496 -2.692 -8.544 1.00 . A A . 21 GLY H 1 1 8 2390 1 1 21 GLY HA2 H 1.978 -2.249 -10.026 1.00 . A A . 21 GLY HA2 1 1 8 2391 1 1 21 GLY HA3 H 2.276 -1.488 -8.470 1.00 . A A . 21 GLY HA3 1 1 8 2392 1 1 21 GLY N N 3.676 -2.904 -9.037 1.00 . A A . 21 GLY N 1 1 9 2393 1 1 1 ASP C C -4.775 -2.360 -2.309 1.00 . A A . 1 ASP C 1 1 9 2394 1 1 1 ASP CA C -3.551 -2.347 -3.219 1.00 . A A . 1 ASP CA 1 1 9 2395 1 1 1 ASP CB C -2.726 -3.618 -3.005 1.00 . A A . 1 ASP CB 1 1 9 2396 1 1 1 ASP CG C -3.504 -4.876 -3.339 1.00 . A A . 1 ASP CG 1 1 9 2397 1 1 1 ASP H1 H -2.050 -1.320 -2.287 1.00 . A A . 1 ASP H1 1 1 9 2398 1 1 1 ASP HA H -3.882 -2.312 -4.246 1.00 . A A . 1 ASP HA 1 1 9 2399 1 1 1 ASP HB2 H -1.850 -3.582 -3.635 1.00 . A A . 1 ASP HB2 1 1 9 2400 1 1 1 ASP HB3 H -2.419 -3.670 -1.971 1.00 . A A . 1 ASP HB3 1 1 9 2401 1 1 1 ASP N N -2.732 -1.165 -2.972 1.00 . A A . 1 ASP N 1 1 9 2402 1 1 1 ASP O O -5.901 -2.163 -2.764 1.00 . A A . 1 ASP O 1 1 9 2403 1 1 1 ASP OD1 O -3.527 -5.261 -4.527 1.00 . A A . 1 ASP OD1 1 1 9 2404 1 1 1 ASP OD2 O -4.089 -5.476 -2.413 1.00 . A A . 1 ASP OD2 1 1 9 2405 1 1 2 GLY C C -5.331 -3.475 1.148 1.00 . A A . 2 GLY C 1 1 9 2406 1 1 2 GLY CA C -5.641 -2.622 -0.067 1.00 . A A . 2 GLY CA 1 1 9 2407 1 1 2 GLY H H -3.628 -2.739 -0.712 1.00 . A A . 2 GLY H 1 1 9 2408 1 1 2 GLY HA2 H -5.849 -1.614 0.259 1.00 . A A . 2 GLY HA2 1 1 9 2409 1 1 2 GLY HA3 H -6.518 -3.019 -0.557 1.00 . A A . 2 GLY HA3 1 1 9 2410 1 1 2 GLY N N -4.546 -2.590 -1.019 1.00 . A A . 2 GLY N 1 1 9 2411 1 1 2 GLY O O -5.829 -3.212 2.243 1.00 . A A . 2 GLY O 1 1 9 2412 1 1 3 MET C C -2.687 -5.160 2.473 1.00 . A A . 3 MET C 1 1 9 2413 1 1 3 MET CA C -4.134 -5.396 2.045 1.00 . A A . 3 MET CA 1 1 9 2414 1 1 3 MET CB C -4.326 -6.854 1.621 1.00 . A A . 3 MET CB 1 1 9 2415 1 1 3 MET CE C -3.473 -10.086 3.137 1.00 . A A . 3 MET CE 1 1 9 2416 1 1 3 MET CG C -4.886 -7.740 2.721 1.00 . A A . 3 MET CG 1 1 9 2417 1 1 3 MET H H -4.144 -4.660 0.060 1.00 . A A . 3 MET H 1 1 9 2418 1 1 3 MET HA H -4.782 -5.186 2.883 1.00 . A A . 3 MET HA 1 1 9 2419 1 1 3 MET HB2 H -5.006 -6.885 0.782 1.00 . A A . 3 MET HB2 1 1 9 2420 1 1 3 MET HB3 H -3.372 -7.257 1.314 1.00 . A A . 3 MET HB3 1 1 9 2421 1 1 3 MET HE1 H -2.730 -10.416 2.426 1.00 . A A . 3 MET HE1 1 1 9 2422 1 1 3 MET HE2 H -3.757 -10.914 3.771 1.00 . A A . 3 MET HE2 1 1 9 2423 1 1 3 MET HE3 H -3.062 -9.293 3.744 1.00 . A A . 3 MET HE3 1 1 9 2424 1 1 3 MET HG2 H -4.275 -7.625 3.604 1.00 . A A . 3 MET HG2 1 1 9 2425 1 1 3 MET HG3 H -5.896 -7.424 2.941 1.00 . A A . 3 MET HG3 1 1 9 2426 1 1 3 MET N N -4.508 -4.501 0.956 1.00 . A A . 3 MET N 1 1 9 2427 1 1 3 MET O O -1.876 -6.087 2.495 1.00 . A A . 3 MET O 1 1 9 2428 1 1 3 MET SD S -4.913 -9.483 2.261 1.00 . A A . 3 MET SD 1 1 9 2429 1 1 4 GLY C C -1.001 -2.622 4.407 1.00 . A A . 4 GLY C 1 1 9 2430 1 1 4 GLY CA C -1.022 -3.581 3.233 1.00 . A A . 4 GLY CA 1 1 9 2431 1 1 4 GLY H H -3.057 -3.217 2.774 1.00 . A A . 4 GLY H 1 1 9 2432 1 1 4 GLY HA2 H -0.510 -4.488 3.515 1.00 . A A . 4 GLY HA2 1 1 9 2433 1 1 4 GLY HA3 H -0.500 -3.128 2.404 1.00 . A A . 4 GLY HA3 1 1 9 2434 1 1 4 GLY N N -2.370 -3.915 2.811 1.00 . A A . 4 GLY N 1 1 9 2435 1 1 4 GLY O O -2.051 -2.252 4.934 1.00 . A A . 4 GLY O 1 1 9 2436 1 1 5 GLU C C 1.699 -0.579 5.874 1.00 . A A . 5 GLU C 1 1 9 2437 1 1 5 GLU CA C 0.349 -1.290 5.933 1.00 . A A . 5 GLU CA 1 1 9 2438 1 1 5 GLU CB C 0.203 -2.032 7.264 1.00 . A A . 5 GLU CB 1 1 9 2439 1 1 5 GLU CD C 1.285 -3.795 8.714 1.00 . A A . 5 GLU CD 1 1 9 2440 1 1 5 GLU CG C 0.936 -3.363 7.303 1.00 . A A . 5 GLU CG 1 1 9 2441 1 1 5 GLU H H 0.997 -2.543 4.354 1.00 . A A . 5 GLU H 1 1 9 2442 1 1 5 GLU HA H -0.435 -0.549 5.856 1.00 . A A . 5 GLU HA 1 1 9 2443 1 1 5 GLU HB2 H 0.592 -1.408 8.055 1.00 . A A . 5 GLU HB2 1 1 9 2444 1 1 5 GLU HB3 H -0.845 -2.217 7.447 1.00 . A A . 5 GLU HB3 1 1 9 2445 1 1 5 GLU HG2 H 0.306 -4.119 6.858 1.00 . A A . 5 GLU HG2 1 1 9 2446 1 1 5 GLU HG3 H 1.849 -3.274 6.733 1.00 . A A . 5 GLU HG3 1 1 9 2447 1 1 5 GLU N N 0.197 -2.215 4.816 1.00 . A A . 5 GLU N 1 1 9 2448 1 1 5 GLU O O 2.522 -0.708 6.780 1.00 . A A . 5 GLU O 1 1 9 2449 1 1 5 GLU OE1 O 2.226 -3.216 9.296 1.00 . A A . 5 GLU OE1 1 1 9 2450 1 1 5 GLU OE2 O 0.617 -4.712 9.237 1.00 . A A . 5 GLU OE2 1 1 9 2451 1 1 6 GLU C C 2.877 2.361 4.242 1.00 . A A . 6 GLU C 1 1 9 2452 1 1 6 GLU CA C 3.161 0.914 4.622 1.00 . A A . 6 GLU CA 1 1 9 2453 1 1 6 GLU CB C 4.030 0.264 3.541 1.00 . A A . 6 GLU CB 1 1 9 2454 1 1 6 GLU CD C 4.873 -1.888 4.560 1.00 . A A . 6 GLU CD 1 1 9 2455 1 1 6 GLU CG C 3.964 -1.253 3.526 1.00 . A A . 6 GLU CG 1 1 9 2456 1 1 6 GLU H H 1.219 0.242 4.115 1.00 . A A . 6 GLU H 1 1 9 2457 1 1 6 GLU HA H 3.695 0.898 5.560 1.00 . A A . 6 GLU HA 1 1 9 2458 1 1 6 GLU HB2 H 3.710 0.623 2.575 1.00 . A A . 6 GLU HB2 1 1 9 2459 1 1 6 GLU HB3 H 5.058 0.556 3.700 1.00 . A A . 6 GLU HB3 1 1 9 2460 1 1 6 GLU HG2 H 2.949 -1.557 3.726 1.00 . A A . 6 GLU HG2 1 1 9 2461 1 1 6 GLU HG3 H 4.258 -1.601 2.546 1.00 . A A . 6 GLU HG3 1 1 9 2462 1 1 6 GLU N N 1.915 0.176 4.801 1.00 . A A . 6 GLU N 1 1 9 2463 1 1 6 GLU O O 3.447 3.289 4.817 1.00 . A A . 6 GLU O 1 1 9 2464 1 1 6 GLU OE1 O 5.244 -1.194 5.530 1.00 . A A . 6 GLU OE1 1 1 9 2465 1 1 6 GLU OE2 O 5.212 -3.079 4.400 1.00 . A A . 6 GLU OE2 1 1 9 2466 1 1 7 PHE C C 0.503 3.836 1.792 1.00 . A A . 7 PHE C 1 1 9 2467 1 1 7 PHE CA C 1.639 3.882 2.807 1.00 . A A . 7 PHE CA 1 1 9 2468 1 1 7 PHE CB C 2.863 4.581 2.208 1.00 . A A . 7 PHE CB 1 1 9 2469 1 1 7 PHE CD1 C 3.300 2.652 0.644 1.00 . A A . 7 PHE CD1 1 1 9 2470 1 1 7 PHE CD2 C 3.741 4.866 -0.124 1.00 . A A . 7 PHE CD2 1 1 9 2471 1 1 7 PHE CE1 C 3.713 2.145 -0.574 1.00 . A A . 7 PHE CE1 1 1 9 2472 1 1 7 PHE CE2 C 4.154 4.365 -1.343 1.00 . A A . 7 PHE CE2 1 1 9 2473 1 1 7 PHE CG C 3.309 4.019 0.883 1.00 . A A . 7 PHE CG 1 1 9 2474 1 1 7 PHE CZ C 4.140 3.002 -1.568 1.00 . A A . 7 PHE CZ 1 1 9 2475 1 1 7 PHE H H 1.575 1.768 2.845 1.00 . A A . 7 PHE H 1 1 9 2476 1 1 7 PHE HA H 1.302 4.442 3.666 1.00 . A A . 7 PHE HA 1 1 9 2477 1 1 7 PHE HB2 H 2.635 5.625 2.062 1.00 . A A . 7 PHE HB2 1 1 9 2478 1 1 7 PHE HB3 H 3.689 4.494 2.900 1.00 . A A . 7 PHE HB3 1 1 9 2479 1 1 7 PHE HD1 H 2.967 1.978 1.417 1.00 . A A . 7 PHE HD1 1 1 9 2480 1 1 7 PHE HD2 H 3.753 5.931 0.051 1.00 . A A . 7 PHE HD2 1 1 9 2481 1 1 7 PHE HE1 H 3.701 1.079 -0.747 1.00 . A A . 7 PHE HE1 1 1 9 2482 1 1 7 PHE HE2 H 4.489 5.037 -2.120 1.00 . A A . 7 PHE HE2 1 1 9 2483 1 1 7 PHE HZ H 4.463 2.608 -2.520 1.00 . A A . 7 PHE HZ 1 1 9 2484 1 1 7 PHE N N 1.994 2.547 3.267 1.00 . A A . 7 PHE N 1 1 9 2485 1 1 7 PHE O O 0.445 2.947 0.944 1.00 . A A . 7 PHE O 1 1 9 2486 1 1 8 ILE C C -1.189 4.609 -0.442 1.00 . A A . 8 ILE C 1 1 9 2487 1 1 8 ILE CA C -1.561 4.897 1.010 1.00 . A A . 8 ILE CA 1 1 9 2488 1 1 8 ILE CB C -2.219 6.291 1.091 1.00 . A A . 8 ILE CB 1 1 9 2489 1 1 8 ILE CD1 C -3.233 7.986 2.702 1.00 . A A . 8 ILE CD1 1 1 9 2490 1 1 8 ILE CG1 C -2.550 6.644 2.544 1.00 . A A . 8 ILE CG1 1 1 9 2491 1 1 8 ILE CG2 C -3.474 6.339 0.228 1.00 . A A . 8 ILE CG2 1 1 9 2492 1 1 8 ILE H H -0.296 5.475 2.604 1.00 . A A . 8 ILE H 1 1 9 2493 1 1 8 ILE HA H -2.286 4.166 1.334 1.00 . A A . 8 ILE HA 1 1 9 2494 1 1 8 ILE HB H -1.520 7.016 0.703 1.00 . A A . 8 ILE HB 1 1 9 2495 1 1 8 ILE HD11 H -2.809 8.508 3.547 1.00 . A A . 8 ILE HD11 1 1 9 2496 1 1 8 ILE HD12 H -4.290 7.835 2.865 1.00 . A A . 8 ILE HD12 1 1 9 2497 1 1 8 ILE HD13 H -3.087 8.572 1.807 1.00 . A A . 8 ILE HD13 1 1 9 2498 1 1 8 ILE HG12 H -3.207 5.890 2.951 1.00 . A A . 8 ILE HG12 1 1 9 2499 1 1 8 ILE HG13 H -1.637 6.668 3.120 1.00 . A A . 8 ILE HG13 1 1 9 2500 1 1 8 ILE HG21 H -3.256 6.851 -0.697 1.00 . A A . 8 ILE HG21 1 1 9 2501 1 1 8 ILE HG22 H -4.256 6.866 0.755 1.00 . A A . 8 ILE HG22 1 1 9 2502 1 1 8 ILE HG23 H -3.802 5.332 0.013 1.00 . A A . 8 ILE HG23 1 1 9 2503 1 1 8 ILE N N -0.404 4.805 1.899 1.00 . A A . 8 ILE N 1 1 9 2504 1 1 8 ILE O O -0.354 5.297 -1.030 1.00 . A A . 8 ILE O 1 1 9 2505 1 1 9 GLU C C -1.898 4.376 -3.343 1.00 . A A . 9 GLU C 1 1 9 2506 1 1 9 GLU CA C -1.577 3.216 -2.404 1.00 . A A . 9 GLU CA 1 1 9 2507 1 1 9 GLU CB C -2.420 1.994 -2.780 1.00 . A A . 9 GLU CB 1 1 9 2508 1 1 9 GLU CD C -2.510 -0.258 -3.918 1.00 . A A . 9 GLU CD 1 1 9 2509 1 1 9 GLU CG C -1.642 0.921 -3.523 1.00 . A A . 9 GLU CG 1 1 9 2510 1 1 9 GLU H H -2.487 3.089 -0.497 1.00 . A A . 9 GLU H 1 1 9 2511 1 1 9 GLU HA H -0.532 2.967 -2.499 1.00 . A A . 9 GLU HA 1 1 9 2512 1 1 9 GLU HB2 H -2.823 1.558 -1.879 1.00 . A A . 9 GLU HB2 1 1 9 2513 1 1 9 GLU HB3 H -3.238 2.315 -3.409 1.00 . A A . 9 GLU HB3 1 1 9 2514 1 1 9 GLU HG2 H -1.221 1.354 -4.418 1.00 . A A . 9 GLU HG2 1 1 9 2515 1 1 9 GLU HG3 H -0.845 0.566 -2.887 1.00 . A A . 9 GLU HG3 1 1 9 2516 1 1 9 GLU N N -1.826 3.592 -1.017 1.00 . A A . 9 GLU N 1 1 9 2517 1 1 9 GLU O O -1.417 4.424 -4.475 1.00 . A A . 9 GLU O 1 1 9 2518 1 1 9 GLU OE1 O -2.974 -0.348 -5.055 1.00 . A A . 9 GLU OE1 1 1 9 2519 1 1 10 GLY C C -4.416 7.051 -3.208 1.00 . A A . 10 GLY C 1 1 9 2520 1 1 10 GLY CA C -3.101 6.450 -3.662 1.00 . A A . 10 GLY CA 1 1 9 2521 1 1 10 GLY H H -3.072 5.208 -1.954 1.00 . A A . 10 GLY H 1 1 9 2522 1 1 10 GLY HA2 H -2.328 7.201 -3.589 1.00 . A A . 10 GLY HA2 1 1 9 2523 1 1 10 GLY HA3 H -3.194 6.142 -4.693 1.00 . A A . 10 GLY HA3 1 1 9 2524 1 1 10 GLY N N -2.718 5.304 -2.862 1.00 . A A . 10 GLY N 1 1 9 2525 1 1 10 GLY O O -4.693 8.222 -3.466 1.00 . A A . 10 GLY O 1 1 9 2526 1 1 11 LEU C C -6.593 6.632 -0.514 1.00 . A A . 11 LEU C 1 1 9 2527 1 1 11 LEU CA C -6.525 6.704 -2.038 1.00 . A A . 11 LEU CA 1 1 9 2528 1 1 11 LEU CB C -7.652 5.869 -2.650 1.00 . A A . 11 LEU CB 1 1 9 2529 1 1 11 LEU CD1 C -7.971 4.186 -4.483 1.00 . A A . 11 LEU CD1 1 1 9 2530 1 1 11 LEU CD2 C -8.320 6.618 -4.948 1.00 . A A . 11 LEU CD2 1 1 9 2531 1 1 11 LEU CG C -7.519 5.600 -4.151 1.00 . A A . 11 LEU CG 1 1 9 2532 1 1 11 LEU H H -4.955 5.321 -2.356 1.00 . A A . 11 LEU H 1 1 9 2533 1 1 11 LEU HA H -6.648 7.732 -2.342 1.00 . A A . 11 LEU HA 1 1 9 2534 1 1 11 LEU HB2 H -7.688 4.919 -2.136 1.00 . A A . 11 LEU HB2 1 1 9 2535 1 1 11 LEU HB3 H -8.585 6.385 -2.482 1.00 . A A . 11 LEU HB3 1 1 9 2536 1 1 11 LEU HD11 H -7.641 3.927 -5.478 1.00 . A A . 11 LEU HD11 1 1 9 2537 1 1 11 LEU HD12 H -9.049 4.133 -4.435 1.00 . A A . 11 LEU HD12 1 1 9 2538 1 1 11 LEU HD13 H -7.545 3.495 -3.770 1.00 . A A . 11 LEU HD13 1 1 9 2539 1 1 11 LEU HD21 H -9.364 6.541 -4.683 1.00 . A A . 11 LEU HD21 1 1 9 2540 1 1 11 LEU HD22 H -8.201 6.423 -6.003 1.00 . A A . 11 LEU HD22 1 1 9 2541 1 1 11 LEU HD23 H -7.964 7.612 -4.723 1.00 . A A . 11 LEU HD23 1 1 9 2542 1 1 11 LEU HG H -6.481 5.693 -4.436 1.00 . A A . 11 LEU HG 1 1 9 2543 1 1 11 LEU N N -5.231 6.245 -2.529 1.00 . A A . 11 LEU N 1 1 9 2544 1 1 11 LEU O O -6.661 7.659 0.161 1.00 . A A . 11 LEU O 1 1 9 2545 1 1 12 VAL C C -5.990 3.903 1.886 1.00 . A A . 12 VAL C 1 1 9 2546 1 1 12 VAL CA C -6.654 5.216 1.471 1.00 . A A . 12 VAL CA 1 1 9 2547 1 1 12 VAL CB C -8.118 5.213 1.963 1.00 . A A . 12 VAL CB 1 1 9 2548 1 1 12 VAL CG1 C -8.178 5.349 3.477 1.00 . A A . 12 VAL CG1 1 1 9 2549 1 1 12 VAL CG2 C -8.914 6.324 1.295 1.00 . A A . 12 VAL CG2 1 1 9 2550 1 1 12 VAL H H -6.534 4.631 -0.563 1.00 . A A . 12 VAL H 1 1 9 2551 1 1 12 VAL HA H -6.137 6.037 1.946 1.00 . A A . 12 VAL HA 1 1 9 2552 1 1 12 VAL HB H -8.565 4.268 1.693 1.00 . A A . 12 VAL HB 1 1 9 2553 1 1 12 VAL HG11 H -7.454 6.082 3.802 1.00 . A A . 12 VAL HG11 1 1 9 2554 1 1 12 VAL HG12 H -7.955 4.395 3.933 1.00 . A A . 12 VAL HG12 1 1 9 2555 1 1 12 VAL HG13 H -9.168 5.665 3.771 1.00 . A A . 12 VAL HG13 1 1 9 2556 1 1 12 VAL HG21 H -8.450 7.277 1.504 1.00 . A A . 12 VAL HG21 1 1 9 2557 1 1 12 VAL HG22 H -9.924 6.325 1.678 1.00 . A A . 12 VAL HG22 1 1 9 2558 1 1 12 VAL HG23 H -8.935 6.161 0.227 1.00 . A A . 12 VAL HG23 1 1 9 2559 1 1 12 VAL N N -6.584 5.413 0.024 1.00 . A A . 12 VAL N 1 1 9 2560 1 1 12 VAL O O -5.730 3.038 1.051 1.00 . A A . 12 VAL O 1 1 9 2561 1 1 13 ARG C C -3.636 2.451 3.315 1.00 . A A . 13 ARG C 1 1 9 2562 1 1 13 ARG CA C -5.097 2.560 3.733 1.00 . A A . 13 ARG CA 1 1 9 2563 1 1 13 ARG CB C -5.862 1.306 3.298 1.00 . A A . 13 ARG CB 1 1 9 2564 1 1 13 ARG CD C -5.369 -0.059 5.356 1.00 . A A . 13 ARG CD 1 1 9 2565 1 1 13 ARG CG C -5.272 0.012 3.840 1.00 . A A . 13 ARG CG 1 1 9 2566 1 1 13 ARG CZ C -7.735 0.153 6.026 1.00 . A A . 13 ARG CZ 1 1 9 2567 1 1 13 ARG H H -5.958 4.493 3.798 1.00 . A A . 13 ARG H 1 1 9 2568 1 1 13 ARG HA H -5.137 2.634 4.808 1.00 . A A . 13 ARG HA 1 1 9 2569 1 1 13 ARG HB2 H -6.882 1.382 3.643 1.00 . A A . 13 ARG HB2 1 1 9 2570 1 1 13 ARG HB3 H -5.860 1.251 2.220 1.00 . A A . 13 ARG HB3 1 1 9 2571 1 1 13 ARG HD2 H -4.580 -0.698 5.723 1.00 . A A . 13 ARG HD2 1 1 9 2572 1 1 13 ARG HD3 H -5.242 0.934 5.761 1.00 . A A . 13 ARG HD3 1 1 9 2573 1 1 13 ARG HE H -6.717 -1.562 5.938 1.00 . A A . 13 ARG HE 1 1 9 2574 1 1 13 ARG HG2 H -5.811 -0.822 3.416 1.00 . A A . 13 ARG HG2 1 1 9 2575 1 1 13 ARG HG3 H -4.233 -0.045 3.551 1.00 . A A . 13 ARG HG3 1 1 9 2576 1 1 13 ARG HH11 H -6.851 1.908 5.546 1.00 . A A . 13 ARG HH11 1 1 9 2577 1 1 13 ARG HH12 H -8.511 2.020 6.022 1.00 . A A . 13 ARG HH12 1 1 9 2578 1 1 13 ARG HH21 H -8.899 -1.410 6.563 1.00 . A A . 13 ARG HH21 1 1 9 2579 1 1 13 ARG HH22 H -9.673 0.140 6.600 1.00 . A A . 13 ARG HH22 1 1 9 2580 1 1 13 ARG N N -5.724 3.765 3.186 1.00 . A A . 13 ARG N 1 1 9 2581 1 1 13 ARG NE N -6.655 -0.593 5.800 1.00 . A A . 13 ARG NE 1 1 9 2582 1 1 13 ARG NH1 N -7.695 1.468 5.850 1.00 . A A . 13 ARG NH1 1 1 9 2583 1 1 13 ARG NH2 N -8.861 -0.419 6.429 1.00 . A A . 13 ARG NH2 1 1 9 2584 1 1 13 ARG O O -3.321 2.389 2.127 1.00 . A A . 13 ARG O 1 1 9 2585 1 1 14 ASP C C -0.991 1.050 3.278 1.00 . A A . 14 ASP C 1 1 9 2586 1 1 14 ASP CA C -1.318 2.321 4.056 1.00 . A A . 14 ASP CA 1 1 9 2587 1 1 14 ASP CB C -0.545 2.337 5.376 1.00 . A A . 14 ASP CB 1 1 9 2588 1 1 14 ASP CG C -0.870 3.553 6.223 1.00 . A A . 14 ASP CG 1 1 9 2589 1 1 14 ASP H H -3.064 2.478 5.231 1.00 . A A . 14 ASP H 1 1 9 2590 1 1 14 ASP HA H -1.025 3.175 3.468 1.00 . A A . 14 ASP HA 1 1 9 2591 1 1 14 ASP HB2 H -0.792 1.452 5.942 1.00 . A A . 14 ASP HB2 1 1 9 2592 1 1 14 ASP HB3 H 0.515 2.340 5.166 1.00 . A A . 14 ASP HB3 1 1 9 2593 1 1 14 ASP N N -2.748 2.425 4.307 1.00 . A A . 14 ASP N 1 1 9 2594 1 1 14 ASP O O -0.658 0.023 3.857 1.00 . A A . 14 ASP O 1 1 9 2595 1 1 14 ASP OD1 O -1.841 4.266 5.891 1.00 . A A . 14 ASP OD1 1 1 9 2596 1 1 14 ASP OD2 O -0.154 3.793 7.217 1.00 . A A . 14 ASP OD2 1 1 9 2597 1 1 15 SER C C 0.509 -0.686 1.482 1.00 . A A . 15 SER C 1 1 9 2598 1 1 15 SER CA C -0.806 -0.013 1.094 1.00 . A A . 15 SER CA 1 1 9 2599 1 1 15 SER CB C -0.754 0.435 -0.369 1.00 . A A . 15 SER CB 1 1 9 2600 1 1 15 SER H H -1.362 1.975 1.559 1.00 . A A . 15 SER H 1 1 9 2601 1 1 15 SER HA H -1.609 -0.725 1.213 1.00 . A A . 15 SER HA 1 1 9 2602 1 1 15 SER HB2 H -1.744 0.377 -0.793 1.00 . A A . 15 SER HB2 1 1 9 2603 1 1 15 SER HB3 H -0.402 1.455 -0.418 1.00 . A A . 15 SER HB3 1 1 9 2604 1 1 15 SER HG H -0.330 -1.205 -1.355 1.00 . A A . 15 SER HG 1 1 9 2605 1 1 15 SER N N -1.090 1.129 1.960 1.00 . A A . 15 SER N 1 1 9 2606 1 1 15 SER O O 1.276 -0.157 2.286 1.00 . A A . 15 SER O 1 1 9 2607 1 1 15 SER OG O 0.116 -0.385 -1.131 1.00 . A A . 15 SER OG 1 1 9 2608 1 1 16 LEU C C 3.149 -2.067 0.365 1.00 . A A . 16 LEU C 1 1 9 2609 1 1 16 LEU CA C 1.979 -2.604 1.185 1.00 . A A . 16 LEU CA 1 1 9 2610 1 1 16 LEU CB C 1.769 -4.091 0.890 1.00 . A A . 16 LEU CB 1 1 9 2611 1 1 16 LEU CD1 C 0.938 -6.227 1.905 1.00 . A A . 16 LEU CD1 1 1 9 2612 1 1 16 LEU CD2 C 3.253 -5.425 2.407 1.00 . A A . 16 LEU CD2 1 1 9 2613 1 1 16 LEU CG C 1.820 -5.006 2.114 1.00 . A A . 16 LEU CG 1 1 9 2614 1 1 16 LEU H H 0.109 -2.226 0.271 1.00 . A A . 16 LEU H 1 1 9 2615 1 1 16 LEU HA H 2.205 -2.484 2.233 1.00 . A A . 16 LEU HA 1 1 9 2616 1 1 16 LEU HB2 H 0.804 -4.209 0.418 1.00 . A A . 16 LEU HB2 1 1 9 2617 1 1 16 LEU HB3 H 2.531 -4.414 0.197 1.00 . A A . 16 LEU HB3 1 1 9 2618 1 1 16 LEU HD11 H 0.057 -5.944 1.348 1.00 . A A . 16 LEU HD11 1 1 9 2619 1 1 16 LEU HD12 H 0.644 -6.628 2.864 1.00 . A A . 16 LEU HD12 1 1 9 2620 1 1 16 LEU HD13 H 1.487 -6.977 1.354 1.00 . A A . 16 LEU HD13 1 1 9 2621 1 1 16 LEU HD21 H 3.713 -4.700 3.062 1.00 . A A . 16 LEU HD21 1 1 9 2622 1 1 16 LEU HD22 H 3.808 -5.478 1.482 1.00 . A A . 16 LEU HD22 1 1 9 2623 1 1 16 LEU HD23 H 3.255 -6.394 2.884 1.00 . A A . 16 LEU HD23 1 1 9 2624 1 1 16 LEU HG H 1.445 -4.468 2.973 1.00 . A A . 16 LEU HG 1 1 9 2625 1 1 16 LEU N N 0.760 -1.856 0.903 1.00 . A A . 16 LEU N 1 1 9 2626 1 1 16 LEU O O 3.047 -1.015 -0.266 1.00 . A A . 16 LEU O 1 1 9 2627 1 1 17 TYR C C 5.114 -2.110 -1.826 1.00 . A A . 17 TYR C 1 1 9 2628 1 1 17 TYR CA C 5.452 -2.401 -0.364 1.00 . A A . 17 TYR CA 1 1 9 2629 1 1 17 TYR CB C 6.521 -3.495 -0.283 1.00 . A A . 17 TYR CB 1 1 9 2630 1 1 17 TYR CD1 C 6.158 -5.793 0.700 1.00 . A A . 17 TYR CD1 1 1 9 2631 1 1 17 TYR CD2 C 5.250 -5.335 -1.456 1.00 . A A . 17 TYR CD2 1 1 9 2632 1 1 17 TYR CE1 C 5.651 -7.078 0.645 1.00 . A A . 17 TYR CE1 1 1 9 2633 1 1 17 TYR CE2 C 4.740 -6.618 -1.518 1.00 . A A . 17 TYR CE2 1 1 9 2634 1 1 17 TYR CG C 5.966 -4.901 -0.348 1.00 . A A . 17 TYR CG 1 1 9 2635 1 1 17 TYR CZ C 4.944 -7.485 -0.466 1.00 . A A . 17 TYR CZ 1 1 9 2636 1 1 17 TYR H H 4.276 -3.628 0.901 1.00 . A A . 17 TYR H 1 1 9 2637 1 1 17 TYR HA H 5.837 -1.500 0.089 1.00 . A A . 17 TYR HA 1 1 9 2638 1 1 17 TYR HB2 H 7.211 -3.376 -1.104 1.00 . A A . 17 TYR HB2 1 1 9 2639 1 1 17 TYR HB3 H 7.059 -3.393 0.649 1.00 . A A . 17 TYR HB3 1 1 9 2640 1 1 17 TYR HD1 H 6.712 -5.471 1.569 1.00 . A A . 17 TYR HD1 1 1 9 2641 1 1 17 TYR HD2 H 5.093 -4.654 -2.280 1.00 . A A . 17 TYR HD2 1 1 9 2642 1 1 17 TYR HE1 H 5.811 -7.756 1.470 1.00 . A A . 17 TYR HE1 1 1 9 2643 1 1 17 TYR HE2 H 4.186 -6.937 -2.389 1.00 . A A . 17 TYR HE2 1 1 9 2644 1 1 17 TYR HH H 3.492 -8.727 -0.686 1.00 . A A . 17 TYR HH 1 1 9 2645 1 1 17 TYR N N 4.258 -2.799 0.379 1.00 . A A . 17 TYR N 1 1 9 2646 1 1 17 TYR O O 4.057 -2.505 -2.316 1.00 . A A . 17 TYR O 1 1 9 2647 1 1 17 TYR OH O 4.438 -8.764 -0.524 1.00 . A A . 17 TYR OH 1 1 9 2648 1 1 18 PRO C C 5.268 -2.240 -4.771 1.00 . A A . 18 PRO C 1 1 9 2649 1 1 18 PRO CA C 5.804 -1.067 -3.952 1.00 . A A . 18 PRO CA 1 1 9 2650 1 1 18 PRO CB C 7.204 -0.679 -4.421 1.00 . A A . 18 PRO CB 1 1 9 2651 1 1 18 PRO CD C 7.302 -0.898 -2.036 1.00 . A A . 18 PRO CD 1 1 9 2652 1 1 18 PRO CG C 7.864 -0.129 -3.204 1.00 . A A . 18 PRO CG 1 1 9 2653 1 1 18 PRO HA H 5.139 -0.222 -4.059 1.00 . A A . 18 PRO HA 1 1 9 2654 1 1 18 PRO HB2 H 7.719 -1.553 -4.792 1.00 . A A . 18 PRO HB2 1 1 9 2655 1 1 18 PRO HB3 H 7.135 0.064 -5.201 1.00 . A A . 18 PRO HB3 1 1 9 2656 1 1 18 PRO HD2 H 7.961 -1.710 -1.769 1.00 . A A . 18 PRO HD2 1 1 9 2657 1 1 18 PRO HD3 H 7.150 -0.242 -1.192 1.00 . A A . 18 PRO HD3 1 1 9 2658 1 1 18 PRO HG2 H 8.933 -0.275 -3.269 1.00 . A A . 18 PRO HG2 1 1 9 2659 1 1 18 PRO HG3 H 7.635 0.922 -3.105 1.00 . A A . 18 PRO HG3 1 1 9 2660 1 1 18 PRO N N 6.012 -1.411 -2.543 1.00 . A A . 18 PRO N 1 1 9 2661 1 1 18 PRO O O 5.317 -3.388 -4.329 1.00 . A A . 18 PRO O 1 1 9 2662 1 1 19 PRO C C 5.274 -3.956 -7.370 1.00 . A A . 19 PRO C 1 1 9 2663 1 1 19 PRO CA C 4.200 -3.002 -6.859 1.00 . A A . 19 PRO CA 1 1 9 2664 1 1 19 PRO CB C 3.595 -2.207 -8.020 1.00 . A A . 19 PRO CB 1 1 9 2665 1 1 19 PRO CD C 4.651 -0.622 -6.580 1.00 . A A . 19 PRO CD 1 1 9 2666 1 1 19 PRO CG C 4.330 -0.912 -8.019 1.00 . A A . 19 PRO CG 1 1 9 2667 1 1 19 PRO HA H 3.424 -3.569 -6.365 1.00 . A A . 19 PRO HA 1 1 9 2668 1 1 19 PRO HB2 H 3.743 -2.746 -8.945 1.00 . A A . 19 PRO HB2 1 1 9 2669 1 1 19 PRO HB3 H 2.539 -2.061 -7.848 1.00 . A A . 19 PRO HB3 1 1 9 2670 1 1 19 PRO HD2 H 5.590 -0.095 -6.502 1.00 . A A . 19 PRO HD2 1 1 9 2671 1 1 19 PRO HD3 H 3.856 -0.052 -6.123 1.00 . A A . 19 PRO HD3 1 1 9 2672 1 1 19 PRO HG2 H 5.239 -1.005 -8.595 1.00 . A A . 19 PRO HG2 1 1 9 2673 1 1 19 PRO HG3 H 3.703 -0.133 -8.428 1.00 . A A . 19 PRO HG3 1 1 9 2674 1 1 19 PRO N N 4.747 -1.964 -5.979 1.00 . A A . 19 PRO N 1 1 9 2675 1 1 19 PRO O O 6.466 -3.742 -7.149 1.00 . A A . 19 PRO O 1 1 9 2676 1 1 20 ALA C C 5.973 -5.796 -10.093 1.00 . A A . 20 ALA C 1 1 9 2677 1 1 20 ALA CA C 5.767 -6.000 -8.596 1.00 . A A . 20 ALA CA 1 1 9 2678 1 1 20 ALA CB C 5.256 -7.406 -8.318 1.00 . A A . 20 ALA CB 1 1 9 2679 1 1 20 ALA H H 3.881 -5.128 -8.197 1.00 . A A . 20 ALA H 1 1 9 2680 1 1 20 ALA HA H 6.715 -5.881 -8.093 1.00 . A A . 20 ALA HA 1 1 9 2681 1 1 20 ALA HB1 H 4.778 -7.430 -7.350 1.00 . A A . 20 ALA HB1 1 1 9 2682 1 1 20 ALA HB2 H 6.084 -8.099 -8.329 1.00 . A A . 20 ALA HB2 1 1 9 2683 1 1 20 ALA HB3 H 4.542 -7.686 -9.079 1.00 . A A . 20 ALA HB3 1 1 9 2684 1 1 20 ALA N N 4.843 -5.011 -8.054 1.00 . A A . 20 ALA N 1 1 9 2685 1 1 20 ALA O O 6.105 -6.759 -10.849 1.00 . A A . 20 ALA O 1 1 9 2686 1 1 21 GLY C C 7.397 -3.340 -12.161 1.00 . A A . 21 GLY C 1 1 9 2687 1 1 21 GLY CA C 6.191 -4.227 -11.921 1.00 . A A . 21 GLY CA 1 1 9 2688 1 1 21 GLY H H 5.889 -3.809 -9.867 1.00 . A A . 21 GLY H 1 1 9 2689 1 1 21 GLY HA2 H 6.322 -5.149 -12.467 1.00 . A A . 21 GLY HA2 1 1 9 2690 1 1 21 GLY HA3 H 5.309 -3.724 -12.290 1.00 . A A . 21 GLY HA3 1 1 9 2691 1 1 21 GLY N N 6.000 -4.536 -10.515 1.00 . A A . 21 GLY N 1 1 10 2692 1 1 1 ASP C C -6.879 -1.405 -1.051 1.00 . A A . 1 ASP C 1 1 10 2693 1 1 1 ASP CA C -6.789 -0.795 -2.449 1.00 . A A . 1 ASP CA 1 1 10 2694 1 1 1 ASP CB C -6.614 -1.900 -3.494 1.00 . A A . 1 ASP CB 1 1 10 2695 1 1 1 ASP CG C -7.856 -2.092 -4.342 1.00 . A A . 1 ASP CG 1 1 10 2696 1 1 1 ASP H1 H -5.995 0.975 -2.066 1.00 . A A . 1 ASP H1 1 1 10 2697 1 1 1 ASP HA H -7.707 -0.265 -2.652 1.00 . A A . 1 ASP HA 1 1 10 2698 1 1 1 ASP HB2 H -5.792 -1.644 -4.145 1.00 . A A . 1 ASP HB2 1 1 10 2699 1 1 1 ASP HB3 H -6.394 -2.832 -2.993 1.00 . A A . 1 ASP HB3 1 1 10 2700 1 1 1 ASP N N -5.695 0.167 -2.534 1.00 . A A . 1 ASP N 1 1 10 2701 1 1 1 ASP O O -7.441 -2.485 -0.872 1.00 . A A . 1 ASP O 1 1 10 2702 1 1 1 ASP OD1 O -8.968 -1.845 -3.830 1.00 . A A . 1 ASP OD1 1 1 10 2703 1 1 1 ASP OD2 O -7.717 -2.490 -5.518 1.00 . A A . 1 ASP OD2 1 1 10 2704 1 1 2 GLY C C -5.859 -2.622 1.430 1.00 . A A . 2 GLY C 1 1 10 2705 1 1 2 GLY CA C -6.354 -1.194 1.304 1.00 . A A . 2 GLY CA 1 1 10 2706 1 1 2 GLY H H -5.890 0.149 -0.264 1.00 . A A . 2 GLY H 1 1 10 2707 1 1 2 GLY HA2 H -5.733 -0.556 1.915 1.00 . A A . 2 GLY HA2 1 1 10 2708 1 1 2 GLY HA3 H -7.370 -1.144 1.669 1.00 . A A . 2 GLY HA3 1 1 10 2709 1 1 2 GLY N N -6.323 -0.706 -0.063 1.00 . A A . 2 GLY N 1 1 10 2710 1 1 2 GLY O O -6.621 -3.522 1.784 1.00 . A A . 2 GLY O 1 1 10 2711 1 1 3 MET C C -2.509 -4.070 1.600 1.00 . A A . 3 MET C 1 1 10 2712 1 1 3 MET CA C -3.984 -4.160 1.229 1.00 . A A . 3 MET CA 1 1 10 2713 1 1 3 MET CB C -4.141 -4.903 -0.100 1.00 . A A . 3 MET CB 1 1 10 2714 1 1 3 MET CE C -5.209 -5.097 -3.444 1.00 . A A . 3 MET CE 1 1 10 2715 1 1 3 MET CG C -5.525 -4.769 -0.713 1.00 . A A . 3 MET CG 1 1 10 2716 1 1 3 MET H H -4.020 -2.074 0.869 1.00 . A A . 3 MET H 1 1 10 2717 1 1 3 MET HA H -4.505 -4.706 2.001 1.00 . A A . 3 MET HA 1 1 10 2718 1 1 3 MET HB2 H -3.420 -4.514 -0.804 1.00 . A A . 3 MET HB2 1 1 10 2719 1 1 3 MET HB3 H -3.944 -5.952 0.063 1.00 . A A . 3 MET HB3 1 1 10 2720 1 1 3 MET HE1 H -5.998 -5.000 -4.176 1.00 . A A . 3 MET HE1 1 1 10 2721 1 1 3 MET HE2 H -4.384 -5.644 -3.875 1.00 . A A . 3 MET HE2 1 1 10 2722 1 1 3 MET HE3 H -4.873 -4.115 -3.145 1.00 . A A . 3 MET HE3 1 1 10 2723 1 1 3 MET HG2 H -6.263 -4.905 0.064 1.00 . A A . 3 MET HG2 1 1 10 2724 1 1 3 MET HG3 H -5.624 -3.778 -1.131 1.00 . A A . 3 MET HG3 1 1 10 2725 1 1 3 MET N N -4.578 -2.831 1.143 1.00 . A A . 3 MET N 1 1 10 2726 1 1 3 MET O O -1.657 -3.842 0.742 1.00 . A A . 3 MET O 1 1 10 2727 1 1 3 MET SD S -5.828 -5.979 -2.014 1.00 . A A . 3 MET SD 1 1 10 2728 1 1 4 GLY C C -0.663 -3.279 4.541 1.00 . A A . 4 GLY C 1 1 10 2729 1 1 4 GLY CA C -0.836 -4.185 3.339 1.00 . A A . 4 GLY CA 1 1 10 2730 1 1 4 GLY H H -2.931 -4.430 3.524 1.00 . A A . 4 GLY H 1 1 10 2731 1 1 4 GLY HA2 H -0.506 -5.179 3.600 1.00 . A A . 4 GLY HA2 1 1 10 2732 1 1 4 GLY HA3 H -0.220 -3.814 2.532 1.00 . A A . 4 GLY HA3 1 1 10 2733 1 1 4 GLY N N -2.211 -4.251 2.883 1.00 . A A . 4 GLY N 1 1 10 2734 1 1 4 GLY O O -1.577 -3.125 5.351 1.00 . A A . 4 GLY O 1 1 10 2735 1 1 5 GLU C C 2.047 -0.924 5.440 1.00 . A A . 5 GLU C 1 1 10 2736 1 1 5 GLU CA C 0.813 -1.768 5.754 1.00 . A A . 5 GLU CA 1 1 10 2737 1 1 5 GLU CB C 1.035 -2.560 7.044 1.00 . A A . 5 GLU CB 1 1 10 2738 1 1 5 GLU CD C 2.109 -4.563 8.147 1.00 . A A . 5 GLU CD 1 1 10 2739 1 1 5 GLU CG C 1.937 -3.771 6.866 1.00 . A A . 5 GLU CG 1 1 10 2740 1 1 5 GLU H H 1.199 -2.835 3.969 1.00 . A A . 5 GLU H 1 1 10 2741 1 1 5 GLU HA H -0.035 -1.112 5.884 1.00 . A A . 5 GLU HA 1 1 10 2742 1 1 5 GLU HB2 H 1.483 -1.910 7.781 1.00 . A A . 5 GLU HB2 1 1 10 2743 1 1 5 GLU HB3 H 0.079 -2.902 7.412 1.00 . A A . 5 GLU HB3 1 1 10 2744 1 1 5 GLU HG2 H 1.506 -4.418 6.116 1.00 . A A . 5 GLU HG2 1 1 10 2745 1 1 5 GLU HG3 H 2.908 -3.434 6.534 1.00 . A A . 5 GLU HG3 1 1 10 2746 1 1 5 GLU N N 0.514 -2.673 4.651 1.00 . A A . 5 GLU N 1 1 10 2747 1 1 5 GLU O O 2.792 -0.535 6.339 1.00 . A A . 5 GLU O 1 1 10 2748 1 1 5 GLU OE1 O 1.554 -5.678 8.235 1.00 . A A . 5 GLU OE1 1 1 10 2749 1 1 5 GLU OE2 O 2.801 -4.069 9.062 1.00 . A A . 5 GLU OE2 1 1 10 2750 1 1 6 GLU C C 3.049 1.632 3.682 1.00 . A A . 6 GLU C 1 1 10 2751 1 1 6 GLU CA C 3.396 0.147 3.716 1.00 . A A . 6 GLU CA 1 1 10 2752 1 1 6 GLU CB C 3.864 -0.313 2.333 1.00 . A A . 6 GLU CB 1 1 10 2753 1 1 6 GLU CD C 6.384 -0.132 2.331 1.00 . A A . 6 GLU CD 1 1 10 2754 1 1 6 GLU CG C 5.078 0.444 1.820 1.00 . A A . 6 GLU CG 1 1 10 2755 1 1 6 GLU H H 1.626 -0.987 3.487 1.00 . A A . 6 GLU H 1 1 10 2756 1 1 6 GLU HA H 4.196 -0.006 4.425 1.00 . A A . 6 GLU HA 1 1 10 2757 1 1 6 GLU HB2 H 4.116 -1.363 2.382 1.00 . A A . 6 GLU HB2 1 1 10 2758 1 1 6 GLU HB3 H 3.057 -0.178 1.628 1.00 . A A . 6 GLU HB3 1 1 10 2759 1 1 6 GLU HG2 H 5.082 0.403 0.741 1.00 . A A . 6 GLU HG2 1 1 10 2760 1 1 6 GLU HG3 H 5.006 1.474 2.140 1.00 . A A . 6 GLU HG3 1 1 10 2761 1 1 6 GLU N N 2.255 -0.647 4.155 1.00 . A A . 6 GLU N 1 1 10 2762 1 1 6 GLU O O 3.516 2.404 4.519 1.00 . A A . 6 GLU O 1 1 10 2763 1 1 6 GLU OE1 O 6.382 -1.296 2.786 1.00 . A A . 6 GLU OE1 1 1 10 2764 1 1 6 GLU OE2 O 7.409 0.579 2.275 1.00 . A A . 6 GLU OE2 1 1 10 2765 1 1 7 PHE C C 0.493 3.574 1.870 1.00 . A A . 7 PHE C 1 1 10 2766 1 1 7 PHE CA C 1.829 3.429 2.589 1.00 . A A . 7 PHE CA 1 1 10 2767 1 1 7 PHE CB C 2.906 4.236 1.856 1.00 . A A . 7 PHE CB 1 1 10 2768 1 1 7 PHE CD1 C 2.785 2.848 -0.235 1.00 . A A . 7 PHE CD1 1 1 10 2769 1 1 7 PHE CD2 C 4.934 3.454 0.603 1.00 . A A . 7 PHE CD2 1 1 10 2770 1 1 7 PHE CE1 C 3.380 2.170 -1.281 1.00 . A A . 7 PHE CE1 1 1 10 2771 1 1 7 PHE CE2 C 5.535 2.777 -0.441 1.00 . A A . 7 PHE CE2 1 1 10 2772 1 1 7 PHE CG C 3.554 3.497 0.719 1.00 . A A . 7 PHE CG 1 1 10 2773 1 1 7 PHE CZ C 4.757 2.134 -1.384 1.00 . A A . 7 PHE CZ 1 1 10 2774 1 1 7 PHE H H 1.884 1.373 2.072 1.00 . A A . 7 PHE H 1 1 10 2775 1 1 7 PHE HA H 1.719 3.823 3.587 1.00 . A A . 7 PHE HA 1 1 10 2776 1 1 7 PHE HB2 H 2.459 5.134 1.455 1.00 . A A . 7 PHE HB2 1 1 10 2777 1 1 7 PHE HB3 H 3.679 4.510 2.559 1.00 . A A . 7 PHE HB3 1 1 10 2778 1 1 7 PHE HD1 H 1.709 2.877 -0.156 1.00 . A A . 7 PHE HD1 1 1 10 2779 1 1 7 PHE HD2 H 5.543 3.956 1.340 1.00 . A A . 7 PHE HD2 1 1 10 2780 1 1 7 PHE HE1 H 2.769 1.668 -2.017 1.00 . A A . 7 PHE HE1 1 1 10 2781 1 1 7 PHE HE2 H 6.612 2.750 -0.520 1.00 . A A . 7 PHE HE2 1 1 10 2782 1 1 7 PHE HZ H 5.224 1.604 -2.201 1.00 . A A . 7 PHE HZ 1 1 10 2783 1 1 7 PHE N N 2.228 2.030 2.713 1.00 . A A . 7 PHE N 1 1 10 2784 1 1 7 PHE O O 0.003 2.639 1.237 1.00 . A A . 7 PHE O 1 1 10 2785 1 1 8 ILE C C -1.465 4.569 -0.068 1.00 . A A . 8 ILE C 1 1 10 2786 1 1 8 ILE CA C -1.380 5.067 1.377 1.00 . A A . 8 ILE CA 1 1 10 2787 1 1 8 ILE CB C -1.658 6.588 1.416 1.00 . A A . 8 ILE CB 1 1 10 2788 1 1 8 ILE CD1 C -0.750 7.344 3.674 1.00 . A A . 8 ILE CD1 1 1 10 2789 1 1 8 ILE CG1 C -1.978 7.031 2.846 1.00 . A A . 8 ILE CG1 1 1 10 2790 1 1 8 ILE CG2 C -2.798 6.962 0.476 1.00 . A A . 8 ILE CG2 1 1 10 2791 1 1 8 ILE H H 0.356 5.455 2.517 1.00 . A A . 8 ILE H 1 1 10 2792 1 1 8 ILE HA H -2.144 4.573 1.958 1.00 . A A . 8 ILE HA 1 1 10 2793 1 1 8 ILE HB H -0.769 7.100 1.081 1.00 . A A . 8 ILE HB 1 1 10 2794 1 1 8 ILE HD11 H -0.357 6.431 4.095 1.00 . A A . 8 ILE HD11 1 1 10 2795 1 1 8 ILE HD12 H -1.017 8.022 4.471 1.00 . A A . 8 ILE HD12 1 1 10 2796 1 1 8 ILE HD13 H 0.000 7.804 3.046 1.00 . A A . 8 ILE HD13 1 1 10 2797 1 1 8 ILE HG12 H -2.589 7.920 2.812 1.00 . A A . 8 ILE HG12 1 1 10 2798 1 1 8 ILE HG13 H -2.523 6.244 3.346 1.00 . A A . 8 ILE HG13 1 1 10 2799 1 1 8 ILE HG21 H -2.391 7.320 -0.458 1.00 . A A . 8 ILE HG21 1 1 10 2800 1 1 8 ILE HG22 H -3.399 7.737 0.929 1.00 . A A . 8 ILE HG22 1 1 10 2801 1 1 8 ILE HG23 H -3.412 6.092 0.292 1.00 . A A . 8 ILE HG23 1 1 10 2802 1 1 8 ILE N N -0.092 4.761 1.990 1.00 . A A . 8 ILE N 1 1 10 2803 1 1 8 ILE O O -0.635 4.916 -0.908 1.00 . A A . 8 ILE O 1 1 10 2804 1 1 9 GLU C C -3.247 4.324 -2.605 1.00 . A A . 9 GLU C 1 1 10 2805 1 1 9 GLU CA C -2.716 3.228 -1.680 1.00 . A A . 9 GLU CA 1 1 10 2806 1 1 9 GLU CB C -3.715 2.069 -1.608 1.00 . A A . 9 GLU CB 1 1 10 2807 1 1 9 GLU CD C -4.419 -0.202 -2.443 1.00 . A A . 9 GLU CD 1 1 10 2808 1 1 9 GLU CG C -3.397 0.913 -2.543 1.00 . A A . 9 GLU CG 1 1 10 2809 1 1 9 GLU H H -3.121 3.540 0.372 1.00 . A A . 9 GLU H 1 1 10 2810 1 1 9 GLU HA H -1.774 2.866 -2.063 1.00 . A A . 9 GLU HA 1 1 10 2811 1 1 9 GLU HB2 H -3.732 1.688 -0.597 1.00 . A A . 9 GLU HB2 1 1 10 2812 1 1 9 GLU HB3 H -4.697 2.443 -1.856 1.00 . A A . 9 GLU HB3 1 1 10 2813 1 1 9 GLU HG2 H -3.381 1.277 -3.559 1.00 . A A . 9 GLU HG2 1 1 10 2814 1 1 9 GLU HG3 H -2.426 0.517 -2.291 1.00 . A A . 9 GLU HG3 1 1 10 2815 1 1 9 GLU N N -2.490 3.767 -0.343 1.00 . A A . 9 GLU N 1 1 10 2816 1 1 9 GLU O O -3.042 5.511 -2.349 1.00 . A A . 9 GLU O 1 1 10 2817 1 1 9 GLU OE1 O -4.069 -1.371 -2.282 1.00 . A A . 9 GLU OE1 1 1 10 2818 1 1 10 GLY C C -5.600 5.723 -3.964 1.00 . A A . 10 GLY C 1 1 10 2819 1 1 10 GLY CA C -4.492 4.900 -4.594 1.00 . A A . 10 GLY CA 1 1 10 2820 1 1 10 GLY H H -4.083 2.973 -3.826 1.00 . A A . 10 GLY H 1 1 10 2821 1 1 10 GLY HA2 H -3.703 5.563 -4.917 1.00 . A A . 10 GLY HA2 1 1 10 2822 1 1 10 GLY HA3 H -4.888 4.380 -5.454 1.00 . A A . 10 GLY HA3 1 1 10 2823 1 1 10 GLY N N -3.939 3.928 -3.671 1.00 . A A . 10 GLY N 1 1 10 2824 1 1 10 GLY O O -5.976 6.773 -4.485 1.00 . A A . 10 GLY O 1 1 10 2825 1 1 11 LEU C C -6.681 6.528 -0.819 1.00 . A A . 11 LEU C 1 1 10 2826 1 1 11 LEU CA C -7.193 5.935 -2.129 1.00 . A A . 11 LEU CA 1 1 10 2827 1 1 11 LEU CB C -8.352 4.975 -1.851 1.00 . A A . 11 LEU CB 1 1 10 2828 1 1 11 LEU CD1 C -9.716 3.308 -3.139 1.00 . A A . 11 LEU CD1 1 1 10 2829 1 1 11 LEU CD2 C -10.556 5.645 -2.841 1.00 . A A . 11 LEU CD2 1 1 10 2830 1 1 11 LEU CG C -9.322 4.772 -3.018 1.00 . A A . 11 LEU CG 1 1 10 2831 1 1 11 LEU H H -5.780 4.401 -2.472 1.00 . A A . 11 LEU H 1 1 10 2832 1 1 11 LEU HA H -7.545 6.737 -2.761 1.00 . A A . 11 LEU HA 1 1 10 2833 1 1 11 LEU HB2 H -7.937 4.014 -1.582 1.00 . A A . 11 LEU HB2 1 1 10 2834 1 1 11 LEU HB3 H -8.912 5.354 -1.008 1.00 . A A . 11 LEU HB3 1 1 10 2835 1 1 11 LEU HD11 H -9.077 2.821 -3.860 1.00 . A A . 11 LEU HD11 1 1 10 2836 1 1 11 LEU HD12 H -10.744 3.236 -3.463 1.00 . A A . 11 LEU HD12 1 1 10 2837 1 1 11 LEU HD13 H -9.608 2.825 -2.179 1.00 . A A . 11 LEU HD13 1 1 10 2838 1 1 11 LEU HD21 H -11.111 5.678 -3.767 1.00 . A A . 11 LEU HD21 1 1 10 2839 1 1 11 LEU HD22 H -10.254 6.645 -2.567 1.00 . A A . 11 LEU HD22 1 1 10 2840 1 1 11 LEU HD23 H -11.181 5.232 -2.062 1.00 . A A . 11 LEU HD23 1 1 10 2841 1 1 11 LEU HG H -8.835 5.063 -3.937 1.00 . A A . 11 LEU HG 1 1 10 2842 1 1 11 LEU N N -6.123 5.242 -2.837 1.00 . A A . 11 LEU N 1 1 10 2843 1 1 11 LEU O O -6.450 7.734 -0.722 1.00 . A A . 11 LEU O 1 1 10 2844 1 1 12 VAL C C -5.914 4.950 2.470 1.00 . A A . 12 VAL C 1 1 10 2845 1 1 12 VAL CA C -6.017 6.117 1.489 1.00 . A A . 12 VAL CA 1 1 10 2846 1 1 12 VAL CB C -6.932 7.205 2.088 1.00 . A A . 12 VAL CB 1 1 10 2847 1 1 12 VAL CG1 C -8.357 6.692 2.222 1.00 . A A . 12 VAL CG1 1 1 10 2848 1 1 12 VAL CG2 C -6.396 7.683 3.433 1.00 . A A . 12 VAL CG2 1 1 10 2849 1 1 12 VAL H H -6.704 4.724 0.048 1.00 . A A . 12 VAL H 1 1 10 2850 1 1 12 VAL HA H -5.036 6.542 1.349 1.00 . A A . 12 VAL HA 1 1 10 2851 1 1 12 VAL HB H -6.943 8.047 1.412 1.00 . A A . 12 VAL HB 1 1 10 2852 1 1 12 VAL HG11 H -8.509 6.305 3.219 1.00 . A A . 12 VAL HG11 1 1 10 2853 1 1 12 VAL HG12 H -8.525 5.905 1.502 1.00 . A A . 12 VAL HG12 1 1 10 2854 1 1 12 VAL HG13 H -9.050 7.500 2.040 1.00 . A A . 12 VAL HG13 1 1 10 2855 1 1 12 VAL HG21 H -5.560 7.066 3.728 1.00 . A A . 12 VAL HG21 1 1 10 2856 1 1 12 VAL HG22 H -7.174 7.614 4.178 1.00 . A A . 12 VAL HG22 1 1 10 2857 1 1 12 VAL HG23 H -6.072 8.710 3.346 1.00 . A A . 12 VAL HG23 1 1 10 2858 1 1 12 VAL N N -6.503 5.674 0.187 1.00 . A A . 12 VAL N 1 1 10 2859 1 1 12 VAL O O -6.832 4.699 3.250 1.00 . A A . 12 VAL O 1 1 10 2860 1 1 13 ARG C C -3.194 2.484 3.086 1.00 . A A . 13 ARG C 1 1 10 2861 1 1 13 ARG CA C -4.562 3.112 3.324 1.00 . A A . 13 ARG CA 1 1 10 2862 1 1 13 ARG CB C -5.654 2.057 3.140 1.00 . A A . 13 ARG CB 1 1 10 2863 1 1 13 ARG CD C -7.445 1.406 4.785 1.00 . A A . 13 ARG CD 1 1 10 2864 1 1 13 ARG CG C -5.975 1.289 4.413 1.00 . A A . 13 ARG CG 1 1 10 2865 1 1 13 ARG CZ C -9.046 3.234 5.208 1.00 . A A . 13 ARG CZ 1 1 10 2866 1 1 13 ARG H H -4.087 4.497 1.793 1.00 . A A . 13 ARG H 1 1 10 2867 1 1 13 ARG HA H -4.598 3.478 4.337 1.00 . A A . 13 ARG HA 1 1 10 2868 1 1 13 ARG HB2 H -6.556 2.543 2.798 1.00 . A A . 13 ARG HB2 1 1 10 2869 1 1 13 ARG HB3 H -5.332 1.349 2.390 1.00 . A A . 13 ARG HB3 1 1 10 2870 1 1 13 ARG HD2 H -8.043 1.129 3.930 1.00 . A A . 13 ARG HD2 1 1 10 2871 1 1 13 ARG HD3 H -7.651 0.730 5.602 1.00 . A A . 13 ARG HD3 1 1 10 2872 1 1 13 ARG HE H -7.071 3.358 5.469 1.00 . A A . 13 ARG HE 1 1 10 2873 1 1 13 ARG HG2 H -5.734 0.247 4.265 1.00 . A A . 13 ARG HG2 1 1 10 2874 1 1 13 ARG HG3 H -5.377 1.687 5.220 1.00 . A A . 13 ARG HG3 1 1 10 2875 1 1 13 ARG HH11 H -9.891 1.518 4.551 1.00 . A A . 13 ARG HH11 1 1 10 2876 1 1 13 ARG HH12 H -10.992 2.819 4.855 1.00 . A A . 13 ARG HH12 1 1 10 2877 1 1 13 ARG HH21 H -8.520 5.069 5.871 1.00 . A A . 13 ARG HH21 1 1 10 2878 1 1 13 ARG HH22 H -10.215 4.834 5.603 1.00 . A A . 13 ARG HH22 1 1 10 2879 1 1 13 ARG N N -4.786 4.246 2.432 1.00 . A A . 13 ARG N 1 1 10 2880 1 1 13 ARG NE N -7.800 2.764 5.192 1.00 . A A . 13 ARG NE 1 1 10 2881 1 1 13 ARG NH1 N -10.059 2.460 4.841 1.00 . A A . 13 ARG NH1 1 1 10 2882 1 1 13 ARG NH2 N -9.279 4.481 5.592 1.00 . A A . 13 ARG NH2 1 1 10 2883 1 1 13 ARG O O -2.783 2.281 1.945 1.00 . A A . 13 ARG O 1 1 10 2884 1 1 14 ASP C C -1.209 0.283 3.283 1.00 . A A . 14 ASP C 1 1 10 2885 1 1 14 ASP CA C -1.174 1.568 4.104 1.00 . A A . 14 ASP CA 1 1 10 2886 1 1 14 ASP CB C -0.648 1.276 5.509 1.00 . A A . 14 ASP CB 1 1 10 2887 1 1 14 ASP CG C -0.690 2.498 6.404 1.00 . A A . 14 ASP CG 1 1 10 2888 1 1 14 ASP H H -2.881 2.366 5.057 1.00 . A A . 14 ASP H 1 1 10 2889 1 1 14 ASP HA H -0.513 2.270 3.622 1.00 . A A . 14 ASP HA 1 1 10 2890 1 1 14 ASP HB2 H -1.252 0.502 5.959 1.00 . A A . 14 ASP HB2 1 1 10 2891 1 1 14 ASP HB3 H 0.374 0.935 5.441 1.00 . A A . 14 ASP HB3 1 1 10 2892 1 1 14 ASP N N -2.496 2.177 4.178 1.00 . A A . 14 ASP N 1 1 10 2893 1 1 14 ASP O O -1.360 -0.809 3.825 1.00 . A A . 14 ASP O 1 1 10 2894 1 1 14 ASP OD1 O -0.665 2.330 7.641 1.00 . A A . 14 ASP OD1 1 1 10 2895 1 1 14 ASP OD2 O -0.748 3.625 5.867 1.00 . A A . 14 ASP OD2 1 1 10 2896 1 1 15 SER C C 0.113 -1.623 1.321 1.00 . A A . 15 SER C 1 1 10 2897 1 1 15 SER CA C -1.081 -0.710 1.061 1.00 . A A . 15 SER CA 1 1 10 2898 1 1 15 SER CB C -1.065 -0.224 -0.388 1.00 . A A . 15 SER CB 1 1 10 2899 1 1 15 SER H H -0.955 1.327 1.605 1.00 . A A . 15 SER H 1 1 10 2900 1 1 15 SER HA H -1.991 -1.264 1.236 1.00 . A A . 15 SER HA 1 1 10 2901 1 1 15 SER HB2 H -1.664 0.670 -0.472 1.00 . A A . 15 SER HB2 1 1 10 2902 1 1 15 SER HB3 H -0.048 -0.005 -0.680 1.00 . A A . 15 SER HB3 1 1 10 2903 1 1 15 SER HG H -2.424 -1.532 -0.914 1.00 . A A . 15 SER HG 1 1 10 2904 1 1 15 SER N N -1.069 0.429 1.971 1.00 . A A . 15 SER N 1 1 10 2905 1 1 15 SER O O 0.707 -1.583 2.394 1.00 . A A . 15 SER O 1 1 10 2906 1 1 15 SER OG O -1.588 -1.210 -1.260 1.00 . A A . 15 SER OG 1 1 10 2907 1 1 16 LEU C C 2.888 -2.700 0.031 1.00 . A A . 16 LEU C 1 1 10 2908 1 1 16 LEU CA C 1.588 -3.361 0.479 1.00 . A A . 16 LEU CA 1 1 10 2909 1 1 16 LEU CB C 1.337 -4.637 -0.325 1.00 . A A . 16 LEU CB 1 1 10 2910 1 1 16 LEU CD1 C -0.654 -6.171 -0.277 1.00 . A A . 16 LEU CD1 1 1 10 2911 1 1 16 LEU CD2 C 1.538 -6.940 0.654 1.00 . A A . 16 LEU CD2 1 1 10 2912 1 1 16 LEU CG C 0.617 -5.747 0.446 1.00 . A A . 16 LEU CG 1 1 10 2913 1 1 16 LEU H H -0.046 -2.438 -0.500 1.00 . A A . 16 LEU H 1 1 10 2914 1 1 16 LEU HA H 1.673 -3.618 1.524 1.00 . A A . 16 LEU HA 1 1 10 2915 1 1 16 LEU HB2 H 0.744 -4.380 -1.191 1.00 . A A . 16 LEU HB2 1 1 10 2916 1 1 16 LEU HB3 H 2.289 -5.020 -0.662 1.00 . A A . 16 LEU HB3 1 1 10 2917 1 1 16 LEU HD11 H -0.992 -5.366 -0.913 1.00 . A A . 16 LEU HD11 1 1 10 2918 1 1 16 LEU HD12 H -1.420 -6.404 0.447 1.00 . A A . 16 LEU HD12 1 1 10 2919 1 1 16 LEU HD13 H -0.451 -7.044 -0.880 1.00 . A A . 16 LEU HD13 1 1 10 2920 1 1 16 LEU HD21 H 2.281 -6.961 -0.130 1.00 . A A . 16 LEU HD21 1 1 10 2921 1 1 16 LEU HD22 H 0.959 -7.851 0.627 1.00 . A A . 16 LEU HD22 1 1 10 2922 1 1 16 LEU HD23 H 2.029 -6.852 1.612 1.00 . A A . 16 LEU HD23 1 1 10 2923 1 1 16 LEU HG H 0.335 -5.371 1.419 1.00 . A A . 16 LEU HG 1 1 10 2924 1 1 16 LEU N N 0.463 -2.446 0.337 1.00 . A A . 16 LEU N 1 1 10 2925 1 1 16 LEU O O 2.877 -1.615 -0.550 1.00 . A A . 16 LEU O 1 1 10 2926 1 1 17 TYR C C 5.362 -2.397 -1.518 1.00 . A A . 17 TYR C 1 1 10 2927 1 1 17 TYR CA C 5.323 -2.839 -0.056 1.00 . A A . 17 TYR CA 1 1 10 2928 1 1 17 TYR CB C 6.401 -3.895 0.196 1.00 . A A . 17 TYR CB 1 1 10 2929 1 1 17 TYR CD1 C 5.916 -5.679 -1.524 1.00 . A A . 17 TYR CD1 1 1 10 2930 1 1 17 TYR CD2 C 5.654 -6.234 0.780 1.00 . A A . 17 TYR CD2 1 1 10 2931 1 1 17 TYR CE1 C 5.534 -6.958 -1.880 1.00 . A A . 17 TYR CE1 1 1 10 2932 1 1 17 TYR CE2 C 5.271 -7.515 0.432 1.00 . A A . 17 TYR CE2 1 1 10 2933 1 1 17 TYR CG C 5.983 -5.296 -0.190 1.00 . A A . 17 TYR CG 1 1 10 2934 1 1 17 TYR CZ C 5.212 -7.872 -0.898 1.00 . A A . 17 TYR CZ 1 1 10 2935 1 1 17 TYR H H 3.950 -4.219 0.780 1.00 . A A . 17 TYR H 1 1 10 2936 1 1 17 TYR HA H 5.523 -1.982 0.570 1.00 . A A . 17 TYR HA 1 1 10 2937 1 1 17 TYR HB2 H 7.281 -3.645 -0.377 1.00 . A A . 17 TYR HB2 1 1 10 2938 1 1 17 TYR HB3 H 6.652 -3.901 1.246 1.00 . A A . 17 TYR HB3 1 1 10 2939 1 1 17 TYR HD1 H 6.169 -4.960 -2.289 1.00 . A A . 17 TYR HD1 1 1 10 2940 1 1 17 TYR HD2 H 5.700 -5.951 1.821 1.00 . A A . 17 TYR HD2 1 1 10 2941 1 1 17 TYR HE1 H 5.488 -7.237 -2.922 1.00 . A A . 17 TYR HE1 1 1 10 2942 1 1 17 TYR HE2 H 5.019 -8.230 1.201 1.00 . A A . 17 TYR HE2 1 1 10 2943 1 1 17 TYR HH H 3.915 -9.142 -1.528 1.00 . A A . 17 TYR HH 1 1 10 2944 1 1 17 TYR N N 4.008 -3.361 0.311 1.00 . A A . 17 TYR N 1 1 10 2945 1 1 17 TYR O O 4.508 -2.784 -2.316 1.00 . A A . 17 TYR O 1 1 10 2946 1 1 17 TYR OH O 4.833 -9.147 -1.249 1.00 . A A . 17 TYR OH 1 1 10 2947 1 1 18 PRO C C 6.374 -2.177 -4.304 1.00 . A A . 18 PRO C 1 1 10 2948 1 1 18 PRO CA C 6.514 -1.073 -3.256 1.00 . A A . 18 PRO CA 1 1 10 2949 1 1 18 PRO CB C 7.936 -0.512 -3.262 1.00 . A A . 18 PRO CB 1 1 10 2950 1 1 18 PRO CD C 7.419 -1.065 -0.991 1.00 . A A . 18 PRO CD 1 1 10 2951 1 1 18 PRO CG C 8.178 -0.092 -1.854 1.00 . A A . 18 PRO CG 1 1 10 2952 1 1 18 PRO HA H 5.811 -0.281 -3.467 1.00 . A A . 18 PRO HA 1 1 10 2953 1 1 18 PRO HB2 H 8.628 -1.282 -3.571 1.00 . A A . 18 PRO HB2 1 1 10 2954 1 1 18 PRO HB3 H 7.993 0.326 -3.939 1.00 . A A . 18 PRO HB3 1 1 10 2955 1 1 18 PRO HD2 H 8.067 -1.865 -0.666 1.00 . A A . 18 PRO HD2 1 1 10 2956 1 1 18 PRO HD3 H 6.991 -0.557 -0.139 1.00 . A A . 18 PRO HD3 1 1 10 2957 1 1 18 PRO HG2 H 9.235 -0.141 -1.634 1.00 . A A . 18 PRO HG2 1 1 10 2958 1 1 18 PRO HG3 H 7.809 0.911 -1.701 1.00 . A A . 18 PRO HG3 1 1 10 2959 1 1 18 PRO N N 6.361 -1.574 -1.886 1.00 . A A . 18 PRO N 1 1 10 2960 1 1 18 PRO O O 6.946 -3.257 -4.157 1.00 . A A . 18 PRO O 1 1 10 2961 1 1 19 PRO C C 6.662 -3.113 -7.291 1.00 . A A . 19 PRO C 1 1 10 2962 1 1 19 PRO CA C 5.406 -2.902 -6.453 1.00 . A A . 19 PRO CA 1 1 10 2963 1 1 19 PRO CB C 4.297 -2.276 -7.302 1.00 . A A . 19 PRO CB 1 1 10 2964 1 1 19 PRO CD C 4.890 -0.659 -5.645 1.00 . A A . 19 PRO CD 1 1 10 2965 1 1 19 PRO CG C 4.424 -0.811 -7.067 1.00 . A A . 19 PRO CG 1 1 10 2966 1 1 19 PRO HA H 5.072 -3.851 -6.061 1.00 . A A . 19 PRO HA 1 1 10 2967 1 1 19 PRO HB2 H 4.451 -2.526 -8.342 1.00 . A A . 19 PRO HB2 1 1 10 2968 1 1 19 PRO HB3 H 3.337 -2.646 -6.975 1.00 . A A . 19 PRO HB3 1 1 10 2969 1 1 19 PRO HD2 H 5.553 0.189 -5.554 1.00 . A A . 19 PRO HD2 1 1 10 2970 1 1 19 PRO HD3 H 4.046 -0.553 -4.981 1.00 . A A . 19 PRO HD3 1 1 10 2971 1 1 19 PRO HG2 H 5.150 -0.392 -7.747 1.00 . A A . 19 PRO HG2 1 1 10 2972 1 1 19 PRO HG3 H 3.464 -0.333 -7.199 1.00 . A A . 19 PRO HG3 1 1 10 2973 1 1 19 PRO N N 5.611 -1.920 -5.383 1.00 . A A . 19 PRO N 1 1 10 2974 1 1 19 PRO O O 7.413 -2.173 -7.550 1.00 . A A . 19 PRO O 1 1 10 2975 1 1 20 ALA C C 7.654 -4.995 -9.960 1.00 . A A . 20 ALA C 1 1 10 2976 1 1 20 ALA CA C 8.052 -4.687 -8.520 1.00 . A A . 20 ALA CA 1 1 10 2977 1 1 20 ALA CB C 8.795 -5.867 -7.912 1.00 . A A . 20 ALA CB 1 1 10 2978 1 1 20 ALA H H 6.251 -5.062 -7.474 1.00 . A A . 20 ALA H 1 1 10 2979 1 1 20 ALA HA H 8.715 -3.835 -8.516 1.00 . A A . 20 ALA HA 1 1 10 2980 1 1 20 ALA HB1 H 8.756 -5.800 -6.835 1.00 . A A . 20 ALA HB1 1 1 10 2981 1 1 20 ALA HB2 H 9.825 -5.851 -8.237 1.00 . A A . 20 ALA HB2 1 1 10 2982 1 1 20 ALA HB3 H 8.331 -6.789 -8.232 1.00 . A A . 20 ALA HB3 1 1 10 2983 1 1 20 ALA N N 6.886 -4.354 -7.712 1.00 . A A . 20 ALA N 1 1 10 2984 1 1 20 ALA O O 7.061 -6.036 -10.243 1.00 . A A . 20 ALA O 1 1 10 2985 1 1 21 GLY C C 7.632 -2.968 -13.041 1.00 . A A . 21 GLY C 1 1 10 2986 1 1 21 GLY CA C 7.655 -4.272 -12.267 1.00 . A A . 21 GLY CA 1 1 10 2987 1 1 21 GLY H H 8.457 -3.271 -10.583 1.00 . A A . 21 GLY H 1 1 10 2988 1 1 21 GLY HA2 H 8.388 -4.928 -12.712 1.00 . A A . 21 GLY HA2 1 1 10 2989 1 1 21 GLY HA3 H 6.682 -4.736 -12.336 1.00 . A A . 21 GLY HA3 1 1 10 2990 1 1 21 GLY N N 7.985 -4.081 -10.867 1.00 . A A . 21 GLY N 1 1 11 2991 1 1 1 ASP C C -4.382 -2.010 -2.216 1.00 . A A . 1 ASP C 1 1 11 2992 1 1 1 ASP CA C -3.417 -1.391 -3.223 1.00 . A A . 1 ASP CA 1 1 11 2993 1 1 1 ASP CB C -2.075 -2.126 -3.183 1.00 . A A . 1 ASP CB 1 1 11 2994 1 1 1 ASP CG C -2.094 -3.409 -3.990 1.00 . A A . 1 ASP CG 1 1 11 2995 1 1 1 ASP H1 H -2.374 0.260 -2.531 1.00 . A A . 1 ASP H1 1 1 11 2996 1 1 1 ASP HA H -3.839 -1.485 -4.213 1.00 . A A . 1 ASP HA 1 1 11 2997 1 1 1 ASP HB2 H -1.307 -1.482 -3.584 1.00 . A A . 1 ASP HB2 1 1 11 2998 1 1 1 ASP HB3 H -1.836 -2.369 -2.158 1.00 . A A . 1 ASP HB3 1 1 11 2999 1 1 1 ASP N N -3.228 0.028 -2.950 1.00 . A A . 1 ASP N 1 1 11 3000 1 1 1 ASP O O -5.045 -3.006 -2.507 1.00 . A A . 1 ASP O 1 1 11 3001 1 1 1 ASP OD1 O -1.407 -3.465 -5.032 1.00 . A A . 1 ASP OD1 1 1 11 3002 1 1 1 ASP OD2 O -2.795 -4.358 -3.580 1.00 . A A . 1 ASP OD2 1 1 11 3003 1 1 2 GLY C C -4.762 -3.094 0.748 1.00 . A A . 2 GLY C 1 1 11 3004 1 1 2 GLY CA C -5.346 -1.913 0.000 1.00 . A A . 2 GLY CA 1 1 11 3005 1 1 2 GLY H H -3.907 -0.619 -0.856 1.00 . A A . 2 GLY H 1 1 11 3006 1 1 2 GLY HA2 H -5.546 -1.119 0.705 1.00 . A A . 2 GLY HA2 1 1 11 3007 1 1 2 GLY HA3 H -6.276 -2.215 -0.458 1.00 . A A . 2 GLY HA3 1 1 11 3008 1 1 2 GLY N N -4.458 -1.411 -1.031 1.00 . A A . 2 GLY N 1 1 11 3009 1 1 2 GLY O O -3.877 -3.782 0.240 1.00 . A A . 2 GLY O 1 1 11 3010 1 1 3 MET C C -3.427 -4.126 3.410 1.00 . A A . 3 MET C 1 1 11 3011 1 1 3 MET CA C -4.787 -4.439 2.790 1.00 . A A . 3 MET CA 1 1 11 3012 1 1 3 MET CB C -4.706 -5.730 1.969 1.00 . A A . 3 MET CB 1 1 11 3013 1 1 3 MET CE C -5.993 -9.485 1.772 1.00 . A A . 3 MET CE 1 1 11 3014 1 1 3 MET CG C -5.435 -6.902 2.606 1.00 . A A . 3 MET CG 1 1 11 3015 1 1 3 MET H H -5.964 -2.744 2.307 1.00 . A A . 3 MET H 1 1 11 3016 1 1 3 MET HA H -5.503 -4.578 3.586 1.00 . A A . 3 MET HA 1 1 11 3017 1 1 3 MET HB2 H -5.139 -5.552 0.996 1.00 . A A . 3 MET HB2 1 1 11 3018 1 1 3 MET HB3 H -3.668 -6.003 1.847 1.00 . A A . 3 MET HB3 1 1 11 3019 1 1 3 MET HE1 H -6.824 -9.343 2.447 1.00 . A A . 3 MET HE1 1 1 11 3020 1 1 3 MET HE2 H -5.701 -10.524 1.774 1.00 . A A . 3 MET HE2 1 1 11 3021 1 1 3 MET HE3 H -6.285 -9.194 0.774 1.00 . A A . 3 MET HE3 1 1 11 3022 1 1 3 MET HG2 H -5.489 -6.737 3.672 1.00 . A A . 3 MET HG2 1 1 11 3023 1 1 3 MET HG3 H -6.435 -6.950 2.199 1.00 . A A . 3 MET HG3 1 1 11 3024 1 1 3 MET N N -5.259 -3.330 1.960 1.00 . A A . 3 MET N 1 1 11 3025 1 1 3 MET O O -3.272 -4.152 4.631 1.00 . A A . 3 MET O 1 1 11 3026 1 1 3 MET SD S -4.612 -8.477 2.307 1.00 . A A . 3 MET SD 1 1 11 3027 1 1 4 GLY C C -1.102 -2.480 4.141 1.00 . A A . 4 GLY C 1 1 11 3028 1 1 4 GLY CA C -1.109 -3.524 3.043 1.00 . A A . 4 GLY CA 1 1 11 3029 1 1 4 GLY H H -2.625 -3.832 1.600 1.00 . A A . 4 GLY H 1 1 11 3030 1 1 4 GLY HA2 H -0.656 -4.427 3.419 1.00 . A A . 4 GLY HA2 1 1 11 3031 1 1 4 GLY HA3 H -0.520 -3.158 2.215 1.00 . A A . 4 GLY HA3 1 1 11 3032 1 1 4 GLY N N -2.444 -3.834 2.562 1.00 . A A . 4 GLY N 1 1 11 3033 1 1 4 GLY O O -2.151 -1.959 4.521 1.00 . A A . 4 GLY O 1 1 11 3034 1 1 5 GLU C C 1.579 -0.460 5.594 1.00 . A A . 5 GLU C 1 1 11 3035 1 1 5 GLU CA C 0.234 -1.174 5.704 1.00 . A A . 5 GLU CA 1 1 11 3036 1 1 5 GLU CB C 0.097 -1.833 7.078 1.00 . A A . 5 GLU CB 1 1 11 3037 1 1 5 GLU CD C 0.489 -1.398 9.535 1.00 . A A . 5 GLU CD 1 1 11 3038 1 1 5 GLU CG C -0.022 -0.839 8.221 1.00 . A A . 5 GLU CG 1 1 11 3039 1 1 5 GLU H H 0.887 -2.615 4.298 1.00 . A A . 5 GLU H 1 1 11 3040 1 1 5 GLU HA H -0.556 -0.446 5.581 1.00 . A A . 5 GLU HA 1 1 11 3041 1 1 5 GLU HB2 H -0.784 -2.457 7.079 1.00 . A A . 5 GLU HB2 1 1 11 3042 1 1 5 GLU HB3 H 0.965 -2.451 7.256 1.00 . A A . 5 GLU HB3 1 1 11 3043 1 1 5 GLU HG2 H 0.549 0.044 7.977 1.00 . A A . 5 GLU HG2 1 1 11 3044 1 1 5 GLU HG3 H -1.062 -0.573 8.342 1.00 . A A . 5 GLU HG3 1 1 11 3045 1 1 5 GLU N N 0.088 -2.169 4.648 1.00 . A A . 5 GLU N 1 1 11 3046 1 1 5 GLU O O 2.278 -0.271 6.590 1.00 . A A . 5 GLU O 1 1 11 3047 1 1 5 GLU OE1 O -0.209 -2.243 10.132 1.00 . A A . 5 GLU OE1 1 1 11 3048 1 1 5 GLU OE2 O 1.589 -0.991 9.965 1.00 . A A . 5 GLU OE2 1 1 11 3049 1 1 6 GLU C C 2.950 2.107 3.822 1.00 . A A . 6 GLU C 1 1 11 3050 1 1 6 GLU CA C 3.193 0.631 4.130 1.00 . A A . 6 GLU CA 1 1 11 3051 1 1 6 GLU CB C 3.949 -0.030 2.973 1.00 . A A . 6 GLU CB 1 1 11 3052 1 1 6 GLU CD C 6.160 0.279 4.157 1.00 . A A . 6 GLU CD 1 1 11 3053 1 1 6 GLU CG C 5.261 -0.673 3.393 1.00 . A A . 6 GLU CG 1 1 11 3054 1 1 6 GLU H H 1.333 -0.242 3.621 1.00 . A A . 6 GLU H 1 1 11 3055 1 1 6 GLU HA H 3.791 0.558 5.026 1.00 . A A . 6 GLU HA 1 1 11 3056 1 1 6 GLU HB2 H 3.321 -0.794 2.540 1.00 . A A . 6 GLU HB2 1 1 11 3057 1 1 6 GLU HB3 H 4.163 0.717 2.222 1.00 . A A . 6 GLU HB3 1 1 11 3058 1 1 6 GLU HG2 H 5.045 -1.523 4.022 1.00 . A A . 6 GLU HG2 1 1 11 3059 1 1 6 GLU HG3 H 5.782 -1.005 2.507 1.00 . A A . 6 GLU HG3 1 1 11 3060 1 1 6 GLU N N 1.934 -0.064 4.375 1.00 . A A . 6 GLU N 1 1 11 3061 1 1 6 GLU O O 3.536 2.987 4.452 1.00 . A A . 6 GLU O 1 1 11 3062 1 1 6 GLU OE1 O 6.931 -0.195 5.018 1.00 . A A . 6 GLU OE1 1 1 11 3063 1 1 6 GLU OE2 O 6.093 1.498 3.894 1.00 . A A . 6 GLU OE2 1 1 11 3064 1 1 7 PHE C C 0.589 3.770 1.483 1.00 . A A . 7 PHE C 1 1 11 3065 1 1 7 PHE CA C 1.757 3.739 2.464 1.00 . A A . 7 PHE CA 1 1 11 3066 1 1 7 PHE CB C 2.979 4.424 1.847 1.00 . A A . 7 PHE CB 1 1 11 3067 1 1 7 PHE CD1 C 4.990 3.049 1.247 1.00 . A A . 7 PHE CD1 1 1 11 3068 1 1 7 PHE CD2 C 3.223 3.226 -0.345 1.00 . A A . 7 PHE CD2 1 1 11 3069 1 1 7 PHE CE1 C 5.699 2.244 0.375 1.00 . A A . 7 PHE CE1 1 1 11 3070 1 1 7 PHE CE2 C 3.927 2.421 -1.221 1.00 . A A . 7 PHE CE2 1 1 11 3071 1 1 7 PHE CG C 3.746 3.548 0.897 1.00 . A A . 7 PHE CG 1 1 11 3072 1 1 7 PHE CZ C 5.167 1.930 -0.860 1.00 . A A . 7 PHE CZ 1 1 11 3073 1 1 7 PHE H H 1.643 1.626 2.386 1.00 . A A . 7 PHE H 1 1 11 3074 1 1 7 PHE HA H 1.469 4.273 3.358 1.00 . A A . 7 PHE HA 1 1 11 3075 1 1 7 PHE HB2 H 2.655 5.299 1.303 1.00 . A A . 7 PHE HB2 1 1 11 3076 1 1 7 PHE HB3 H 3.650 4.726 2.637 1.00 . A A . 7 PHE HB3 1 1 11 3077 1 1 7 PHE HD1 H 5.407 3.293 2.213 1.00 . A A . 7 PHE HD1 1 1 11 3078 1 1 7 PHE HD2 H 2.254 3.610 -0.628 1.00 . A A . 7 PHE HD2 1 1 11 3079 1 1 7 PHE HE1 H 6.668 1.861 0.659 1.00 . A A . 7 PHE HE1 1 1 11 3080 1 1 7 PHE HE2 H 3.509 2.178 -2.186 1.00 . A A . 7 PHE HE2 1 1 11 3081 1 1 7 PHE HZ H 5.719 1.301 -1.543 1.00 . A A . 7 PHE HZ 1 1 11 3082 1 1 7 PHE N N 2.080 2.369 2.851 1.00 . A A . 7 PHE N 1 1 11 3083 1 1 7 PHE O O 0.490 2.929 0.591 1.00 . A A . 7 PHE O 1 1 11 3084 1 1 8 ILE C C -1.121 4.852 -0.665 1.00 . A A . 8 ILE C 1 1 11 3085 1 1 8 ILE CA C -1.472 4.894 0.821 1.00 . A A . 8 ILE CA 1 1 11 3086 1 1 8 ILE CB C -2.198 6.216 1.130 1.00 . A A . 8 ILE CB 1 1 11 3087 1 1 8 ILE CD1 C -2.026 8.746 0.892 1.00 . A A . 8 ILE CD1 1 1 11 3088 1 1 8 ILE CG1 C -1.324 7.414 0.746 1.00 . A A . 8 ILE CG1 1 1 11 3089 1 1 8 ILE CG2 C -2.575 6.280 2.602 1.00 . A A . 8 ILE CG2 1 1 11 3090 1 1 8 ILE H H -0.166 5.377 2.400 1.00 . A A . 8 ILE H 1 1 11 3091 1 1 8 ILE HA H -2.147 4.081 1.043 1.00 . A A . 8 ILE HA 1 1 11 3092 1 1 8 ILE HB H -3.103 6.242 0.553 1.00 . A A . 8 ILE HB 1 1 11 3093 1 1 8 ILE HD11 H -1.669 9.426 0.133 1.00 . A A . 8 ILE HD11 1 1 11 3094 1 1 8 ILE HD12 H -1.819 9.156 1.870 1.00 . A A . 8 ILE HD12 1 1 11 3095 1 1 8 ILE HD13 H -3.091 8.606 0.778 1.00 . A A . 8 ILE HD13 1 1 11 3096 1 1 8 ILE HG12 H -0.449 7.430 1.378 1.00 . A A . 8 ILE HG12 1 1 11 3097 1 1 8 ILE HG13 H -1.017 7.311 -0.285 1.00 . A A . 8 ILE HG13 1 1 11 3098 1 1 8 ILE HG21 H -2.622 5.280 3.006 1.00 . A A . 8 ILE HG21 1 1 11 3099 1 1 8 ILE HG22 H -3.539 6.756 2.706 1.00 . A A . 8 ILE HG22 1 1 11 3100 1 1 8 ILE HG23 H -1.832 6.851 3.139 1.00 . A A . 8 ILE HG23 1 1 11 3101 1 1 8 ILE N N -0.298 4.743 1.667 1.00 . A A . 8 ILE N 1 1 11 3102 1 1 8 ILE O O -0.060 5.318 -1.079 1.00 . A A . 8 ILE O 1 1 11 3103 1 1 9 GLU C C -2.732 5.197 -3.626 1.00 . A A . 9 GLU C 1 1 11 3104 1 1 9 GLU CA C -1.839 4.197 -2.900 1.00 . A A . 9 GLU CA 1 1 11 3105 1 1 9 GLU CB C -2.149 2.778 -3.382 1.00 . A A . 9 GLU CB 1 1 11 3106 1 1 9 GLU CD C -3.895 0.960 -3.621 1.00 . A A . 9 GLU CD 1 1 11 3107 1 1 9 GLU CG C -3.613 2.397 -3.231 1.00 . A A . 9 GLU CG 1 1 11 3108 1 1 9 GLU H H -2.859 3.950 -1.064 1.00 . A A . 9 GLU H 1 1 11 3109 1 1 9 GLU HA H -0.807 4.428 -3.116 1.00 . A A . 9 GLU HA 1 1 11 3110 1 1 9 GLU HB2 H -1.884 2.698 -4.426 1.00 . A A . 9 GLU HB2 1 1 11 3111 1 1 9 GLU HB3 H -1.555 2.078 -2.813 1.00 . A A . 9 GLU HB3 1 1 11 3112 1 1 9 GLU HG2 H -3.899 2.534 -2.200 1.00 . A A . 9 GLU HG2 1 1 11 3113 1 1 9 GLU HG3 H -4.206 3.047 -3.856 1.00 . A A . 9 GLU HG3 1 1 11 3114 1 1 9 GLU N N -2.031 4.297 -1.458 1.00 . A A . 9 GLU N 1 1 11 3115 1 1 9 GLU O O -2.295 5.885 -4.548 1.00 . A A . 9 GLU O 1 1 11 3116 1 1 9 GLU OE1 O -4.706 0.694 -4.508 1.00 . A A . 9 GLU OE1 1 1 11 3117 1 1 10 GLY C C -6.015 6.626 -2.847 1.00 . A A . 10 GLY C 1 1 11 3118 1 1 10 GLY CA C -4.934 6.182 -3.812 1.00 . A A . 10 GLY CA 1 1 11 3119 1 1 10 GLY H H -4.278 4.693 -2.461 1.00 . A A . 10 GLY H 1 1 11 3120 1 1 10 GLY HA2 H -4.400 7.052 -4.164 1.00 . A A . 10 GLY HA2 1 1 11 3121 1 1 10 GLY HA3 H -5.399 5.692 -4.655 1.00 . A A . 10 GLY HA3 1 1 11 3122 1 1 10 GLY N N -3.990 5.268 -3.200 1.00 . A A . 10 GLY N 1 1 11 3123 1 1 10 GLY O O -7.205 6.467 -3.119 1.00 . A A . 10 GLY O 1 1 11 3124 1 1 11 LEU C C -7.114 6.494 0.102 1.00 . A A . 11 LEU C 1 1 11 3125 1 1 11 LEU CA C -6.531 7.660 -0.692 1.00 . A A . 11 LEU CA 1 1 11 3126 1 1 11 LEU CB C -7.663 8.476 -1.325 1.00 . A A . 11 LEU CB 1 1 11 3127 1 1 11 LEU CD1 C -8.186 9.403 -3.597 1.00 . A A . 11 LEU CD1 1 1 11 3128 1 1 11 LEU CD2 C -7.133 10.867 -1.865 1.00 . A A . 11 LEU CD2 1 1 11 3129 1 1 11 LEU CG C -7.225 9.453 -2.419 1.00 . A A . 11 LEU CG 1 1 11 3130 1 1 11 LEU H H -4.633 7.280 -1.558 1.00 . A A . 11 LEU H 1 1 11 3131 1 1 11 LEU HA H -5.980 8.296 -0.015 1.00 . A A . 11 LEU HA 1 1 11 3132 1 1 11 LEU HB2 H -8.379 7.787 -1.750 1.00 . A A . 11 LEU HB2 1 1 11 3133 1 1 11 LEU HB3 H -8.152 9.039 -0.545 1.00 . A A . 11 LEU HB3 1 1 11 3134 1 1 11 LEU HD11 H -7.809 8.714 -4.340 1.00 . A A . 11 LEU HD11 1 1 11 3135 1 1 11 LEU HD12 H -8.275 10.387 -4.032 1.00 . A A . 11 LEU HD12 1 1 11 3136 1 1 11 LEU HD13 H -9.155 9.070 -3.257 1.00 . A A . 11 LEU HD13 1 1 11 3137 1 1 11 LEU HD21 H -6.224 10.971 -1.290 1.00 . A A . 11 LEU HD21 1 1 11 3138 1 1 11 LEU HD22 H -7.985 11.061 -1.229 1.00 . A A . 11 LEU HD22 1 1 11 3139 1 1 11 LEU HD23 H -7.125 11.574 -2.681 1.00 . A A . 11 LEU HD23 1 1 11 3140 1 1 11 LEU HG H -6.246 9.169 -2.776 1.00 . A A . 11 LEU HG 1 1 11 3141 1 1 11 LEU N N -5.597 7.185 -1.713 1.00 . A A . 11 LEU N 1 1 11 3142 1 1 11 LEU O O -8.276 6.528 0.509 1.00 . A A . 11 LEU O 1 1 11 3143 1 1 12 VAL C C -5.682 3.876 2.093 1.00 . A A . 12 VAL C 1 1 11 3144 1 1 12 VAL CA C -6.736 4.294 1.072 1.00 . A A . 12 VAL CA 1 1 11 3145 1 1 12 VAL CB C -7.034 3.106 0.136 1.00 . A A . 12 VAL CB 1 1 11 3146 1 1 12 VAL CG1 C -8.142 3.461 -0.843 1.00 . A A . 12 VAL CG1 1 1 11 3147 1 1 12 VAL CG2 C -5.776 2.680 -0.606 1.00 . A A . 12 VAL CG2 1 1 11 3148 1 1 12 VAL H H -5.385 5.499 -0.024 1.00 . A A . 12 VAL H 1 1 11 3149 1 1 12 VAL HA H -7.646 4.552 1.595 1.00 . A A . 12 VAL HA 1 1 11 3150 1 1 12 VAL HB H -7.370 2.275 0.737 1.00 . A A . 12 VAL HB 1 1 11 3151 1 1 12 VAL HG11 H -8.851 4.119 -0.361 1.00 . A A . 12 VAL HG11 1 1 11 3152 1 1 12 VAL HG12 H -8.645 2.559 -1.159 1.00 . A A . 12 VAL HG12 1 1 11 3153 1 1 12 VAL HG13 H -7.718 3.957 -1.703 1.00 . A A . 12 VAL HG13 1 1 11 3154 1 1 12 VAL HG21 H -5.151 3.543 -0.779 1.00 . A A . 12 VAL HG21 1 1 11 3155 1 1 12 VAL HG22 H -6.049 2.236 -1.552 1.00 . A A . 12 VAL HG22 1 1 11 3156 1 1 12 VAL HG23 H -5.236 1.957 -0.012 1.00 . A A . 12 VAL HG23 1 1 11 3157 1 1 12 VAL N N -6.301 5.467 0.323 1.00 . A A . 12 VAL N 1 1 11 3158 1 1 12 VAL O O -4.671 4.556 2.268 1.00 . A A . 12 VAL O 1 1 11 3159 1 1 13 ARG C C -3.564 2.212 3.226 1.00 . A A . 13 ARG C 1 1 11 3160 1 1 13 ARG CA C -4.990 2.244 3.768 1.00 . A A . 13 ARG CA 1 1 11 3161 1 1 13 ARG CB C -5.412 0.844 4.222 1.00 . A A . 13 ARG CB 1 1 11 3162 1 1 13 ARG CD C -4.629 0.595 6.599 1.00 . A A . 13 ARG CD 1 1 11 3163 1 1 13 ARG CG C -5.829 0.777 5.682 1.00 . A A . 13 ARG CG 1 1 11 3164 1 1 13 ARG CZ C -3.631 1.809 8.499 1.00 . A A . 13 ARG CZ 1 1 11 3165 1 1 13 ARG H H -6.745 2.253 2.582 1.00 . A A . 13 ARG H 1 1 11 3166 1 1 13 ARG HA H -5.022 2.911 4.615 1.00 . A A . 13 ARG HA 1 1 11 3167 1 1 13 ARG HB2 H -6.246 0.518 3.617 1.00 . A A . 13 ARG HB2 1 1 11 3168 1 1 13 ARG HB3 H -4.586 0.163 4.074 1.00 . A A . 13 ARG HB3 1 1 11 3169 1 1 13 ARG HD2 H -4.607 -0.429 6.942 1.00 . A A . 13 ARG HD2 1 1 11 3170 1 1 13 ARG HD3 H -3.729 0.807 6.041 1.00 . A A . 13 ARG HD3 1 1 11 3171 1 1 13 ARG HE H -5.562 1.854 8.000 1.00 . A A . 13 ARG HE 1 1 11 3172 1 1 13 ARG HG2 H -6.333 1.695 5.945 1.00 . A A . 13 ARG HG2 1 1 11 3173 1 1 13 ARG HG3 H -6.503 -0.057 5.816 1.00 . A A . 13 ARG HG3 1 1 11 3174 1 1 13 ARG HH11 H -2.316 0.710 7.424 1.00 . A A . 13 ARG HH11 1 1 11 3175 1 1 13 ARG HH12 H -1.640 1.573 8.764 1.00 . A A . 13 ARG HH12 1 1 11 3176 1 1 13 ARG HH21 H -4.675 2.990 9.764 1.00 . A A . 13 ARG HH21 1 1 11 3177 1 1 13 ARG HH22 H -2.979 2.867 10.093 1.00 . A A . 13 ARG HH22 1 1 11 3178 1 1 13 ARG N N -5.922 2.753 2.764 1.00 . A A . 13 ARG N 1 1 11 3179 1 1 13 ARG NE N -4.688 1.482 7.759 1.00 . A A . 13 ARG NE 1 1 11 3180 1 1 13 ARG NH1 N -2.430 1.324 8.205 1.00 . A A . 13 ARG NH1 1 1 11 3181 1 1 13 ARG NH2 N -3.773 2.622 9.537 1.00 . A A . 13 ARG NH2 1 1 11 3182 1 1 13 ARG O O -3.352 2.161 2.014 1.00 . A A . 13 ARG O 1 1 11 3183 1 1 14 ASP C C -0.864 1.007 2.893 1.00 . A A . 14 ASP C 1 1 11 3184 1 1 14 ASP CA C -1.185 2.226 3.754 1.00 . A A . 14 ASP CA 1 1 11 3185 1 1 14 ASP CB C -0.304 2.229 5.004 1.00 . A A . 14 ASP CB 1 1 11 3186 1 1 14 ASP CG C -0.146 3.615 5.596 1.00 . A A . 14 ASP CG 1 1 11 3187 1 1 14 ASP H H -2.826 2.293 5.081 1.00 . A A . 14 ASP H 1 1 11 3188 1 1 14 ASP HA H -0.985 3.118 3.183 1.00 . A A . 14 ASP HA 1 1 11 3189 1 1 14 ASP HB2 H -0.748 1.587 5.750 1.00 . A A . 14 ASP HB2 1 1 11 3190 1 1 14 ASP HB3 H 0.674 1.852 4.748 1.00 . A A . 14 ASP HB3 1 1 11 3191 1 1 14 ASP N N -2.592 2.247 4.133 1.00 . A A . 14 ASP N 1 1 11 3192 1 1 14 ASP O O -0.447 -0.026 3.402 1.00 . A A . 14 ASP O 1 1 11 3193 1 1 14 ASP OD1 O 1.008 4.071 5.741 1.00 . A A . 14 ASP OD1 1 1 11 3194 1 1 14 ASP OD2 O -1.176 4.245 5.916 1.00 . A A . 14 ASP OD2 1 1 11 3195 1 1 15 SER C C 0.435 -0.742 1.000 1.00 . A A . 15 SER C 1 1 11 3196 1 1 15 SER CA C -0.813 0.060 0.635 1.00 . A A . 15 SER CA 1 1 11 3197 1 1 15 SER CB C -0.663 0.628 -0.776 1.00 . A A . 15 SER CB 1 1 11 3198 1 1 15 SER H H -1.409 1.992 1.254 1.00 . A A . 15 SER H 1 1 11 3199 1 1 15 SER HA H -1.666 -0.601 0.653 1.00 . A A . 15 SER HA 1 1 11 3200 1 1 15 SER HB2 H -1.532 1.222 -1.017 1.00 . A A . 15 SER HB2 1 1 11 3201 1 1 15 SER HB3 H 0.220 1.248 -0.821 1.00 . A A . 15 SER HB3 1 1 11 3202 1 1 15 SER HG H 0.359 -0.431 -2.069 1.00 . A A . 15 SER HG 1 1 11 3203 1 1 15 SER N N -1.069 1.142 1.588 1.00 . A A . 15 SER N 1 1 11 3204 1 1 15 SER O O 1.322 -0.251 1.698 1.00 . A A . 15 SER O 1 1 11 3205 1 1 15 SER OG O -0.541 -0.409 -1.734 1.00 . A A . 15 SER OG 1 1 11 3206 1 1 16 LEU C C 2.887 -2.355 0.107 1.00 . A A . 16 LEU C 1 1 11 3207 1 1 16 LEU CA C 1.620 -2.861 0.792 1.00 . A A . 16 LEU CA 1 1 11 3208 1 1 16 LEU CB C 1.296 -4.284 0.328 1.00 . A A . 16 LEU CB 1 1 11 3209 1 1 16 LEU CD1 C 0.057 -6.260 1.257 1.00 . A A . 16 LEU CD1 1 1 11 3210 1 1 16 LEU CD2 C 2.544 -6.125 1.487 1.00 . A A . 16 LEU CD2 1 1 11 3211 1 1 16 LEU CG C 1.247 -5.331 1.444 1.00 . A A . 16 LEU CG 1 1 11 3212 1 1 16 LEU H H -0.251 -2.312 -0.027 1.00 . A A . 16 LEU H 1 1 11 3213 1 1 16 LEU HA H 1.783 -2.870 1.859 1.00 . A A . 16 LEU HA 1 1 11 3214 1 1 16 LEU HB2 H 0.335 -4.267 -0.166 1.00 . A A . 16 LEU HB2 1 1 11 3215 1 1 16 LEU HB3 H 2.044 -4.590 -0.389 1.00 . A A . 16 LEU HB3 1 1 11 3216 1 1 16 LEU HD11 H -0.314 -6.568 2.223 1.00 . A A . 16 LEU HD11 1 1 11 3217 1 1 16 LEU HD12 H 0.363 -7.129 0.694 1.00 . A A . 16 LEU HD12 1 1 11 3218 1 1 16 LEU HD13 H -0.724 -5.741 0.721 1.00 . A A . 16 LEU HD13 1 1 11 3219 1 1 16 LEU HD21 H 2.436 -6.953 2.171 1.00 . A A . 16 LEU HD21 1 1 11 3220 1 1 16 LEU HD22 H 3.346 -5.484 1.820 1.00 . A A . 16 LEU HD22 1 1 11 3221 1 1 16 LEU HD23 H 2.769 -6.500 0.499 1.00 . A A . 16 LEU HD23 1 1 11 3222 1 1 16 LEU HG H 1.130 -4.828 2.393 1.00 . A A . 16 LEU HG 1 1 11 3223 1 1 16 LEU N N 0.490 -1.980 0.521 1.00 . A A . 16 LEU N 1 1 11 3224 1 1 16 LEU O O 2.948 -1.208 -0.337 1.00 . A A . 16 LEU O 1 1 11 3225 1 1 17 TYR C C 5.179 -3.295 -2.073 1.00 . A A . 17 TYR C 1 1 11 3226 1 1 17 TYR CA C 5.161 -2.856 -0.608 1.00 . A A . 17 TYR CA 1 1 11 3227 1 1 17 TYR CB C 6.353 -3.479 0.138 1.00 . A A . 17 TYR CB 1 1 11 3228 1 1 17 TYR CD1 C 5.721 -4.091 2.507 1.00 . A A . 17 TYR CD1 1 1 11 3229 1 1 17 TYR CD2 C 5.862 -5.840 0.894 1.00 . A A . 17 TYR CD2 1 1 11 3230 1 1 17 TYR CE1 C 5.372 -5.009 3.479 1.00 . A A . 17 TYR CE1 1 1 11 3231 1 1 17 TYR CE2 C 5.513 -6.765 1.861 1.00 . A A . 17 TYR CE2 1 1 11 3232 1 1 17 TYR CG C 5.972 -4.489 1.200 1.00 . A A . 17 TYR CG 1 1 11 3233 1 1 17 TYR CZ C 5.270 -6.344 3.151 1.00 . A A . 17 TYR CZ 1 1 11 3234 1 1 17 TYR H H 3.784 -4.117 0.394 1.00 . A A . 17 TYR H 1 1 11 3235 1 1 17 TYR HA H 5.249 -1.781 -0.566 1.00 . A A . 17 TYR HA 1 1 11 3236 1 1 17 TYR HB2 H 6.992 -3.979 -0.573 1.00 . A A . 17 TYR HB2 1 1 11 3237 1 1 17 TYR HB3 H 6.914 -2.690 0.619 1.00 . A A . 17 TYR HB3 1 1 11 3238 1 1 17 TYR HD1 H 5.802 -3.044 2.761 1.00 . A A . 17 TYR HD1 1 1 11 3239 1 1 17 TYR HD2 H 6.054 -6.167 -0.117 1.00 . A A . 17 TYR HD2 1 1 11 3240 1 1 17 TYR HE1 H 5.181 -4.679 4.490 1.00 . A A . 17 TYR HE1 1 1 11 3241 1 1 17 TYR HE2 H 5.433 -7.811 1.603 1.00 . A A . 17 TYR HE2 1 1 11 3242 1 1 17 TYR HH H 5.342 -7.029 4.947 1.00 . A A . 17 TYR HH 1 1 11 3243 1 1 17 TYR N N 3.895 -3.217 0.024 1.00 . A A . 17 TYR N 1 1 11 3244 1 1 17 TYR O O 5.064 -4.483 -2.372 1.00 . A A . 17 TYR O 1 1 11 3245 1 1 17 TYR OH O 4.922 -7.262 4.116 1.00 . A A . 17 TYR OH 1 1 11 3246 1 1 18 PRO C C 6.348 -3.759 -4.779 1.00 . A A . 18 PRO C 1 1 11 3247 1 1 18 PRO CA C 5.359 -2.643 -4.446 1.00 . A A . 18 PRO CA 1 1 11 3248 1 1 18 PRO CB C 5.810 -1.324 -5.075 1.00 . A A . 18 PRO CB 1 1 11 3249 1 1 18 PRO CD C 5.472 -0.894 -2.749 1.00 . A A . 18 PRO CD 1 1 11 3250 1 1 18 PRO CG C 5.362 -0.277 -4.116 1.00 . A A . 18 PRO CG 1 1 11 3251 1 1 18 PRO HA H 4.379 -2.905 -4.816 1.00 . A A . 18 PRO HA 1 1 11 3252 1 1 18 PRO HB2 H 6.884 -1.324 -5.189 1.00 . A A . 18 PRO HB2 1 1 11 3253 1 1 18 PRO HB3 H 5.339 -1.202 -6.040 1.00 . A A . 18 PRO HB3 1 1 11 3254 1 1 18 PRO HD2 H 6.437 -0.677 -2.314 1.00 . A A . 18 PRO HD2 1 1 11 3255 1 1 18 PRO HD3 H 4.679 -0.537 -2.110 1.00 . A A . 18 PRO HD3 1 1 11 3256 1 1 18 PRO HG2 H 6.006 0.588 -4.190 1.00 . A A . 18 PRO HG2 1 1 11 3257 1 1 18 PRO HG3 H 4.338 -0.003 -4.322 1.00 . A A . 18 PRO HG3 1 1 11 3258 1 1 18 PRO N N 5.326 -2.340 -3.011 1.00 . A A . 18 PRO N 1 1 11 3259 1 1 18 PRO O O 7.561 -3.549 -4.752 1.00 . A A . 18 PRO O 1 1 11 3260 1 1 19 PRO C C 7.507 -5.877 -6.708 1.00 . A A . 19 PRO C 1 1 11 3261 1 1 19 PRO CA C 6.701 -6.110 -5.434 1.00 . A A . 19 PRO CA 1 1 11 3262 1 1 19 PRO CB C 5.711 -7.264 -5.627 1.00 . A A . 19 PRO CB 1 1 11 3263 1 1 19 PRO CD C 4.414 -5.311 -5.157 1.00 . A A . 19 PRO CD 1 1 11 3264 1 1 19 PRO CG C 4.402 -6.611 -5.910 1.00 . A A . 19 PRO CG 1 1 11 3265 1 1 19 PRO HA H 7.376 -6.345 -4.624 1.00 . A A . 19 PRO HA 1 1 11 3266 1 1 19 PRO HB2 H 6.031 -7.880 -6.455 1.00 . A A . 19 PRO HB2 1 1 11 3267 1 1 19 PRO HB3 H 5.668 -7.857 -4.726 1.00 . A A . 19 PRO HB3 1 1 11 3268 1 1 19 PRO HD2 H 3.856 -4.559 -5.695 1.00 . A A . 19 PRO HD2 1 1 11 3269 1 1 19 PRO HD3 H 4.009 -5.446 -4.164 1.00 . A A . 19 PRO HD3 1 1 11 3270 1 1 19 PRO HG2 H 4.302 -6.429 -6.970 1.00 . A A . 19 PRO HG2 1 1 11 3271 1 1 19 PRO HG3 H 3.596 -7.239 -5.560 1.00 . A A . 19 PRO HG3 1 1 11 3272 1 1 19 PRO N N 5.846 -4.966 -5.099 1.00 . A A . 19 PRO N 1 1 11 3273 1 1 19 PRO O O 8.732 -5.996 -6.708 1.00 . A A . 19 PRO O 1 1 11 3274 1 1 20 ALA C C 6.577 -4.478 -9.998 1.00 . A A . 20 ALA C 1 1 11 3275 1 1 20 ALA CA C 7.471 -5.294 -9.069 1.00 . A A . 20 ALA CA 1 1 11 3276 1 1 20 ALA CB C 7.862 -6.610 -9.727 1.00 . A A . 20 ALA CB 1 1 11 3277 1 1 20 ALA H H 5.839 -5.463 -7.731 1.00 . A A . 20 ALA H 1 1 11 3278 1 1 20 ALA HA H 8.374 -4.735 -8.874 1.00 . A A . 20 ALA HA 1 1 11 3279 1 1 20 ALA HB1 H 7.007 -7.024 -10.241 1.00 . A A . 20 ALA HB1 1 1 11 3280 1 1 20 ALA HB2 H 8.200 -7.304 -8.972 1.00 . A A . 20 ALA HB2 1 1 11 3281 1 1 20 ALA HB3 H 8.658 -6.435 -10.436 1.00 . A A . 20 ALA HB3 1 1 11 3282 1 1 20 ALA N N 6.814 -5.544 -7.792 1.00 . A A . 20 ALA N 1 1 11 3283 1 1 20 ALA O O 6.111 -4.976 -11.024 1.00 . A A . 20 ALA O 1 1 11 3284 1 1 21 GLY C C 6.308 -1.527 -11.427 1.00 . A A . 21 GLY C 1 1 11 3285 1 1 21 GLY CA C 5.505 -2.358 -10.445 1.00 . A A . 21 GLY CA 1 1 11 3286 1 1 21 GLY H H 6.740 -2.879 -8.806 1.00 . A A . 21 GLY H 1 1 11 3287 1 1 21 GLY HA2 H 4.805 -2.969 -10.997 1.00 . A A . 21 GLY HA2 1 1 11 3288 1 1 21 GLY HA3 H 4.953 -1.695 -9.796 1.00 . A A . 21 GLY HA3 1 1 11 3289 1 1 21 GLY N N 6.342 -3.222 -9.633 1.00 . A A . 21 GLY N 1 1 12 3290 1 1 1 ASP C C -6.297 -2.289 -2.038 1.00 . A A . 1 ASP C 1 1 12 3291 1 1 1 ASP CA C -5.348 -2.244 -3.234 1.00 . A A . 1 ASP CA 1 1 12 3292 1 1 1 ASP CB C -4.727 -3.623 -3.465 1.00 . A A . 1 ASP CB 1 1 12 3293 1 1 1 ASP CG C -4.068 -3.738 -4.826 1.00 . A A . 1 ASP CG 1 1 12 3294 1 1 1 ASP H1 H -3.682 -1.512 -2.328 1.00 . A A . 1 ASP H1 1 1 12 3295 1 1 1 ASP HA H -5.911 -1.963 -4.111 1.00 . A A . 1 ASP HA 1 1 12 3296 1 1 1 ASP HB2 H -3.980 -3.806 -2.707 1.00 . A A . 1 ASP HB2 1 1 12 3297 1 1 1 ASP HB3 H -5.499 -4.375 -3.394 1.00 . A A . 1 ASP HB3 1 1 12 3298 1 1 1 ASP N N -4.303 -1.246 -3.037 1.00 . A A . 1 ASP N 1 1 12 3299 1 1 1 ASP O O -7.383 -1.710 -2.076 1.00 . A A . 1 ASP O 1 1 12 3300 1 1 1 ASP OD1 O -4.758 -3.507 -5.841 1.00 . A A . 1 ASP OD1 1 1 12 3301 1 1 1 ASP OD2 O -2.862 -4.058 -4.876 1.00 . A A . 1 ASP OD2 1 1 12 3302 1 1 2 GLY C C -6.329 -4.252 1.091 1.00 . A A . 2 GLY C 1 1 12 3303 1 1 2 GLY CA C -6.713 -3.082 0.207 1.00 . A A . 2 GLY CA 1 1 12 3304 1 1 2 GLY H H -5.008 -3.421 -1.003 1.00 . A A . 2 GLY H 1 1 12 3305 1 1 2 GLY HA2 H -6.621 -2.171 0.777 1.00 . A A . 2 GLY HA2 1 1 12 3306 1 1 2 GLY HA3 H -7.743 -3.199 -0.098 1.00 . A A . 2 GLY HA3 1 1 12 3307 1 1 2 GLY N N -5.883 -2.979 -0.979 1.00 . A A . 2 GLY N 1 1 12 3308 1 1 2 GLY O O -7.178 -5.060 1.465 1.00 . A A . 2 GLY O 1 1 12 3309 1 1 3 MET C C -3.044 -5.301 2.489 1.00 . A A . 3 MET C 1 1 12 3310 1 1 3 MET CA C -4.550 -5.422 2.275 1.00 . A A . 3 MET CA 1 1 12 3311 1 1 3 MET CB C -4.881 -6.782 1.655 1.00 . A A . 3 MET CB 1 1 12 3312 1 1 3 MET CE C -3.787 -7.421 4.955 1.00 . A A . 3 MET CE 1 1 12 3313 1 1 3 MET CG C -5.306 -7.827 2.674 1.00 . A A . 3 MET CG 1 1 12 3314 1 1 3 MET H H -4.416 -3.667 1.097 1.00 . A A . 3 MET H 1 1 12 3315 1 1 3 MET HA H -5.045 -5.344 3.231 1.00 . A A . 3 MET HA 1 1 12 3316 1 1 3 MET HB2 H -5.685 -6.656 0.945 1.00 . A A . 3 MET HB2 1 1 12 3317 1 1 3 MET HB3 H -4.009 -7.151 1.136 1.00 . A A . 3 MET HB3 1 1 12 3318 1 1 3 MET HE1 H -4.777 -7.183 5.315 1.00 . A A . 3 MET HE1 1 1 12 3319 1 1 3 MET HE2 H -3.289 -6.514 4.646 1.00 . A A . 3 MET HE2 1 1 12 3320 1 1 3 MET HE3 H -3.220 -7.890 5.746 1.00 . A A . 3 MET HE3 1 1 12 3321 1 1 3 MET HG2 H -5.970 -7.364 3.388 1.00 . A A . 3 MET HG2 1 1 12 3322 1 1 3 MET HG3 H -5.830 -8.619 2.159 1.00 . A A . 3 MET HG3 1 1 12 3323 1 1 3 MET N N -5.045 -4.342 1.426 1.00 . A A . 3 MET N 1 1 12 3324 1 1 3 MET O O -2.329 -6.302 2.517 1.00 . A A . 3 MET O 1 1 12 3325 1 1 3 MET SD S -3.909 -8.540 3.563 1.00 . A A . 3 MET SD 1 1 12 3326 1 1 4 GLY C C -0.877 -2.990 4.076 1.00 . A A . 4 GLY C 1 1 12 3327 1 1 4 GLY CA C -1.153 -3.838 2.852 1.00 . A A . 4 GLY CA 1 1 12 3328 1 1 4 GLY H H -3.189 -3.308 2.611 1.00 . A A . 4 GLY H 1 1 12 3329 1 1 4 GLY HA2 H -0.656 -4.788 2.967 1.00 . A A . 4 GLY HA2 1 1 12 3330 1 1 4 GLY HA3 H -0.750 -3.335 1.985 1.00 . A A . 4 GLY HA3 1 1 12 3331 1 1 4 GLY N N -2.571 -4.068 2.642 1.00 . A A . 4 GLY N 1 1 12 3332 1 1 4 GLY O O -1.713 -2.892 4.974 1.00 . A A . 4 GLY O 1 1 12 3333 1 1 5 GLU C C 1.948 -0.728 4.897 1.00 . A A . 5 GLU C 1 1 12 3334 1 1 5 GLU CA C 0.679 -1.513 5.221 1.00 . A A . 5 GLU CA 1 1 12 3335 1 1 5 GLU CB C 0.886 -2.348 6.486 1.00 . A A . 5 GLU CB 1 1 12 3336 1 1 5 GLU CD C -1.005 -1.352 7.833 1.00 . A A . 5 GLU CD 1 1 12 3337 1 1 5 GLU CG C 0.485 -1.627 7.763 1.00 . A A . 5 GLU CG 1 1 12 3338 1 1 5 GLU H H 0.916 -2.480 3.355 1.00 . A A . 5 GLU H 1 1 12 3339 1 1 5 GLU HA H -0.127 -0.814 5.387 1.00 . A A . 5 GLU HA 1 1 12 3340 1 1 5 GLU HB2 H 0.298 -3.251 6.408 1.00 . A A . 5 GLU HB2 1 1 12 3341 1 1 5 GLU HB3 H 1.930 -2.613 6.562 1.00 . A A . 5 GLU HB3 1 1 12 3342 1 1 5 GLU HG2 H 0.762 -2.238 8.609 1.00 . A A . 5 GLU HG2 1 1 12 3343 1 1 5 GLU HG3 H 1.013 -0.686 7.811 1.00 . A A . 5 GLU HG3 1 1 12 3344 1 1 5 GLU N N 0.296 -2.367 4.105 1.00 . A A . 5 GLU N 1 1 12 3345 1 1 5 GLU O O 2.863 -0.639 5.716 1.00 . A A . 5 GLU O 1 1 12 3346 1 1 5 GLU OE1 O -1.397 -0.172 7.718 1.00 . A A . 5 GLU OE1 1 1 12 3347 1 1 5 GLU OE2 O -1.779 -2.317 8.003 1.00 . A A . 5 GLU OE2 1 1 12 3348 1 1 6 GLU C C 2.805 2.113 3.226 1.00 . A A . 6 GLU C 1 1 12 3349 1 1 6 GLU CA C 3.142 0.625 3.260 1.00 . A A . 6 GLU CA 1 1 12 3350 1 1 6 GLU CB C 3.603 0.165 1.876 1.00 . A A . 6 GLU CB 1 1 12 3351 1 1 6 GLU CD C 6.056 -0.417 1.733 1.00 . A A . 6 GLU CD 1 1 12 3352 1 1 6 GLU CG C 4.645 -0.940 1.919 1.00 . A A . 6 GLU CG 1 1 12 3353 1 1 6 GLU H H 1.228 -0.264 3.090 1.00 . A A . 6 GLU H 1 1 12 3354 1 1 6 GLU HA H 3.940 0.465 3.969 1.00 . A A . 6 GLU HA 1 1 12 3355 1 1 6 GLU HB2 H 2.747 -0.198 1.326 1.00 . A A . 6 GLU HB2 1 1 12 3356 1 1 6 GLU HB3 H 4.026 1.008 1.351 1.00 . A A . 6 GLU HB3 1 1 12 3357 1 1 6 GLU HG2 H 4.586 -1.437 2.876 1.00 . A A . 6 GLU HG2 1 1 12 3358 1 1 6 GLU HG3 H 4.433 -1.649 1.132 1.00 . A A . 6 GLU HG3 1 1 12 3359 1 1 6 GLU N N 1.991 -0.157 3.698 1.00 . A A . 6 GLU N 1 1 12 3360 1 1 6 GLU O O 3.246 2.879 4.084 1.00 . A A . 6 GLU O 1 1 12 3361 1 1 6 GLU OE1 O 6.276 0.376 0.794 1.00 . A A . 6 GLU OE1 1 1 12 3362 1 1 6 GLU OE2 O 6.941 -0.801 2.526 1.00 . A A . 6 GLU OE2 1 1 12 3363 1 1 7 PHE C C 0.339 4.037 1.275 1.00 . A A . 7 PHE C 1 1 12 3364 1 1 7 PHE CA C 1.624 3.914 2.088 1.00 . A A . 7 PHE CA 1 1 12 3365 1 1 7 PHE CB C 2.743 4.721 1.426 1.00 . A A . 7 PHE CB 1 1 12 3366 1 1 7 PHE CD1 C 2.660 3.618 -0.828 1.00 . A A . 7 PHE CD1 1 1 12 3367 1 1 7 PHE CD2 C 4.757 3.732 0.301 1.00 . A A . 7 PHE CD2 1 1 12 3368 1 1 7 PHE CE1 C 3.261 2.963 -1.886 1.00 . A A . 7 PHE CE1 1 1 12 3369 1 1 7 PHE CE2 C 5.364 3.077 -0.754 1.00 . A A . 7 PHE CE2 1 1 12 3370 1 1 7 PHE CG C 3.400 4.009 0.276 1.00 . A A . 7 PHE CG 1 1 12 3371 1 1 7 PHE CZ C 4.615 2.692 -1.849 1.00 . A A . 7 PHE CZ 1 1 12 3372 1 1 7 PHE H H 1.699 1.859 1.579 1.00 . A A . 7 PHE H 1 1 12 3373 1 1 7 PHE HA H 1.445 4.308 3.077 1.00 . A A . 7 PHE HA 1 1 12 3374 1 1 7 PHE HB2 H 2.336 5.648 1.052 1.00 . A A . 7 PHE HB2 1 1 12 3375 1 1 7 PHE HB3 H 3.504 4.938 2.162 1.00 . A A . 7 PHE HB3 1 1 12 3376 1 1 7 PHE HD1 H 1.601 3.830 -0.858 1.00 . A A . 7 PHE HD1 1 1 12 3377 1 1 7 PHE HD2 H 5.344 4.032 1.157 1.00 . A A . 7 PHE HD2 1 1 12 3378 1 1 7 PHE HE1 H 2.673 2.662 -2.740 1.00 . A A . 7 PHE HE1 1 1 12 3379 1 1 7 PHE HE2 H 6.423 2.866 -0.722 1.00 . A A . 7 PHE HE2 1 1 12 3380 1 1 7 PHE HZ H 5.087 2.180 -2.674 1.00 . A A . 7 PHE HZ 1 1 12 3381 1 1 7 PHE N N 2.020 2.516 2.231 1.00 . A A . 7 PHE N 1 1 12 3382 1 1 7 PHE O O -0.067 3.097 0.595 1.00 . A A . 7 PHE O 1 1 12 3383 1 1 8 ILE C C -1.602 4.780 -0.714 1.00 . A A . 8 ILE C 1 1 12 3384 1 1 8 ILE CA C -1.547 5.476 0.647 1.00 . A A . 8 ILE CA 1 1 12 3385 1 1 8 ILE CB C -1.762 6.990 0.438 1.00 . A A . 8 ILE CB 1 1 12 3386 1 1 8 ILE CD1 C -1.935 9.218 1.668 1.00 . A A . 8 ILE CD1 1 1 12 3387 1 1 8 ILE CG1 C -1.588 7.747 1.760 1.00 . A A . 8 ILE CG1 1 1 12 3388 1 1 8 ILE CG2 C -3.141 7.253 -0.153 1.00 . A A . 8 ILE CG2 1 1 12 3389 1 1 8 ILE H H 0.086 5.908 1.926 1.00 . A A . 8 ILE H 1 1 12 3390 1 1 8 ILE HA H -2.357 5.105 1.256 1.00 . A A . 8 ILE HA 1 1 12 3391 1 1 8 ILE HB H -1.024 7.340 -0.268 1.00 . A A . 8 ILE HB 1 1 12 3392 1 1 8 ILE HD11 H -2.265 9.448 0.666 1.00 . A A . 8 ILE HD11 1 1 12 3393 1 1 8 ILE HD12 H -1.063 9.809 1.905 1.00 . A A . 8 ILE HD12 1 1 12 3394 1 1 8 ILE HD13 H -2.725 9.446 2.368 1.00 . A A . 8 ILE HD13 1 1 12 3395 1 1 8 ILE HG12 H -2.226 7.303 2.508 1.00 . A A . 8 ILE HG12 1 1 12 3396 1 1 8 ILE HG13 H -0.559 7.669 2.079 1.00 . A A . 8 ILE HG13 1 1 12 3397 1 1 8 ILE HG21 H -3.791 7.651 0.612 1.00 . A A . 8 ILE HG21 1 1 12 3398 1 1 8 ILE HG22 H -3.554 6.330 -0.531 1.00 . A A . 8 ILE HG22 1 1 12 3399 1 1 8 ILE HG23 H -3.057 7.966 -0.960 1.00 . A A . 8 ILE HG23 1 1 12 3400 1 1 8 ILE N N -0.296 5.206 1.360 1.00 . A A . 8 ILE N 1 1 12 3401 1 1 8 ILE O O -0.675 4.888 -1.517 1.00 . A A . 8 ILE O 1 1 12 3402 1 1 9 GLU C C -3.645 4.208 -3.235 1.00 . A A . 9 GLU C 1 1 12 3403 1 1 9 GLU CA C -2.886 3.354 -2.222 1.00 . A A . 9 GLU CA 1 1 12 3404 1 1 9 GLU CB C -3.644 2.046 -1.983 1.00 . A A . 9 GLU CB 1 1 12 3405 1 1 9 GLU CD C -4.522 0.047 -3.258 1.00 . A A . 9 GLU CD 1 1 12 3406 1 1 9 GLU CG C -3.347 0.974 -3.018 1.00 . A A . 9 GLU CG 1 1 12 3407 1 1 9 GLU H H -3.402 4.021 -0.281 1.00 . A A . 9 GLU H 1 1 12 3408 1 1 9 GLU HA H -1.909 3.125 -2.621 1.00 . A A . 9 GLU HA 1 1 12 3409 1 1 9 GLU HB2 H -3.379 1.661 -1.010 1.00 . A A . 9 GLU HB2 1 1 12 3410 1 1 9 GLU HB3 H -4.705 2.250 -2.003 1.00 . A A . 9 GLU HB3 1 1 12 3411 1 1 9 GLU HG2 H -3.092 1.454 -3.951 1.00 . A A . 9 GLU HG2 1 1 12 3412 1 1 9 GLU HG3 H -2.508 0.387 -2.678 1.00 . A A . 9 GLU HG3 1 1 12 3413 1 1 9 GLU N N -2.700 4.068 -0.962 1.00 . A A . 9 GLU N 1 1 12 3414 1 1 9 GLU O O -4.316 3.681 -4.122 1.00 . A A . 9 GLU O 1 1 12 3415 1 1 9 GLU OE1 O -5.607 0.487 -3.638 1.00 . A A . 9 GLU OE1 1 1 12 3416 1 1 10 GLY C C -5.188 7.349 -3.300 1.00 . A A . 10 GLY C 1 1 12 3417 1 1 10 GLY CA C -4.221 6.423 -4.012 1.00 . A A . 10 GLY CA 1 1 12 3418 1 1 10 GLY H H -2.990 5.893 -2.376 1.00 . A A . 10 GLY H 1 1 12 3419 1 1 10 GLY HA2 H -3.486 7.020 -4.533 1.00 . A A . 10 GLY HA2 1 1 12 3420 1 1 10 GLY HA3 H -4.769 5.836 -4.734 1.00 . A A . 10 GLY HA3 1 1 12 3421 1 1 10 GLY N N -3.537 5.526 -3.100 1.00 . A A . 10 GLY N 1 1 12 3422 1 1 10 GLY O O -5.351 8.505 -3.690 1.00 . A A . 10 GLY O 1 1 12 3423 1 1 11 LEU C C -6.315 7.788 -0.038 1.00 . A A . 11 LEU C 1 1 12 3424 1 1 11 LEU CA C -6.785 7.632 -1.482 1.00 . A A . 11 LEU CA 1 1 12 3425 1 1 11 LEU CB C -8.181 6.990 -1.513 1.00 . A A . 11 LEU CB 1 1 12 3426 1 1 11 LEU CD1 C -7.897 4.500 -1.397 1.00 . A A . 11 LEU CD1 1 1 12 3427 1 1 11 LEU CD2 C -9.700 5.485 -2.823 1.00 . A A . 11 LEU CD2 1 1 12 3428 1 1 11 LEU CG C -8.289 5.670 -2.285 1.00 . A A . 11 LEU CG 1 1 12 3429 1 1 11 LEU H H -5.656 5.912 -1.990 1.00 . A A . 11 LEU H 1 1 12 3430 1 1 11 LEU HA H -6.840 8.611 -1.933 1.00 . A A . 11 LEU HA 1 1 12 3431 1 1 11 LEU HB2 H -8.495 6.810 -0.495 1.00 . A A . 11 LEU HB2 1 1 12 3432 1 1 11 LEU HB3 H -8.865 7.696 -1.960 1.00 . A A . 11 LEU HB3 1 1 12 3433 1 1 11 LEU HD11 H -8.246 4.679 -0.391 1.00 . A A . 11 LEU HD11 1 1 12 3434 1 1 11 LEU HD12 H -6.823 4.395 -1.393 1.00 . A A . 11 LEU HD12 1 1 12 3435 1 1 11 LEU HD13 H -8.346 3.594 -1.777 1.00 . A A . 11 LEU HD13 1 1 12 3436 1 1 11 LEU HD21 H -9.700 4.709 -3.574 1.00 . A A . 11 LEU HD21 1 1 12 3437 1 1 11 LEU HD22 H -10.043 6.410 -3.261 1.00 . A A . 11 LEU HD22 1 1 12 3438 1 1 11 LEU HD23 H -10.359 5.203 -2.015 1.00 . A A . 11 LEU HD23 1 1 12 3439 1 1 11 LEU HG H -7.611 5.694 -3.125 1.00 . A A . 11 LEU HG 1 1 12 3440 1 1 11 LEU N N -5.829 6.841 -2.252 1.00 . A A . 11 LEU N 1 1 12 3441 1 1 11 LEU O O -5.872 8.862 0.368 1.00 . A A . 11 LEU O 1 1 12 3442 1 1 12 VAL C C -5.940 5.309 2.695 1.00 . A A . 12 VAL C 1 1 12 3443 1 1 12 VAL CA C -6.000 6.725 2.128 1.00 . A A . 12 VAL CA 1 1 12 3444 1 1 12 VAL CB C -6.952 7.581 2.987 1.00 . A A . 12 VAL CB 1 1 12 3445 1 1 12 VAL CG1 C -8.377 7.055 2.898 1.00 . A A . 12 VAL CG1 1 1 12 3446 1 1 12 VAL CG2 C -6.479 7.623 4.433 1.00 . A A . 12 VAL CG2 1 1 12 3447 1 1 12 VAL H H -6.776 5.882 0.349 1.00 . A A . 12 VAL H 1 1 12 3448 1 1 12 VAL HA H -5.014 7.163 2.176 1.00 . A A . 12 VAL HA 1 1 12 3449 1 1 12 VAL HB H -6.942 8.589 2.600 1.00 . A A . 12 VAL HB 1 1 12 3450 1 1 12 VAL HG11 H -8.532 6.596 1.932 1.00 . A A . 12 VAL HG11 1 1 12 3451 1 1 12 VAL HG12 H -9.071 7.873 3.022 1.00 . A A . 12 VAL HG12 1 1 12 3452 1 1 12 VAL HG13 H -8.540 6.323 3.675 1.00 . A A . 12 VAL HG13 1 1 12 3453 1 1 12 VAL HG21 H -7.055 6.924 5.021 1.00 . A A . 12 VAL HG21 1 1 12 3454 1 1 12 VAL HG22 H -6.613 8.620 4.827 1.00 . A A . 12 VAL HG22 1 1 12 3455 1 1 12 VAL HG23 H -5.434 7.356 4.478 1.00 . A A . 12 VAL HG23 1 1 12 3456 1 1 12 VAL N N -6.415 6.709 0.731 1.00 . A A . 12 VAL N 1 1 12 3457 1 1 12 VAL O O -6.888 4.839 3.323 1.00 . A A . 12 VAL O 1 1 12 3458 1 1 13 ARG C C -3.219 2.777 2.684 1.00 . A A . 13 ARG C 1 1 12 3459 1 1 13 ARG CA C -4.634 3.274 2.954 1.00 . A A . 13 ARG CA 1 1 12 3460 1 1 13 ARG CB C -5.648 2.336 2.299 1.00 . A A . 13 ARG CB 1 1 12 3461 1 1 13 ARG CD C -5.211 -0.035 1.565 1.00 . A A . 13 ARG CD 1 1 12 3462 1 1 13 ARG CG C -5.509 0.887 2.739 1.00 . A A . 13 ARG CG 1 1 12 3463 1 1 13 ARG CZ C -7.308 0.156 0.280 1.00 . A A . 13 ARG CZ 1 1 12 3464 1 1 13 ARG H H -4.099 5.063 1.960 1.00 . A A . 13 ARG H 1 1 12 3465 1 1 13 ARG HA H -4.797 3.277 4.018 1.00 . A A . 13 ARG HA 1 1 12 3466 1 1 13 ARG HB2 H -6.644 2.672 2.549 1.00 . A A . 13 ARG HB2 1 1 12 3467 1 1 13 ARG HB3 H -5.521 2.382 1.228 1.00 . A A . 13 ARG HB3 1 1 12 3468 1 1 13 ARG HD2 H -4.160 0.038 1.326 1.00 . A A . 13 ARG HD2 1 1 12 3469 1 1 13 ARG HD3 H -5.444 -1.049 1.853 1.00 . A A . 13 ARG HD3 1 1 12 3470 1 1 13 ARG HE H -5.504 0.687 -0.388 1.00 . A A . 13 ARG HE 1 1 12 3471 1 1 13 ARG HG2 H -4.700 0.815 3.451 1.00 . A A . 13 ARG HG2 1 1 12 3472 1 1 13 ARG HG3 H -6.430 0.573 3.207 1.00 . A A . 13 ARG HG3 1 1 12 3473 1 1 13 ARG HH11 H -7.531 -0.630 2.130 1.00 . A A . 13 ARG HH11 1 1 12 3474 1 1 13 ARG HH12 H -8.989 -0.472 1.211 1.00 . A A . 13 ARG HH12 1 1 12 3475 1 1 13 ARG HH21 H -7.420 0.894 -1.598 1.00 . A A . 13 ARG HH21 1 1 12 3476 1 1 13 ARG HH22 H -8.927 0.392 -0.906 1.00 . A A . 13 ARG HH22 1 1 12 3477 1 1 13 ARG N N -4.818 4.635 2.468 1.00 . A A . 13 ARG N 1 1 12 3478 1 1 13 ARG NE N -5.990 0.313 0.377 1.00 . A A . 13 ARG NE 1 1 12 3479 1 1 13 ARG NH1 N -7.999 -0.358 1.290 1.00 . A A . 13 ARG NH1 1 1 12 3480 1 1 13 ARG NH2 N -7.937 0.510 -0.832 1.00 . A A . 13 ARG NH2 1 1 12 3481 1 1 13 ARG O O -2.767 2.743 1.540 1.00 . A A . 13 ARG O 1 1 12 3482 1 1 14 ASP C C -1.113 0.653 2.739 1.00 . A A . 14 ASP C 1 1 12 3483 1 1 14 ASP CA C -1.166 1.886 3.639 1.00 . A A . 14 ASP CA 1 1 12 3484 1 1 14 ASP CB C -0.611 1.555 5.024 1.00 . A A . 14 ASP CB 1 1 12 3485 1 1 14 ASP CG C -0.580 2.765 5.938 1.00 . A A . 14 ASP CG 1 1 12 3486 1 1 14 ASP H H -2.945 2.437 4.634 1.00 . A A . 14 ASP H 1 1 12 3487 1 1 14 ASP HA H -0.562 2.664 3.196 1.00 . A A . 14 ASP HA 1 1 12 3488 1 1 14 ASP HB2 H -1.231 0.799 5.482 1.00 . A A . 14 ASP HB2 1 1 12 3489 1 1 14 ASP HB3 H 0.395 1.179 4.922 1.00 . A A . 14 ASP HB3 1 1 12 3490 1 1 14 ASP N N -2.527 2.387 3.750 1.00 . A A . 14 ASP N 1 1 12 3491 1 1 14 ASP O O -1.213 -0.479 3.206 1.00 . A A . 14 ASP O 1 1 12 3492 1 1 14 ASP OD1 O 0.363 3.575 5.818 1.00 . A A . 14 ASP OD1 1 1 12 3493 1 1 14 ASP OD2 O -1.499 2.903 6.772 1.00 . A A . 14 ASP OD2 1 1 12 3494 1 1 15 SER C C 0.236 -1.147 0.751 1.00 . A A . 15 SER C 1 1 12 3495 1 1 15 SER CA C -0.893 -0.163 0.443 1.00 . A A . 15 SER CA 1 1 12 3496 1 1 15 SER CB C -0.688 0.449 -0.946 1.00 . A A . 15 SER CB 1 1 12 3497 1 1 15 SER H H -0.896 1.826 1.154 1.00 . A A . 15 SER H 1 1 12 3498 1 1 15 SER HA H -1.834 -0.692 0.457 1.00 . A A . 15 SER HA 1 1 12 3499 1 1 15 SER HB2 H -1.486 1.145 -1.151 1.00 . A A . 15 SER HB2 1 1 12 3500 1 1 15 SER HB3 H 0.258 0.970 -0.970 1.00 . A A . 15 SER HB3 1 1 12 3501 1 1 15 SER HG H -1.462 -1.104 -1.855 1.00 . A A . 15 SER HG 1 1 12 3502 1 1 15 SER N N -0.961 0.899 1.445 1.00 . A A . 15 SER N 1 1 12 3503 1 1 15 SER O O 0.693 -1.240 1.886 1.00 . A A . 15 SER O 1 1 12 3504 1 1 15 SER OG O -0.684 -0.550 -1.951 1.00 . A A . 15 SER OG 1 1 12 3505 1 1 16 LEU C C 2.576 -3.002 -1.367 1.00 . A A . 16 LEU C 1 1 12 3506 1 1 16 LEU CA C 1.756 -2.856 -0.088 1.00 . A A . 16 LEU CA 1 1 12 3507 1 1 16 LEU CB C 1.180 -4.214 0.319 1.00 . A A . 16 LEU CB 1 1 12 3508 1 1 16 LEU CD1 C -0.229 -4.528 -1.729 1.00 . A A . 16 LEU CD1 1 1 12 3509 1 1 16 LEU CD2 C -0.742 -5.823 0.349 1.00 . A A . 16 LEU CD2 1 1 12 3510 1 1 16 LEU CG C -0.225 -4.505 -0.209 1.00 . A A . 16 LEU CG 1 1 12 3511 1 1 16 LEU H H 0.281 -1.770 -1.151 1.00 . A A . 16 LEU H 1 1 12 3512 1 1 16 LEU HA H 2.401 -2.498 0.700 1.00 . A A . 16 LEU HA 1 1 12 3513 1 1 16 LEU HB2 H 1.844 -4.986 -0.042 1.00 . A A . 16 LEU HB2 1 1 12 3514 1 1 16 LEU HB3 H 1.152 -4.261 1.397 1.00 . A A . 16 LEU HB3 1 1 12 3515 1 1 16 LEU HD11 H -1.235 -4.698 -2.084 1.00 . A A . 16 LEU HD11 1 1 12 3516 1 1 16 LEU HD12 H 0.415 -5.322 -2.078 1.00 . A A . 16 LEU HD12 1 1 12 3517 1 1 16 LEU HD13 H 0.130 -3.582 -2.104 1.00 . A A . 16 LEU HD13 1 1 12 3518 1 1 16 LEU HD21 H -1.822 -5.821 0.335 1.00 . A A . 16 LEU HD21 1 1 12 3519 1 1 16 LEU HD22 H -0.395 -5.945 1.364 1.00 . A A . 16 LEU HD22 1 1 12 3520 1 1 16 LEU HD23 H -0.375 -6.639 -0.257 1.00 . A A . 16 LEU HD23 1 1 12 3521 1 1 16 LEU HG H -0.892 -3.718 0.114 1.00 . A A . 16 LEU HG 1 1 12 3522 1 1 16 LEU N N 0.682 -1.883 -0.264 1.00 . A A . 16 LEU N 1 1 12 3523 1 1 16 LEU O O 2.342 -2.300 -2.351 1.00 . A A . 16 LEU O 1 1 12 3524 1 1 17 TYR C C 5.278 -2.951 -2.794 1.00 . A A . 17 TYR C 1 1 12 3525 1 1 17 TYR CA C 4.398 -4.163 -2.498 1.00 . A A . 17 TYR CA 1 1 12 3526 1 1 17 TYR CB C 3.557 -4.508 -3.730 1.00 . A A . 17 TYR CB 1 1 12 3527 1 1 17 TYR CD1 C 1.434 -5.744 -4.315 1.00 . A A . 17 TYR CD1 1 1 12 3528 1 1 17 TYR CD2 C 2.729 -6.549 -2.482 1.00 . A A . 17 TYR CD2 1 1 12 3529 1 1 17 TYR CE1 C 0.515 -6.757 -4.116 1.00 . A A . 17 TYR CE1 1 1 12 3530 1 1 17 TYR CE2 C 1.814 -7.564 -2.277 1.00 . A A . 17 TYR CE2 1 1 12 3531 1 1 17 TYR CG C 2.555 -5.621 -3.503 1.00 . A A . 17 TYR CG 1 1 12 3532 1 1 17 TYR CZ C 0.710 -7.663 -3.096 1.00 . A A . 17 TYR CZ 1 1 12 3533 1 1 17 TYR H H 3.676 -4.446 -0.528 1.00 . A A . 17 TYR H 1 1 12 3534 1 1 17 TYR HA H 5.034 -5.003 -2.263 1.00 . A A . 17 TYR HA 1 1 12 3535 1 1 17 TYR HB2 H 3.009 -3.630 -4.038 1.00 . A A . 17 TYR HB2 1 1 12 3536 1 1 17 TYR HB3 H 4.216 -4.812 -4.531 1.00 . A A . 17 TYR HB3 1 1 12 3537 1 1 17 TYR HD1 H 1.284 -5.032 -5.113 1.00 . A A . 17 TYR HD1 1 1 12 3538 1 1 17 TYR HD2 H 3.594 -6.468 -1.841 1.00 . A A . 17 TYR HD2 1 1 12 3539 1 1 17 TYR HE1 H -0.349 -6.835 -4.758 1.00 . A A . 17 TYR HE1 1 1 12 3540 1 1 17 TYR HE2 H 1.967 -8.275 -1.478 1.00 . A A . 17 TYR HE2 1 1 12 3541 1 1 17 TYR HH H -1.026 -8.300 -2.568 1.00 . A A . 17 TYR HH 1 1 12 3542 1 1 17 TYR N N 3.539 -3.919 -1.343 1.00 . A A . 17 TYR N 1 1 12 3543 1 1 17 TYR O O 4.968 -2.149 -3.675 1.00 . A A . 17 TYR O 1 1 12 3544 1 1 17 TYR OH O -0.203 -8.673 -2.895 1.00 . A A . 17 TYR OH 1 1 12 3545 1 1 18 PRO C C 7.864 -1.611 -3.679 1.00 . A A . 18 PRO C 1 1 12 3546 1 1 18 PRO CA C 7.322 -1.684 -2.252 1.00 . A A . 18 PRO CA 1 1 12 3547 1 1 18 PRO CB C 8.457 -1.974 -1.263 1.00 . A A . 18 PRO CB 1 1 12 3548 1 1 18 PRO CD C 6.840 -3.713 -0.991 1.00 . A A . 18 PRO CD 1 1 12 3549 1 1 18 PRO CG C 7.867 -2.900 -0.255 1.00 . A A . 18 PRO CG 1 1 12 3550 1 1 18 PRO HA H 6.857 -0.742 -2.001 1.00 . A A . 18 PRO HA 1 1 12 3551 1 1 18 PRO HB2 H 9.285 -2.431 -1.784 1.00 . A A . 18 PRO HB2 1 1 12 3552 1 1 18 PRO HB3 H 8.782 -1.051 -0.805 1.00 . A A . 18 PRO HB3 1 1 12 3553 1 1 18 PRO HD2 H 7.289 -4.605 -1.403 1.00 . A A . 18 PRO HD2 1 1 12 3554 1 1 18 PRO HD3 H 6.020 -3.969 -0.336 1.00 . A A . 18 PRO HD3 1 1 12 3555 1 1 18 PRO HG2 H 8.636 -3.544 0.147 1.00 . A A . 18 PRO HG2 1 1 12 3556 1 1 18 PRO HG3 H 7.399 -2.333 0.536 1.00 . A A . 18 PRO HG3 1 1 12 3557 1 1 18 PRO N N 6.394 -2.803 -2.060 1.00 . A A . 18 PRO N 1 1 12 3558 1 1 18 PRO O O 7.887 -0.539 -4.285 1.00 . A A . 18 PRO O 1 1 12 3559 1 1 19 PRO C C 7.754 -2.870 -6.659 1.00 . A A . 19 PRO C 1 1 12 3560 1 1 19 PRO CA C 8.850 -2.797 -5.601 1.00 . A A . 19 PRO CA 1 1 12 3561 1 1 19 PRO CB C 9.675 -4.080 -5.593 1.00 . A A . 19 PRO CB 1 1 12 3562 1 1 19 PRO CD C 8.327 -4.084 -3.604 1.00 . A A . 19 PRO CD 1 1 12 3563 1 1 19 PRO CG C 8.959 -4.977 -4.643 1.00 . A A . 19 PRO CG 1 1 12 3564 1 1 19 PRO HA H 9.492 -1.952 -5.803 1.00 . A A . 19 PRO HA 1 1 12 3565 1 1 19 PRO HB2 H 9.706 -4.500 -6.588 1.00 . A A . 19 PRO HB2 1 1 12 3566 1 1 19 PRO HB3 H 10.677 -3.867 -5.254 1.00 . A A . 19 PRO HB3 1 1 12 3567 1 1 19 PRO HD2 H 7.323 -4.417 -3.386 1.00 . A A . 19 PRO HD2 1 1 12 3568 1 1 19 PRO HD3 H 8.924 -4.073 -2.705 1.00 . A A . 19 PRO HD3 1 1 12 3569 1 1 19 PRO HG2 H 8.198 -5.534 -5.169 1.00 . A A . 19 PRO HG2 1 1 12 3570 1 1 19 PRO HG3 H 9.662 -5.652 -4.177 1.00 . A A . 19 PRO HG3 1 1 12 3571 1 1 19 PRO N N 8.310 -2.751 -4.243 1.00 . A A . 19 PRO N 1 1 12 3572 1 1 19 PRO O O 6.578 -2.651 -6.366 1.00 . A A . 19 PRO O 1 1 12 3573 1 1 20 ALA C C 6.471 -4.624 -8.968 1.00 . A A . 20 ALA C 1 1 12 3574 1 1 20 ALA CA C 7.196 -3.282 -8.992 1.00 . A A . 20 ALA CA 1 1 12 3575 1 1 20 ALA CB C 7.908 -3.087 -10.323 1.00 . A A . 20 ALA CB 1 1 12 3576 1 1 20 ALA H H 9.096 -3.343 -8.064 1.00 . A A . 20 ALA H 1 1 12 3577 1 1 20 ALA HA H 6.469 -2.490 -8.880 1.00 . A A . 20 ALA HA 1 1 12 3578 1 1 20 ALA HB1 H 8.171 -4.050 -10.735 1.00 . A A . 20 ALA HB1 1 1 12 3579 1 1 20 ALA HB2 H 8.804 -2.504 -10.169 1.00 . A A . 20 ALA HB2 1 1 12 3580 1 1 20 ALA HB3 H 7.255 -2.568 -11.008 1.00 . A A . 20 ALA HB3 1 1 12 3581 1 1 20 ALA N N 8.146 -3.180 -7.891 1.00 . A A . 20 ALA N 1 1 12 3582 1 1 20 ALA O O 6.585 -5.422 -9.899 1.00 . A A . 20 ALA O 1 1 12 3583 1 1 21 GLY C C 5.076 -6.699 -6.374 1.00 . A A . 21 GLY C 1 1 12 3584 1 1 21 GLY CA C 4.991 -6.114 -7.770 1.00 . A A . 21 GLY CA 1 1 12 3585 1 1 21 GLY H H 5.670 -4.196 -7.184 1.00 . A A . 21 GLY H 1 1 12 3586 1 1 21 GLY HA2 H 3.953 -5.934 -8.010 1.00 . A A . 21 GLY HA2 1 1 12 3587 1 1 21 GLY HA3 H 5.393 -6.828 -8.473 1.00 . A A . 21 GLY HA3 1 1 12 3588 1 1 21 GLY N N 5.724 -4.868 -7.895 1.00 . A A . 21 GLY N 1 1 13 3589 1 1 1 ASP C C -6.248 -1.345 -2.201 1.00 . A A . 1 ASP C 1 1 13 3590 1 1 1 ASP CA C -6.241 -0.361 -3.367 1.00 . A A . 1 ASP CA 1 1 13 3591 1 1 1 ASP CB C -6.172 -1.119 -4.695 1.00 . A A . 1 ASP CB 1 1 13 3592 1 1 1 ASP CG C -7.483 -1.073 -5.455 1.00 . A A . 1 ASP CG 1 1 13 3593 1 1 1 ASP H1 H -5.432 1.253 -2.624 1.00 . A A . 1 ASP H1 1 1 13 3594 1 1 1 ASP HA H -7.154 0.215 -3.340 1.00 . A A . 1 ASP HA 1 1 13 3595 1 1 1 ASP HB2 H -5.404 -0.679 -5.314 1.00 . A A . 1 ASP HB2 1 1 13 3596 1 1 1 ASP HB3 H -5.924 -2.153 -4.502 1.00 . A A . 1 ASP HB3 1 1 13 3597 1 1 1 ASP N N -5.124 0.571 -3.257 1.00 . A A . 1 ASP N 1 1 13 3598 1 1 1 ASP O O -6.712 -2.478 -2.335 1.00 . A A . 1 ASP O 1 1 13 3599 1 1 1 ASP OD1 O -8.084 -2.147 -5.667 1.00 . A A . 1 ASP OD1 1 1 13 3600 1 1 1 ASP OD2 O -7.909 0.037 -5.837 1.00 . A A . 1 ASP OD2 1 1 13 3601 1 1 2 GLY C C -4.925 -3.043 -0.119 1.00 . A A . 2 GLY C 1 1 13 3602 1 1 2 GLY CA C -5.692 -1.756 0.117 1.00 . A A . 2 GLY CA 1 1 13 3603 1 1 2 GLY H H -5.381 0.009 -1.009 1.00 . A A . 2 GLY H 1 1 13 3604 1 1 2 GLY HA2 H -5.220 -1.214 0.923 1.00 . A A . 2 GLY HA2 1 1 13 3605 1 1 2 GLY HA3 H -6.703 -2.001 0.406 1.00 . A A . 2 GLY HA3 1 1 13 3606 1 1 2 GLY N N -5.733 -0.904 -1.057 1.00 . A A . 2 GLY N 1 1 13 3607 1 1 2 GLY O O -5.415 -3.951 -0.790 1.00 . A A . 2 GLY O 1 1 13 3608 1 1 3 MET C C -1.563 -4.137 1.038 1.00 . A A . 3 MET C 1 1 13 3609 1 1 3 MET CA C -2.880 -4.306 0.287 1.00 . A A . 3 MET CA 1 1 13 3610 1 1 3 MET CB C -2.601 -4.578 -1.193 1.00 . A A . 3 MET CB 1 1 13 3611 1 1 3 MET CE C 0.915 -3.349 -2.368 1.00 . A A . 3 MET CE 1 1 13 3612 1 1 3 MET CG C -1.809 -3.473 -1.874 1.00 . A A . 3 MET CG 1 1 13 3613 1 1 3 MET H H -3.386 -2.363 0.961 1.00 . A A . 3 MET H 1 1 13 3614 1 1 3 MET HA H -3.415 -5.146 0.704 1.00 . A A . 3 MET HA 1 1 13 3615 1 1 3 MET HB2 H -2.041 -5.498 -1.278 1.00 . A A . 3 MET HB2 1 1 13 3616 1 1 3 MET HB3 H -3.541 -4.690 -1.711 1.00 . A A . 3 MET HB3 1 1 13 3617 1 1 3 MET HE1 H 1.600 -3.144 -3.178 1.00 . A A . 3 MET HE1 1 1 13 3618 1 1 3 MET HE2 H 1.383 -4.019 -1.662 1.00 . A A . 3 MET HE2 1 1 13 3619 1 1 3 MET HE3 H 0.658 -2.426 -1.871 1.00 . A A . 3 MET HE3 1 1 13 3620 1 1 3 MET HG2 H -2.494 -2.843 -2.421 1.00 . A A . 3 MET HG2 1 1 13 3621 1 1 3 MET HG3 H -1.310 -2.887 -1.116 1.00 . A A . 3 MET HG3 1 1 13 3622 1 1 3 MET N N -3.719 -3.121 0.436 1.00 . A A . 3 MET N 1 1 13 3623 1 1 3 MET O O -0.510 -4.565 0.566 1.00 . A A . 3 MET O 1 1 13 3624 1 1 3 MET SD S -0.570 -4.109 -3.020 1.00 . A A . 3 MET SD 1 1 13 3625 1 1 4 GLY C C -0.683 -2.441 4.223 1.00 . A A . 4 GLY C 1 1 13 3626 1 1 4 GLY CA C -0.430 -3.297 2.999 1.00 . A A . 4 GLY CA 1 1 13 3627 1 1 4 GLY H H -2.493 -3.189 2.536 1.00 . A A . 4 GLY H 1 1 13 3628 1 1 4 GLY HA2 H -0.046 -4.253 3.315 1.00 . A A . 4 GLY HA2 1 1 13 3629 1 1 4 GLY HA3 H 0.311 -2.809 2.383 1.00 . A A . 4 GLY HA3 1 1 13 3630 1 1 4 GLY N N -1.627 -3.510 2.208 1.00 . A A . 4 GLY N 1 1 13 3631 1 1 4 GLY O O -1.824 -2.292 4.661 1.00 . A A . 4 GLY O 1 1 13 3632 1 1 5 GLU C C 1.503 -0.108 6.072 1.00 . A A . 5 GLU C 1 1 13 3633 1 1 5 GLU CA C 0.278 -1.012 5.947 1.00 . A A . 5 GLU CA 1 1 13 3634 1 1 5 GLU CB C 0.112 -1.858 7.211 1.00 . A A . 5 GLU CB 1 1 13 3635 1 1 5 GLU CD C -1.497 -2.745 8.946 1.00 . A A . 5 GLU CD 1 1 13 3636 1 1 5 GLU CG C -1.340 -2.141 7.564 1.00 . A A . 5 GLU CG 1 1 13 3637 1 1 5 GLU H H 1.267 -2.020 4.370 1.00 . A A . 5 GLU H 1 1 13 3638 1 1 5 GLU HA H -0.597 -0.390 5.820 1.00 . A A . 5 GLU HA 1 1 13 3639 1 1 5 GLU HB2 H 0.616 -2.802 7.068 1.00 . A A . 5 GLU HB2 1 1 13 3640 1 1 5 GLU HB3 H 0.567 -1.338 8.041 1.00 . A A . 5 GLU HB3 1 1 13 3641 1 1 5 GLU HG2 H -1.892 -1.214 7.529 1.00 . A A . 5 GLU HG2 1 1 13 3642 1 1 5 GLU HG3 H -1.746 -2.830 6.838 1.00 . A A . 5 GLU HG3 1 1 13 3643 1 1 5 GLU N N 0.386 -1.868 4.771 1.00 . A A . 5 GLU N 1 1 13 3644 1 1 5 GLU O O 2.146 -0.055 7.121 1.00 . A A . 5 GLU O 1 1 13 3645 1 1 5 GLU OE1 O -2.267 -3.718 9.085 1.00 . A A . 5 GLU OE1 1 1 13 3646 1 1 5 GLU OE2 O -0.850 -2.243 9.890 1.00 . A A . 5 GLU OE2 1 1 13 3647 1 1 6 GLU C C 2.520 2.946 4.706 1.00 . A A . 6 GLU C 1 1 13 3648 1 1 6 GLU CA C 2.960 1.509 4.976 1.00 . A A . 6 GLU CA 1 1 13 3649 1 1 6 GLU CB C 3.973 1.065 3.919 1.00 . A A . 6 GLU CB 1 1 13 3650 1 1 6 GLU CD C 5.232 -0.729 5.179 1.00 . A A . 6 GLU CD 1 1 13 3651 1 1 6 GLU CG C 4.330 -0.411 4.002 1.00 . A A . 6 GLU CG 1 1 13 3652 1 1 6 GLU H H 1.264 0.518 4.188 1.00 . A A . 6 GLU H 1 1 13 3653 1 1 6 GLU HA H 3.428 1.467 5.947 1.00 . A A . 6 GLU HA 1 1 13 3654 1 1 6 GLU HB2 H 3.563 1.260 2.939 1.00 . A A . 6 GLU HB2 1 1 13 3655 1 1 6 GLU HB3 H 4.879 1.639 4.042 1.00 . A A . 6 GLU HB3 1 1 13 3656 1 1 6 GLU HG2 H 3.420 -0.982 4.103 1.00 . A A . 6 GLU HG2 1 1 13 3657 1 1 6 GLU HG3 H 4.835 -0.697 3.091 1.00 . A A . 6 GLU HG3 1 1 13 3658 1 1 6 GLU N N 1.816 0.604 4.993 1.00 . A A . 6 GLU N 1 1 13 3659 1 1 6 GLU O O 2.716 3.829 5.541 1.00 . A A . 6 GLU O 1 1 13 3660 1 1 6 GLU OE1 O 5.354 0.124 6.083 1.00 . A A . 6 GLU OE1 1 1 13 3661 1 1 6 GLU OE2 O 5.816 -1.833 5.197 1.00 . A A . 6 GLU OE2 1 1 13 3662 1 1 7 PHE C C 0.373 4.458 2.108 1.00 . A A . 7 PHE C 1 1 13 3663 1 1 7 PHE CA C 1.465 4.515 3.172 1.00 . A A . 7 PHE CA 1 1 13 3664 1 1 7 PHE CB C 2.637 5.363 2.676 1.00 . A A . 7 PHE CB 1 1 13 3665 1 1 7 PHE CD1 C 4.303 3.740 1.737 1.00 . A A . 7 PHE CD1 1 1 13 3666 1 1 7 PHE CD2 C 3.145 5.177 0.226 1.00 . A A . 7 PHE CD2 1 1 13 3667 1 1 7 PHE CE1 C 4.985 3.170 0.678 1.00 . A A . 7 PHE CE1 1 1 13 3668 1 1 7 PHE CE2 C 3.824 4.612 -0.837 1.00 . A A . 7 PHE CE2 1 1 13 3669 1 1 7 PHE CG C 3.377 4.748 1.523 1.00 . A A . 7 PHE CG 1 1 13 3670 1 1 7 PHE CZ C 4.745 3.607 -0.610 1.00 . A A . 7 PHE CZ 1 1 13 3671 1 1 7 PHE H H 1.797 2.437 2.909 1.00 . A A . 7 PHE H 1 1 13 3672 1 1 7 PHE HA H 1.053 4.971 4.060 1.00 . A A . 7 PHE HA 1 1 13 3673 1 1 7 PHE HB2 H 2.266 6.326 2.357 1.00 . A A . 7 PHE HB2 1 1 13 3674 1 1 7 PHE HB3 H 3.338 5.504 3.485 1.00 . A A . 7 PHE HB3 1 1 13 3675 1 1 7 PHE HD1 H 4.490 3.397 2.744 1.00 . A A . 7 PHE HD1 1 1 13 3676 1 1 7 PHE HD2 H 2.425 5.962 0.048 1.00 . A A . 7 PHE HD2 1 1 13 3677 1 1 7 PHE HE1 H 5.705 2.385 0.858 1.00 . A A . 7 PHE HE1 1 1 13 3678 1 1 7 PHE HE2 H 3.635 4.955 -1.843 1.00 . A A . 7 PHE HE2 1 1 13 3679 1 1 7 PHE HZ H 5.277 3.164 -1.439 1.00 . A A . 7 PHE HZ 1 1 13 3680 1 1 7 PHE N N 1.926 3.178 3.537 1.00 . A A . 7 PHE N 1 1 13 3681 1 1 7 PHE O O 0.374 3.577 1.249 1.00 . A A . 7 PHE O 1 1 13 3682 1 1 8 ILE C C -1.416 4.860 -0.087 1.00 . A A . 8 ILE C 1 1 13 3683 1 1 8 ILE CA C -1.699 5.504 1.269 1.00 . A A . 8 ILE CA 1 1 13 3684 1 1 8 ILE CB C -2.115 6.972 1.038 1.00 . A A . 8 ILE CB 1 1 13 3685 1 1 8 ILE CD1 C -2.809 9.112 2.246 1.00 . A A . 8 ILE CD1 1 1 13 3686 1 1 8 ILE CG1 C -2.255 7.708 2.376 1.00 . A A . 8 ILE CG1 1 1 13 3687 1 1 8 ILE CG2 C -3.418 7.034 0.253 1.00 . A A . 8 ILE CG2 1 1 13 3688 1 1 8 ILE H H -0.493 6.064 2.917 1.00 . A A . 8 ILE H 1 1 13 3689 1 1 8 ILE HA H -2.534 4.992 1.724 1.00 . A A . 8 ILE HA 1 1 13 3690 1 1 8 ILE HB H -1.347 7.452 0.450 1.00 . A A . 8 ILE HB 1 1 13 3691 1 1 8 ILE HD11 H -3.122 9.285 1.227 1.00 . A A . 8 ILE HD11 1 1 13 3692 1 1 8 ILE HD12 H -2.044 9.827 2.512 1.00 . A A . 8 ILE HD12 1 1 13 3693 1 1 8 ILE HD13 H -3.654 9.228 2.907 1.00 . A A . 8 ILE HD13 1 1 13 3694 1 1 8 ILE HG12 H -2.918 7.149 3.018 1.00 . A A . 8 ILE HG12 1 1 13 3695 1 1 8 ILE HG13 H -1.284 7.778 2.843 1.00 . A A . 8 ILE HG13 1 1 13 3696 1 1 8 ILE HG21 H -3.533 6.130 -0.327 1.00 . A A . 8 ILE HG21 1 1 13 3697 1 1 8 ILE HG22 H -3.399 7.886 -0.410 1.00 . A A . 8 ILE HG22 1 1 13 3698 1 1 8 ILE HG23 H -4.247 7.130 0.938 1.00 . A A . 8 ILE HG23 1 1 13 3699 1 1 8 ILE N N -0.563 5.408 2.194 1.00 . A A . 8 ILE N 1 1 13 3700 1 1 8 ILE O O -0.365 5.081 -0.688 1.00 . A A . 8 ILE O 1 1 13 3701 1 1 9 GLU C C -2.891 4.215 -2.955 1.00 . A A . 9 GLU C 1 1 13 3702 1 1 9 GLU CA C -2.248 3.389 -1.845 1.00 . A A . 9 GLU CA 1 1 13 3703 1 1 9 GLU CB C -2.902 2.006 -1.781 1.00 . A A . 9 GLU CB 1 1 13 3704 1 1 9 GLU CD C -3.865 0.148 -3.194 1.00 . A A . 9 GLU CD 1 1 13 3705 1 1 9 GLU CG C -2.803 1.224 -3.080 1.00 . A A . 9 GLU CG 1 1 13 3706 1 1 9 GLU H H -3.189 3.937 -0.032 1.00 . A A . 9 GLU H 1 1 13 3707 1 1 9 GLU HA H -1.196 3.273 -2.059 1.00 . A A . 9 GLU HA 1 1 13 3708 1 1 9 GLU HB2 H -2.425 1.431 -1.002 1.00 . A A . 9 GLU HB2 1 1 13 3709 1 1 9 GLU HB3 H -3.947 2.125 -1.536 1.00 . A A . 9 GLU HB3 1 1 13 3710 1 1 9 GLU HG2 H -2.916 1.908 -3.908 1.00 . A A . 9 GLU HG2 1 1 13 3711 1 1 9 GLU HG3 H -1.831 0.756 -3.131 1.00 . A A . 9 GLU HG3 1 1 13 3712 1 1 9 GLU N N -2.373 4.067 -0.561 1.00 . A A . 9 GLU N 1 1 13 3713 1 1 9 GLU O O -2.198 4.835 -3.762 1.00 . A A . 9 GLU O 1 1 13 3714 1 1 9 GLU OE1 O -3.557 -1.043 -3.223 1.00 . A A . 9 GLU OE1 1 1 13 3715 1 1 10 GLY C C -5.944 5.941 -3.417 1.00 . A A . 10 GLY C 1 1 13 3716 1 1 10 GLY CA C -4.937 4.967 -4.004 1.00 . A A . 10 GLY CA 1 1 13 3717 1 1 10 GLY H H -4.717 3.702 -2.321 1.00 . A A . 10 GLY H 1 1 13 3718 1 1 10 GLY HA2 H -4.224 5.520 -4.597 1.00 . A A . 10 GLY HA2 1 1 13 3719 1 1 10 GLY HA3 H -5.459 4.272 -4.645 1.00 . A A . 10 GLY HA3 1 1 13 3720 1 1 10 GLY N N -4.220 4.217 -2.989 1.00 . A A . 10 GLY N 1 1 13 3721 1 1 10 GLY O O -6.420 6.838 -4.113 1.00 . A A . 10 GLY O 1 1 13 3722 1 1 11 LEU C C -6.964 6.715 0.026 1.00 . A A . 11 LEU C 1 1 13 3723 1 1 11 LEU CA C -7.233 6.643 -1.475 1.00 . A A . 11 LEU CA 1 1 13 3724 1 1 11 LEU CB C -8.661 6.155 -1.730 1.00 . A A . 11 LEU CB 1 1 13 3725 1 1 11 LEU CD1 C -10.520 5.677 -3.342 1.00 . A A . 11 LEU CD1 1 1 13 3726 1 1 11 LEU CD2 C -9.214 7.801 -3.537 1.00 . A A . 11 LEU CD2 1 1 13 3727 1 1 11 LEU CG C -9.156 6.326 -3.167 1.00 . A A . 11 LEU CG 1 1 13 3728 1 1 11 LEU H H -5.866 5.035 -1.633 1.00 . A A . 11 LEU H 1 1 13 3729 1 1 11 LEU HA H -7.121 7.632 -1.895 1.00 . A A . 11 LEU HA 1 1 13 3730 1 1 11 LEU HB2 H -8.712 5.107 -1.475 1.00 . A A . 11 LEU HB2 1 1 13 3731 1 1 11 LEU HB3 H -9.327 6.700 -1.078 1.00 . A A . 11 LEU HB3 1 1 13 3732 1 1 11 LEU HD11 H -11.032 5.656 -2.392 1.00 . A A . 11 LEU HD11 1 1 13 3733 1 1 11 LEU HD12 H -10.394 4.668 -3.706 1.00 . A A . 11 LEU HD12 1 1 13 3734 1 1 11 LEU HD13 H -11.101 6.246 -4.052 1.00 . A A . 11 LEU HD13 1 1 13 3735 1 1 11 LEU HD21 H -9.710 7.914 -4.489 1.00 . A A . 11 LEU HD21 1 1 13 3736 1 1 11 LEU HD22 H -8.211 8.195 -3.604 1.00 . A A . 11 LEU HD22 1 1 13 3737 1 1 11 LEU HD23 H -9.763 8.342 -2.779 1.00 . A A . 11 LEU HD23 1 1 13 3738 1 1 11 LEU HG H -8.465 5.839 -3.839 1.00 . A A . 11 LEU HG 1 1 13 3739 1 1 11 LEU N N -6.273 5.767 -2.139 1.00 . A A . 11 LEU N 1 1 13 3740 1 1 11 LEU O O -6.375 7.680 0.514 1.00 . A A . 11 LEU O 1 1 13 3741 1 1 12 VAL C C -6.840 4.248 2.670 1.00 . A A . 12 VAL C 1 1 13 3742 1 1 12 VAL CA C -7.212 5.651 2.200 1.00 . A A . 12 VAL CA 1 1 13 3743 1 1 12 VAL CB C -8.479 6.108 2.948 1.00 . A A . 12 VAL CB 1 1 13 3744 1 1 12 VAL CG1 C -8.200 6.251 4.436 1.00 . A A . 12 VAL CG1 1 1 13 3745 1 1 12 VAL CG2 C -9.000 7.414 2.368 1.00 . A A . 12 VAL CG2 1 1 13 3746 1 1 12 VAL H H -7.869 4.954 0.312 1.00 . A A . 12 VAL H 1 1 13 3747 1 1 12 VAL HA H -6.408 6.328 2.450 1.00 . A A . 12 VAL HA 1 1 13 3748 1 1 12 VAL HB H -9.241 5.353 2.819 1.00 . A A . 12 VAL HB 1 1 13 3749 1 1 12 VAL HG11 H -8.455 5.330 4.940 1.00 . A A . 12 VAL HG11 1 1 13 3750 1 1 12 VAL HG12 H -8.794 7.058 4.838 1.00 . A A . 12 VAL HG12 1 1 13 3751 1 1 12 VAL HG13 H -7.152 6.465 4.587 1.00 . A A . 12 VAL HG13 1 1 13 3752 1 1 12 VAL HG21 H -8.187 7.953 1.904 1.00 . A A . 12 VAL HG21 1 1 13 3753 1 1 12 VAL HG22 H -9.425 8.015 3.159 1.00 . A A . 12 VAL HG22 1 1 13 3754 1 1 12 VAL HG23 H -9.760 7.203 1.629 1.00 . A A . 12 VAL HG23 1 1 13 3755 1 1 12 VAL N N -7.403 5.693 0.755 1.00 . A A . 12 VAL N 1 1 13 3756 1 1 12 VAL O O -7.701 3.474 3.088 1.00 . A A . 12 VAL O 1 1 13 3757 1 1 13 ARG C C -3.550 2.530 2.869 1.00 . A A . 13 ARG C 1 1 13 3758 1 1 13 ARG CA C -5.062 2.622 3.026 1.00 . A A . 13 ARG CA 1 1 13 3759 1 1 13 ARG CB C -5.741 1.509 2.223 1.00 . A A . 13 ARG CB 1 1 13 3760 1 1 13 ARG CD C -6.653 0.372 4.279 1.00 . A A . 13 ARG CD 1 1 13 3761 1 1 13 ARG CG C -5.872 0.198 2.984 1.00 . A A . 13 ARG CG 1 1 13 3762 1 1 13 ARG CZ C -8.877 1.148 5.006 1.00 . A A . 13 ARG CZ 1 1 13 3763 1 1 13 ARG H H -4.912 4.592 2.265 1.00 . A A . 13 ARG H 1 1 13 3764 1 1 13 ARG HA H -5.304 2.501 4.068 1.00 . A A . 13 ARG HA 1 1 13 3765 1 1 13 ARG HB2 H -6.730 1.837 1.940 1.00 . A A . 13 ARG HB2 1 1 13 3766 1 1 13 ARG HB3 H -5.165 1.324 1.329 1.00 . A A . 13 ARG HB3 1 1 13 3767 1 1 13 ARG HD2 H -6.803 -0.599 4.725 1.00 . A A . 13 ARG HD2 1 1 13 3768 1 1 13 ARG HD3 H -6.078 0.990 4.952 1.00 . A A . 13 ARG HD3 1 1 13 3769 1 1 13 ARG HE H -8.156 1.320 3.154 1.00 . A A . 13 ARG HE 1 1 13 3770 1 1 13 ARG HG2 H -6.386 -0.518 2.361 1.00 . A A . 13 ARG HG2 1 1 13 3771 1 1 13 ARG HG3 H -4.883 -0.170 3.218 1.00 . A A . 13 ARG HG3 1 1 13 3772 1 1 13 ARG HH11 H -7.778 0.272 6.461 1.00 . A A . 13 ARG HH11 1 1 13 3773 1 1 13 ARG HH12 H -9.342 0.832 6.949 1.00 . A A . 13 ARG HH12 1 1 13 3774 1 1 13 ARG HH21 H -10.212 2.059 3.794 1.00 . A A . 13 ARG HH21 1 1 13 3775 1 1 13 ARG HH22 H -10.724 1.846 5.435 1.00 . A A . 13 ARG HH22 1 1 13 3776 1 1 13 ARG N N -5.551 3.930 2.603 1.00 . A A . 13 ARG N 1 1 13 3777 1 1 13 ARG NE N -7.956 0.996 4.057 1.00 . A A . 13 ARG NE 1 1 13 3778 1 1 13 ARG NH1 N -8.646 0.715 6.240 1.00 . A A . 13 ARG NH1 1 1 13 3779 1 1 13 ARG NH2 N -10.032 1.733 4.722 1.00 . A A . 13 ARG NH2 1 1 13 3780 1 1 13 ARG O O -3.036 2.471 1.752 1.00 . A A . 13 ARG O 1 1 13 3781 1 1 14 ASP C C -0.909 1.223 3.211 1.00 . A A . 14 ASP C 1 1 13 3782 1 1 14 ASP CA C -1.392 2.439 3.995 1.00 . A A . 14 ASP CA 1 1 13 3783 1 1 14 ASP CB C -0.866 2.378 5.430 1.00 . A A . 14 ASP CB 1 1 13 3784 1 1 14 ASP CG C -1.141 3.654 6.201 1.00 . A A . 14 ASP CG 1 1 13 3785 1 1 14 ASP H H -3.315 2.576 4.853 1.00 . A A . 14 ASP H 1 1 13 3786 1 1 14 ASP HA H -1.016 3.330 3.525 1.00 . A A . 14 ASP HA 1 1 13 3787 1 1 14 ASP HB2 H -1.340 1.558 5.947 1.00 . A A . 14 ASP HB2 1 1 13 3788 1 1 14 ASP HB3 H 0.201 2.216 5.408 1.00 . A A . 14 ASP HB3 1 1 13 3789 1 1 14 ASP N N -2.845 2.521 3.997 1.00 . A A . 14 ASP N 1 1 13 3790 1 1 14 ASP O O -0.677 0.164 3.775 1.00 . A A . 14 ASP O 1 1 13 3791 1 1 14 ASP OD1 O -0.190 4.435 6.414 1.00 . A A . 14 ASP OD1 1 1 13 3792 1 1 14 ASP OD2 O -2.307 3.872 6.592 1.00 . A A . 14 ASP OD2 1 1 13 3793 1 1 15 SER C C 1.016 -0.281 1.540 1.00 . A A . 15 SER C 1 1 13 3794 1 1 15 SER CA C -0.302 0.304 1.037 1.00 . A A . 15 SER CA 1 1 13 3795 1 1 15 SER CB C -0.129 0.811 -0.397 1.00 . A A . 15 SER CB 1 1 13 3796 1 1 15 SER H H -0.965 2.255 1.516 1.00 . A A . 15 SER H 1 1 13 3797 1 1 15 SER HA H -1.055 -0.469 1.046 1.00 . A A . 15 SER HA 1 1 13 3798 1 1 15 SER HB2 H -0.560 1.797 -0.481 1.00 . A A . 15 SER HB2 1 1 13 3799 1 1 15 SER HB3 H 0.923 0.857 -0.638 1.00 . A A . 15 SER HB3 1 1 13 3800 1 1 15 SER HG H -0.225 -0.141 -2.106 1.00 . A A . 15 SER HG 1 1 13 3801 1 1 15 SER N N -0.760 1.386 1.905 1.00 . A A . 15 SER N 1 1 13 3802 1 1 15 SER O O 1.627 0.251 2.466 1.00 . A A . 15 SER O 1 1 13 3803 1 1 15 SER OG O -0.772 -0.048 -1.323 1.00 . A A . 15 SER OG 1 1 13 3804 1 1 16 LEU C C 3.803 -1.730 0.298 1.00 . A A . 16 LEU C 1 1 13 3805 1 1 16 LEU CA C 2.700 -2.024 1.311 1.00 . A A . 16 LEU CA 1 1 13 3806 1 1 16 LEU CB C 2.498 -3.537 1.446 1.00 . A A . 16 LEU CB 1 1 13 3807 1 1 16 LEU CD1 C 2.518 -5.604 2.868 1.00 . A A . 16 LEU CD1 1 1 13 3808 1 1 16 LEU CD2 C 4.095 -3.727 3.372 1.00 . A A . 16 LEU CD2 1 1 13 3809 1 1 16 LEU CG C 2.711 -4.095 2.856 1.00 . A A . 16 LEU CG 1 1 13 3810 1 1 16 LEU H H 0.924 -1.754 0.188 1.00 . A A . 16 LEU H 1 1 13 3811 1 1 16 LEU HA H 2.995 -1.624 2.269 1.00 . A A . 16 LEU HA 1 1 13 3812 1 1 16 LEU HB2 H 1.491 -3.773 1.135 1.00 . A A . 16 LEU HB2 1 1 13 3813 1 1 16 LEU HB3 H 3.187 -4.035 0.780 1.00 . A A . 16 LEU HB3 1 1 13 3814 1 1 16 LEU HD11 H 2.025 -5.895 3.783 1.00 . A A . 16 LEU HD11 1 1 13 3815 1 1 16 LEU HD12 H 3.481 -6.090 2.807 1.00 . A A . 16 LEU HD12 1 1 13 3816 1 1 16 LEU HD13 H 1.912 -5.897 2.024 1.00 . A A . 16 LEU HD13 1 1 13 3817 1 1 16 LEU HD21 H 4.738 -4.594 3.327 1.00 . A A . 16 LEU HD21 1 1 13 3818 1 1 16 LEU HD22 H 4.019 -3.388 4.395 1.00 . A A . 16 LEU HD22 1 1 13 3819 1 1 16 LEU HD23 H 4.510 -2.939 2.762 1.00 . A A . 16 LEU HD23 1 1 13 3820 1 1 16 LEU HG H 1.979 -3.662 3.521 1.00 . A A . 16 LEU HG 1 1 13 3821 1 1 16 LEU N N 1.452 -1.376 0.923 1.00 . A A . 16 LEU N 1 1 13 3822 1 1 16 LEU O O 4.670 -0.890 0.537 1.00 . A A . 16 LEU O 1 1 13 3823 1 1 17 TYR C C 4.456 -3.124 -3.091 1.00 . A A . 17 TYR C 1 1 13 3824 1 1 17 TYR CA C 4.761 -2.241 -1.882 1.00 . A A . 17 TYR CA 1 1 13 3825 1 1 17 TYR CB C 6.159 -2.555 -1.346 1.00 . A A . 17 TYR CB 1 1 13 3826 1 1 17 TYR CD1 C 6.437 -3.782 0.844 1.00 . A A . 17 TYR CD1 1 1 13 3827 1 1 17 TYR CD2 C 6.073 -5.070 -1.129 1.00 . A A . 17 TYR CD2 1 1 13 3828 1 1 17 TYR CE1 C 6.498 -4.941 1.594 1.00 . A A . 17 TYR CE1 1 1 13 3829 1 1 17 TYR CE2 C 6.132 -6.233 -0.386 1.00 . A A . 17 TYR CE2 1 1 13 3830 1 1 17 TYR CG C 6.224 -3.826 -0.529 1.00 . A A . 17 TYR CG 1 1 13 3831 1 1 17 TYR CZ C 6.345 -6.164 0.975 1.00 . A A . 17 TYR CZ 1 1 13 3832 1 1 17 TYR H H 3.048 -3.084 -0.966 1.00 . A A . 17 TYR H 1 1 13 3833 1 1 17 TYR HA H 4.727 -1.207 -2.188 1.00 . A A . 17 TYR HA 1 1 13 3834 1 1 17 TYR HB2 H 6.840 -2.661 -2.177 1.00 . A A . 17 TYR HB2 1 1 13 3835 1 1 17 TYR HB3 H 6.488 -1.739 -0.719 1.00 . A A . 17 TYR HB3 1 1 13 3836 1 1 17 TYR HD1 H 6.557 -2.823 1.326 1.00 . A A . 17 TYR HD1 1 1 13 3837 1 1 17 TYR HD2 H 5.908 -5.121 -2.195 1.00 . A A . 17 TYR HD2 1 1 13 3838 1 1 17 TYR HE1 H 6.663 -4.886 2.660 1.00 . A A . 17 TYR HE1 1 1 13 3839 1 1 17 TYR HE2 H 6.012 -7.190 -0.871 1.00 . A A . 17 TYR HE2 1 1 13 3840 1 1 17 TYR HH H 5.646 -7.365 2.305 1.00 . A A . 17 TYR HH 1 1 13 3841 1 1 17 TYR N N 3.764 -2.428 -0.834 1.00 . A A . 17 TYR N 1 1 13 3842 1 1 17 TYR O O 3.907 -4.217 -2.949 1.00 . A A . 17 TYR O 1 1 13 3843 1 1 17 TYR OH O 6.405 -7.320 1.718 1.00 . A A . 17 TYR OH 1 1 13 3844 1 1 18 PRO C C 5.152 -4.823 -5.480 1.00 . A A . 18 PRO C 1 1 13 3845 1 1 18 PRO CA C 4.571 -3.411 -5.539 1.00 . A A . 18 PRO CA 1 1 13 3846 1 1 18 PRO CB C 5.290 -2.583 -6.607 1.00 . A A . 18 PRO CB 1 1 13 3847 1 1 18 PRO CD C 5.467 -1.364 -4.560 1.00 . A A . 18 PRO CD 1 1 13 3848 1 1 18 PRO CG C 5.340 -1.203 -6.049 1.00 . A A . 18 PRO CG 1 1 13 3849 1 1 18 PRO HA H 3.518 -3.467 -5.770 1.00 . A A . 18 PRO HA 1 1 13 3850 1 1 18 PRO HB2 H 6.281 -2.981 -6.768 1.00 . A A . 18 PRO HB2 1 1 13 3851 1 1 18 PRO HB3 H 4.729 -2.614 -7.529 1.00 . A A . 18 PRO HB3 1 1 13 3852 1 1 18 PRO HD2 H 6.507 -1.394 -4.271 1.00 . A A . 18 PRO HD2 1 1 13 3853 1 1 18 PRO HD3 H 4.954 -0.563 -4.049 1.00 . A A . 18 PRO HD3 1 1 13 3854 1 1 18 PRO HG2 H 6.198 -0.678 -6.444 1.00 . A A . 18 PRO HG2 1 1 13 3855 1 1 18 PRO HG3 H 4.431 -0.675 -6.293 1.00 . A A . 18 PRO HG3 1 1 13 3856 1 1 18 PRO N N 4.809 -2.658 -4.302 1.00 . A A . 18 PRO N 1 1 13 3857 1 1 18 PRO O O 6.076 -5.091 -4.712 1.00 . A A . 18 PRO O 1 1 13 3858 1 1 19 PRO C C 6.562 -7.237 -6.705 1.00 . A A . 19 PRO C 1 1 13 3859 1 1 19 PRO CA C 5.086 -7.136 -6.337 1.00 . A A . 19 PRO CA 1 1 13 3860 1 1 19 PRO CB C 4.216 -7.791 -7.419 1.00 . A A . 19 PRO CB 1 1 13 3861 1 1 19 PRO CD C 3.515 -5.510 -7.244 1.00 . A A . 19 PRO CD 1 1 13 3862 1 1 19 PRO CG C 3.636 -6.661 -8.201 1.00 . A A . 19 PRO CG 1 1 13 3863 1 1 19 PRO HA H 4.921 -7.632 -5.391 1.00 . A A . 19 PRO HA 1 1 13 3864 1 1 19 PRO HB2 H 4.831 -8.425 -8.041 1.00 . A A . 19 PRO HB2 1 1 13 3865 1 1 19 PRO HB3 H 3.443 -8.382 -6.951 1.00 . A A . 19 PRO HB3 1 1 13 3866 1 1 19 PRO HD2 H 3.645 -4.572 -7.763 1.00 . A A . 19 PRO HD2 1 1 13 3867 1 1 19 PRO HD3 H 2.561 -5.536 -6.740 1.00 . A A . 19 PRO HD3 1 1 13 3868 1 1 19 PRO HG2 H 4.294 -6.402 -9.017 1.00 . A A . 19 PRO HG2 1 1 13 3869 1 1 19 PRO HG3 H 2.663 -6.938 -8.577 1.00 . A A . 19 PRO HG3 1 1 13 3870 1 1 19 PRO N N 4.616 -5.747 -6.298 1.00 . A A . 19 PRO N 1 1 13 3871 1 1 19 PRO O O 7.387 -7.655 -5.892 1.00 . A A . 19 PRO O 1 1 13 3872 1 1 20 ALA C C 8.549 -5.781 -9.402 1.00 . A A . 20 ALA C 1 1 13 3873 1 1 20 ALA CA C 8.268 -6.903 -8.408 1.00 . A A . 20 ALA CA 1 1 13 3874 1 1 20 ALA CB C 8.561 -8.256 -9.039 1.00 . A A . 20 ALA CB 1 1 13 3875 1 1 20 ALA H H 6.189 -6.530 -8.538 1.00 . A A . 20 ALA H 1 1 13 3876 1 1 20 ALA HA H 8.917 -6.783 -7.553 1.00 . A A . 20 ALA HA 1 1 13 3877 1 1 20 ALA HB1 H 8.388 -9.036 -8.313 1.00 . A A . 20 ALA HB1 1 1 13 3878 1 1 20 ALA HB2 H 9.592 -8.286 -9.362 1.00 . A A . 20 ALA HB2 1 1 13 3879 1 1 20 ALA HB3 H 7.913 -8.405 -9.890 1.00 . A A . 20 ALA HB3 1 1 13 3880 1 1 20 ALA N N 6.890 -6.854 -7.935 1.00 . A A . 20 ALA N 1 1 13 3881 1 1 20 ALA O O 8.630 -6.012 -10.608 1.00 . A A . 20 ALA O 1 1 13 3882 1 1 21 GLY C C 9.162 -2.142 -8.957 1.00 . A A . 21 GLY C 1 1 13 3883 1 1 21 GLY CA C 8.970 -3.425 -9.743 1.00 . A A . 21 GLY CA 1 1 13 3884 1 1 21 GLY H H 8.624 -4.441 -7.917 1.00 . A A . 21 GLY H 1 1 13 3885 1 1 21 GLY HA2 H 9.867 -3.623 -10.312 1.00 . A A . 21 GLY HA2 1 1 13 3886 1 1 21 GLY HA3 H 8.144 -3.296 -10.426 1.00 . A A . 21 GLY HA3 1 1 13 3887 1 1 21 GLY N N 8.698 -4.565 -8.887 1.00 . A A . 21 GLY N 1 1 14 3888 1 1 1 ASP C C -5.567 -1.125 -3.676 1.00 . A A . 1 ASP C 1 1 14 3889 1 1 1 ASP CA C -4.878 -0.204 -4.678 1.00 . A A . 1 ASP CA 1 1 14 3890 1 1 1 ASP CB C -3.978 -1.024 -5.604 1.00 . A A . 1 ASP CB 1 1 14 3891 1 1 1 ASP CG C -2.688 -1.451 -4.931 1.00 . A A . 1 ASP CG 1 1 14 3892 1 1 1 ASP H1 H -4.408 1.012 -3.080 1.00 . A A . 1 ASP H1 1 1 14 3893 1 1 1 ASP HA H -5.633 0.290 -5.271 1.00 . A A . 1 ASP HA 1 1 14 3894 1 1 1 ASP HB2 H -4.508 -1.912 -5.917 1.00 . A A . 1 ASP HB2 1 1 14 3895 1 1 1 ASP HB3 H -3.731 -0.432 -6.474 1.00 . A A . 1 ASP HB3 1 1 14 3896 1 1 1 ASP N N -4.103 0.826 -3.993 1.00 . A A . 1 ASP N 1 1 14 3897 1 1 1 ASP O O -6.772 -1.360 -3.759 1.00 . A A . 1 ASP O 1 1 14 3898 1 1 1 ASP OD1 O -1.773 -0.609 -4.814 1.00 . A A . 1 ASP OD1 1 1 14 3899 1 1 1 ASP OD2 O -2.593 -2.627 -4.522 1.00 . A A . 1 ASP OD2 1 1 14 3900 1 1 2 GLY C C -4.309 -3.499 -1.179 1.00 . A A . 2 GLY C 1 1 14 3901 1 1 2 GLY CA C -5.343 -2.534 -1.725 1.00 . A A . 2 GLY CA 1 1 14 3902 1 1 2 GLY H H -3.838 -1.421 -2.713 1.00 . A A . 2 GLY H 1 1 14 3903 1 1 2 GLY HA2 H -5.733 -1.942 -0.910 1.00 . A A . 2 GLY HA2 1 1 14 3904 1 1 2 GLY HA3 H -6.151 -3.100 -2.164 1.00 . A A . 2 GLY HA3 1 1 14 3905 1 1 2 GLY N N -4.792 -1.644 -2.729 1.00 . A A . 2 GLY N 1 1 14 3906 1 1 2 GLY O O -3.282 -3.742 -1.813 1.00 . A A . 2 GLY O 1 1 14 3907 1 1 3 MET C C -2.283 -4.358 0.827 1.00 . A A . 3 MET C 1 1 14 3908 1 1 3 MET CA C -3.658 -4.991 0.632 1.00 . A A . 3 MET CA 1 1 14 3909 1 1 3 MET CB C -3.532 -6.260 -0.213 1.00 . A A . 3 MET CB 1 1 14 3910 1 1 3 MET CE C -0.947 -8.781 -1.266 1.00 . A A . 3 MET CE 1 1 14 3911 1 1 3 MET CG C -2.605 -7.303 0.388 1.00 . A A . 3 MET CG 1 1 14 3912 1 1 3 MET H H -5.411 -3.815 0.460 1.00 . A A . 3 MET H 1 1 14 3913 1 1 3 MET HA H -4.062 -5.251 1.599 1.00 . A A . 3 MET HA 1 1 14 3914 1 1 3 MET HB2 H -4.511 -6.702 -0.326 1.00 . A A . 3 MET HB2 1 1 14 3915 1 1 3 MET HB3 H -3.153 -5.993 -1.189 1.00 . A A . 3 MET HB3 1 1 14 3916 1 1 3 MET HE1 H -1.585 -9.504 -0.780 1.00 . A A . 3 MET HE1 1 1 14 3917 1 1 3 MET HE2 H 0.060 -9.168 -1.318 1.00 . A A . 3 MET HE2 1 1 14 3918 1 1 3 MET HE3 H -1.312 -8.590 -2.264 1.00 . A A . 3 MET HE3 1 1 14 3919 1 1 3 MET HG2 H -2.528 -7.127 1.451 1.00 . A A . 3 MET HG2 1 1 14 3920 1 1 3 MET HG3 H -3.029 -8.282 0.217 1.00 . A A . 3 MET HG3 1 1 14 3921 1 1 3 MET N N -4.577 -4.049 0.002 1.00 . A A . 3 MET N 1 1 14 3922 1 1 3 MET O O -1.477 -4.305 -0.101 1.00 . A A . 3 MET O 1 1 14 3923 1 1 3 MET SD S -0.951 -7.256 -0.327 1.00 . A A . 3 MET SD 1 1 14 3924 1 1 4 GLY C C -0.797 -2.410 3.591 1.00 . A A . 4 GLY C 1 1 14 3925 1 1 4 GLY CA C -0.751 -3.251 2.332 1.00 . A A . 4 GLY CA 1 1 14 3926 1 1 4 GLY H H -2.708 -3.945 2.739 1.00 . A A . 4 GLY H 1 1 14 3927 1 1 4 GLY HA2 H -0.002 -4.018 2.451 1.00 . A A . 4 GLY HA2 1 1 14 3928 1 1 4 GLY HA3 H -0.475 -2.617 1.502 1.00 . A A . 4 GLY HA3 1 1 14 3929 1 1 4 GLY N N -2.026 -3.877 2.039 1.00 . A A . 4 GLY N 1 1 14 3930 1 1 4 GLY O O -1.867 -2.189 4.158 1.00 . A A . 4 GLY O 1 1 14 3931 1 1 5 GLU C C 1.687 -0.215 5.185 1.00 . A A . 5 GLU C 1 1 14 3932 1 1 5 GLU CA C 0.447 -1.102 5.222 1.00 . A A . 5 GLU CA 1 1 14 3933 1 1 5 GLU CB C 0.463 -1.974 6.479 1.00 . A A . 5 GLU CB 1 1 14 3934 1 1 5 GLU CD C 0.455 -1.892 9.003 1.00 . A A . 5 GLU CD 1 1 14 3935 1 1 5 GLU CG C -0.040 -1.255 7.719 1.00 . A A . 5 GLU CG 1 1 14 3936 1 1 5 GLU H H 1.184 -2.136 3.528 1.00 . A A . 5 GLU H 1 1 14 3937 1 1 5 GLU HA H -0.429 -0.469 5.243 1.00 . A A . 5 GLU HA 1 1 14 3938 1 1 5 GLU HB2 H -0.161 -2.839 6.311 1.00 . A A . 5 GLU HB2 1 1 14 3939 1 1 5 GLU HB3 H 1.476 -2.301 6.664 1.00 . A A . 5 GLU HB3 1 1 14 3940 1 1 5 GLU HG2 H 0.302 -0.231 7.689 1.00 . A A . 5 GLU HG2 1 1 14 3941 1 1 5 GLU HG3 H -1.120 -1.274 7.717 1.00 . A A . 5 GLU HG3 1 1 14 3942 1 1 5 GLU N N 0.365 -1.932 4.026 1.00 . A A . 5 GLU N 1 1 14 3943 1 1 5 GLU O O 2.444 -0.143 6.153 1.00 . A A . 5 GLU O 1 1 14 3944 1 1 5 GLU OE1 O 1.278 -1.262 9.699 1.00 . A A . 5 GLU OE1 1 1 14 3945 1 1 5 GLU OE2 O 0.019 -3.021 9.312 1.00 . A A . 5 GLU OE2 1 1 14 3946 1 1 6 GLU C C 2.577 2.803 3.763 1.00 . A A . 6 GLU C 1 1 14 3947 1 1 6 GLU CA C 3.029 1.351 3.895 1.00 . A A . 6 GLU CA 1 1 14 3948 1 1 6 GLU CB C 3.854 0.937 2.674 1.00 . A A . 6 GLU CB 1 1 14 3949 1 1 6 GLU CD C 5.325 -0.774 3.810 1.00 . A A . 6 GLU CD 1 1 14 3950 1 1 6 GLU CG C 5.274 0.517 3.016 1.00 . A A . 6 GLU CG 1 1 14 3951 1 1 6 GLU H H 1.245 0.368 3.325 1.00 . A A . 6 GLU H 1 1 14 3952 1 1 6 GLU HA H 3.644 1.261 4.778 1.00 . A A . 6 GLU HA 1 1 14 3953 1 1 6 GLU HB2 H 3.364 0.105 2.189 1.00 . A A . 6 GLU HB2 1 1 14 3954 1 1 6 GLU HB3 H 3.902 1.766 1.984 1.00 . A A . 6 GLU HB3 1 1 14 3955 1 1 6 GLU HG2 H 5.826 0.379 2.098 1.00 . A A . 6 GLU HG2 1 1 14 3956 1 1 6 GLU HG3 H 5.737 1.300 3.599 1.00 . A A . 6 GLU HG3 1 1 14 3957 1 1 6 GLU N N 1.885 0.464 4.060 1.00 . A A . 6 GLU N 1 1 14 3958 1 1 6 GLU O O 3.006 3.665 4.529 1.00 . A A . 6 GLU O 1 1 14 3959 1 1 6 GLU OE1 O 5.801 -0.742 4.965 1.00 . A A . 6 GLU OE1 1 1 14 3960 1 1 6 GLU OE2 O 4.890 -1.816 3.278 1.00 . A A . 6 GLU OE2 1 1 14 3961 1 1 7 PHE C C -0.030 4.441 1.685 1.00 . A A . 7 PHE C 1 1 14 3962 1 1 7 PHE CA C 1.203 4.427 2.582 1.00 . A A . 7 PHE CA 1 1 14 3963 1 1 7 PHE CB C 2.295 5.316 1.984 1.00 . A A . 7 PHE CB 1 1 14 3964 1 1 7 PHE CD1 C 4.212 4.081 0.936 1.00 . A A . 7 PHE CD1 1 1 14 3965 1 1 7 PHE CD2 C 2.404 4.763 -0.462 1.00 . A A . 7 PHE CD2 1 1 14 3966 1 1 7 PHE CE1 C 4.849 3.520 -0.155 1.00 . A A . 7 PHE CE1 1 1 14 3967 1 1 7 PHE CE2 C 3.036 4.204 -1.557 1.00 . A A . 7 PHE CE2 1 1 14 3968 1 1 7 PHE CG C 2.984 4.707 0.796 1.00 . A A . 7 PHE CG 1 1 14 3969 1 1 7 PHE CZ C 4.260 3.582 -1.403 1.00 . A A . 7 PHE CZ 1 1 14 3970 1 1 7 PHE H H 1.391 2.346 2.212 1.00 . A A . 7 PHE H 1 1 14 3971 1 1 7 PHE HA H 0.920 4.818 3.546 1.00 . A A . 7 PHE HA 1 1 14 3972 1 1 7 PHE HB2 H 1.856 6.251 1.670 1.00 . A A . 7 PHE HB2 1 1 14 3973 1 1 7 PHE HB3 H 3.042 5.511 2.739 1.00 . A A . 7 PHE HB3 1 1 14 3974 1 1 7 PHE HD1 H 4.673 4.031 1.912 1.00 . A A . 7 PHE HD1 1 1 14 3975 1 1 7 PHE HD2 H 1.447 5.248 -0.583 1.00 . A A . 7 PHE HD2 1 1 14 3976 1 1 7 PHE HE1 H 5.805 3.035 -0.032 1.00 . A A . 7 PHE HE1 1 1 14 3977 1 1 7 PHE HE2 H 2.574 4.254 -2.532 1.00 . A A . 7 PHE HE2 1 1 14 3978 1 1 7 PHE HZ H 4.756 3.146 -2.257 1.00 . A A . 7 PHE HZ 1 1 14 3979 1 1 7 PHE N N 1.704 3.072 2.792 1.00 . A A . 7 PHE N 1 1 14 3980 1 1 7 PHE O O -0.086 3.749 0.668 1.00 . A A . 7 PHE O 1 1 14 3981 1 1 8 ILE C C -2.063 5.435 -0.155 1.00 . A A . 8 ILE C 1 1 14 3982 1 1 8 ILE CA C -2.270 5.371 1.356 1.00 . A A . 8 ILE CA 1 1 14 3983 1 1 8 ILE CB C -3.025 6.630 1.812 1.00 . A A . 8 ILE CB 1 1 14 3984 1 1 8 ILE CD1 C -2.063 8.399 0.253 1.00 . A A . 8 ILE CD1 1 1 14 3985 1 1 8 ILE CG1 C -2.136 7.867 1.668 1.00 . A A . 8 ILE CG1 1 1 14 3986 1 1 8 ILE CG2 C -3.492 6.474 3.251 1.00 . A A . 8 ILE CG2 1 1 14 3987 1 1 8 ILE H H -0.903 5.759 2.905 1.00 . A A . 8 ILE H 1 1 14 3988 1 1 8 ILE HA H -2.880 4.514 1.588 1.00 . A A . 8 ILE HA 1 1 14 3989 1 1 8 ILE HB H -3.892 6.745 1.189 1.00 . A A . 8 ILE HB 1 1 14 3990 1 1 8 ILE HD11 H -2.225 9.466 0.261 1.00 . A A . 8 ILE HD11 1 1 14 3991 1 1 8 ILE HD12 H -2.822 7.923 -0.351 1.00 . A A . 8 ILE HD12 1 1 14 3992 1 1 8 ILE HD13 H -1.088 8.186 -0.161 1.00 . A A . 8 ILE HD13 1 1 14 3993 1 1 8 ILE HG12 H -2.521 8.655 2.297 1.00 . A A . 8 ILE HG12 1 1 14 3994 1 1 8 ILE HG13 H -1.133 7.619 1.982 1.00 . A A . 8 ILE HG13 1 1 14 3995 1 1 8 ILE HG21 H -4.154 5.625 3.325 1.00 . A A . 8 ILE HG21 1 1 14 3996 1 1 8 ILE HG22 H -4.017 7.367 3.558 1.00 . A A . 8 ILE HG22 1 1 14 3997 1 1 8 ILE HG23 H -2.637 6.321 3.893 1.00 . A A . 8 ILE HG23 1 1 14 3998 1 1 8 ILE N N -1.017 5.240 2.084 1.00 . A A . 8 ILE N 1 1 14 3999 1 1 8 ILE O O -1.081 5.998 -0.638 1.00 . A A . 8 ILE O 1 1 14 4000 1 1 9 GLU C C -3.655 6.070 -2.917 1.00 . A A . 9 GLU C 1 1 14 4001 1 1 9 GLU CA C -2.947 4.845 -2.349 1.00 . A A . 9 GLU CA 1 1 14 4002 1 1 9 GLU CB C -3.588 3.565 -2.894 1.00 . A A . 9 GLU CB 1 1 14 4003 1 1 9 GLU CD C -3.446 1.767 -4.663 1.00 . A A . 9 GLU CD 1 1 14 4004 1 1 9 GLU CG C -2.682 2.776 -3.826 1.00 . A A . 9 GLU CG 1 1 14 4005 1 1 9 GLU H H -3.765 4.428 -0.443 1.00 . A A . 9 GLU H 1 1 14 4006 1 1 9 GLU HA H -1.908 4.873 -2.641 1.00 . A A . 9 GLU HA 1 1 14 4007 1 1 9 GLU HB2 H -3.854 2.928 -2.064 1.00 . A A . 9 GLU HB2 1 1 14 4008 1 1 9 GLU HB3 H -4.485 3.827 -3.436 1.00 . A A . 9 GLU HB3 1 1 14 4009 1 1 9 GLU HG2 H -2.181 3.465 -4.490 1.00 . A A . 9 GLU HG2 1 1 14 4010 1 1 9 GLU HG3 H -1.948 2.249 -3.234 1.00 . A A . 9 GLU HG3 1 1 14 4011 1 1 9 GLU N N -3.006 4.856 -0.892 1.00 . A A . 9 GLU N 1 1 14 4012 1 1 9 GLU O O -3.102 6.794 -3.745 1.00 . A A . 9 GLU O 1 1 14 4013 1 1 9 GLU OE1 O -3.444 1.836 -5.892 1.00 . A A . 9 GLU OE1 1 1 14 4014 1 1 10 GLY C C -5.982 8.404 -1.803 1.00 . A A . 10 GLY C 1 1 14 4015 1 1 10 GLY CA C -5.653 7.434 -2.923 1.00 . A A . 10 GLY CA 1 1 14 4016 1 1 10 GLY H H -5.267 5.683 -1.798 1.00 . A A . 10 GLY H 1 1 14 4017 1 1 10 GLY HA2 H -5.087 7.954 -3.681 1.00 . A A . 10 GLY HA2 1 1 14 4018 1 1 10 GLY HA3 H -6.576 7.078 -3.358 1.00 . A A . 10 GLY HA3 1 1 14 4019 1 1 10 GLY N N -4.882 6.295 -2.460 1.00 . A A . 10 GLY N 1 1 14 4020 1 1 10 GLY O O -6.222 9.586 -2.050 1.00 . A A . 10 GLY O 1 1 14 4021 1 1 11 LEU C C -6.301 7.916 1.878 1.00 . A A . 11 LEU C 1 1 14 4022 1 1 11 LEU CA C -6.294 8.739 0.591 1.00 . A A . 11 LEU CA 1 1 14 4023 1 1 11 LEU CB C -7.647 9.433 0.412 1.00 . A A . 11 LEU CB 1 1 14 4024 1 1 11 LEU CD1 C -9.645 8.040 1.011 1.00 . A A . 11 LEU CD1 1 1 14 4025 1 1 11 LEU CD2 C -9.601 9.293 -1.153 1.00 . A A . 11 LEU CD2 1 1 14 4026 1 1 11 LEU CG C -8.768 8.541 -0.126 1.00 . A A . 11 LEU CG 1 1 14 4027 1 1 11 LEU H H -5.794 6.956 -0.435 1.00 . A A . 11 LEU H 1 1 14 4028 1 1 11 LEU HA H -5.523 9.490 0.665 1.00 . A A . 11 LEU HA 1 1 14 4029 1 1 11 LEU HB2 H -7.955 9.827 1.370 1.00 . A A . 11 LEU HB2 1 1 14 4030 1 1 11 LEU HB3 H -7.514 10.259 -0.272 1.00 . A A . 11 LEU HB3 1 1 14 4031 1 1 11 LEU HD11 H -9.039 7.499 1.722 1.00 . A A . 11 LEU HD11 1 1 14 4032 1 1 11 LEU HD12 H -10.407 7.385 0.615 1.00 . A A . 11 LEU HD12 1 1 14 4033 1 1 11 LEU HD13 H -10.112 8.881 1.502 1.00 . A A . 11 LEU HD13 1 1 14 4034 1 1 11 LEU HD21 H -9.598 10.347 -0.917 1.00 . A A . 11 LEU HD21 1 1 14 4035 1 1 11 LEU HD22 H -10.616 8.923 -1.133 1.00 . A A . 11 LEU HD22 1 1 14 4036 1 1 11 LEU HD23 H -9.182 9.142 -2.137 1.00 . A A . 11 LEU HD23 1 1 14 4037 1 1 11 LEU HG H -8.331 7.681 -0.614 1.00 . A A . 11 LEU HG 1 1 14 4038 1 1 11 LEU N N -5.993 7.905 -0.569 1.00 . A A . 11 LEU N 1 1 14 4039 1 1 11 LEU O O -5.912 8.407 2.938 1.00 . A A . 11 LEU O 1 1 14 4040 1 1 12 VAL C C -6.220 4.413 2.646 1.00 . A A . 12 VAL C 1 1 14 4041 1 1 12 VAL CA C -6.809 5.790 2.950 1.00 . A A . 12 VAL CA 1 1 14 4042 1 1 12 VAL CB C -8.261 5.621 3.445 1.00 . A A . 12 VAL CB 1 1 14 4043 1 1 12 VAL CG1 C -9.118 4.949 2.383 1.00 . A A . 12 VAL CG1 1 1 14 4044 1 1 12 VAL CG2 C -8.298 4.835 4.747 1.00 . A A . 12 VAL CG2 1 1 14 4045 1 1 12 VAL H H -7.052 6.330 0.915 1.00 . A A . 12 VAL H 1 1 14 4046 1 1 12 VAL HA H -6.234 6.248 3.740 1.00 . A A . 12 VAL HA 1 1 14 4047 1 1 12 VAL HB H -8.670 6.604 3.633 1.00 . A A . 12 VAL HB 1 1 14 4048 1 1 12 VAL HG11 H -10.148 4.933 2.709 1.00 . A A . 12 VAL HG11 1 1 14 4049 1 1 12 VAL HG12 H -8.774 3.937 2.230 1.00 . A A . 12 VAL HG12 1 1 14 4050 1 1 12 VAL HG13 H -9.042 5.499 1.457 1.00 . A A . 12 VAL HG13 1 1 14 4051 1 1 12 VAL HG21 H -8.046 3.803 4.552 1.00 . A A . 12 VAL HG21 1 1 14 4052 1 1 12 VAL HG22 H -9.290 4.888 5.172 1.00 . A A . 12 VAL HG22 1 1 14 4053 1 1 12 VAL HG23 H -7.586 5.254 5.442 1.00 . A A . 12 VAL HG23 1 1 14 4054 1 1 12 VAL N N -6.750 6.667 1.784 1.00 . A A . 12 VAL N 1 1 14 4055 1 1 12 VAL O O -6.109 4.017 1.486 1.00 . A A . 12 VAL O 1 1 14 4056 1 1 13 ARG C C -3.813 2.409 3.132 1.00 . A A . 13 ARG C 1 1 14 4057 1 1 13 ARG CA C -5.272 2.349 3.569 1.00 . A A . 13 ARG CA 1 1 14 4058 1 1 13 ARG CB C -6.076 1.507 2.573 1.00 . A A . 13 ARG CB 1 1 14 4059 1 1 13 ARG CD C -5.612 -0.584 1.255 1.00 . A A . 13 ARG CD 1 1 14 4060 1 1 13 ARG CG C -5.761 0.022 2.642 1.00 . A A . 13 ARG CG 1 1 14 4061 1 1 13 ARG CZ C -6.823 0.649 -0.510 1.00 . A A . 13 ARG CZ 1 1 14 4062 1 1 13 ARG H H -5.966 4.064 4.599 1.00 . A A . 13 ARG H 1 1 14 4063 1 1 13 ARG HA H -5.319 1.876 4.538 1.00 . A A . 13 ARG HA 1 1 14 4064 1 1 13 ARG HB2 H -7.129 1.640 2.774 1.00 . A A . 13 ARG HB2 1 1 14 4065 1 1 13 ARG HB3 H -5.862 1.852 1.574 1.00 . A A . 13 ARG HB3 1 1 14 4066 1 1 13 ARG HD2 H -4.732 -0.172 0.788 1.00 . A A . 13 ARG HD2 1 1 14 4067 1 1 13 ARG HD3 H -5.495 -1.653 1.357 1.00 . A A . 13 ARG HD3 1 1 14 4068 1 1 13 ARG HE H -7.563 -0.881 0.537 1.00 . A A . 13 ARG HE 1 1 14 4069 1 1 13 ARG HG2 H -4.837 -0.115 3.184 1.00 . A A . 13 ARG HG2 1 1 14 4070 1 1 13 ARG HG3 H -6.563 -0.482 3.162 1.00 . A A . 13 ARG HG3 1 1 14 4071 1 1 13 ARG HH11 H -4.947 1.331 -0.176 1.00 . A A . 13 ARG HH11 1 1 14 4072 1 1 13 ARG HH12 H -5.830 2.164 -1.409 1.00 . A A . 13 ARG HH12 1 1 14 4073 1 1 13 ARG HH21 H -8.714 0.222 -1.082 1.00 . A A . 13 ARG HH21 1 1 14 4074 1 1 13 ARG HH22 H -7.964 1.538 -1.922 1.00 . A A . 13 ARG HH22 1 1 14 4075 1 1 13 ARG N N -5.848 3.688 3.702 1.00 . A A . 13 ARG N 1 1 14 4076 1 1 13 ARG NE N -6.774 -0.313 0.411 1.00 . A A . 13 ARG NE 1 1 14 4077 1 1 13 ARG NH1 N -5.781 1.446 -0.714 1.00 . A A . 13 ARG NH1 1 1 14 4078 1 1 13 ARG NH2 N -7.924 0.817 -1.230 1.00 . A A . 13 ARG NH2 1 1 14 4079 1 1 13 ARG O O -3.517 2.493 1.942 1.00 . A A . 13 ARG O 1 1 14 4080 1 1 14 ASP C C -1.067 1.326 2.830 1.00 . A A . 14 ASP C 1 1 14 4081 1 1 14 ASP CA C -1.475 2.401 3.836 1.00 . A A . 14 ASP CA 1 1 14 4082 1 1 14 ASP CB C -0.688 2.219 5.136 1.00 . A A . 14 ASP CB 1 1 14 4083 1 1 14 ASP CG C -0.665 3.478 5.979 1.00 . A A . 14 ASP CG 1 1 14 4084 1 1 14 ASP H H -3.207 2.289 5.034 1.00 . A A . 14 ASP H 1 1 14 4085 1 1 14 ASP HA H -1.247 3.369 3.425 1.00 . A A . 14 ASP HA 1 1 14 4086 1 1 14 ASP HB2 H -1.141 1.429 5.716 1.00 . A A . 14 ASP HB2 1 1 14 4087 1 1 14 ASP HB3 H 0.329 1.947 4.898 1.00 . A A . 14 ASP HB3 1 1 14 4088 1 1 14 ASP N N -2.906 2.358 4.107 1.00 . A A . 14 ASP N 1 1 14 4089 1 1 14 ASP O O -0.652 0.237 3.207 1.00 . A A . 14 ASP O 1 1 14 4090 1 1 14 ASP OD1 O -1.736 3.875 6.484 1.00 . A A . 14 ASP OD1 1 1 14 4091 1 1 14 ASP OD2 O 0.425 4.068 6.135 1.00 . A A . 14 ASP OD2 1 1 14 4092 1 1 15 SER C C 0.489 0.011 0.761 1.00 . A A . 15 SER C 1 1 14 4093 1 1 15 SER CA C -0.833 0.722 0.474 1.00 . A A . 15 SER CA 1 1 14 4094 1 1 15 SER CB C -0.726 1.479 -0.849 1.00 . A A . 15 SER CB 1 1 14 4095 1 1 15 SER H H -1.526 2.531 1.320 1.00 . A A . 15 SER H 1 1 14 4096 1 1 15 SER HA H -1.618 -0.015 0.395 1.00 . A A . 15 SER HA 1 1 14 4097 1 1 15 SER HB2 H 0.215 2.008 -0.882 1.00 . A A . 15 SER HB2 1 1 14 4098 1 1 15 SER HB3 H -0.773 0.777 -1.668 1.00 . A A . 15 SER HB3 1 1 14 4099 1 1 15 SER HG H -1.416 3.255 -1.284 1.00 . A A . 15 SER HG 1 1 14 4100 1 1 15 SER N N -1.188 1.647 1.550 1.00 . A A . 15 SER N 1 1 14 4101 1 1 15 SER O O 1.277 0.463 1.589 1.00 . A A . 15 SER O 1 1 14 4102 1 1 15 SER OG O -1.777 2.416 -0.989 1.00 . A A . 15 SER OG 1 1 14 4103 1 1 16 LEU C C 3.019 -1.436 -0.751 1.00 . A A . 16 LEU C 1 1 14 4104 1 1 16 LEU CA C 1.951 -1.867 0.250 1.00 . A A . 16 LEU CA 1 1 14 4105 1 1 16 LEU CB C 1.670 -3.365 0.101 1.00 . A A . 16 LEU CB 1 1 14 4106 1 1 16 LEU CD1 C 1.571 -5.579 1.271 1.00 . A A . 16 LEU CD1 1 1 14 4107 1 1 16 LEU CD2 C 3.781 -4.478 0.869 1.00 . A A . 16 LEU CD2 1 1 14 4108 1 1 16 LEU CG C 2.307 -4.252 1.172 1.00 . A A . 16 LEU CG 1 1 14 4109 1 1 16 LEU H H 0.058 -1.409 -0.581 1.00 . A A . 16 LEU H 1 1 14 4110 1 1 16 LEU HA H 2.315 -1.677 1.249 1.00 . A A . 16 LEU HA 1 1 14 4111 1 1 16 LEU HB2 H 0.601 -3.513 0.128 1.00 . A A . 16 LEU HB2 1 1 14 4112 1 1 16 LEU HB3 H 2.035 -3.686 -0.864 1.00 . A A . 16 LEU HB3 1 1 14 4113 1 1 16 LEU HD11 H 0.544 -5.446 0.965 1.00 . A A . 16 LEU HD11 1 1 14 4114 1 1 16 LEU HD12 H 1.599 -5.931 2.292 1.00 . A A . 16 LEU HD12 1 1 14 4115 1 1 16 LEU HD13 H 2.047 -6.304 0.628 1.00 . A A . 16 LEU HD13 1 1 14 4116 1 1 16 LEU HD21 H 3.957 -4.338 -0.187 1.00 . A A . 16 LEU HD21 1 1 14 4117 1 1 16 LEU HD22 H 4.056 -5.484 1.149 1.00 . A A . 16 LEU HD22 1 1 14 4118 1 1 16 LEU HD23 H 4.376 -3.773 1.430 1.00 . A A . 16 LEU HD23 1 1 14 4119 1 1 16 LEU HG H 2.233 -3.757 2.129 1.00 . A A . 16 LEU HG 1 1 14 4120 1 1 16 LEU N N 0.724 -1.099 0.069 1.00 . A A . 16 LEU N 1 1 14 4121 1 1 16 LEU O O 2.707 -0.954 -1.839 1.00 . A A . 16 LEU O 1 1 14 4122 1 1 17 TYR C C 5.423 -2.113 -2.495 1.00 . A A . 17 TYR C 1 1 14 4123 1 1 17 TYR CA C 5.399 -1.248 -1.237 1.00 . A A . 17 TYR CA 1 1 14 4124 1 1 17 TYR CB C 6.722 -1.388 -0.480 1.00 . A A . 17 TYR CB 1 1 14 4125 1 1 17 TYR CD1 C 6.819 -3.908 -0.333 1.00 . A A . 17 TYR CD1 1 1 14 4126 1 1 17 TYR CD2 C 6.975 -2.655 1.689 1.00 . A A . 17 TYR CD2 1 1 14 4127 1 1 17 TYR CE1 C 6.928 -5.085 0.383 1.00 . A A . 17 TYR CE1 1 1 14 4128 1 1 17 TYR CE2 C 7.085 -3.828 2.412 1.00 . A A . 17 TYR CE2 1 1 14 4129 1 1 17 TYR CG C 6.840 -2.674 0.306 1.00 . A A . 17 TYR CG 1 1 14 4130 1 1 17 TYR CZ C 7.061 -5.040 1.754 1.00 . A A . 17 TYR CZ 1 1 14 4131 1 1 17 TYR H H 4.466 -2.006 0.506 1.00 . A A . 17 TYR H 1 1 14 4132 1 1 17 TYR HA H 5.268 -0.216 -1.527 1.00 . A A . 17 TYR HA 1 1 14 4133 1 1 17 TYR HB2 H 7.537 -1.357 -1.187 1.00 . A A . 17 TYR HB2 1 1 14 4134 1 1 17 TYR HB3 H 6.821 -0.564 0.212 1.00 . A A . 17 TYR HB3 1 1 14 4135 1 1 17 TYR HD1 H 6.715 -3.941 -1.407 1.00 . A A . 17 TYR HD1 1 1 14 4136 1 1 17 TYR HD2 H 6.993 -1.705 2.202 1.00 . A A . 17 TYR HD2 1 1 14 4137 1 1 17 TYR HE1 H 6.909 -6.034 -0.133 1.00 . A A . 17 TYR HE1 1 1 14 4138 1 1 17 TYR HE2 H 7.189 -3.792 3.486 1.00 . A A . 17 TYR HE2 1 1 14 4139 1 1 17 TYR HH H 7.813 -6.095 3.175 1.00 . A A . 17 TYR HH 1 1 14 4140 1 1 17 TYR N N 4.281 -1.615 -0.374 1.00 . A A . 17 TYR N 1 1 14 4141 1 1 17 TYR O O 4.803 -3.176 -2.539 1.00 . A A . 17 TYR O 1 1 14 4142 1 1 17 TYR OH O 7.170 -6.209 2.471 1.00 . A A . 17 TYR OH 1 1 14 4143 1 1 18 PRO C C 6.562 -3.890 -4.582 1.00 . A A . 18 PRO C 1 1 14 4144 1 1 18 PRO CA C 6.250 -2.409 -4.800 1.00 . A A . 18 PRO CA 1 1 14 4145 1 1 18 PRO CB C 7.411 -1.717 -5.514 1.00 . A A . 18 PRO CB 1 1 14 4146 1 1 18 PRO CD C 6.918 -0.411 -3.571 1.00 . A A . 18 PRO CD 1 1 14 4147 1 1 18 PRO CG C 7.390 -0.321 -4.997 1.00 . A A . 18 PRO CG 1 1 14 4148 1 1 18 PRO HA H 5.352 -2.311 -5.391 1.00 . A A . 18 PRO HA 1 1 14 4149 1 1 18 PRO HB2 H 8.337 -2.217 -5.269 1.00 . A A . 18 PRO HB2 1 1 14 4150 1 1 18 PRO HB3 H 7.251 -1.745 -6.581 1.00 . A A . 18 PRO HB3 1 1 14 4151 1 1 18 PRO HD2 H 7.762 -0.460 -2.898 1.00 . A A . 18 PRO HD2 1 1 14 4152 1 1 18 PRO HD3 H 6.289 0.433 -3.328 1.00 . A A . 18 PRO HD3 1 1 14 4153 1 1 18 PRO HG2 H 8.383 0.100 -5.037 1.00 . A A . 18 PRO HG2 1 1 14 4154 1 1 18 PRO HG3 H 6.705 0.276 -5.580 1.00 . A A . 18 PRO HG3 1 1 14 4155 1 1 18 PRO N N 6.146 -1.669 -3.539 1.00 . A A . 18 PRO N 1 1 14 4156 1 1 18 PRO O O 7.623 -4.236 -4.062 1.00 . A A . 18 PRO O 1 1 14 4157 1 1 19 PRO C C 6.945 -6.774 -5.705 1.00 . A A . 19 PRO C 1 1 14 4158 1 1 19 PRO CA C 5.832 -6.235 -4.815 1.00 . A A . 19 PRO CA 1 1 14 4159 1 1 19 PRO CB C 4.481 -6.826 -5.230 1.00 . A A . 19 PRO CB 1 1 14 4160 1 1 19 PRO CD C 4.345 -4.471 -5.605 1.00 . A A . 19 PRO CD 1 1 14 4161 1 1 19 PRO CG C 3.877 -5.801 -6.125 1.00 . A A . 19 PRO CG 1 1 14 4162 1 1 19 PRO HA H 6.040 -6.493 -3.787 1.00 . A A . 19 PRO HA 1 1 14 4163 1 1 19 PRO HB2 H 4.639 -7.761 -5.747 1.00 . A A . 19 PRO HB2 1 1 14 4164 1 1 19 PRO HB3 H 3.873 -6.991 -4.353 1.00 . A A . 19 PRO HB3 1 1 14 4165 1 1 19 PRO HD2 H 4.472 -3.772 -6.418 1.00 . A A . 19 PRO HD2 1 1 14 4166 1 1 19 PRO HD3 H 3.647 -4.084 -4.877 1.00 . A A . 19 PRO HD3 1 1 14 4167 1 1 19 PRO HG2 H 4.221 -5.950 -7.138 1.00 . A A . 19 PRO HG2 1 1 14 4168 1 1 19 PRO HG3 H 2.800 -5.863 -6.080 1.00 . A A . 19 PRO HG3 1 1 14 4169 1 1 19 PRO N N 5.640 -4.789 -4.976 1.00 . A A . 19 PRO N 1 1 14 4170 1 1 19 PRO O O 7.659 -6.010 -6.355 1.00 . A A . 19 PRO O 1 1 14 4171 1 1 20 ALA C C 7.546 -9.222 -7.867 1.00 . A A . 20 ALA C 1 1 14 4172 1 1 20 ALA CA C 8.117 -8.737 -6.539 1.00 . A A . 20 ALA CA 1 1 14 4173 1 1 20 ALA CB C 8.741 -9.896 -5.777 1.00 . A A . 20 ALA CB 1 1 14 4174 1 1 20 ALA H H 6.490 -8.651 -5.189 1.00 . A A . 20 ALA H 1 1 14 4175 1 1 20 ALA HA H 8.890 -8.008 -6.736 1.00 . A A . 20 ALA HA 1 1 14 4176 1 1 20 ALA HB1 H 9.386 -9.511 -5.001 1.00 . A A . 20 ALA HB1 1 1 14 4177 1 1 20 ALA HB2 H 9.320 -10.504 -6.456 1.00 . A A . 20 ALA HB2 1 1 14 4178 1 1 20 ALA HB3 H 7.962 -10.496 -5.332 1.00 . A A . 20 ALA HB3 1 1 14 4179 1 1 20 ALA N N 7.089 -8.095 -5.729 1.00 . A A . 20 ALA N 1 1 14 4180 1 1 20 ALA O O 6.700 -10.115 -7.902 1.00 . A A . 20 ALA O 1 1 14 4181 1 1 21 GLY C C 8.551 -8.720 -11.366 1.00 . A A . 21 GLY C 1 1 14 4182 1 1 21 GLY CA C 7.538 -9.010 -10.275 1.00 . A A . 21 GLY CA 1 1 14 4183 1 1 21 GLY H H 8.687 -7.919 -8.870 1.00 . A A . 21 GLY H 1 1 14 4184 1 1 21 GLY HA2 H 7.321 -10.068 -10.272 1.00 . A A . 21 GLY HA2 1 1 14 4185 1 1 21 GLY HA3 H 6.629 -8.467 -10.490 1.00 . A A . 21 GLY HA3 1 1 14 4186 1 1 21 GLY N N 8.014 -8.626 -8.959 1.00 . A A . 21 GLY N 1 1 15 4187 1 1 1 ASP C C -6.735 -0.063 -2.941 1.00 . A A . 1 ASP C 1 1 15 4188 1 1 1 ASP CA C -6.108 0.654 -4.132 1.00 . A A . 1 ASP CA 1 1 15 4189 1 1 1 ASP CB C -5.646 -0.368 -5.172 1.00 . A A . 1 ASP CB 1 1 15 4190 1 1 1 ASP CG C -6.792 -0.897 -6.012 1.00 . A A . 1 ASP CG 1 1 15 4191 1 1 1 ASP H1 H -4.607 1.346 -2.816 1.00 . A A . 1 ASP H1 1 1 15 4192 1 1 1 ASP HA H -6.850 1.300 -4.580 1.00 . A A . 1 ASP HA 1 1 15 4193 1 1 1 ASP HB2 H -4.927 0.098 -5.830 1.00 . A A . 1 ASP HB2 1 1 15 4194 1 1 1 ASP HB3 H -5.179 -1.200 -4.666 1.00 . A A . 1 ASP HB3 1 1 15 4195 1 1 1 ASP N N -4.989 1.486 -3.707 1.00 . A A . 1 ASP N 1 1 15 4196 1 1 1 ASP O O -7.948 -0.006 -2.738 1.00 . A A . 1 ASP O 1 1 15 4197 1 1 1 ASP OD1 O -7.524 -0.076 -6.604 1.00 . A A . 1 ASP OD1 1 1 15 4198 1 1 1 ASP OD2 O -6.957 -2.133 -6.079 1.00 . A A . 1 ASP OD2 1 1 15 4199 1 1 2 GLY C C -5.349 -2.367 -0.383 1.00 . A A . 2 GLY C 1 1 15 4200 1 1 2 GLY CA C -6.394 -1.453 -0.994 1.00 . A A . 2 GLY CA 1 1 15 4201 1 1 2 GLY H H -4.943 -0.746 -2.365 1.00 . A A . 2 GLY H 1 1 15 4202 1 1 2 GLY HA2 H -6.707 -0.736 -0.249 1.00 . A A . 2 GLY HA2 1 1 15 4203 1 1 2 GLY HA3 H -7.247 -2.046 -1.287 1.00 . A A . 2 GLY HA3 1 1 15 4204 1 1 2 GLY N N -5.900 -0.737 -2.155 1.00 . A A . 2 GLY N 1 1 15 4205 1 1 2 GLY O O -5.095 -2.313 0.820 1.00 . A A . 2 GLY O 1 1 15 4206 1 1 3 MET C C -2.405 -3.422 -0.481 1.00 . A A . 3 MET C 1 1 15 4207 1 1 3 MET CA C -3.723 -4.143 -0.747 1.00 . A A . 3 MET CA 1 1 15 4208 1 1 3 MET CB C -3.510 -5.254 -1.776 1.00 . A A . 3 MET CB 1 1 15 4209 1 1 3 MET CE C -4.062 -7.550 0.819 1.00 . A A . 3 MET CE 1 1 15 4210 1 1 3 MET CG C -2.646 -6.396 -1.266 1.00 . A A . 3 MET CG 1 1 15 4211 1 1 3 MET H H -4.991 -3.208 -2.162 1.00 . A A . 3 MET H 1 1 15 4212 1 1 3 MET HA H -4.072 -4.581 0.176 1.00 . A A . 3 MET HA 1 1 15 4213 1 1 3 MET HB2 H -4.472 -5.656 -2.059 1.00 . A A . 3 MET HB2 1 1 15 4214 1 1 3 MET HB3 H -3.034 -4.833 -2.649 1.00 . A A . 3 MET HB3 1 1 15 4215 1 1 3 MET HE1 H -5.003 -7.020 0.842 1.00 . A A . 3 MET HE1 1 1 15 4216 1 1 3 MET HE2 H -3.298 -6.948 1.290 1.00 . A A . 3 MET HE2 1 1 15 4217 1 1 3 MET HE3 H -4.162 -8.485 1.351 1.00 . A A . 3 MET HE3 1 1 15 4218 1 1 3 MET HG2 H -1.917 -6.644 -2.023 1.00 . A A . 3 MET HG2 1 1 15 4219 1 1 3 MET HG3 H -2.135 -6.071 -0.371 1.00 . A A . 3 MET HG3 1 1 15 4220 1 1 3 MET N N -4.744 -3.211 -1.213 1.00 . A A . 3 MET N 1 1 15 4221 1 1 3 MET O O -2.031 -2.503 -1.209 1.00 . A A . 3 MET O 1 1 15 4222 1 1 3 MET SD S -3.602 -7.876 -0.881 1.00 . A A . 3 MET SD 1 1 15 4223 1 1 4 GLY C C -0.410 -2.699 2.328 1.00 . A A . 4 GLY C 1 1 15 4224 1 1 4 GLY CA C -0.435 -3.231 0.910 1.00 . A A . 4 GLY CA 1 1 15 4225 1 1 4 GLY H H -2.052 -4.584 1.111 1.00 . A A . 4 GLY H 1 1 15 4226 1 1 4 GLY HA2 H 0.349 -3.963 0.800 1.00 . A A . 4 GLY HA2 1 1 15 4227 1 1 4 GLY HA3 H -0.250 -2.415 0.229 1.00 . A A . 4 GLY HA3 1 1 15 4228 1 1 4 GLY N N -1.704 -3.847 0.567 1.00 . A A . 4 GLY N 1 1 15 4229 1 1 4 GLY O O -1.383 -2.841 3.068 1.00 . A A . 4 GLY O 1 1 15 4230 1 1 5 GLU C C 2.054 -0.597 4.143 1.00 . A A . 5 GLU C 1 1 15 4231 1 1 5 GLU CA C 0.846 -1.527 4.050 1.00 . A A . 5 GLU CA 1 1 15 4232 1 1 5 GLU CB C 0.968 -2.652 5.079 1.00 . A A . 5 GLU CB 1 1 15 4233 1 1 5 GLU CD C 2.861 -3.926 6.162 1.00 . A A . 5 GLU CD 1 1 15 4234 1 1 5 GLU CG C 2.177 -3.547 4.863 1.00 . A A . 5 GLU CG 1 1 15 4235 1 1 5 GLU H H 1.448 -1.998 2.075 1.00 . A A . 5 GLU H 1 1 15 4236 1 1 5 GLU HA H -0.045 -0.956 4.261 1.00 . A A . 5 GLU HA 1 1 15 4237 1 1 5 GLU HB2 H 1.041 -2.216 6.065 1.00 . A A . 5 GLU HB2 1 1 15 4238 1 1 5 GLU HB3 H 0.080 -3.265 5.031 1.00 . A A . 5 GLU HB3 1 1 15 4239 1 1 5 GLU HG2 H 1.856 -4.451 4.367 1.00 . A A . 5 GLU HG2 1 1 15 4240 1 1 5 GLU HG3 H 2.887 -3.026 4.238 1.00 . A A . 5 GLU HG3 1 1 15 4241 1 1 5 GLU N N 0.706 -2.082 2.709 1.00 . A A . 5 GLU N 1 1 15 4242 1 1 5 GLU O O 2.817 -0.648 5.107 1.00 . A A . 5 GLU O 1 1 15 4243 1 1 5 GLU OE1 O 2.807 -5.116 6.537 1.00 . A A . 5 GLU OE1 1 1 15 4244 1 1 5 GLU OE2 O 3.451 -3.032 6.805 1.00 . A A . 5 GLU OE2 1 1 15 4245 1 1 6 GLU C C 2.827 2.633 3.323 1.00 . A A . 6 GLU C 1 1 15 4246 1 1 6 GLU CA C 3.325 1.205 3.105 1.00 . A A . 6 GLU CA 1 1 15 4247 1 1 6 GLU CB C 4.075 1.108 1.775 1.00 . A A . 6 GLU CB 1 1 15 4248 1 1 6 GLU CD C 6.364 1.078 2.854 1.00 . A A . 6 GLU CD 1 1 15 4249 1 1 6 GLU CG C 5.466 1.724 1.816 1.00 . A A . 6 GLU CG 1 1 15 4250 1 1 6 GLU H H 1.572 0.250 2.398 1.00 . A A . 6 GLU H 1 1 15 4251 1 1 6 GLU HA H 4.000 0.948 3.908 1.00 . A A . 6 GLU HA 1 1 15 4252 1 1 6 GLU HB2 H 4.173 0.068 1.505 1.00 . A A . 6 GLU HB2 1 1 15 4253 1 1 6 GLU HB3 H 3.502 1.616 1.014 1.00 . A A . 6 GLU HB3 1 1 15 4254 1 1 6 GLU HG2 H 5.925 1.609 0.845 1.00 . A A . 6 GLU HG2 1 1 15 4255 1 1 6 GLU HG3 H 5.373 2.775 2.046 1.00 . A A . 6 GLU HG3 1 1 15 4256 1 1 6 GLU N N 2.216 0.257 3.136 1.00 . A A . 6 GLU N 1 1 15 4257 1 1 6 GLU O O 3.218 3.294 4.285 1.00 . A A . 6 GLU O 1 1 15 4258 1 1 6 GLU OE1 O 5.977 0.025 3.404 1.00 . A A . 6 GLU OE1 1 1 15 4259 1 1 6 GLU OE2 O 7.456 1.625 3.117 1.00 . A A . 6 GLU OE2 1 1 15 4260 1 1 7 PHE C C 0.142 4.608 1.710 1.00 . A A . 7 PHE C 1 1 15 4261 1 1 7 PHE CA C 1.417 4.456 2.533 1.00 . A A . 7 PHE CA 1 1 15 4262 1 1 7 PHE CB C 2.454 5.487 2.081 1.00 . A A . 7 PHE CB 1 1 15 4263 1 1 7 PHE CD1 C 2.452 6.294 -0.295 1.00 . A A . 7 PHE CD1 1 1 15 4264 1 1 7 PHE CD2 C 3.619 4.278 0.216 1.00 . A A . 7 PHE CD2 1 1 15 4265 1 1 7 PHE CE1 C 2.816 6.172 -1.623 1.00 . A A . 7 PHE CE1 1 1 15 4266 1 1 7 PHE CE2 C 3.985 4.150 -1.111 1.00 . A A . 7 PHE CE2 1 1 15 4267 1 1 7 PHE CG C 2.849 5.350 0.638 1.00 . A A . 7 PHE CG 1 1 15 4268 1 1 7 PHE CZ C 3.583 5.098 -2.031 1.00 . A A . 7 PHE CZ 1 1 15 4269 1 1 7 PHE H H 1.684 2.533 1.681 1.00 . A A . 7 PHE H 1 1 15 4270 1 1 7 PHE HA H 1.176 4.631 3.571 1.00 . A A . 7 PHE HA 1 1 15 4271 1 1 7 PHE HB2 H 2.050 6.478 2.222 1.00 . A A . 7 PHE HB2 1 1 15 4272 1 1 7 PHE HB3 H 3.345 5.378 2.683 1.00 . A A . 7 PHE HB3 1 1 15 4273 1 1 7 PHE HD1 H 1.852 7.134 0.023 1.00 . A A . 7 PHE HD1 1 1 15 4274 1 1 7 PHE HD2 H 3.933 3.536 0.934 1.00 . A A . 7 PHE HD2 1 1 15 4275 1 1 7 PHE HE1 H 2.500 6.914 -2.341 1.00 . A A . 7 PHE HE1 1 1 15 4276 1 1 7 PHE HE2 H 4.585 3.309 -1.427 1.00 . A A . 7 PHE HE2 1 1 15 4277 1 1 7 PHE HZ H 3.868 5.000 -3.069 1.00 . A A . 7 PHE HZ 1 1 15 4278 1 1 7 PHE N N 1.962 3.104 2.427 1.00 . A A . 7 PHE N 1 1 15 4279 1 1 7 PHE O O -0.035 3.944 0.689 1.00 . A A . 7 PHE O 1 1 15 4280 1 1 8 ILE C C -1.918 5.670 -0.008 1.00 . A A . 8 ILE C 1 1 15 4281 1 1 8 ILE CA C -2.025 5.750 1.514 1.00 . A A . 8 ILE CA 1 1 15 4282 1 1 8 ILE CB C -2.579 7.139 1.896 1.00 . A A . 8 ILE CB 1 1 15 4283 1 1 8 ILE CD1 C -1.361 8.154 3.887 1.00 . A A . 8 ILE CD1 1 1 15 4284 1 1 8 ILE CG1 C -2.540 7.332 3.414 1.00 . A A . 8 ILE CG1 1 1 15 4285 1 1 8 ILE CG2 C -3.997 7.308 1.370 1.00 . A A . 8 ILE CG2 1 1 15 4286 1 1 8 ILE H H -0.533 5.975 3.000 1.00 . A A . 8 ILE H 1 1 15 4287 1 1 8 ILE HA H -2.730 5.005 1.852 1.00 . A A . 8 ILE HA 1 1 15 4288 1 1 8 ILE HB H -1.957 7.888 1.429 1.00 . A A . 8 ILE HB 1 1 15 4289 1 1 8 ILE HD11 H -0.711 7.538 4.491 1.00 . A A . 8 ILE HD11 1 1 15 4290 1 1 8 ILE HD12 H -1.715 8.988 4.475 1.00 . A A . 8 ILE HD12 1 1 15 4291 1 1 8 ILE HD13 H -0.813 8.524 3.032 1.00 . A A . 8 ILE HD13 1 1 15 4292 1 1 8 ILE HG12 H -3.441 7.835 3.731 1.00 . A A . 8 ILE HG12 1 1 15 4293 1 1 8 ILE HG13 H -2.485 6.365 3.892 1.00 . A A . 8 ILE HG13 1 1 15 4294 1 1 8 ILE HG21 H -4.095 8.277 0.903 1.00 . A A . 8 ILE HG21 1 1 15 4295 1 1 8 ILE HG22 H -4.697 7.231 2.189 1.00 . A A . 8 ILE HG22 1 1 15 4296 1 1 8 ILE HG23 H -4.208 6.537 0.645 1.00 . A A . 8 ILE HG23 1 1 15 4297 1 1 8 ILE N N -0.745 5.489 2.177 1.00 . A A . 8 ILE N 1 1 15 4298 1 1 8 ILE O O -0.944 6.138 -0.600 1.00 . A A . 8 ILE O 1 1 15 4299 1 1 9 GLU C C -3.833 6.022 -2.713 1.00 . A A . 9 GLU C 1 1 15 4300 1 1 9 GLU CA C -2.966 4.935 -2.084 1.00 . A A . 9 GLU CA 1 1 15 4301 1 1 9 GLU CB C -3.504 3.554 -2.466 1.00 . A A . 9 GLU CB 1 1 15 4302 1 1 9 GLU CD C -4.459 2.409 -4.504 1.00 . A A . 9 GLU CD 1 1 15 4303 1 1 9 GLU CG C -3.300 3.200 -3.931 1.00 . A A . 9 GLU CG 1 1 15 4304 1 1 9 GLU H H -3.679 4.729 -0.102 1.00 . A A . 9 GLU H 1 1 15 4305 1 1 9 GLU HA H -1.956 5.035 -2.453 1.00 . A A . 9 GLU HA 1 1 15 4306 1 1 9 GLU HB2 H -3.005 2.808 -1.866 1.00 . A A . 9 GLU HB2 1 1 15 4307 1 1 9 GLU HB3 H -4.562 3.523 -2.256 1.00 . A A . 9 GLU HB3 1 1 15 4308 1 1 9 GLU HG2 H -3.191 4.112 -4.498 1.00 . A A . 9 GLU HG2 1 1 15 4309 1 1 9 GLU HG3 H -2.399 2.611 -4.024 1.00 . A A . 9 GLU HG3 1 1 15 4310 1 1 9 GLU N N -2.931 5.076 -0.632 1.00 . A A . 9 GLU N 1 1 15 4311 1 1 9 GLU O O -4.364 5.850 -3.810 1.00 . A A . 9 GLU O 1 1 15 4312 1 1 9 GLU OE1 O -4.870 2.625 -5.644 1.00 . A A . 9 GLU OE1 1 1 15 4313 1 1 10 GLY C C -6.150 8.307 -1.873 1.00 . A A . 10 GLY C 1 1 15 4314 1 1 10 GLY CA C -4.779 8.238 -2.520 1.00 . A A . 10 GLY CA 1 1 15 4315 1 1 10 GLY H H -3.530 7.228 -1.142 1.00 . A A . 10 GLY H 1 1 15 4316 1 1 10 GLY HA2 H -4.260 9.167 -2.335 1.00 . A A . 10 GLY HA2 1 1 15 4317 1 1 10 GLY HA3 H -4.903 8.113 -3.586 1.00 . A A . 10 GLY HA3 1 1 15 4318 1 1 10 GLY N N -3.975 7.143 -2.011 1.00 . A A . 10 GLY N 1 1 15 4319 1 1 10 GLY O O -6.745 9.380 -1.780 1.00 . A A . 10 GLY O 1 1 15 4320 1 1 11 LEU C C -7.837 7.144 0.732 1.00 . A A . 11 LEU C 1 1 15 4321 1 1 11 LEU CA C -7.966 7.103 -0.789 1.00 . A A . 11 LEU CA 1 1 15 4322 1 1 11 LEU CB C -8.727 5.842 -1.221 1.00 . A A . 11 LEU CB 1 1 15 4323 1 1 11 LEU CD1 C -9.051 3.951 -2.837 1.00 . A A . 11 LEU CD1 1 1 15 4324 1 1 11 LEU CD2 C -8.414 6.218 -3.679 1.00 . A A . 11 LEU CD2 1 1 15 4325 1 1 11 LEU CG C -8.266 5.219 -2.541 1.00 . A A . 11 LEU CG 1 1 15 4326 1 1 11 LEU H H -6.135 6.336 -1.529 1.00 . A A . 11 LEU H 1 1 15 4327 1 1 11 LEU HA H -8.522 7.971 -1.109 1.00 . A A . 11 LEU HA 1 1 15 4328 1 1 11 LEU HB2 H -8.626 5.100 -0.443 1.00 . A A . 11 LEU HB2 1 1 15 4329 1 1 11 LEU HB3 H -9.772 6.096 -1.317 1.00 . A A . 11 LEU HB3 1 1 15 4330 1 1 11 LEU HD11 H -8.592 3.116 -2.329 1.00 . A A . 11 LEU HD11 1 1 15 4331 1 1 11 LEU HD12 H -9.052 3.768 -3.902 1.00 . A A . 11 LEU HD12 1 1 15 4332 1 1 11 LEU HD13 H -10.068 4.067 -2.492 1.00 . A A . 11 LEU HD13 1 1 15 4333 1 1 11 LEU HD21 H -8.558 5.686 -4.608 1.00 . A A . 11 LEU HD21 1 1 15 4334 1 1 11 LEU HD22 H -7.522 6.823 -3.744 1.00 . A A . 11 LEU HD22 1 1 15 4335 1 1 11 LEU HD23 H -9.268 6.853 -3.491 1.00 . A A . 11 LEU HD23 1 1 15 4336 1 1 11 LEU HG H -7.222 4.954 -2.462 1.00 . A A . 11 LEU HG 1 1 15 4337 1 1 11 LEU N N -6.654 7.160 -1.427 1.00 . A A . 11 LEU N 1 1 15 4338 1 1 11 LEU O O -8.134 8.161 1.359 1.00 . A A . 11 LEU O 1 1 15 4339 1 1 12 VAL C C -6.806 4.536 3.182 1.00 . A A . 12 VAL C 1 1 15 4340 1 1 12 VAL CA C -7.224 5.945 2.767 1.00 . A A . 12 VAL CA 1 1 15 4341 1 1 12 VAL CB C -8.522 6.327 3.512 1.00 . A A . 12 VAL CB 1 1 15 4342 1 1 12 VAL CG1 C -9.670 5.425 3.086 1.00 . A A . 12 VAL CG1 1 1 15 4343 1 1 12 VAL CG2 C -8.315 6.264 5.019 1.00 . A A . 12 VAL CG2 1 1 15 4344 1 1 12 VAL H H -7.170 5.258 0.766 1.00 . A A . 12 VAL H 1 1 15 4345 1 1 12 VAL HA H -6.449 6.640 3.056 1.00 . A A . 12 VAL HA 1 1 15 4346 1 1 12 VAL HB H -8.778 7.343 3.250 1.00 . A A . 12 VAL HB 1 1 15 4347 1 1 12 VAL HG11 H -10.600 5.968 3.157 1.00 . A A . 12 VAL HG11 1 1 15 4348 1 1 12 VAL HG12 H -9.708 4.560 3.733 1.00 . A A . 12 VAL HG12 1 1 15 4349 1 1 12 VAL HG13 H -9.517 5.105 2.066 1.00 . A A . 12 VAL HG13 1 1 15 4350 1 1 12 VAL HG21 H -7.309 6.577 5.257 1.00 . A A . 12 VAL HG21 1 1 15 4351 1 1 12 VAL HG22 H -8.468 5.252 5.361 1.00 . A A . 12 VAL HG22 1 1 15 4352 1 1 12 VAL HG23 H -9.021 6.920 5.507 1.00 . A A . 12 VAL HG23 1 1 15 4353 1 1 12 VAL N N -7.392 6.035 1.319 1.00 . A A . 12 VAL N 1 1 15 4354 1 1 12 VAL O O -7.576 3.810 3.812 1.00 . A A . 12 VAL O 1 1 15 4355 1 1 13 ARG C C -3.622 2.668 2.745 1.00 . A A . 13 ARG C 1 1 15 4356 1 1 13 ARG CA C -5.075 2.830 3.169 1.00 . A A . 13 ARG CA 1 1 15 4357 1 1 13 ARG CB C -5.936 1.747 2.514 1.00 . A A . 13 ARG CB 1 1 15 4358 1 1 13 ARG CD C -5.601 -0.040 4.251 1.00 . A A . 13 ARG CD 1 1 15 4359 1 1 13 ARG CG C -5.451 0.331 2.785 1.00 . A A . 13 ARG CG 1 1 15 4360 1 1 13 ARG CZ C -5.147 -2.461 4.316 1.00 . A A . 13 ARG CZ 1 1 15 4361 1 1 13 ARG H H -5.012 4.772 2.326 1.00 . A A . 13 ARG H 1 1 15 4362 1 1 13 ARG HA H -5.131 2.720 4.238 1.00 . A A . 13 ARG HA 1 1 15 4363 1 1 13 ARG HB2 H -6.947 1.834 2.885 1.00 . A A . 13 ARG HB2 1 1 15 4364 1 1 13 ARG HB3 H -5.940 1.904 1.445 1.00 . A A . 13 ARG HB3 1 1 15 4365 1 1 13 ARG HD2 H -4.657 0.123 4.749 1.00 . A A . 13 ARG HD2 1 1 15 4366 1 1 13 ARG HD3 H -6.356 0.592 4.694 1.00 . A A . 13 ARG HD3 1 1 15 4367 1 1 13 ARG HE H -6.932 -1.623 4.623 1.00 . A A . 13 ARG HE 1 1 15 4368 1 1 13 ARG HG2 H -6.032 -0.358 2.189 1.00 . A A . 13 ARG HG2 1 1 15 4369 1 1 13 ARG HG3 H -4.410 0.258 2.508 1.00 . A A . 13 ARG HG3 1 1 15 4370 1 1 13 ARG HH11 H -3.527 -1.314 3.931 1.00 . A A . 13 ARG HH11 1 1 15 4371 1 1 13 ARG HH12 H -3.236 -3.021 3.972 1.00 . A A . 13 ARG HH12 1 1 15 4372 1 1 13 ARG HH21 H -6.551 -3.869 4.680 1.00 . A A . 13 ARG HH21 1 1 15 4373 1 1 13 ARG HH22 H -4.951 -4.470 4.396 1.00 . A A . 13 ARG HH22 1 1 15 4374 1 1 13 ARG N N -5.583 4.153 2.828 1.00 . A A . 13 ARG N 1 1 15 4375 1 1 13 ARG NE N -5.991 -1.438 4.422 1.00 . A A . 13 ARG NE 1 1 15 4376 1 1 13 ARG NH1 N -3.865 -2.247 4.051 1.00 . A A . 13 ARG NH1 1 1 15 4377 1 1 13 ARG NH2 N -5.586 -3.702 4.478 1.00 . A A . 13 ARG NH2 1 1 15 4378 1 1 13 ARG O O -3.282 2.852 1.577 1.00 . A A . 13 ARG O 1 1 15 4379 1 1 14 ASP C C -1.142 1.151 2.285 1.00 . A A . 14 ASP C 1 1 15 4380 1 1 14 ASP CA C -1.352 2.118 3.447 1.00 . A A . 14 ASP CA 1 1 15 4381 1 1 14 ASP CB C -0.641 1.597 4.702 1.00 . A A . 14 ASP CB 1 1 15 4382 1 1 14 ASP CG C -1.478 0.597 5.479 1.00 . A A . 14 ASP CG 1 1 15 4383 1 1 14 ASP H H -3.110 2.186 4.616 1.00 . A A . 14 ASP H 1 1 15 4384 1 1 14 ASP HA H -0.932 3.074 3.181 1.00 . A A . 14 ASP HA 1 1 15 4385 1 1 14 ASP HB2 H 0.280 1.116 4.411 1.00 . A A . 14 ASP HB2 1 1 15 4386 1 1 14 ASP HB3 H -0.415 2.431 5.350 1.00 . A A . 14 ASP HB3 1 1 15 4387 1 1 14 ASP N N -2.772 2.316 3.707 1.00 . A A . 14 ASP N 1 1 15 4388 1 1 14 ASP O O -1.012 -0.056 2.481 1.00 . A A . 14 ASP O 1 1 15 4389 1 1 14 ASP OD1 O -2.279 -0.124 4.848 1.00 . A A . 14 ASP OD1 1 1 15 4390 1 1 14 ASP OD2 O -1.332 0.537 6.718 1.00 . A A . 14 ASP OD2 1 1 15 4391 1 1 15 SER C C 0.262 -0.023 -0.035 1.00 . A A . 15 SER C 1 1 15 4392 1 1 15 SER CA C -0.939 0.914 -0.143 1.00 . A A . 15 SER CA 1 1 15 4393 1 1 15 SER CB C -0.764 1.841 -1.346 1.00 . A A . 15 SER CB 1 1 15 4394 1 1 15 SER H H -1.244 2.668 1.000 1.00 . A A . 15 SER H 1 1 15 4395 1 1 15 SER HA H -1.828 0.320 -0.288 1.00 . A A . 15 SER HA 1 1 15 4396 1 1 15 SER HB2 H -1.174 2.812 -1.112 1.00 . A A . 15 SER HB2 1 1 15 4397 1 1 15 SER HB3 H 0.288 1.940 -1.572 1.00 . A A . 15 SER HB3 1 1 15 4398 1 1 15 SER HG H -0.910 1.514 -3.272 1.00 . A A . 15 SER HG 1 1 15 4399 1 1 15 SER N N -1.122 1.700 1.076 1.00 . A A . 15 SER N 1 1 15 4400 1 1 15 SER O O 0.899 -0.116 1.011 1.00 . A A . 15 SER O 1 1 15 4401 1 1 15 SER OG O -1.430 1.328 -2.486 1.00 . A A . 15 SER OG 1 1 15 4402 1 1 16 LEU C C 2.916 -1.051 -1.786 1.00 . A A . 16 LEU C 1 1 15 4403 1 1 16 LEU CA C 1.677 -1.663 -1.140 1.00 . A A . 16 LEU CA 1 1 15 4404 1 1 16 LEU CB C 1.281 -2.943 -1.878 1.00 . A A . 16 LEU CB 1 1 15 4405 1 1 16 LEU CD1 C 0.676 -5.292 -1.235 1.00 . A A . 16 LEU CD1 1 1 15 4406 1 1 16 LEU CD2 C 3.017 -4.758 -1.940 1.00 . A A . 16 LEU CD2 1 1 15 4407 1 1 16 LEU CG C 1.774 -4.239 -1.228 1.00 . A A . 16 LEU CG 1 1 15 4408 1 1 16 LEU H H 0.013 -0.616 -1.929 1.00 . A A . 16 LEU H 1 1 15 4409 1 1 16 LEU HA H 1.910 -1.912 -0.116 1.00 . A A . 16 LEU HA 1 1 15 4410 1 1 16 LEU HB2 H 0.202 -2.980 -1.937 1.00 . A A . 16 LEU HB2 1 1 15 4411 1 1 16 LEU HB3 H 1.678 -2.895 -2.881 1.00 . A A . 16 LEU HB3 1 1 15 4412 1 1 16 LEU HD11 H 0.759 -5.893 -2.128 1.00 . A A . 16 LEU HD11 1 1 15 4413 1 1 16 LEU HD12 H -0.289 -4.806 -1.216 1.00 . A A . 16 LEU HD12 1 1 15 4414 1 1 16 LEU HD13 H 0.778 -5.924 -0.365 1.00 . A A . 16 LEU HD13 1 1 15 4415 1 1 16 LEU HD21 H 3.883 -4.598 -1.314 1.00 . A A . 16 LEU HD21 1 1 15 4416 1 1 16 LEU HD22 H 3.145 -4.231 -2.874 1.00 . A A . 16 LEU HD22 1 1 15 4417 1 1 16 LEU HD23 H 2.906 -5.815 -2.135 1.00 . A A . 16 LEU HD23 1 1 15 4418 1 1 16 LEU HG H 2.037 -4.035 -0.199 1.00 . A A . 16 LEU HG 1 1 15 4419 1 1 16 LEU N N 0.560 -0.725 -1.123 1.00 . A A . 16 LEU N 1 1 15 4420 1 1 16 LEU O O 2.863 0.035 -2.363 1.00 . A A . 16 LEU O 1 1 15 4421 1 1 17 TYR C C 5.658 -2.149 -3.478 1.00 . A A . 17 TYR C 1 1 15 4422 1 1 17 TYR CA C 5.298 -1.319 -2.247 1.00 . A A . 17 TYR CA 1 1 15 4423 1 1 17 TYR CB C 6.419 -1.420 -1.202 1.00 . A A . 17 TYR CB 1 1 15 4424 1 1 17 TYR CD1 C 6.198 -3.802 -0.390 1.00 . A A . 17 TYR CD1 1 1 15 4425 1 1 17 TYR CD2 C 5.875 -2.043 1.186 1.00 . A A . 17 TYR CD2 1 1 15 4426 1 1 17 TYR CE1 C 5.959 -4.737 0.599 1.00 . A A . 17 TYR CE1 1 1 15 4427 1 1 17 TYR CE2 C 5.635 -2.972 2.181 1.00 . A A . 17 TYR CE2 1 1 15 4428 1 1 17 TYR CG C 6.160 -2.441 -0.114 1.00 . A A . 17 TYR CG 1 1 15 4429 1 1 17 TYR CZ C 5.678 -4.318 1.882 1.00 . A A . 17 TYR CZ 1 1 15 4430 1 1 17 TYR H H 3.999 -2.624 -1.208 1.00 . A A . 17 TYR H 1 1 15 4431 1 1 17 TYR HA H 5.183 -0.287 -2.543 1.00 . A A . 17 TYR HA 1 1 15 4432 1 1 17 TYR HB2 H 7.337 -1.698 -1.696 1.00 . A A . 17 TYR HB2 1 1 15 4433 1 1 17 TYR HB3 H 6.549 -0.457 -0.730 1.00 . A A . 17 TYR HB3 1 1 15 4434 1 1 17 TYR HD1 H 6.419 -4.128 -1.395 1.00 . A A . 17 TYR HD1 1 1 15 4435 1 1 17 TYR HD2 H 5.841 -0.988 1.417 1.00 . A A . 17 TYR HD2 1 1 15 4436 1 1 17 TYR HE1 H 5.993 -5.791 0.365 1.00 . A A . 17 TYR HE1 1 1 15 4437 1 1 17 TYR HE2 H 5.414 -2.643 3.186 1.00 . A A . 17 TYR HE2 1 1 15 4438 1 1 17 TYR HH H 6.229 -5.773 3.012 1.00 . A A . 17 TYR HH 1 1 15 4439 1 1 17 TYR N N 4.030 -1.767 -1.680 1.00 . A A . 17 TYR N 1 1 15 4440 1 1 17 TYR O O 4.999 -3.144 -3.775 1.00 . A A . 17 TYR O 1 1 15 4441 1 1 17 TYR OH O 5.439 -5.246 2.869 1.00 . A A . 17 TYR OH 1 1 15 4442 1 1 18 PRO C C 7.141 -3.982 -5.235 1.00 . A A . 18 PRO C 1 1 15 4443 1 1 18 PRO CA C 7.156 -2.464 -5.416 1.00 . A A . 18 PRO CA 1 1 15 4444 1 1 18 PRO CB C 8.583 -1.955 -5.601 1.00 . A A . 18 PRO CB 1 1 15 4445 1 1 18 PRO CD C 7.557 -0.568 -3.936 1.00 . A A . 18 PRO CD 1 1 15 4446 1 1 18 PRO CG C 8.550 -0.564 -5.070 1.00 . A A . 18 PRO CG 1 1 15 4447 1 1 18 PRO HA H 6.560 -2.198 -6.277 1.00 . A A . 18 PRO HA 1 1 15 4448 1 1 18 PRO HB2 H 9.266 -2.578 -5.042 1.00 . A A . 18 PRO HB2 1 1 15 4449 1 1 18 PRO HB3 H 8.844 -1.972 -6.648 1.00 . A A . 18 PRO HB3 1 1 15 4450 1 1 18 PRO HD2 H 8.068 -0.672 -2.992 1.00 . A A . 18 PRO HD2 1 1 15 4451 1 1 18 PRO HD3 H 6.968 0.337 -3.949 1.00 . A A . 18 PRO HD3 1 1 15 4452 1 1 18 PRO HG2 H 9.530 -0.286 -4.708 1.00 . A A . 18 PRO HG2 1 1 15 4453 1 1 18 PRO HG3 H 8.230 0.117 -5.845 1.00 . A A . 18 PRO HG3 1 1 15 4454 1 1 18 PRO N N 6.713 -1.749 -4.214 1.00 . A A . 18 PRO N 1 1 15 4455 1 1 18 PRO O O 7.036 -4.481 -4.115 1.00 . A A . 18 PRO O 1 1 15 4456 1 1 19 PRO C C 8.111 -6.769 -5.191 1.00 . A A . 19 PRO C 1 1 15 4457 1 1 19 PRO CA C 7.242 -6.204 -6.311 1.00 . A A . 19 PRO CA 1 1 15 4458 1 1 19 PRO CB C 7.806 -6.604 -7.687 1.00 . A A . 19 PRO CB 1 1 15 4459 1 1 19 PRO CD C 7.377 -4.241 -7.713 1.00 . A A . 19 PRO CD 1 1 15 4460 1 1 19 PRO CG C 8.178 -5.324 -8.372 1.00 . A A . 19 PRO CG 1 1 15 4461 1 1 19 PRO HA H 6.238 -6.590 -6.209 1.00 . A A . 19 PRO HA 1 1 15 4462 1 1 19 PRO HB2 H 8.668 -7.239 -7.551 1.00 . A A . 19 PRO HB2 1 1 15 4463 1 1 19 PRO HB3 H 7.048 -7.138 -8.242 1.00 . A A . 19 PRO HB3 1 1 15 4464 1 1 19 PRO HD2 H 7.912 -3.303 -7.737 1.00 . A A . 19 PRO HD2 1 1 15 4465 1 1 19 PRO HD3 H 6.410 -4.142 -8.183 1.00 . A A . 19 PRO HD3 1 1 15 4466 1 1 19 PRO HG2 H 9.234 -5.136 -8.247 1.00 . A A . 19 PRO HG2 1 1 15 4467 1 1 19 PRO HG3 H 7.931 -5.386 -9.422 1.00 . A A . 19 PRO HG3 1 1 15 4468 1 1 19 PRO N N 7.246 -4.740 -6.342 1.00 . A A . 19 PRO N 1 1 15 4469 1 1 19 PRO O O 9.321 -6.548 -5.156 1.00 . A A . 19 PRO O 1 1 15 4470 1 1 20 ALA C C 7.758 -9.550 -2.948 1.00 . A A . 20 ALA C 1 1 15 4471 1 1 20 ALA CA C 8.188 -8.102 -3.153 1.00 . A A . 20 ALA CA 1 1 15 4472 1 1 20 ALA CB C 7.948 -7.295 -1.887 1.00 . A A . 20 ALA CB 1 1 15 4473 1 1 20 ALA H H 6.514 -7.640 -4.362 1.00 . A A . 20 ALA H 1 1 15 4474 1 1 20 ALA HA H 9.245 -8.078 -3.373 1.00 . A A . 20 ALA HA 1 1 15 4475 1 1 20 ALA HB1 H 8.200 -6.260 -2.065 1.00 . A A . 20 ALA HB1 1 1 15 4476 1 1 20 ALA HB2 H 8.565 -7.683 -1.090 1.00 . A A . 20 ALA HB2 1 1 15 4477 1 1 20 ALA HB3 H 6.908 -7.368 -1.604 1.00 . A A . 20 ALA HB3 1 1 15 4478 1 1 20 ALA N N 7.480 -7.501 -4.277 1.00 . A A . 20 ALA N 1 1 15 4479 1 1 20 ALA O O 6.903 -9.842 -2.112 1.00 . A A . 20 ALA O 1 1 15 4480 1 1 21 GLY C C 7.454 -12.428 -4.888 1.00 . A A . 21 GLY C 1 1 15 4481 1 1 21 GLY CA C 8.023 -11.862 -3.602 1.00 . A A . 21 GLY CA 1 1 15 4482 1 1 21 GLY H H 9.031 -10.164 -4.365 1.00 . A A . 21 GLY H 1 1 15 4483 1 1 21 GLY HA2 H 8.915 -12.413 -3.344 1.00 . A A . 21 GLY HA2 1 1 15 4484 1 1 21 GLY HA3 H 7.295 -11.987 -2.814 1.00 . A A . 21 GLY HA3 1 1 15 4485 1 1 21 GLY N N 8.357 -10.455 -3.716 1.00 . A A . 21 GLY N 1 1 stop_ save_
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