NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
651698 | 7bw5 | 36343 | cing | 4-filtered-FRED | STAR | entry | full | 126 |
data_FRED_restraints_with_modified_coordinates_PDB_code_7bw5 # This FRED archive file contains, for PDB entry <7bw5>: # # - 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_7bw5 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 7bw5 _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 1651.80 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 $lasso_peptide_koreensin A . 1 1 stop_ save_ save_lasso_peptide_koreensin _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "lasso peptide koreensin" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code GPKGDFPDVGDGRILAG _Entity.Number_of_monomers 17 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 GLY . 1 1 2 PRO . 1 1 3 LYS . 1 1 4 GLY . 1 1 5 ASP . 1 1 6 PHE . 1 1 7 PRO . 1 1 8 ASP . 1 1 9 VAL . 1 1 10 GLY . 1 1 11 ASP . 1 1 12 GLY . 1 1 13 ARG . 1 1 14 ILE . 1 1 15 LEU . 1 1 16 ALA . 1 1 17 GLY . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID GLY 1 1 1 1 PRO 2 2 1 1 LYS 3 3 1 1 GLY 4 4 1 1 ASP 5 5 1 1 PHE 6 6 1 1 PRO 7 7 1 1 ASP 8 8 1 1 VAL 9 9 1 1 GLY 10 10 1 1 ASP 11 11 1 1 GLY 12 12 1 1 ARG 13 13 1 1 ILE 14 14 1 1 LEU 15 15 1 1 ALA 16 16 1 1 GLY 17 17 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 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 1 GLY QA . 1 . HA# 1 1 1 1 2 1 1 2 PRO HA . 2 . HA 1 1 2 1 1 1 1 1 GLY QA . 1 . HA# 1 1 2 1 2 1 1 2 PRO QB . 2 . HB# 1 1 3 1 1 1 1 1 GLY QA . 1 . HA# 1 1 3 1 2 1 1 3 LYS H . 3 . HN 1 1 4 1 1 1 1 1 GLY QA . 1 . HA# 1 1 4 1 2 1 1 9 VAL H . 9 . HN 1 1 5 1 1 1 1 1 GLY QA . 1 . HA# 1 1 5 1 2 1 1 11 ASP H . 11 . HN 1 1 6 1 1 1 1 1 GLY QA . 1 . HA# 1 1 6 1 2 1 1 12 GLY H . 12 . HN 1 1 7 1 1 1 1 1 GLY QA . 1 . HA# 1 1 7 1 2 1 1 13 ARG H . 13 . HN 1 1 8 1 1 1 1 1 GLY QA . 1 . HA# 1 1 8 1 2 1 1 13 ARG HA . 13 . HA 1 1 9 1 1 1 1 2 PRO HA . 2 . HA 1 1 9 1 2 1 1 2 PRO QD . 2 . HD# 1 1 10 1 1 1 1 2 PRO HA . 2 . HA 1 1 10 1 2 1 1 3 LYS H . 3 . HN 1 1 11 1 1 1 1 2 PRO HA . 2 . HA 1 1 11 1 2 1 1 3 LYS HA . 3 . HA 1 1 12 1 1 1 1 2 PRO HA . 2 . HA 1 1 12 1 2 1 1 11 ASP H . 11 . HN 1 1 13 1 1 1 1 2 PRO HA . 2 . HA 1 1 13 1 2 1 1 12 GLY H . 12 . HN 1 1 14 1 1 1 1 2 PRO QB . 2 . HB# 1 1 14 1 2 1 1 3 LYS H . 3 . HN 1 1 15 1 1 1 1 2 PRO QD . 2 . HD# 1 1 15 1 2 1 1 3 LYS H . 3 . HN 1 1 16 1 1 1 1 2 PRO QD . 2 . HD# 1 1 16 1 2 1 1 4 GLY H . 4 . HN 1 1 17 1 1 1 1 2 PRO QG . 2 . HG# 1 1 17 1 2 1 1 3 LYS H . 3 . HN 1 1 18 1 1 1 1 3 LYS H . 3 . HN 1 1 18 1 2 1 1 3 LYS QB . 3 . HB# 1 1 19 1 1 1 1 3 LYS H . 3 . HN 1 1 19 1 2 1 1 3 LYS QD . 3 . HD# 1 1 20 1 1 1 1 3 LYS H . 3 . HN 1 1 20 1 2 1 1 3 LYS QE . 3 . HE# 1 1 21 1 1 1 1 3 LYS H . 3 . HN 1 1 21 1 2 1 1 3 LYS QG . 3 . HG# 1 1 22 1 1 1 1 3 LYS H . 3 . HN 1 1 22 1 2 1 1 4 GLY H . 4 . HN 1 1 23 1 1 1 1 3 LYS HA . 3 . HA 1 1 23 1 2 1 1 4 GLY H . 4 . HN 1 1 24 1 1 1 1 3 LYS HA . 3 . HA 1 1 24 1 2 1 1 11 ASP H . 11 . HN 1 1 25 1 1 1 1 3 LYS HA . 3 . HA 1 1 25 1 2 1 1 11 ASP HA . 11 . HA 1 1 26 1 1 1 1 3 LYS HA . 3 . HA 1 1 26 1 2 1 1 11 ASP QB . 11 . HB# 1 1 27 1 1 1 1 3 LYS HA . 3 . HA 1 1 27 1 2 1 1 12 GLY H . 12 . HN 1 1 28 1 1 1 1 3 LYS QB . 3 . HB# 1 1 28 1 2 1 1 4 GLY H . 4 . HN 1 1 29 1 1 1 1 3 LYS QG . 3 . HG# 1 1 29 1 2 1 1 4 GLY H . 4 . HN 1 1 30 1 1 1 1 4 GLY H . 4 . HN 1 1 30 1 2 1 1 5 ASP H . 5 . HN 1 1 31 1 1 1 1 4 GLY H . 4 . HN 1 1 31 1 2 1 1 6 PHE H . 6 . HN 1 1 32 1 1 1 1 4 GLY H . 4 . HN 1 1 32 1 2 1 1 12 GLY H . 12 . HN 1 1 33 1 1 1 1 4 GLY H . 4 . HN 1 1 33 1 2 1 1 12 GLY QA . 12 . HA# 1 1 34 1 1 1 1 4 GLY H . 4 . HN 1 1 34 1 2 1 1 13 ARG H . 13 . HN 1 1 35 1 1 1 1 4 GLY H . 4 . HN 1 1 35 1 2 1 1 14 ILE MG . 14 . HG2# 1 1 36 1 1 1 1 4 GLY QA . 4 . HA# 1 1 36 1 2 1 1 5 ASP H . 5 . HN 1 1 37 1 1 1 1 4 GLY QA . 4 . HA# 1 1 37 1 2 1 1 5 ASP HA . 5 . HA 1 1 38 1 1 1 1 4 GLY QA . 4 . HA# 1 1 38 1 2 1 1 6 PHE H . 6 . HN 1 1 39 1 1 1 1 4 GLY QA . 4 . HA# 1 1 39 1 2 1 1 13 ARG H . 13 . HN 1 1 40 1 1 1 1 4 GLY QA . 4 . HA# 1 1 40 1 2 1 1 14 ILE QG . 14 . HG1# 1 1 41 1 1 1 1 5 ASP H . 5 . HN 1 1 41 1 2 1 1 5 ASP QB . 5 . HB# 1 1 42 1 1 1 1 5 ASP H . 5 . HN 1 1 42 1 2 1 1 6 PHE H . 6 . HN 1 1 43 1 1 1 1 5 ASP HA . 5 . HA 1 1 43 1 2 1 1 6 PHE H . 6 . HN 1 1 44 1 1 1 1 5 ASP HA . 5 . HA 1 1 44 1 2 1 1 6 PHE HA . 6 . HA 1 1 45 1 1 1 1 5 ASP QB . 5 . HB# 1 1 45 1 2 1 1 6 PHE H . 6 . HN 1 1 46 1 1 1 1 5 ASP QB . 5 . HB# 1 1 46 1 2 1 1 6 PHE QD . 6 . HD# 1 1 47 1 1 1 1 6 PHE H . 6 . HN 1 1 47 1 2 1 1 6 PHE QB . 6 . HB# 1 1 48 1 1 1 1 6 PHE H . 6 . HN 1 1 48 1 2 1 1 7 PRO QD . 7 . HD# 1 1 49 1 1 1 1 6 PHE HA . 6 . HA 1 1 49 1 2 1 1 7 PRO QD . 7 . HD# 1 1 50 1 1 1 1 6 PHE HA . 6 . HA 1 1 50 1 2 1 1 7 PRO QG . 7 . HG# 1 1 51 1 1 1 1 6 PHE QB . 6 . HB# 1 1 51 1 2 1 1 7 PRO QD . 7 . HD# 1 1 52 1 1 1 1 6 PHE QB . 6 . HB# 1 1 52 1 2 1 1 13 ARG HE . 13 . HE 1 1 53 1 1 1 1 6 PHE QB . 6 . HB# 1 1 53 1 2 1 1 13 ARG QG . 13 . HG# 1 1 54 1 1 1 1 6 PHE QD . 6 . HD# 1 1 54 1 2 1 1 7 PRO QD . 7 . HD# 1 1 55 1 1 1 1 6 PHE QD . 6 . HD# 1 1 55 1 2 1 1 13 ARG QG . 13 . HG# 1 1 56 1 1 1 1 6 PHE QD . 6 . HD# 1 1 56 1 2 1 1 14 ILE MG . 14 . HG2# 1 1 57 1 1 1 1 6 PHE QD . 6 . HD# 1 1 57 1 2 1 1 16 ALA MB . 16 . HB# 1 1 58 1 1 1 1 7 PRO HA . 7 . HA 1 1 58 1 2 1 1 8 ASP H . 8 . HN 1 1 59 1 1 1 1 7 PRO HA . 7 . HA 1 1 59 1 2 1 1 12 GLY H . 12 . HN 1 1 60 1 1 1 1 7 PRO HA . 7 . HA 1 1 60 1 2 1 1 13 ARG H . 13 . HN 1 1 61 1 1 1 1 7 PRO QB . 7 . HB# 1 1 61 1 2 1 1 8 ASP H . 8 . HN 1 1 62 1 1 1 1 7 PRO QB . 7 . HB# 1 1 62 1 2 1 1 9 VAL H . 9 . HN 1 1 63 1 1 1 1 7 PRO QD . 7 . HD# 1 1 63 1 2 1 1 8 ASP H . 8 . HN 1 1 64 1 1 1 1 8 ASP H . 8 . HN 1 1 64 1 2 1 1 8 ASP QB . 8 . HB# 1 1 65 1 1 1 1 8 ASP H . 8 . HN 1 1 65 1 2 1 1 9 VAL H . 9 . HN 1 1 66 1 1 1 1 8 ASP H . 8 . HN 1 1 66 1 2 1 1 10 GLY H . 10 . HN 1 1 67 1 1 1 1 8 ASP H . 8 . HN 1 1 67 1 2 1 1 12 GLY H . 12 . HN 1 1 68 1 1 1 1 8 ASP H . 8 . HN 1 1 68 1 2 1 1 13 ARG H . 13 . HN 1 1 69 1 1 1 1 8 ASP HA . 8 . HA 1 1 69 1 2 1 1 9 VAL H . 9 . HN 1 1 70 1 1 1 1 8 ASP HA . 8 . HA 1 1 70 1 2 1 1 9 VAL QG . 9 . HG# 1 1 71 1 1 1 1 8 ASP QB . 8 . HB# 1 1 71 1 2 1 1 9 VAL H . 9 . HN 1 1 72 1 1 1 1 8 ASP QB . 8 . HB# 1 1 72 1 2 1 1 13 ARG QB . 13 . HB# 1 1 73 1 1 1 1 8 ASP QB . 8 . HB# 1 1 73 1 2 1 1 13 ARG QD . 13 . HD# 1 1 74 1 1 1 1 8 ASP QB . 8 . HB# 1 1 74 1 2 1 1 13 ARG HE . 13 . HE 1 1 75 1 1 1 1 8 ASP QB . 8 . HB# 1 1 75 1 2 1 1 13 ARG QG . 13 . HG# 1 1 76 1 1 1 1 9 VAL H . 9 . HN 1 1 76 1 2 1 1 9 VAL HB . 9 . HB 1 1 77 1 1 1 1 9 VAL H . 9 . HN 1 1 77 1 2 1 1 9 VAL QG . 9 . HG# 1 1 78 1 1 1 1 9 VAL H . 9 . HN 1 1 78 1 2 1 1 10 GLY H . 10 . HN 1 1 79 1 1 1 1 9 VAL H . 9 . HN 1 1 79 1 2 1 1 13 ARG QB . 13 . HB# 1 1 80 1 1 1 1 9 VAL HA . 9 . HA 1 1 80 1 2 1 1 10 GLY H . 10 . HN 1 1 81 1 1 1 1 9 VAL HB . 9 . HB 1 1 81 1 2 1 1 10 GLY H . 10 . HN 1 1 82 1 1 1 1 9 VAL QG . 9 . HG# 1 1 82 1 2 1 1 10 GLY H . 10 . HN 1 1 83 1 1 1 1 10 GLY H . 10 . HN 1 1 83 1 2 1 1 11 ASP H . 11 . HN 1 1 84 1 1 1 1 10 GLY H . 10 . HN 1 1 84 1 2 1 1 12 GLY H . 12 . HN 1 1 85 1 1 1 1 10 GLY QA . 10 . HA# 1 1 85 1 2 1 1 11 ASP H . 11 . HN 1 1 86 1 1 1 1 10 GLY QA . 10 . HA# 1 1 86 1 2 1 1 11 ASP HA . 11 . HA 1 1 87 1 1 1 1 10 GLY QA . 10 . HA# 1 1 87 1 2 1 1 12 GLY H . 12 . HN 1 1 88 1 1 1 1 11 ASP H . 11 . HN 1 1 88 1 2 1 1 11 ASP QB . 11 . HB# 1 1 89 1 1 1 1 11 ASP H . 11 . HN 1 1 89 1 2 1 1 12 GLY H . 12 . HN 1 1 90 1 1 1 1 11 ASP HA . 11 . HA 1 1 90 1 2 1 1 12 GLY H . 12 . HN 1 1 91 1 1 1 1 12 GLY H . 12 . HN 1 1 91 1 2 1 1 13 ARG H . 13 . HN 1 1 92 1 1 1 1 12 GLY QA . 12 . HA# 1 1 92 1 2 1 1 13 ARG H . 13 . HN 1 1 93 1 1 1 1 13 ARG H . 13 . HN 1 1 93 1 2 1 1 13 ARG QB . 13 . HB# 1 1 94 1 1 1 1 13 ARG H . 13 . HN 1 1 94 1 2 1 1 13 ARG QD . 13 . HD# 1 1 95 1 1 1 1 13 ARG H . 13 . HN 1 1 95 1 2 1 1 13 ARG QG . 13 . HG# 1 1 96 1 1 1 1 13 ARG H . 13 . HN 1 1 96 1 2 1 1 14 ILE H . 14 . HN 1 1 97 1 1 1 1 13 ARG HA . 13 . HA 1 1 97 1 2 1 1 14 ILE H . 14 . HN 1 1 98 1 1 1 1 13 ARG QB . 13 . HB# 1 1 98 1 2 1 1 14 ILE H . 14 . HN 1 1 99 1 1 1 1 13 ARG QG . 13 . HG# 1 1 99 1 2 1 1 14 ILE H . 14 . HN 1 1 100 1 1 1 1 14 ILE H . 14 . HN 1 1 100 1 2 1 1 14 ILE MD . 14 . HD1# 1 1 101 1 1 1 1 14 ILE H . 14 . HN 1 1 101 1 2 1 1 14 ILE QG . 14 . HG1# 1 1 102 1 1 1 1 14 ILE H . 14 . HN 1 1 102 1 2 1 1 14 ILE MG . 14 . HG2# 1 1 103 1 1 1 1 14 ILE H . 14 . HN 1 1 103 1 2 1 1 15 LEU H . 15 . HN 1 1 104 1 1 1 1 14 ILE HA . 14 . HA 1 1 104 1 2 1 1 15 LEU H . 15 . HN 1 1 105 1 1 1 1 14 ILE QG . 14 . HG1# 1 1 105 1 2 1 1 15 LEU H . 15 . HN 1 1 106 1 1 1 1 14 ILE MG . 14 . HG2# 1 1 106 1 2 1 1 15 LEU H . 15 . HN 1 1 107 1 1 1 1 15 LEU H . 15 . HN 1 1 107 1 2 1 1 15 LEU QB . 15 . HB# 1 1 108 1 1 1 1 15 LEU H . 15 . HN 1 1 108 1 2 1 1 15 LEU QD . 15 . HD# 1 1 109 1 1 1 1 15 LEU H . 15 . HN 1 1 109 1 2 1 1 15 LEU HG . 15 . HG 1 1 110 1 1 1 1 15 LEU H . 15 . HN 1 1 110 1 2 1 1 16 ALA H . 16 . HN 1 1 111 1 1 1 1 15 LEU HA . 15 . HA 1 1 111 1 2 1 1 16 ALA H . 16 . HN 1 1 112 1 1 1 1 15 LEU HA . 15 . HA 1 1 112 1 2 1 1 16 ALA MB . 16 . HB# 1 1 113 1 1 1 1 15 LEU QB . 15 . HB# 1 1 113 1 2 1 1 16 ALA H . 16 . HN 1 1 114 1 1 1 1 15 LEU QD . 15 . HD# 1 1 114 1 2 1 1 16 ALA H . 16 . HN 1 1 115 1 1 1 1 16 ALA H . 16 . HN 1 1 115 1 2 1 1 16 ALA MB . 16 . HB# 1 1 116 1 1 1 1 16 ALA H . 16 . HN 1 1 116 1 2 1 1 17 GLY H . 17 . HN 1 1 117 1 1 1 1 16 ALA HA . 16 . HA 1 1 117 1 2 1 1 17 GLY H . 17 . HN 1 1 118 1 1 1 1 16 ALA MB . 16 . HB# 1 1 118 1 2 1 1 17 GLY H . 17 . HN 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 2.0 1.8 6.0 1 1 2 1 . . . . . 2.0 1.8 7.0 1 1 3 1 . . . . . 2.0 1.8 6.0 1 1 4 1 . . . . . 2.0 1.8 7.0 1 1 5 1 . . . . . 2.0 1.8 6.0 1 1 6 1 . . . . . 2.0 1.8 6.0 1 1 7 1 . . . . . 2.0 1.8 6.0 1 1 8 1 . . . . . 2.0 1.8 7.0 1 1 9 1 . . . . . 2.0 1.8 6.0 1 1 10 1 . . . . . 2.0 1.8 3.5 1 1 11 1 . . . . . 2.0 1.8 6.0 1 1 12 1 . . . . . 2.0 1.8 3.5 1 1 13 1 . . . . . 2.0 1.8 5.0 1 1 14 1 . . . . . 2.0 1.8 4.5 1 1 15 1 . . . . . 2.0 1.8 6.0 1 1 16 1 . . . . . 2.0 1.8 6.0 1 1 17 1 . . . . . 2.0 1.8 4.5 1 1 18 1 . . . . . 2.0 1.8 4.5 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 6.0 1 1 22 1 . . . . . 2.0 1.8 5.0 1 1 23 1 . . . . . 2.0 1.8 2.9 1 1 24 1 . . . . . 2.0 1.8 5.0 1 1 25 1 . . . . . 2.0 1.8 6.0 1 1 26 1 . . . . . 2.0 1.8 4.5 1 1 27 1 . . . . . 2.0 1.8 5.0 1 1 28 1 . . . . . 2.0 1.8 4.5 1 1 29 1 . . . . . 2.0 1.8 4.5 1 1 30 1 . . . . . 2.0 1.8 5.0 1 1 31 1 . . . . . 2.0 1.8 5.0 1 1 32 1 . . . . . 2.0 1.8 5.0 1 1 33 1 . . . . . 2.0 1.8 3.9 1 1 34 1 . . . . . 2.0 1.8 5.0 1 1 35 1 . . . . . 2.0 1.8 8.4 1 1 36 1 . . . . . 2.0 1.8 4.5 1 1 37 1 . . . . . 2.0 1.8 6.0 1 1 38 1 . . . . . 2.0 1.8 6.0 1 1 39 1 . . . . . 2.0 1.8 6.0 1 1 40 1 . . . . . 2.0 1.8 7.5 1 1 41 1 . . . . . 2.0 1.8 5.0 1 1 42 1 . . . . . 2.0 1.8 5.0 1 1 43 1 . . . . . 2.0 1.8 3.5 1 1 44 1 . . . . . 2.0 1.8 6.0 1 1 45 1 . . . . . 2.0 1.8 4.5 1 1 46 1 . . . . . 2.0 1.8 7.0 1 1 47 1 . . . . . 2.0 1.8 4.5 1 1 48 1 . . . . . 2.0 1.8 6.0 1 1 49 1 . . . . . 2.0 1.8 3.9 1 1 50 1 . . . . . 2.0 1.8 6.0 1 1 51 1 . . . . . 2.0 1.8 5.5 1 1 52 1 . . . . . 2.0 1.8 6.0 1 1 53 1 . . . . . 2.0 1.8 7.0 1 1 54 1 . . . . . 2.0 1.8 5.5 1 1 55 1 . . . . . 2.0 1.8 8.4 1 1 56 1 . . . . . 2.0 1.8 8.9 1 1 57 1 . . . . . 2.0 1.8 8.4 1 1 58 1 . . . . . 2.0 1.8 2.9 1 1 59 1 . . . . . 2.0 1.8 5.0 1 1 60 1 . . . . . 2.0 1.8 5.0 1 1 61 1 . . . . . 2.0 1.8 5.0 1 1 62 1 . . . . . 2.0 1.8 7.0 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 3.5 1 1 66 1 . . . . . 2.0 1.8 5.0 1 1 67 1 . . . . . 2.0 1.8 5.0 1 1 68 1 . . . . . 2.0 1.8 5.0 1 1 69 1 . . . . . 2.0 1.8 5.0 1 1 70 1 . . . . . 2.0 1.8 7.4 1 1 71 1 . . . . . 2.0 1.8 4.5 1 1 72 1 . . . . . 2.0 1.8 5.5 1 1 73 1 . . . . . 2.0 1.8 7.0 1 1 74 1 . . . . . 2.0 1.8 6.0 1 1 75 1 . . . . . 2.0 1.8 5.5 1 1 76 1 . . . . . 2.0 1.8 3.5 1 1 77 1 . . . . . 2.0 1.8 5.9 1 1 78 1 . . . . . 2.0 1.8 5.0 1 1 79 1 . . . . . 2.0 1.8 6.0 1 1 80 1 . . . . . 2.0 1.8 2.9 1 1 81 1 . . . . . 2.0 1.8 5.0 1 1 82 1 . . . . . 2.0 1.8 5.9 1 1 83 1 . . . . . 2.0 1.8 5.0 1 1 84 1 . . . . . 2.0 1.8 5.0 1 1 85 1 . . . . . 2.0 1.8 3.9 1 1 86 1 . . . . . 2.0 1.8 6.0 1 1 87 1 . . . . . 2.0 1.8 5.0 1 1 88 1 . . . . . 2.0 1.8 3.9 1 1 89 1 . . . . . 2.0 1.8 3.5 1 1 90 1 . . . . . 2.0 1.8 4.0 1 1 91 1 . . . . . 2.0 1.8 5.0 1 1 92 1 . . . . . 2.0 1.8 3.9 1 1 93 1 . . . . . 2.0 1.8 4.5 1 1 94 1 . . . . . 2.0 1.8 6.0 1 1 95 1 . . . . . 2.0 1.8 6.0 1 1 96 1 . . . . . 2.0 1.8 5.0 1 1 97 1 . . . . . 2.0 1.8 2.9 1 1 98 1 . . . . . 2.0 1.8 4.5 1 1 99 1 . . . . . 2.0 1.8 6.0 1 1 100 1 . . . . . 2.0 1.8 6.5 1 1 101 1 . . . . . 2.0 1.8 6.0 1 1 102 1 . . . . . 2.0 1.8 6.5 1 1 103 1 . . . . . 2.0 1.8 2.9 1 1 104 1 . . . . . 2.0 1.8 5.0 1 1 105 1 . . . . . 2.0 1.8 6.0 1 1 106 1 . . . . . 2.0 1.8 6.5 1 1 107 1 . . . . . 2.0 1.8 4.5 1 1 108 1 . . . . . 2.0 1.8 7.4 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 2.9 1 1 112 1 . . . . . 2.0 1.8 6.5 1 1 113 1 . . . . . 2.0 1.8 4.5 1 1 114 1 . . . . . 2.0 1.8 7.4 1 1 115 1 . . . . . 2.0 1.8 5.0 1 1 116 1 . . . . . 2.0 1.8 5.0 1 1 117 1 . . . . . 2.0 1.8 5.0 1 1 118 1 . . . . . 2.0 1.8 6.5 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 2 PRO C 1 1 3 LYS N 1 1 3 LYS CA 1 1 3 LYS C -89.99999 -30.0 . 2 . C . 3 . N . 3 . CA . 3 . C 1 1 2 . 1 1 5 ASP C 1 1 6 PHE N 1 1 6 PHE CA 1 1 6 PHE C -150.0 -89.99999 . 5 . C . 6 . N . 6 . CA . 6 . C 1 1 3 . 1 1 8 ASP C 1 1 9 VAL N 1 1 9 VAL CA 1 1 9 VAL C -160.0 -80.0 . 8 . C . 9 . N . 9 . CA . 9 . C 1 1 4 . 1 1 10 GLY C 1 1 11 ASP N 1 1 11 ASP CA 1 1 11 ASP C -150.0 -89.99999 . 10 . C . 11 . N . 11 . CA . 11 . C 1 1 5 . 1 1 12 GLY C 1 1 13 ARG N 1 1 13 ARG CA 1 1 13 ARG C -150.0 -89.99999 . 12 . C . 13 . N . 13 . CA . 13 . C 1 1 6 . 1 1 13 ARG C 1 1 14 ILE N 1 1 14 ILE CA 1 1 14 ILE C -179.99998 -20.0 . 13 . C . 14 . N . 14 . CA . 14 . C 1 1 7 . 1 1 15 LEU C 1 1 16 ALA N 1 1 16 ALA CA 1 1 16 ALA C -150.0 -89.99999 . 15 . C . 16 . N . 16 . CA . 16 . C 1 1 8 . 1 1 14 ILE C 1 1 15 LEU N 1 1 15 LEU CA 1 1 15 LEU C -150.0 -89.99999 . 14 . C . 15 . N . 15 . CA . 15 . 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 GLY C C 1.545 -2.887 0.867 1.00 . A A . 1 GLY C 1 1 1 2 1 1 1 GLY CA C 1.964 -2.166 -0.400 1.00 . A A . 1 GLY CA 1 1 1 3 1 1 1 GLY H1 H 2.106 -2.296 -2.186 1.00 . A A . 1 GLY H1 1 1 1 4 1 1 1 GLY HA2 H 3.037 -2.053 -0.398 1.00 . A A . 1 GLY HA2 1 1 1 5 1 1 1 GLY HA3 H 1.510 -1.186 -0.409 1.00 . A A . 1 GLY HA3 1 1 1 6 1 1 1 GLY N N 1.570 -2.875 -1.605 1.00 . A A . 1 GLY N 1 1 1 7 1 1 1 GLY O O 0.631 -3.712 0.842 1.00 . A A . 1 GLY O 1 1 1 8 1 1 2 PRO C C 0.745 -2.515 4.011 1.00 . A A . 2 PRO C 1 1 1 9 1 1 2 PRO CA C 1.888 -3.221 3.279 1.00 . A A . 2 PRO CA 1 1 1 10 1 1 2 PRO CB C 3.202 -3.108 4.053 1.00 . A A . 2 PRO CB 1 1 1 11 1 1 2 PRO CD C 3.303 -1.625 2.127 1.00 . A A . 2 PRO CD 1 1 1 12 1 1 2 PRO CG C 3.922 -1.930 3.472 1.00 . A A . 2 PRO CG 1 1 1 13 1 1 2 PRO HA H 1.634 -4.262 3.151 1.00 . A A . 2 PRO HA 1 1 1 14 1 1 2 PRO HB2 H 2.989 -2.959 5.102 1.00 . A A . 2 PRO HB2 1 1 1 15 1 1 2 PRO HB3 H 3.772 -4.017 3.926 1.00 . A A . 2 PRO HB3 1 1 1 16 1 1 2 PRO HD2 H 2.924 -0.614 2.110 1.00 . A A . 2 PRO HD2 1 1 1 17 1 1 2 PRO HD3 H 4.029 -1.767 1.340 1.00 . A A . 2 PRO HD3 1 1 1 18 1 1 2 PRO HG2 H 3.814 -1.079 4.128 1.00 . A A . 2 PRO HG2 1 1 1 19 1 1 2 PRO HG3 H 4.969 -2.171 3.351 1.00 . A A . 2 PRO HG3 1 1 1 20 1 1 2 PRO N N 2.202 -2.594 2.003 1.00 . A A . 2 PRO N 1 1 1 21 1 1 2 PRO O O -0.411 -2.922 3.904 1.00 . A A . 2 PRO O 1 1 1 22 1 1 3 LYS C C -0.511 0.425 4.639 1.00 . A A . 3 LYS C 1 1 1 23 1 1 3 LYS CA C 0.055 -0.710 5.489 1.00 . A A . 3 LYS CA 1 1 1 24 1 1 3 LYS CB C 0.646 -0.152 6.786 1.00 . A A . 3 LYS CB 1 1 1 25 1 1 3 LYS CD C 0.590 -0.186 9.298 1.00 . A A . 3 LYS CD 1 1 1 26 1 1 3 LYS CE C 0.185 -1.123 10.425 1.00 . A A . 3 LYS CE 1 1 1 27 1 1 3 LYS CG C -0.176 -0.486 8.020 1.00 . A A . 3 LYS CG 1 1 1 28 1 1 3 LYS H H 2.000 -1.174 4.803 1.00 . A A . 3 LYS H 1 1 1 29 1 1 3 LYS HA H -0.746 -1.391 5.735 1.00 . A A . 3 LYS HA 1 1 1 30 1 1 3 LYS HB2 H 1.638 -0.557 6.919 1.00 . A A . 3 LYS HB2 1 1 1 31 1 1 3 LYS HB3 H 0.715 0.923 6.706 1.00 . A A . 3 LYS HB3 1 1 1 32 1 1 3 LYS HD2 H 1.647 -0.303 9.109 1.00 . A A . 3 LYS HD2 1 1 1 33 1 1 3 LYS HD3 H 0.387 0.832 9.597 1.00 . A A . 3 LYS HD3 1 1 1 34 1 1 3 LYS HE2 H -0.732 -1.623 10.150 1.00 . A A . 3 LYS HE2 1 1 1 35 1 1 3 LYS HE3 H 0.966 -1.856 10.565 1.00 . A A . 3 LYS HE3 1 1 1 36 1 1 3 LYS HG2 H -1.081 0.102 8.008 1.00 . A A . 3 LYS HG2 1 1 1 37 1 1 3 LYS HG3 H -0.426 -1.537 7.999 1.00 . A A . 3 LYS HG3 1 1 1 38 1 1 3 LYS HZ1 H 0.627 0.412 11.771 1.00 . A A . 3 LYS HZ1 1 1 1 39 1 1 3 LYS HZ2 H 0.136 -1.027 12.511 1.00 . A A . 3 LYS HZ2 1 1 1 40 1 1 3 LYS HZ3 H -1.005 -0.036 11.754 1.00 . A A . 3 LYS HZ3 1 1 1 41 1 1 3 LYS N N 1.066 -1.458 4.752 1.00 . A A . 3 LYS N 1 1 1 42 1 1 3 LYS NZ N -0.029 -0.392 11.705 1.00 . A A . 3 LYS NZ 1 1 1 43 1 1 3 LYS O O 0.055 1.517 4.589 1.00 . A A . 3 LYS O 1 1 1 44 1 1 4 GLY C C -3.703 0.862 2.826 1.00 . A A . 4 GLY C 1 1 1 45 1 1 4 GLY CA C -2.251 1.170 3.135 1.00 . A A . 4 GLY CA 1 1 1 46 1 1 4 GLY H H -2.038 -0.729 4.050 1.00 . A A . 4 GLY H 1 1 1 47 1 1 4 GLY HA2 H -2.197 2.123 3.641 1.00 . A A . 4 GLY HA2 1 1 1 48 1 1 4 GLY HA3 H -1.703 1.237 2.207 1.00 . A A . 4 GLY HA3 1 1 1 49 1 1 4 GLY N N -1.630 0.159 3.973 1.00 . A A . 4 GLY N 1 1 1 50 1 1 4 GLY O O -4.299 -0.029 3.432 1.00 . A A . 4 GLY O 1 1 1 51 1 1 5 ASP C C -5.772 0.718 0.126 1.00 . A A . 5 ASP C 1 1 1 52 1 1 5 ASP CA C -5.666 1.404 1.488 1.00 . A A . 5 ASP CA 1 1 1 53 1 1 5 ASP CB C -6.400 2.746 1.453 1.00 . A A . 5 ASP CB 1 1 1 54 1 1 5 ASP CG C -7.135 3.037 2.747 1.00 . A A . 5 ASP CG 1 1 1 55 1 1 5 ASP H H -3.746 2.296 1.433 1.00 . A A . 5 ASP H 1 1 1 56 1 1 5 ASP HA H -6.131 0.772 2.230 1.00 . A A . 5 ASP HA 1 1 1 57 1 1 5 ASP HB2 H -5.685 3.536 1.282 1.00 . A A . 5 ASP HB2 1 1 1 58 1 1 5 ASP HB3 H -7.119 2.736 0.646 1.00 . A A . 5 ASP HB3 1 1 1 59 1 1 5 ASP N N -4.274 1.601 1.879 1.00 . A A . 5 ASP N 1 1 1 60 1 1 5 ASP O O -6.864 0.354 -0.309 1.00 . A A . 5 ASP O 1 1 1 61 1 1 5 ASP OD1 O -7.487 2.073 3.458 1.00 . A A . 5 ASP OD1 1 1 1 62 1 1 5 ASP OD2 O -7.357 4.228 3.049 1.00 . A A . 5 ASP OD2 1 1 1 63 1 1 6 PHE C C -3.957 -1.477 -1.767 1.00 . A A . 6 PHE C 1 1 1 64 1 1 6 PHE CA C -4.610 -0.099 -1.853 1.00 . A A . 6 PHE CA 1 1 1 65 1 1 6 PHE CB C -3.854 0.773 -2.858 1.00 . A A . 6 PHE CB 1 1 1 66 1 1 6 PHE CD1 C -4.957 2.326 -4.491 1.00 . A A . 6 PHE CD1 1 1 1 67 1 1 6 PHE CD2 C -4.833 2.989 -2.203 1.00 . A A . 6 PHE CD2 1 1 1 68 1 1 6 PHE CE1 C -5.609 3.505 -4.800 1.00 . A A . 6 PHE CE1 1 1 1 69 1 1 6 PHE CE2 C -5.484 4.169 -2.507 1.00 . A A . 6 PHE CE2 1 1 1 70 1 1 6 PHE CG C -4.562 2.055 -3.191 1.00 . A A . 6 PHE CG 1 1 1 71 1 1 6 PHE CZ C -5.873 4.427 -3.807 1.00 . A A . 6 PHE CZ 1 1 1 72 1 1 6 PHE H H -3.793 0.854 -0.151 1.00 . A A . 6 PHE H 1 1 1 73 1 1 6 PHE HA H -5.630 -0.216 -2.186 1.00 . A A . 6 PHE HA 1 1 1 74 1 1 6 PHE HB2 H -2.887 1.024 -2.449 1.00 . A A . 6 PHE HB2 1 1 1 75 1 1 6 PHE HB3 H -3.719 0.218 -3.775 1.00 . A A . 6 PHE HB3 1 1 1 76 1 1 6 PHE HD1 H -4.752 1.605 -5.268 1.00 . A A . 6 PHE HD1 1 1 1 77 1 1 6 PHE HD2 H -4.529 2.788 -1.186 1.00 . A A . 6 PHE HD2 1 1 1 78 1 1 6 PHE HE1 H -5.911 3.704 -5.818 1.00 . A A . 6 PHE HE1 1 1 1 79 1 1 6 PHE HE2 H -5.689 4.889 -1.728 1.00 . A A . 6 PHE HE2 1 1 1 80 1 1 6 PHE HZ H -6.382 5.349 -4.046 1.00 . A A . 6 PHE HZ 1 1 1 81 1 1 6 PHE N N -4.635 0.544 -0.544 1.00 . A A . 6 PHE N 1 1 1 82 1 1 6 PHE O O -2.744 -1.607 -1.927 1.00 . A A . 6 PHE O 1 1 1 83 1 1 7 PRO C C -3.235 -4.245 -2.478 1.00 . A A . 7 PRO C 1 1 1 84 1 1 7 PRO CA C -4.254 -3.900 -1.396 1.00 . A A . 7 PRO CA 1 1 1 85 1 1 7 PRO CB C -5.518 -4.740 -1.561 1.00 . A A . 7 PRO CB 1 1 1 86 1 1 7 PRO CD C -6.218 -2.459 -1.301 1.00 . A A . 7 PRO CD 1 1 1 87 1 1 7 PRO CG C -6.608 -3.887 -1.011 1.00 . A A . 7 PRO CG 1 1 1 88 1 1 7 PRO HA H -3.822 -4.084 -0.423 1.00 . A A . 7 PRO HA 1 1 1 89 1 1 7 PRO HB2 H -5.674 -4.958 -2.608 1.00 . A A . 7 PRO HB2 1 1 1 90 1 1 7 PRO HB3 H -5.419 -5.660 -1.006 1.00 . A A . 7 PRO HB3 1 1 1 91 1 1 7 PRO HD2 H -6.716 -2.107 -2.192 1.00 . A A . 7 PRO HD2 1 1 1 92 1 1 7 PRO HD3 H -6.457 -1.827 -0.460 1.00 . A A . 7 PRO HD3 1 1 1 93 1 1 7 PRO HG2 H -7.542 -4.125 -1.499 1.00 . A A . 7 PRO HG2 1 1 1 94 1 1 7 PRO HG3 H -6.692 -4.042 0.054 1.00 . A A . 7 PRO HG3 1 1 1 95 1 1 7 PRO N N -4.757 -2.528 -1.508 1.00 . A A . 7 PRO N 1 1 1 96 1 1 7 PRO O O -3.529 -4.165 -3.670 1.00 . A A . 7 PRO O 1 1 1 97 1 1 8 ASP C C -0.211 -6.219 -2.501 1.00 . A A . 8 ASP C 1 1 1 98 1 1 8 ASP CA C -0.973 -4.989 -2.984 1.00 . A A . 8 ASP CA 1 1 1 99 1 1 8 ASP CB C -0.005 -3.818 -3.178 1.00 . A A . 8 ASP CB 1 1 1 100 1 1 8 ASP CG C 0.287 -3.071 -1.889 1.00 . A A . 8 ASP CG 1 1 1 101 1 1 8 ASP H H -1.861 -4.675 -1.088 1.00 . A A . 8 ASP H 1 1 1 102 1 1 8 ASP HA H -1.434 -5.220 -3.933 1.00 . A A . 8 ASP HA 1 1 1 103 1 1 8 ASP HB2 H 0.929 -4.193 -3.569 1.00 . A A . 8 ASP HB2 1 1 1 104 1 1 8 ASP HB3 H -0.431 -3.122 -3.886 1.00 . A A . 8 ASP HB3 1 1 1 105 1 1 8 ASP N N -2.036 -4.630 -2.052 1.00 . A A . 8 ASP N 1 1 1 106 1 1 8 ASP O O -0.129 -7.226 -3.205 1.00 . A A . 8 ASP O 1 1 1 107 1 1 8 ASP OD1 O -0.628 -2.673 -1.167 1.00 . A A . 8 ASP OD1 1 1 1 108 1 1 9 VAL C C 0.897 -7.327 0.785 1.00 . A A . 9 VAL C 1 1 1 109 1 1 9 VAL CA C 1.099 -7.244 -0.724 1.00 . A A . 9 VAL CA 1 1 1 110 1 1 9 VAL CB C 2.606 -7.114 -1.023 1.00 . A A . 9 VAL CB 1 1 1 111 1 1 9 VAL CG1 C 3.335 -8.403 -0.671 1.00 . A A . 9 VAL CG1 1 1 1 112 1 1 9 VAL CG2 C 2.832 -6.746 -2.482 1.00 . A A . 9 VAL CG2 1 1 1 113 1 1 9 VAL H H 0.246 -5.306 -0.781 1.00 . A A . 9 VAL H 1 1 1 114 1 1 9 VAL HA H 0.741 -8.157 -1.176 1.00 . A A . 9 VAL HA 1 1 1 115 1 1 9 VAL HB H 3.007 -6.322 -0.408 1.00 . A A . 9 VAL HB 1 1 1 116 1 1 9 VAL HG11 H 3.596 -8.928 -1.578 1.00 . A A . 9 VAL HG11 1 1 1 117 1 1 9 VAL HG12 H 2.694 -9.027 -0.066 1.00 . A A . 9 VAL HG12 1 1 1 118 1 1 9 VAL HG13 H 4.233 -8.169 -0.119 1.00 . A A . 9 VAL HG13 1 1 1 119 1 1 9 VAL HG21 H 3.829 -7.041 -2.777 1.00 . A A . 9 VAL HG21 1 1 1 120 1 1 9 VAL HG22 H 2.721 -5.679 -2.605 1.00 . A A . 9 VAL HG22 1 1 1 121 1 1 9 VAL HG23 H 2.108 -7.257 -3.099 1.00 . A A . 9 VAL HG23 1 1 1 122 1 1 9 VAL N N 0.345 -6.134 -1.296 1.00 . A A . 9 VAL N 1 1 1 123 1 1 9 VAL O O 1.797 -7.732 1.521 1.00 . A A . 9 VAL O 1 1 1 124 1 1 10 GLY C C -1.892 -6.283 2.996 1.00 . A A . 10 GLY C 1 1 1 125 1 1 10 GLY CA C -0.591 -6.983 2.658 1.00 . A A . 10 GLY CA 1 1 1 126 1 1 10 GLY H H -0.970 -6.630 0.605 1.00 . A A . 10 GLY H 1 1 1 127 1 1 10 GLY HA2 H -0.658 -8.014 2.972 1.00 . A A . 10 GLY HA2 1 1 1 128 1 1 10 GLY HA3 H 0.213 -6.505 3.198 1.00 . A A . 10 GLY HA3 1 1 1 129 1 1 10 GLY N N -0.291 -6.943 1.239 1.00 . A A . 10 GLY N 1 1 1 130 1 1 10 GLY O O -2.974 -6.831 2.781 1.00 . A A . 10 GLY O 1 1 1 131 1 1 11 ASP C C -3.310 -3.283 2.799 1.00 . A A . 11 ASP C 1 1 1 132 1 1 11 ASP CA C -2.967 -4.291 3.890 1.00 . A A . 11 ASP CA 1 1 1 133 1 1 11 ASP CB C -2.735 -3.566 5.217 1.00 . A A . 11 ASP CB 1 1 1 134 1 1 11 ASP CG C -3.981 -3.531 6.081 1.00 . A A . 11 ASP CG 1 1 1 135 1 1 11 ASP H H -0.898 -4.684 3.669 1.00 . A A . 11 ASP H 1 1 1 136 1 1 11 ASP HA H -3.793 -4.976 4.003 1.00 . A A . 11 ASP HA 1 1 1 137 1 1 11 ASP HB2 H -1.955 -4.072 5.766 1.00 . A A . 11 ASP HB2 1 1 1 138 1 1 11 ASP HB3 H -2.428 -2.550 5.017 1.00 . A A . 11 ASP HB3 1 1 1 139 1 1 11 ASP N N -1.788 -5.068 3.524 1.00 . A A . 11 ASP N 1 1 1 140 1 1 11 ASP O O -4.482 -3.005 2.543 1.00 . A A . 11 ASP O 1 1 1 141 1 1 11 ASP OD1 O -3.848 -3.329 7.306 1.00 . A A . 11 ASP OD1 1 1 1 142 1 1 11 ASP OD2 O -5.089 -3.703 5.532 1.00 . A A . 11 ASP OD2 1 1 1 143 1 1 12 GLY C C -1.273 -0.910 0.839 1.00 . A A . 12 GLY C 1 1 1 144 1 1 12 GLY CA C -2.495 -1.770 1.100 1.00 . A A . 12 GLY CA 1 1 1 145 1 1 12 GLY H H -1.368 -2.999 2.404 1.00 . A A . 12 GLY H 1 1 1 146 1 1 12 GLY HA2 H -2.750 -2.297 0.194 1.00 . A A . 12 GLY HA2 1 1 1 147 1 1 12 GLY HA3 H -3.320 -1.129 1.375 1.00 . A A . 12 GLY HA3 1 1 1 148 1 1 12 GLY N N -2.281 -2.739 2.158 1.00 . A A . 12 GLY N 1 1 1 149 1 1 12 GLY O O -0.289 -0.976 1.576 1.00 . A A . 12 GLY O 1 1 1 150 1 1 13 ARG C C -0.643 2.241 -0.482 1.00 . A A . 13 ARG C 1 1 1 151 1 1 13 ARG CA C -0.228 0.776 -0.577 1.00 . A A . 13 ARG CA 1 1 1 152 1 1 13 ARG CB C 0.256 0.462 -1.994 1.00 . A A . 13 ARG CB 1 1 1 153 1 1 13 ARG CD C 2.211 0.273 -3.562 1.00 . A A . 13 ARG CD 1 1 1 154 1 1 13 ARG CG C 1.712 0.824 -2.235 1.00 . A A . 13 ARG CG 1 1 1 155 1 1 13 ARG CZ C 1.276 -0.126 -5.807 1.00 . A A . 13 ARG CZ 1 1 1 156 1 1 13 ARG H H -2.148 -0.095 -0.764 1.00 . A A . 13 ARG H 1 1 1 157 1 1 13 ARG HA H 0.578 0.596 0.118 1.00 . A A . 13 ARG HA 1 1 1 158 1 1 13 ARG HB2 H 0.135 -0.595 -2.177 1.00 . A A . 13 ARG HB2 1 1 1 159 1 1 13 ARG HB3 H -0.351 1.012 -2.699 1.00 . A A . 13 ARG HB3 1 1 1 160 1 1 13 ARG HD2 H 3.157 0.738 -3.797 1.00 . A A . 13 ARG HD2 1 1 1 161 1 1 13 ARG HD3 H 2.349 -0.794 -3.465 1.00 . A A . 13 ARG HD3 1 1 1 162 1 1 13 ARG HE H 0.603 1.237 -4.513 1.00 . A A . 13 ARG HE 1 1 1 163 1 1 13 ARG HG2 H 1.810 1.899 -2.244 1.00 . A A . 13 ARG HG2 1 1 1 164 1 1 13 ARG HG3 H 2.312 0.413 -1.437 1.00 . A A . 13 ARG HG3 1 1 1 165 1 1 13 ARG HH11 H 2.840 -1.316 -5.328 1.00 . A A . 13 ARG HH11 1 1 1 166 1 1 13 ARG HH12 H 2.164 -1.576 -6.901 1.00 . A A . 13 ARG HH12 1 1 1 167 1 1 13 ARG HH21 H -0.287 0.896 -6.581 1.00 . A A . 13 ARG HH21 1 1 1 168 1 1 13 ARG HH22 H 0.389 -0.321 -7.613 1.00 . A A . 13 ARG HH22 1 1 1 169 1 1 13 ARG N N -1.336 -0.102 -0.215 1.00 . A A . 13 ARG N 1 1 1 170 1 1 13 ARG NE N 1.272 0.534 -4.651 1.00 . A A . 13 ARG NE 1 1 1 171 1 1 13 ARG NH1 N 2.167 -1.084 -6.030 1.00 . A A . 13 ARG NH1 1 1 1 172 1 1 13 ARG NH2 N 0.387 0.174 -6.744 1.00 . A A . 13 ARG NH2 1 1 1 173 1 1 13 ARG O O -1.830 2.556 -0.399 1.00 . A A . 13 ARG O 1 1 1 174 1 1 14 ILE C C 0.519 5.279 -1.686 1.00 . A A . 14 ILE C 1 1 1 175 1 1 14 ILE CA C 0.081 4.564 -0.411 1.00 . A A . 14 ILE CA 1 1 1 176 1 1 14 ILE CB C 0.804 5.198 0.792 1.00 . A A . 14 ILE CB 1 1 1 177 1 1 14 ILE CD1 C 3.095 5.562 1.839 1.00 . A A . 14 ILE CD1 1 1 1 178 1 1 14 ILE CG1 C 2.310 4.951 0.699 1.00 . A A . 14 ILE CG1 1 1 1 179 1 1 14 ILE CG2 C 0.249 4.643 2.095 1.00 . A A . 14 ILE CG2 1 1 1 180 1 1 14 ILE H H 1.270 2.819 -0.563 1.00 . A A . 14 ILE H 1 1 1 181 1 1 14 ILE HA H -0.982 4.702 -0.280 1.00 . A A . 14 ILE HA 1 1 1 182 1 1 14 ILE HB H 0.619 6.262 0.775 1.00 . A A . 14 ILE HB 1 1 1 183 1 1 14 ILE HD11 H 2.904 5.007 2.746 1.00 . A A . 14 ILE HD11 1 1 1 184 1 1 14 ILE HD12 H 2.792 6.590 1.975 1.00 . A A . 14 ILE HD12 1 1 1 185 1 1 14 ILE HD13 H 4.150 5.525 1.610 1.00 . A A . 14 ILE HD13 1 1 1 186 1 1 14 ILE HG12 H 2.495 3.887 0.703 1.00 . A A . 14 ILE HG12 1 1 1 187 1 1 14 ILE HG13 H 2.681 5.373 -0.224 1.00 . A A . 14 ILE HG13 1 1 1 188 1 1 14 ILE HG21 H 0.203 5.431 2.832 1.00 . A A . 14 ILE HG21 1 1 1 189 1 1 14 ILE HG22 H 0.893 3.853 2.453 1.00 . A A . 14 ILE HG22 1 1 1 190 1 1 14 ILE HG23 H -0.743 4.250 1.926 1.00 . A A . 14 ILE HG23 1 1 1 191 1 1 14 ILE N N 0.344 3.132 -0.495 1.00 . A A . 14 ILE N 1 1 1 192 1 1 14 ILE O O -0.139 6.214 -2.142 1.00 . A A . 14 ILE O 1 1 1 193 1 1 15 LEU C C 2.297 4.377 -4.578 1.00 . A A . 15 LEU C 1 1 1 194 1 1 15 LEU CA C 2.158 5.427 -3.480 1.00 . A A . 15 LEU CA 1 1 1 195 1 1 15 LEU CB C 3.514 6.084 -3.212 1.00 . A A . 15 LEU CB 1 1 1 196 1 1 15 LEU CD1 C 3.366 7.862 -4.974 1.00 . A A . 15 LEU CD1 1 1 1 197 1 1 15 LEU CD2 C 5.599 7.158 -4.095 1.00 . A A . 15 LEU CD2 1 1 1 198 1 1 15 LEU CG C 4.189 6.701 -4.438 1.00 . A A . 15 LEU CG 1 1 1 199 1 1 15 LEU H H 2.113 4.082 -1.846 1.00 . A A . 15 LEU H 1 1 1 200 1 1 15 LEU HA H 1.460 6.183 -3.807 1.00 . A A . 15 LEU HA 1 1 1 201 1 1 15 LEU HB2 H 3.373 6.861 -2.474 1.00 . A A . 15 LEU HB2 1 1 1 202 1 1 15 LEU HB3 H 4.177 5.337 -2.802 1.00 . A A . 15 LEU HB3 1 1 1 203 1 1 15 LEU HD11 H 2.889 8.375 -4.151 1.00 . A A . 15 LEU HD11 1 1 1 204 1 1 15 LEU HD12 H 2.611 7.487 -5.650 1.00 . A A . 15 LEU HD12 1 1 1 205 1 1 15 LEU HD13 H 4.012 8.548 -5.500 1.00 . A A . 15 LEU HD13 1 1 1 206 1 1 15 LEU HD21 H 6.004 7.725 -4.920 1.00 . A A . 15 LEU HD21 1 1 1 207 1 1 15 LEU HD22 H 6.222 6.296 -3.909 1.00 . A A . 15 LEU HD22 1 1 1 208 1 1 15 LEU HD23 H 5.571 7.779 -3.211 1.00 . A A . 15 LEU HD23 1 1 1 209 1 1 15 LEU HG H 4.259 5.954 -5.216 1.00 . A A . 15 LEU HG 1 1 1 210 1 1 15 LEU N N 1.633 4.831 -2.257 1.00 . A A . 15 LEU N 1 1 1 211 1 1 15 LEU O O 2.640 3.226 -4.309 1.00 . A A . 15 LEU O 1 1 1 212 1 1 16 ALA C C 2.722 4.575 -8.166 1.00 . A A . 16 ALA C 1 1 1 213 1 1 16 ALA CA C 2.121 3.874 -6.952 1.00 . A A . 16 ALA CA 1 1 1 214 1 1 16 ALA CB C 0.749 3.309 -7.289 1.00 . A A . 16 ALA CB 1 1 1 215 1 1 16 ALA H H 1.757 5.711 -5.966 1.00 . A A . 16 ALA H 1 1 1 216 1 1 16 ALA HA H 2.762 3.052 -6.669 1.00 . A A . 16 ALA HA 1 1 1 217 1 1 16 ALA HB1 H 0.351 2.790 -6.429 1.00 . A A . 16 ALA HB1 1 1 1 218 1 1 16 ALA HB2 H 0.837 2.620 -8.116 1.00 . A A . 16 ALA HB2 1 1 1 219 1 1 16 ALA HB3 H 0.084 4.115 -7.561 1.00 . A A . 16 ALA HB3 1 1 1 220 1 1 16 ALA N N 2.026 4.781 -5.815 1.00 . A A . 16 ALA N 1 1 1 221 1 1 16 ALA O O 2.163 4.531 -9.262 1.00 . A A . 16 ALA O 1 1 1 222 1 1 17 GLY C C 5.046 4.976 -10.115 1.00 . A A . 17 GLY C 1 1 1 223 1 1 17 GLY CA C 4.524 5.920 -9.051 1.00 . A A . 17 GLY CA 1 1 1 224 1 1 17 GLY H H 4.266 5.221 -7.069 1.00 . A A . 17 GLY H 1 1 1 225 1 1 17 GLY HA2 H 3.819 6.602 -9.504 1.00 . A A . 17 GLY HA2 1 1 1 226 1 1 17 GLY HA3 H 5.351 6.487 -8.651 1.00 . A A . 17 GLY HA3 1 1 1 227 1 1 17 GLY N N 3.866 5.220 -7.963 1.00 . A A . 17 GLY N 1 1 1 228 1 1 17 GLY O O 4.221 4.303 -10.768 1.00 . A A . 17 GLY O 1 1 1 229 1 1 17 GLY OXT O 6.280 4.910 -10.297 1.00 . A A . 17 GLY OXT 1 1 2 230 1 1 1 GLY C C 1.094 -2.948 0.594 1.00 . A A . 1 GLY C 1 1 2 231 1 1 1 GLY CA C 1.301 -2.532 -0.850 1.00 . A A . 1 GLY CA 1 1 2 232 1 1 1 GLY H1 H -0.245 -2.304 -1.893 1.00 . A A . 1 GLY H1 1 1 2 233 1 1 1 GLY HA2 H 2.281 -2.856 -1.169 1.00 . A A . 1 GLY HA2 1 1 2 234 1 1 1 GLY HA3 H 1.252 -1.456 -0.913 1.00 . A A . 1 GLY HA3 1 1 2 235 1 1 1 GLY N N 0.306 -3.100 -1.742 1.00 . A A . 1 GLY N 1 1 2 236 1 1 1 GLY O O 0.084 -3.571 0.922 1.00 . A A . 1 GLY O 1 1 2 237 1 1 2 PRO C C 0.893 -2.130 3.641 1.00 . A A . 2 PRO C 1 1 2 238 1 1 2 PRO CA C 1.942 -2.969 2.905 1.00 . A A . 2 PRO CA 1 1 2 239 1 1 2 PRO CB C 3.351 -2.700 3.439 1.00 . A A . 2 PRO CB 1 1 2 240 1 1 2 PRO CD C 3.280 -1.876 1.182 1.00 . A A . 2 PRO CD 1 1 2 241 1 1 2 PRO CG C 3.919 -1.663 2.530 1.00 . A A . 2 PRO CG 1 1 2 242 1 1 2 PRO HA H 1.704 -4.015 3.028 1.00 . A A . 2 PRO HA 1 1 2 243 1 1 2 PRO HB2 H 3.291 -2.344 4.457 1.00 . A A . 2 PRO HB2 1 1 2 244 1 1 2 PRO HB3 H 3.930 -3.611 3.405 1.00 . A A . 2 PRO HB3 1 1 2 245 1 1 2 PRO HD2 H 3.054 -0.926 0.719 1.00 . A A . 2 PRO HD2 1 1 2 246 1 1 2 PRO HD3 H 3.930 -2.460 0.547 1.00 . A A . 2 PRO HD3 1 1 2 247 1 1 2 PRO HG2 H 3.683 -0.678 2.903 1.00 . A A . 2 PRO HG2 1 1 2 248 1 1 2 PRO HG3 H 4.989 -1.788 2.458 1.00 . A A . 2 PRO HG3 1 1 2 249 1 1 2 PRO N N 2.042 -2.616 1.488 1.00 . A A . 2 PRO N 1 1 2 250 1 1 2 PRO O O -0.275 -2.510 3.703 1.00 . A A . 2 PRO O 1 1 2 251 1 1 3 LYS C C -0.241 0.911 3.982 1.00 . A A . 3 LYS C 1 1 2 252 1 1 3 LYS CA C 0.385 -0.119 4.918 1.00 . A A . 3 LYS CA 1 1 2 253 1 1 3 LYS CB C 1.114 0.588 6.062 1.00 . A A . 3 LYS CB 1 1 2 254 1 1 3 LYS CD C 1.129 0.835 8.563 1.00 . A A . 3 LYS CD 1 1 2 255 1 1 3 LYS CE C 1.282 -0.523 9.229 1.00 . A A . 3 LYS CE 1 1 2 256 1 1 3 LYS CG C 0.267 0.749 7.313 1.00 . A A . 3 LYS CG 1 1 2 257 1 1 3 LYS H H 2.244 -0.731 4.118 1.00 . A A . 3 LYS H 1 1 2 258 1 1 3 LYS HA H -0.399 -0.735 5.330 1.00 . A A . 3 LYS HA 1 1 2 259 1 1 3 LYS HB2 H 1.994 0.019 6.319 1.00 . A A . 3 LYS HB2 1 1 2 260 1 1 3 LYS HB3 H 1.416 1.570 5.729 1.00 . A A . 3 LYS HB3 1 1 2 261 1 1 3 LYS HD2 H 2.107 1.203 8.289 1.00 . A A . 3 LYS HD2 1 1 2 262 1 1 3 LYS HD3 H 0.667 1.518 9.260 1.00 . A A . 3 LYS HD3 1 1 2 263 1 1 3 LYS HE2 H 1.415 -1.273 8.463 1.00 . A A . 3 LYS HE2 1 1 2 264 1 1 3 LYS HE3 H 2.155 -0.501 9.865 1.00 . A A . 3 LYS HE3 1 1 2 265 1 1 3 LYS HG2 H -0.316 1.653 7.228 1.00 . A A . 3 LYS HG2 1 1 2 266 1 1 3 LYS HG3 H -0.394 -0.101 7.401 1.00 . A A . 3 LYS HG3 1 1 2 267 1 1 3 LYS HZ1 H -0.037 -1.908 10.069 1.00 . A A . 3 LYS HZ1 1 1 2 268 1 1 3 LYS HZ2 H -0.763 -0.439 9.649 1.00 . A A . 3 LYS HZ2 1 1 2 269 1 1 3 LYS HZ3 H 0.216 -0.535 11.025 1.00 . A A . 3 LYS HZ3 1 1 2 270 1 1 3 LYS N N 1.305 -0.992 4.196 1.00 . A A . 3 LYS N 1 1 2 271 1 1 3 LYS NZ N 0.091 -0.876 10.050 1.00 . A A . 3 LYS NZ 1 1 2 272 1 1 3 LYS O O 0.243 2.038 3.875 1.00 . A A . 3 LYS O 1 1 2 273 1 1 4 GLY C C -3.462 1.123 2.236 1.00 . A A . 4 GLY C 1 1 2 274 1 1 4 GLY CA C -1.984 1.428 2.390 1.00 . A A . 4 GLY CA 1 1 2 275 1 1 4 GLY H H -1.659 -0.391 3.429 1.00 . A A . 4 GLY H 1 1 2 276 1 1 4 GLY HA2 H -1.874 2.436 2.760 1.00 . A A . 4 GLY HA2 1 1 2 277 1 1 4 GLY HA3 H -1.511 1.358 1.422 1.00 . A A . 4 GLY HA3 1 1 2 278 1 1 4 GLY N N -1.317 0.520 3.306 1.00 . A A . 4 GLY N 1 1 2 279 1 1 4 GLY O O -4.046 0.409 3.051 1.00 . A A . 4 GLY O 1 1 2 280 1 1 5 ASP C C -5.711 0.561 -0.291 1.00 . A A . 5 ASP C 1 1 2 281 1 1 5 ASP CA C -5.491 1.459 0.927 1.00 . A A . 5 ASP CA 1 1 2 282 1 1 5 ASP CB C -6.194 2.801 0.718 1.00 . A A . 5 ASP CB 1 1 2 283 1 1 5 ASP CG C -5.543 3.633 -0.370 1.00 . A A . 5 ASP CG 1 1 2 284 1 1 5 ASP H H -3.551 2.232 0.573 1.00 . A A . 5 ASP H 1 1 2 285 1 1 5 ASP HA H -5.915 0.975 1.794 1.00 . A A . 5 ASP HA 1 1 2 286 1 1 5 ASP HB2 H -7.223 2.622 0.442 1.00 . A A . 5 ASP HB2 1 1 2 287 1 1 5 ASP HB3 H -6.166 3.362 1.640 1.00 . A A . 5 ASP HB3 1 1 2 288 1 1 5 ASP N N -4.070 1.670 1.186 1.00 . A A . 5 ASP N 1 1 2 289 1 1 5 ASP O O -6.838 0.156 -0.575 1.00 . A A . 5 ASP O 1 1 2 290 1 1 5 ASP OD1 O -5.769 3.334 -1.562 1.00 . A A . 5 ASP OD1 1 1 2 291 1 1 5 ASP OD2 O -4.808 4.584 -0.030 1.00 . A A . 5 ASP OD2 1 1 2 292 1 1 6 PHE C C -4.050 -1.949 -1.934 1.00 . A A . 6 PHE C 1 1 2 293 1 1 6 PHE CA C -4.720 -0.601 -2.189 1.00 . A A . 6 PHE CA 1 1 2 294 1 1 6 PHE CB C -4.067 0.088 -3.389 1.00 . A A . 6 PHE CB 1 1 2 295 1 1 6 PHE CD1 C -6.137 1.380 -3.974 1.00 . A A . 6 PHE CD1 1 1 2 296 1 1 6 PHE CD2 C -4.040 2.513 -4.036 1.00 . A A . 6 PHE CD2 1 1 2 297 1 1 6 PHE CE1 C -6.779 2.542 -4.360 1.00 . A A . 6 PHE CE1 1 1 2 298 1 1 6 PHE CE2 C -4.676 3.678 -4.422 1.00 . A A . 6 PHE CE2 1 1 2 299 1 1 6 PHE CG C -4.762 1.353 -3.808 1.00 . A A . 6 PHE CG 1 1 2 300 1 1 6 PHE CZ C -6.048 3.692 -4.584 1.00 . A A . 6 PHE CZ 1 1 2 301 1 1 6 PHE H H -3.759 0.601 -0.736 1.00 . A A . 6 PHE H 1 1 2 302 1 1 6 PHE HA H -5.765 -0.766 -2.404 1.00 . A A . 6 PHE HA 1 1 2 303 1 1 6 PHE HB2 H -3.046 0.338 -3.141 1.00 . A A . 6 PHE HB2 1 1 2 304 1 1 6 PHE HB3 H -4.072 -0.589 -4.231 1.00 . A A . 6 PHE HB3 1 1 2 305 1 1 6 PHE HD1 H -6.711 0.482 -3.798 1.00 . A A . 6 PHE HD1 1 1 2 306 1 1 6 PHE HD2 H -2.967 2.503 -3.910 1.00 . A A . 6 PHE HD2 1 1 2 307 1 1 6 PHE HE1 H -7.852 2.551 -4.486 1.00 . A A . 6 PHE HE1 1 1 2 308 1 1 6 PHE HE2 H -4.101 4.575 -4.597 1.00 . A A . 6 PHE HE2 1 1 2 309 1 1 6 PHE HZ H -6.547 4.601 -4.886 1.00 . A A . 6 PHE HZ 1 1 2 310 1 1 6 PHE N N -4.633 0.251 -1.008 1.00 . A A . 6 PHE N 1 1 2 311 1 1 6 PHE O O -2.880 -2.143 -2.267 1.00 . A A . 6 PHE O 1 1 2 312 1 1 7 PRO C C -3.442 -4.829 -2.169 1.00 . A A . 7 PRO C 1 1 2 313 1 1 7 PRO CA C -4.256 -4.234 -1.024 1.00 . A A . 7 PRO CA 1 1 2 314 1 1 7 PRO CB C -5.520 -5.055 -0.784 1.00 . A A . 7 PRO CB 1 1 2 315 1 1 7 PRO CD C -6.186 -2.751 -0.894 1.00 . A A . 7 PRO CD 1 1 2 316 1 1 7 PRO CG C -6.508 -4.076 -0.250 1.00 . A A . 7 PRO CG 1 1 2 317 1 1 7 PRO HA H -3.656 -4.224 -0.126 1.00 . A A . 7 PRO HA 1 1 2 318 1 1 7 PRO HB2 H -5.854 -5.487 -1.717 1.00 . A A . 7 PRO HB2 1 1 2 319 1 1 7 PRO HB3 H -5.316 -5.838 -0.070 1.00 . A A . 7 PRO HB3 1 1 2 320 1 1 7 PRO HD2 H -6.835 -2.577 -1.740 1.00 . A A . 7 PRO HD2 1 1 2 321 1 1 7 PRO HD3 H -6.280 -1.951 -0.175 1.00 . A A . 7 PRO HD3 1 1 2 322 1 1 7 PRO HG2 H -7.509 -4.385 -0.512 1.00 . A A . 7 PRO HG2 1 1 2 323 1 1 7 PRO HG3 H -6.407 -4.003 0.823 1.00 . A A . 7 PRO HG3 1 1 2 324 1 1 7 PRO N N -4.783 -2.901 -1.331 1.00 . A A . 7 PRO N 1 1 2 325 1 1 7 PRO O O -3.989 -5.183 -3.214 1.00 . A A . 7 PRO O 1 1 2 326 1 1 8 ASP C C -0.306 -6.534 -2.359 1.00 . A A . 8 ASP C 1 1 2 327 1 1 8 ASP CA C -1.245 -5.498 -2.974 1.00 . A A . 8 ASP CA 1 1 2 328 1 1 8 ASP CB C -0.441 -4.383 -3.655 1.00 . A A . 8 ASP CB 1 1 2 329 1 1 8 ASP CG C 0.676 -3.839 -2.783 1.00 . A A . 8 ASP CG 1 1 2 330 1 1 8 ASP H H -1.758 -4.644 -1.107 1.00 . A A . 8 ASP H 1 1 2 331 1 1 8 ASP HA H -1.859 -5.988 -3.716 1.00 . A A . 8 ASP HA 1 1 2 332 1 1 8 ASP HB2 H -0.004 -4.768 -4.563 1.00 . A A . 8 ASP HB2 1 1 2 333 1 1 8 ASP HB3 H -1.109 -3.569 -3.900 1.00 . A A . 8 ASP HB3 1 1 2 334 1 1 8 ASP N N -2.134 -4.940 -1.962 1.00 . A A . 8 ASP N 1 1 2 335 1 1 8 ASP O O -0.128 -7.625 -2.900 1.00 . A A . 8 ASP O 1 1 2 336 1 1 8 ASP OD1 O 1.854 -4.079 -3.046 1.00 . A A . 8 ASP OD1 1 1 2 337 1 1 9 VAL C C 1.145 -6.859 0.983 1.00 . A A . 9 VAL C 1 1 2 338 1 1 9 VAL CA C 1.205 -7.080 -0.527 1.00 . A A . 9 VAL CA 1 1 2 339 1 1 9 VAL CB C 2.657 -6.889 -1.011 1.00 . A A . 9 VAL CB 1 1 2 340 1 1 9 VAL CG1 C 3.583 -7.895 -0.344 1.00 . A A . 9 VAL CG1 1 1 2 341 1 1 9 VAL CG2 C 2.735 -7.008 -2.526 1.00 . A A . 9 VAL CG2 1 1 2 342 1 1 9 VAL H H 0.104 -5.300 -0.839 1.00 . A A . 9 VAL H 1 1 2 343 1 1 9 VAL HA H 0.906 -8.095 -0.744 1.00 . A A . 9 VAL HA 1 1 2 344 1 1 9 VAL HB H 2.980 -5.896 -0.733 1.00 . A A . 9 VAL HB 1 1 2 345 1 1 9 VAL HG11 H 4.021 -7.451 0.538 1.00 . A A . 9 VAL HG11 1 1 2 346 1 1 9 VAL HG12 H 4.366 -8.177 -1.032 1.00 . A A . 9 VAL HG12 1 1 2 347 1 1 9 VAL HG13 H 3.018 -8.772 -0.062 1.00 . A A . 9 VAL HG13 1 1 2 348 1 1 9 VAL HG21 H 2.425 -7.998 -2.825 1.00 . A A . 9 VAL HG21 1 1 2 349 1 1 9 VAL HG22 H 3.751 -6.837 -2.848 1.00 . A A . 9 VAL HG22 1 1 2 350 1 1 9 VAL HG23 H 2.085 -6.275 -2.979 1.00 . A A . 9 VAL HG23 1 1 2 351 1 1 9 VAL N N 0.288 -6.183 -1.222 1.00 . A A . 9 VAL N 1 1 2 352 1 1 9 VAL O O 2.166 -6.624 1.630 1.00 . A A . 9 VAL O 1 1 2 353 1 1 10 GLY C C -1.559 -6.081 3.301 1.00 . A A . 10 GLY C 1 1 2 354 1 1 10 GLY CA C -0.236 -6.742 2.965 1.00 . A A . 10 GLY CA 1 1 2 355 1 1 10 GLY H H -0.839 -7.125 0.972 1.00 . A A . 10 GLY H 1 1 2 356 1 1 10 GLY HA2 H -0.191 -7.703 3.456 1.00 . A A . 10 GLY HA2 1 1 2 357 1 1 10 GLY HA3 H 0.568 -6.122 3.334 1.00 . A A . 10 GLY HA3 1 1 2 358 1 1 10 GLY N N -0.061 -6.936 1.537 1.00 . A A . 10 GLY N 1 1 2 359 1 1 10 GLY O O -2.607 -6.725 3.270 1.00 . A A . 10 GLY O 1 1 2 360 1 1 11 ASP C C -3.152 -3.171 2.782 1.00 . A A . 11 ASP C 1 1 2 361 1 1 11 ASP CA C -2.713 -4.040 3.956 1.00 . A A . 11 ASP CA 1 1 2 362 1 1 11 ASP CB C -2.469 -3.168 5.189 1.00 . A A . 11 ASP CB 1 1 2 363 1 1 11 ASP CG C -3.706 -3.029 6.056 1.00 . A A . 11 ASP CG 1 1 2 364 1 1 11 ASP H H -0.644 -4.332 3.622 1.00 . A A . 11 ASP H 1 1 2 365 1 1 11 ASP HA H -3.496 -4.751 4.177 1.00 . A A . 11 ASP HA 1 1 2 366 1 1 11 ASP HB2 H -1.684 -3.610 5.785 1.00 . A A . 11 ASP HB2 1 1 2 367 1 1 11 ASP HB3 H -2.162 -2.183 4.870 1.00 . A A . 11 ASP HB3 1 1 2 368 1 1 11 ASP N N -1.510 -4.791 3.618 1.00 . A A . 11 ASP N 1 1 2 369 1 1 11 ASP O O -4.345 -2.951 2.570 1.00 . A A . 11 ASP O 1 1 2 370 1 1 11 ASP OD1 O -3.855 -3.822 7.009 1.00 . A A . 11 ASP OD1 1 1 2 371 1 1 11 ASP OD2 O -4.524 -2.126 5.782 1.00 . A A . 11 ASP OD2 1 1 2 372 1 1 12 GLY C C -1.331 -0.929 0.503 1.00 . A A . 12 GLY C 1 1 2 373 1 1 12 GLY CA C -2.480 -1.846 0.875 1.00 . A A . 12 GLY CA 1 1 2 374 1 1 12 GLY H H -1.246 -2.894 2.238 1.00 . A A . 12 GLY H 1 1 2 375 1 1 12 GLY HA2 H -2.704 -2.481 0.032 1.00 . A A . 12 GLY HA2 1 1 2 376 1 1 12 GLY HA3 H -3.348 -1.244 1.100 1.00 . A A . 12 GLY HA3 1 1 2 377 1 1 12 GLY N N -2.178 -2.682 2.020 1.00 . A A . 12 GLY N 1 1 2 378 1 1 12 GLY O O -0.384 -0.764 1.272 1.00 . A A . 12 GLY O 1 1 2 379 1 1 13 ARG C C -0.763 2.026 -0.925 1.00 . A A . 13 ARG C 1 1 2 380 1 1 13 ARG CA C -0.374 0.570 -1.161 1.00 . A A . 13 ARG CA 1 1 2 381 1 1 13 ARG CB C -0.117 0.334 -2.651 1.00 . A A . 13 ARG CB 1 1 2 382 1 1 13 ARG CD C 1.557 0.017 -4.494 1.00 . A A . 13 ARG CD 1 1 2 383 1 1 13 ARG CG C 1.354 0.368 -3.030 1.00 . A A . 13 ARG CG 1 1 2 384 1 1 13 ARG CZ C 1.378 -2.017 -5.877 1.00 . A A . 13 ARG CZ 1 1 2 385 1 1 13 ARG H H -2.192 -0.507 -1.250 1.00 . A A . 13 ARG H 1 1 2 386 1 1 13 ARG HA H 0.530 0.358 -0.611 1.00 . A A . 13 ARG HA 1 1 2 387 1 1 13 ARG HB2 H -0.515 -0.632 -2.924 1.00 . A A . 13 ARG HB2 1 1 2 388 1 1 13 ARG HB3 H -0.630 1.097 -3.218 1.00 . A A . 13 ARG HB3 1 1 2 389 1 1 13 ARG HD2 H 0.733 0.420 -5.064 1.00 . A A . 13 ARG HD2 1 1 2 390 1 1 13 ARG HD3 H 2.480 0.462 -4.834 1.00 . A A . 13 ARG HD3 1 1 2 391 1 1 13 ARG HE H 1.848 -1.988 -3.938 1.00 . A A . 13 ARG HE 1 1 2 392 1 1 13 ARG HG2 H 1.740 1.360 -2.851 1.00 . A A . 13 ARG HG2 1 1 2 393 1 1 13 ARG HG3 H 1.889 -0.345 -2.420 1.00 . A A . 13 ARG HG3 1 1 2 394 1 1 13 ARG HH11 H 1.016 -0.294 -6.875 1.00 . A A . 13 ARG HH11 1 1 2 395 1 1 13 ARG HH12 H 0.891 -1.740 -7.820 1.00 . A A . 13 ARG HH12 1 1 2 396 1 1 13 ARG HH21 H 1.683 -3.889 -5.181 1.00 . A A . 13 ARG HH21 1 1 2 397 1 1 13 ARG HH22 H 1.268 -3.780 -6.859 1.00 . A A . 13 ARG HH22 1 1 2 398 1 1 13 ARG N N -1.413 -0.334 -0.682 1.00 . A A . 13 ARG N 1 1 2 399 1 1 13 ARG NE N 1.618 -1.427 -4.708 1.00 . A A . 13 ARG NE 1 1 2 400 1 1 13 ARG NH1 N 1.069 -1.290 -6.945 1.00 . A A . 13 ARG NH1 1 1 2 401 1 1 13 ARG NH2 N 1.449 -3.337 -5.981 1.00 . A A . 13 ARG NH2 1 1 2 402 1 1 13 ARG O O -1.926 2.401 -1.078 1.00 . A A . 13 ARG O 1 1 2 403 1 1 14 ILE C C 0.695 5.130 -1.333 1.00 . A A . 14 ILE C 1 1 2 404 1 1 14 ILE CA C -0.018 4.260 -0.302 1.00 . A A . 14 ILE CA 1 1 2 405 1 1 14 ILE CB C 0.440 4.678 1.114 1.00 . A A . 14 ILE CB 1 1 2 406 1 1 14 ILE CD1 C 2.895 4.096 0.758 1.00 . A A . 14 ILE CD1 1 1 2 407 1 1 14 ILE CG1 C 1.642 3.843 1.567 1.00 . A A . 14 ILE CG1 1 1 2 408 1 1 14 ILE CG2 C -0.709 4.545 2.104 1.00 . A A . 14 ILE CG2 1 1 2 409 1 1 14 ILE H H 1.125 2.483 -0.453 1.00 . A A . 14 ILE H 1 1 2 410 1 1 14 ILE HA H -1.082 4.436 -0.377 1.00 . A A . 14 ILE HA 1 1 2 411 1 1 14 ILE HB H 0.729 5.718 1.079 1.00 . A A . 14 ILE HB 1 1 2 412 1 1 14 ILE HD11 H 2.784 5.013 0.200 1.00 . A A . 14 ILE HD11 1 1 2 413 1 1 14 ILE HD12 H 3.053 3.275 0.074 1.00 . A A . 14 ILE HD12 1 1 2 414 1 1 14 ILE HD13 H 3.742 4.179 1.422 1.00 . A A . 14 ILE HD13 1 1 2 415 1 1 14 ILE HG12 H 1.862 4.074 2.599 1.00 . A A . 14 ILE HG12 1 1 2 416 1 1 14 ILE HG13 H 1.396 2.795 1.482 1.00 . A A . 14 ILE HG13 1 1 2 417 1 1 14 ILE HG21 H -0.381 3.980 2.964 1.00 . A A . 14 ILE HG21 1 1 2 418 1 1 14 ILE HG22 H -1.536 4.036 1.632 1.00 . A A . 14 ILE HG22 1 1 2 419 1 1 14 ILE HG23 H -1.026 5.528 2.421 1.00 . A A . 14 ILE HG23 1 1 2 420 1 1 14 ILE N N 0.219 2.842 -0.555 1.00 . A A . 14 ILE N 1 1 2 421 1 1 14 ILE O O 0.260 6.244 -1.626 1.00 . A A . 14 ILE O 1 1 2 422 1 1 15 LEU C C 2.808 4.478 -4.113 1.00 . A A . 15 LEU C 1 1 2 423 1 1 15 LEU CA C 2.562 5.344 -2.881 1.00 . A A . 15 LEU CA 1 1 2 424 1 1 15 LEU CB C 3.896 5.808 -2.289 1.00 . A A . 15 LEU CB 1 1 2 425 1 1 15 LEU CD1 C 3.589 8.133 -3.180 1.00 . A A . 15 LEU CD1 1 1 2 426 1 1 15 LEU CD2 C 3.090 7.640 -0.778 1.00 . A A . 15 LEU CD2 1 1 2 427 1 1 15 LEU CG C 3.978 7.302 -1.966 1.00 . A A . 15 LEU CG 1 1 2 428 1 1 15 LEU H H 2.088 3.722 -1.610 1.00 . A A . 15 LEU H 1 1 2 429 1 1 15 LEU HA H 1.988 6.211 -3.175 1.00 . A A . 15 LEU HA 1 1 2 430 1 1 15 LEU HB2 H 4.073 5.255 -1.378 1.00 . A A . 15 LEU HB2 1 1 2 431 1 1 15 LEU HB3 H 4.682 5.572 -2.991 1.00 . A A . 15 LEU HB3 1 1 2 432 1 1 15 LEU HD11 H 3.930 7.639 -4.078 1.00 . A A . 15 LEU HD11 1 1 2 433 1 1 15 LEU HD12 H 4.046 9.109 -3.110 1.00 . A A . 15 LEU HD12 1 1 2 434 1 1 15 LEU HD13 H 2.515 8.239 -3.213 1.00 . A A . 15 LEU HD13 1 1 2 435 1 1 15 LEU HD21 H 2.603 8.588 -0.949 1.00 . A A . 15 LEU HD21 1 1 2 436 1 1 15 LEU HD22 H 3.694 7.702 0.116 1.00 . A A . 15 LEU HD22 1 1 2 437 1 1 15 LEU HD23 H 2.344 6.869 -0.654 1.00 . A A . 15 LEU HD23 1 1 2 438 1 1 15 LEU HG H 4.997 7.551 -1.706 1.00 . A A . 15 LEU HG 1 1 2 439 1 1 15 LEU N N 1.791 4.614 -1.882 1.00 . A A . 15 LEU N 1 1 2 440 1 1 15 LEU O O 3.873 3.878 -4.260 1.00 . A A . 15 LEU O 1 1 2 441 1 1 16 ALA C C 2.390 4.475 -7.385 1.00 . A A . 16 ALA C 1 1 2 442 1 1 16 ALA CA C 1.923 3.621 -6.211 1.00 . A A . 16 ALA CA 1 1 2 443 1 1 16 ALA CB C 0.589 2.963 -6.531 1.00 . A A . 16 ALA CB 1 1 2 444 1 1 16 ALA H H 0.990 4.914 -4.821 1.00 . A A . 16 ALA H 1 1 2 445 1 1 16 ALA HA H 2.649 2.840 -6.036 1.00 . A A . 16 ALA HA 1 1 2 446 1 1 16 ALA HB1 H 0.759 1.961 -6.895 1.00 . A A . 16 ALA HB1 1 1 2 447 1 1 16 ALA HB2 H 0.075 3.539 -7.287 1.00 . A A . 16 ALA HB2 1 1 2 448 1 1 16 ALA HB3 H -0.016 2.923 -5.637 1.00 . A A . 16 ALA HB3 1 1 2 449 1 1 16 ALA N N 1.815 4.415 -4.994 1.00 . A A . 16 ALA N 1 1 2 450 1 1 16 ALA O O 1.831 4.404 -8.480 1.00 . A A . 16 ALA O 1 1 2 451 1 1 17 GLY C C 5.302 6.717 -7.848 1.00 . A A . 17 GLY C 1 1 2 452 1 1 17 GLY CA C 3.944 6.140 -8.197 1.00 . A A . 17 GLY CA 1 1 2 453 1 1 17 GLY H H 3.825 5.297 -6.258 1.00 . A A . 17 GLY H 1 1 2 454 1 1 17 GLY HA2 H 4.032 5.564 -9.107 1.00 . A A . 17 GLY HA2 1 1 2 455 1 1 17 GLY HA3 H 3.252 6.952 -8.363 1.00 . A A . 17 GLY HA3 1 1 2 456 1 1 17 GLY N N 3.419 5.283 -7.150 1.00 . A A . 17 GLY N 1 1 2 457 1 1 17 GLY O O 5.355 7.649 -7.019 1.00 . A A . 17 GLY O 1 1 2 458 1 1 17 GLY OXT O 6.311 6.236 -8.404 1.00 . A A . 17 GLY OXT 1 1 3 459 1 1 1 GLY C C 0.967 -3.015 1.017 1.00 . A A . 1 GLY C 1 1 3 460 1 1 1 GLY CA C 1.284 -2.433 -0.348 1.00 . A A . 1 GLY CA 1 1 3 461 1 1 1 GLY H1 H -0.587 -2.691 -1.285 1.00 . A A . 1 GLY H1 1 1 3 462 1 1 1 GLY HA2 H 2.289 -2.718 -0.623 1.00 . A A . 1 GLY HA2 1 1 3 463 1 1 1 GLY HA3 H 1.232 -1.356 -0.288 1.00 . A A . 1 GLY HA3 1 1 3 464 1 1 1 GLY N N 0.368 -2.890 -1.378 1.00 . A A . 1 GLY N 1 1 3 465 1 1 1 GLY O O -0.066 -3.659 1.194 1.00 . A A . 1 GLY O 1 1 3 466 1 1 2 PRO C C 0.561 -2.550 4.127 1.00 . A A . 2 PRO C 1 1 3 467 1 1 2 PRO CA C 1.644 -3.320 3.365 1.00 . A A . 2 PRO CA 1 1 3 468 1 1 2 PRO CB C 3.018 -3.152 4.019 1.00 . A A . 2 PRO CB 1 1 3 469 1 1 2 PRO CD C 3.109 -2.048 1.886 1.00 . A A . 2 PRO CD 1 1 3 470 1 1 2 PRO CG C 3.660 -2.022 3.288 1.00 . A A . 2 PRO CG 1 1 3 471 1 1 2 PRO HA H 1.382 -4.368 3.346 1.00 . A A . 2 PRO HA 1 1 3 472 1 1 2 PRO HB2 H 2.895 -2.926 5.068 1.00 . A A . 2 PRO HB2 1 1 3 473 1 1 2 PRO HB3 H 3.585 -4.064 3.908 1.00 . A A . 2 PRO HB3 1 1 3 474 1 1 2 PRO HD2 H 2.920 -1.044 1.538 1.00 . A A . 2 PRO HD2 1 1 3 475 1 1 2 PRO HD3 H 3.795 -2.554 1.222 1.00 . A A . 2 PRO HD3 1 1 3 476 1 1 2 PRO HG2 H 3.414 -1.087 3.767 1.00 . A A . 2 PRO HG2 1 1 3 477 1 1 2 PRO HG3 H 4.731 -2.161 3.269 1.00 . A A . 2 PRO HG3 1 1 3 478 1 1 2 PRO N N 1.848 -2.804 2.011 1.00 . A A . 2 PRO N 1 1 3 479 1 1 2 PRO O O -0.615 -2.901 4.056 1.00 . A A . 2 PRO O 1 1 3 480 1 1 3 LYS C C -0.542 0.451 4.784 1.00 . A A . 3 LYS C 1 1 3 481 1 1 3 LYS CA C -0.003 -0.708 5.617 1.00 . A A . 3 LYS CA 1 1 3 482 1 1 3 LYS CB C 0.648 -0.177 6.897 1.00 . A A . 3 LYS CB 1 1 3 483 1 1 3 LYS CD C 0.072 0.719 9.175 1.00 . A A . 3 LYS CD 1 1 3 484 1 1 3 LYS CE C -0.982 1.814 9.157 1.00 . A A . 3 LYS CE 1 1 3 485 1 1 3 LYS CG C -0.218 -0.352 8.135 1.00 . A A . 3 LYS CG 1 1 3 486 1 1 3 LYS H H 1.899 -1.264 4.882 1.00 . A A . 3 LYS H 1 1 3 487 1 1 3 LYS HA H -0.827 -1.352 5.886 1.00 . A A . 3 LYS HA 1 1 3 488 1 1 3 LYS HB2 H 1.578 -0.701 7.058 1.00 . A A . 3 LYS HB2 1 1 3 489 1 1 3 LYS HB3 H 0.854 0.876 6.775 1.00 . A A . 3 LYS HB3 1 1 3 490 1 1 3 LYS HD2 H 0.084 0.262 10.154 1.00 . A A . 3 LYS HD2 1 1 3 491 1 1 3 LYS HD3 H 1.038 1.156 8.968 1.00 . A A . 3 LYS HD3 1 1 3 492 1 1 3 LYS HE2 H -0.602 2.652 8.591 1.00 . A A . 3 LYS HE2 1 1 3 493 1 1 3 LYS HE3 H -1.872 1.432 8.679 1.00 . A A . 3 LYS HE3 1 1 3 494 1 1 3 LYS HG2 H -1.257 -0.289 7.848 1.00 . A A . 3 LYS HG2 1 1 3 495 1 1 3 LYS HG3 H -0.020 -1.323 8.566 1.00 . A A . 3 LYS HG3 1 1 3 496 1 1 3 LYS HZ1 H -2.337 2.523 10.580 1.00 . A A . 3 LYS HZ1 1 1 3 497 1 1 3 LYS HZ2 H -0.765 3.113 10.778 1.00 . A A . 3 LYS HZ2 1 1 3 498 1 1 3 LYS HZ3 H -1.132 1.522 11.220 1.00 . A A . 3 LYS HZ3 1 1 3 499 1 1 3 LYS N N 0.953 -1.505 4.855 1.00 . A A . 3 LYS N 1 1 3 500 1 1 3 LYS NZ N -1.328 2.275 10.530 1.00 . A A . 3 LYS NZ 1 1 3 501 1 1 3 LYS O O -0.030 1.569 4.854 1.00 . A A . 3 LYS O 1 1 3 502 1 1 4 GLY C C -3.655 1.009 2.948 1.00 . A A . 4 GLY C 1 1 3 503 1 1 4 GLY CA C -2.169 1.217 3.170 1.00 . A A . 4 GLY CA 1 1 3 504 1 1 4 GLY H H -1.950 -0.726 3.983 1.00 . A A . 4 GLY H 1 1 3 505 1 1 4 GLY HA2 H -2.019 2.174 3.649 1.00 . A A . 4 GLY HA2 1 1 3 506 1 1 4 GLY HA3 H -1.671 1.226 2.213 1.00 . A A . 4 GLY HA3 1 1 3 507 1 1 4 GLY N N -1.580 0.182 3.999 1.00 . A A . 4 GLY N 1 1 3 508 1 1 4 GLY O O -4.311 0.306 3.716 1.00 . A A . 4 GLY O 1 1 3 509 1 1 5 ASP C C -5.818 0.712 0.287 1.00 . A A . 5 ASP C 1 1 3 510 1 1 5 ASP CA C -5.604 1.506 1.575 1.00 . A A . 5 ASP CA 1 1 3 511 1 1 5 ASP CB C -6.235 2.894 1.442 1.00 . A A . 5 ASP CB 1 1 3 512 1 1 5 ASP CG C -5.402 3.832 0.588 1.00 . A A . 5 ASP CG 1 1 3 513 1 1 5 ASP H H -3.610 2.172 1.322 1.00 . A A . 5 ASP H 1 1 3 514 1 1 5 ASP HA H -6.084 0.981 2.388 1.00 . A A . 5 ASP HA 1 1 3 515 1 1 5 ASP HB2 H -7.210 2.797 0.990 1.00 . A A . 5 ASP HB2 1 1 3 516 1 1 5 ASP HB3 H -6.340 3.329 2.425 1.00 . A A . 5 ASP HB3 1 1 3 517 1 1 5 ASP N N -4.186 1.624 1.896 1.00 . A A . 5 ASP N 1 1 3 518 1 1 5 ASP O O -6.912 0.208 0.035 1.00 . A A . 5 ASP O 1 1 3 519 1 1 5 ASP OD1 O -4.410 3.367 -0.012 1.00 . A A . 5 ASP OD1 1 1 3 520 1 1 5 ASP OD2 O -5.743 5.031 0.520 1.00 . A A . 5 ASP OD2 1 1 3 521 1 1 6 PHE C C -4.053 -1.427 -1.709 1.00 . A A . 6 PHE C 1 1 3 522 1 1 6 PHE CA C -4.853 -0.128 -1.785 1.00 . A A . 6 PHE CA 1 1 3 523 1 1 6 PHE CB C -4.337 0.736 -2.938 1.00 . A A . 6 PHE CB 1 1 3 524 1 1 6 PHE CD1 C -5.732 1.558 -4.855 1.00 . A A . 6 PHE CD1 1 1 3 525 1 1 6 PHE CD2 C -6.006 2.598 -2.726 1.00 . A A . 6 PHE CD2 1 1 3 526 1 1 6 PHE CE1 C -6.691 2.396 -5.391 1.00 . A A . 6 PHE CE1 1 1 3 527 1 1 6 PHE CE2 C -6.965 3.440 -3.257 1.00 . A A . 6 PHE CE2 1 1 3 528 1 1 6 PHE CG C -5.379 1.649 -3.518 1.00 . A A . 6 PHE CG 1 1 3 529 1 1 6 PHE CZ C -7.308 3.339 -4.592 1.00 . A A . 6 PHE CZ 1 1 3 530 1 1 6 PHE H H -3.923 1.028 -0.275 1.00 . A A . 6 PHE H 1 1 3 531 1 1 6 PHE HA H -5.891 -0.367 -1.963 1.00 . A A . 6 PHE HA 1 1 3 532 1 1 6 PHE HB2 H -3.521 1.347 -2.582 1.00 . A A . 6 PHE HB2 1 1 3 533 1 1 6 PHE HB3 H -3.980 0.092 -3.728 1.00 . A A . 6 PHE HB3 1 1 3 534 1 1 6 PHE HD1 H -5.251 0.821 -5.481 1.00 . A A . 6 PHE HD1 1 1 3 535 1 1 6 PHE HD2 H -5.738 2.678 -1.683 1.00 . A A . 6 PHE HD2 1 1 3 536 1 1 6 PHE HE1 H -6.957 2.316 -6.435 1.00 . A A . 6 PHE HE1 1 1 3 537 1 1 6 PHE HE2 H -7.445 4.176 -2.630 1.00 . A A . 6 PHE HE2 1 1 3 538 1 1 6 PHE HZ H -8.057 3.995 -5.009 1.00 . A A . 6 PHE HZ 1 1 3 539 1 1 6 PHE N N -4.771 0.605 -0.526 1.00 . A A . 6 PHE N 1 1 3 540 1 1 6 PHE O O -2.852 -1.441 -1.978 1.00 . A A . 6 PHE O 1 1 3 541 1 1 7 PRO C C -3.126 -4.149 -2.392 1.00 . A A . 7 PRO C 1 1 3 542 1 1 7 PRO CA C -4.055 -3.848 -1.219 1.00 . A A . 7 PRO CA 1 1 3 543 1 1 7 PRO CB C -5.231 -4.821 -1.204 1.00 . A A . 7 PRO CB 1 1 3 544 1 1 7 PRO CD C -6.145 -2.614 -0.993 1.00 . A A . 7 PRO CD 1 1 3 545 1 1 7 PRO CG C -6.344 -4.050 -0.582 1.00 . A A . 7 PRO CG 1 1 3 546 1 1 7 PRO HA H -3.504 -3.932 -0.295 1.00 . A A . 7 PRO HA 1 1 3 547 1 1 7 PRO HB2 H -5.470 -5.118 -2.215 1.00 . A A . 7 PRO HB2 1 1 3 548 1 1 7 PRO HB3 H -4.977 -5.690 -0.616 1.00 . A A . 7 PRO HB3 1 1 3 549 1 1 7 PRO HD2 H -6.757 -2.380 -1.852 1.00 . A A . 7 PRO HD2 1 1 3 550 1 1 7 PRO HD3 H -6.378 -1.952 -0.172 1.00 . A A . 7 PRO HD3 1 1 3 551 1 1 7 PRO HG2 H -7.292 -4.416 -0.949 1.00 . A A . 7 PRO HG2 1 1 3 552 1 1 7 PRO HG3 H -6.297 -4.141 0.493 1.00 . A A . 7 PRO HG3 1 1 3 553 1 1 7 PRO N N -4.710 -2.541 -1.336 1.00 . A A . 7 PRO N 1 1 3 554 1 1 7 PRO O O -3.466 -3.898 -3.548 1.00 . A A . 7 PRO O 1 1 3 555 1 1 8 ASP C C 0.000 -6.097 -2.607 1.00 . A A . 8 ASP C 1 1 3 556 1 1 8 ASP CA C -0.973 -5.032 -3.110 1.00 . A A . 8 ASP CA 1 1 3 557 1 1 8 ASP CB C -0.210 -3.779 -3.555 1.00 . A A . 8 ASP CB 1 1 3 558 1 1 8 ASP CG C 0.830 -3.327 -2.545 1.00 . A A . 8 ASP CG 1 1 3 559 1 1 8 ASP H H -1.741 -4.870 -1.143 1.00 . A A . 8 ASP H 1 1 3 560 1 1 8 ASP HA H -1.512 -5.431 -3.956 1.00 . A A . 8 ASP HA 1 1 3 561 1 1 8 ASP HB2 H 0.292 -3.986 -4.488 1.00 . A A . 8 ASP HB2 1 1 3 562 1 1 8 ASP HB3 H -0.914 -2.973 -3.704 1.00 . A A . 8 ASP HB3 1 1 3 563 1 1 8 ASP N N -1.952 -4.693 -2.083 1.00 . A A . 8 ASP N 1 1 3 564 1 1 8 ASP O O 0.315 -7.049 -3.321 1.00 . A A . 8 ASP O 1 1 3 565 1 1 8 ASP OD1 O 2.030 -3.368 -2.816 1.00 . A A . 8 ASP OD1 1 1 3 566 1 1 9 VAL C C 1.228 -6.940 0.737 1.00 . A A . 9 VAL C 1 1 3 567 1 1 9 VAL CA C 1.406 -6.875 -0.778 1.00 . A A . 9 VAL CA 1 1 3 568 1 1 9 VAL CB C 2.867 -6.503 -1.106 1.00 . A A . 9 VAL CB 1 1 3 569 1 1 9 VAL CG1 C 3.229 -5.151 -0.504 1.00 . A A . 9 VAL CG1 1 1 3 570 1 1 9 VAL CG2 C 3.819 -7.589 -0.621 1.00 . A A . 9 VAL CG2 1 1 3 571 1 1 9 VAL H H 0.182 -5.151 -0.855 1.00 . A A . 9 VAL H 1 1 3 572 1 1 9 VAL HA H 1.203 -7.851 -1.196 1.00 . A A . 9 VAL HA 1 1 3 573 1 1 9 VAL HB H 2.963 -6.427 -2.180 1.00 . A A . 9 VAL HB 1 1 3 574 1 1 9 VAL HG11 H 4.177 -5.225 0.007 1.00 . A A . 9 VAL HG11 1 1 3 575 1 1 9 VAL HG12 H 2.465 -4.852 0.197 1.00 . A A . 9 VAL HG12 1 1 3 576 1 1 9 VAL HG13 H 3.302 -4.415 -1.291 1.00 . A A . 9 VAL HG13 1 1 3 577 1 1 9 VAL HG21 H 3.281 -8.287 0.003 1.00 . A A . 9 VAL HG21 1 1 3 578 1 1 9 VAL HG22 H 4.619 -7.140 -0.051 1.00 . A A . 9 VAL HG22 1 1 3 579 1 1 9 VAL HG23 H 4.232 -8.111 -1.471 1.00 . A A . 9 VAL HG23 1 1 3 580 1 1 9 VAL N N 0.471 -5.929 -1.375 1.00 . A A . 9 VAL N 1 1 3 581 1 1 9 VAL O O 2.203 -6.991 1.488 1.00 . A A . 9 VAL O 1 1 3 582 1 1 10 GLY C C -1.684 -6.446 2.936 1.00 . A A . 10 GLY C 1 1 3 583 1 1 10 GLY CA C -0.311 -6.993 2.601 1.00 . A A . 10 GLY CA 1 1 3 584 1 1 10 GLY H H -0.762 -6.892 0.535 1.00 . A A . 10 GLY H 1 1 3 585 1 1 10 GLY HA2 H -0.255 -8.021 2.928 1.00 . A A . 10 GLY HA2 1 1 3 586 1 1 10 GLY HA3 H 0.433 -6.416 3.131 1.00 . A A . 10 GLY HA3 1 1 3 587 1 1 10 GLY N N -0.025 -6.936 1.180 1.00 . A A . 10 GLY N 1 1 3 588 1 1 10 GLY O O -2.683 -7.160 2.848 1.00 . A A . 10 GLY O 1 1 3 589 1 1 11 ASP C C -3.353 -3.454 2.646 1.00 . A A . 11 ASP C 1 1 3 590 1 1 11 ASP CA C -2.998 -4.531 3.666 1.00 . A A . 11 ASP CA 1 1 3 591 1 1 11 ASP CB C -2.917 -3.919 5.065 1.00 . A A . 11 ASP CB 1 1 3 592 1 1 11 ASP CG C -4.220 -4.050 5.830 1.00 . A A . 11 ASP CG 1 1 3 593 1 1 11 ASP H H -0.905 -4.656 3.368 1.00 . A A . 11 ASP H 1 1 3 594 1 1 11 ASP HA H -3.769 -5.287 3.656 1.00 . A A . 11 ASP HA 1 1 3 595 1 1 11 ASP HB2 H -2.141 -4.418 5.626 1.00 . A A . 11 ASP HB2 1 1 3 596 1 1 11 ASP HB3 H -2.675 -2.869 4.979 1.00 . A A . 11 ASP HB3 1 1 3 597 1 1 11 ASP N N -1.736 -5.174 3.319 1.00 . A A . 11 ASP N 1 1 3 598 1 1 11 ASP O O -4.521 -3.271 2.303 1.00 . A A . 11 ASP O 1 1 3 599 1 1 11 ASP OD1 O -5.270 -4.249 5.184 1.00 . A A . 11 ASP OD1 1 1 3 600 1 1 11 ASP OD2 O -4.189 -3.954 7.075 1.00 . A A . 11 ASP OD2 1 1 3 601 1 1 12 GLY C C -1.332 -0.844 0.949 1.00 . A A . 12 GLY C 1 1 3 602 1 1 12 GLY CA C -2.562 -1.699 1.184 1.00 . A A . 12 GLY CA 1 1 3 603 1 1 12 GLY H H -1.426 -2.938 2.471 1.00 . A A . 12 GLY H 1 1 3 604 1 1 12 GLY HA2 H -2.851 -2.155 0.251 1.00 . A A . 12 GLY HA2 1 1 3 605 1 1 12 GLY HA3 H -3.367 -1.067 1.529 1.00 . A A . 12 GLY HA3 1 1 3 606 1 1 12 GLY N N -2.336 -2.746 2.162 1.00 . A A . 12 GLY N 1 1 3 607 1 1 12 GLY O O -0.432 -0.795 1.787 1.00 . A A . 12 GLY O 1 1 3 608 1 1 13 ARG C C -0.554 2.165 -0.437 1.00 . A A . 13 ARG C 1 1 3 609 1 1 13 ARG CA C -0.169 0.693 -0.540 1.00 . A A . 13 ARG CA 1 1 3 610 1 1 13 ARG CB C 0.324 0.382 -1.955 1.00 . A A . 13 ARG CB 1 1 3 611 1 1 13 ARG CD C -0.248 0.182 -4.394 1.00 . A A . 13 ARG CD 1 1 3 612 1 1 13 ARG CG C -0.682 0.725 -3.042 1.00 . A A . 13 ARG CG 1 1 3 613 1 1 13 ARG CZ C -1.555 1.557 -5.967 1.00 . A A . 13 ARG CZ 1 1 3 614 1 1 13 ARG H H -2.045 -0.246 -0.821 1.00 . A A . 13 ARG H 1 1 3 615 1 1 13 ARG HA H 0.627 0.492 0.161 1.00 . A A . 13 ARG HA 1 1 3 616 1 1 13 ARG HB2 H 1.228 0.944 -2.141 1.00 . A A . 13 ARG HB2 1 1 3 617 1 1 13 ARG HB3 H 0.548 -0.672 -2.023 1.00 . A A . 13 ARG HB3 1 1 3 618 1 1 13 ARG HD2 H 0.655 0.691 -4.699 1.00 . A A . 13 ARG HD2 1 1 3 619 1 1 13 ARG HD3 H -0.048 -0.874 -4.296 1.00 . A A . 13 ARG HD3 1 1 3 620 1 1 13 ARG HE H -1.773 -0.410 -5.713 1.00 . A A . 13 ARG HE 1 1 3 621 1 1 13 ARG HG2 H -1.638 0.296 -2.783 1.00 . A A . 13 ARG HG2 1 1 3 622 1 1 13 ARG HG3 H -0.773 1.800 -3.108 1.00 . A A . 13 ARG HG3 1 1 3 623 1 1 13 ARG HH11 H -0.182 2.587 -4.895 1.00 . A A . 13 ARG HH11 1 1 3 624 1 1 13 ARG HH12 H -1.114 3.530 -6.009 1.00 . A A . 13 ARG HH12 1 1 3 625 1 1 13 ARG HH21 H -2.999 0.829 -7.178 1.00 . A A . 13 ARG HH21 1 1 3 626 1 1 13 ARG HH22 H -2.714 2.532 -7.305 1.00 . A A . 13 ARG HH22 1 1 3 627 1 1 13 ARG N N -1.296 -0.167 -0.195 1.00 . A A . 13 ARG N 1 1 3 628 1 1 13 ARG NE N -1.271 0.378 -5.418 1.00 . A A . 13 ARG NE 1 1 3 629 1 1 13 ARG NH1 N -0.896 2.647 -5.593 1.00 . A A . 13 ARG NH1 1 1 3 630 1 1 13 ARG NH2 N -2.500 1.647 -6.893 1.00 . A A . 13 ARG NH2 1 1 3 631 1 1 13 ARG O O -1.645 2.502 0.024 1.00 . A A . 13 ARG O 1 1 3 632 1 1 14 ILE C C 0.607 5.156 -2.100 1.00 . A A . 14 ILE C 1 1 3 633 1 1 14 ILE CA C 0.107 4.475 -0.830 1.00 . A A . 14 ILE CA 1 1 3 634 1 1 14 ILE CB C 0.784 5.127 0.391 1.00 . A A . 14 ILE CB 1 1 3 635 1 1 14 ILE CD1 C 2.962 5.231 1.708 1.00 . A A . 14 ILE CD1 1 1 3 636 1 1 14 ILE CG1 C 2.237 4.661 0.508 1.00 . A A . 14 ILE CG1 1 1 3 637 1 1 14 ILE CG2 C 0.011 4.800 1.661 1.00 . A A . 14 ILE CG2 1 1 3 638 1 1 14 ILE H H 1.200 2.707 -1.227 1.00 . A A . 14 ILE H 1 1 3 639 1 1 14 ILE HA H -0.960 4.630 -0.748 1.00 . A A . 14 ILE HA 1 1 3 640 1 1 14 ILE HB H 0.767 6.198 0.256 1.00 . A A . 14 ILE HB 1 1 3 641 1 1 14 ILE HD11 H 3.291 6.235 1.486 1.00 . A A . 14 ILE HD11 1 1 3 642 1 1 14 ILE HD12 H 3.819 4.614 1.937 1.00 . A A . 14 ILE HD12 1 1 3 643 1 1 14 ILE HD13 H 2.295 5.249 2.557 1.00 . A A . 14 ILE HD13 1 1 3 644 1 1 14 ILE HG12 H 2.258 3.585 0.589 1.00 . A A . 14 ILE HG12 1 1 3 645 1 1 14 ILE HG13 H 2.776 4.961 -0.379 1.00 . A A . 14 ILE HG13 1 1 3 646 1 1 14 ILE HG21 H 0.479 3.965 2.162 1.00 . A A . 14 ILE HG21 1 1 3 647 1 1 14 ILE HG22 H -1.006 4.543 1.406 1.00 . A A . 14 ILE HG22 1 1 3 648 1 1 14 ILE HG23 H 0.013 5.659 2.315 1.00 . A A . 14 ILE HG23 1 1 3 649 1 1 14 ILE N N 0.350 3.038 -0.870 1.00 . A A . 14 ILE N 1 1 3 650 1 1 14 ILE O O -0.068 6.020 -2.660 1.00 . A A . 14 ILE O 1 1 3 651 1 1 15 LEU C C 2.015 4.506 -4.986 1.00 . A A . 15 LEU C 1 1 3 652 1 1 15 LEU CA C 2.382 5.332 -3.758 1.00 . A A . 15 LEU CA 1 1 3 653 1 1 15 LEU CB C 3.904 5.412 -3.619 1.00 . A A . 15 LEU CB 1 1 3 654 1 1 15 LEU CD1 C 3.953 7.912 -3.788 1.00 . A A . 15 LEU CD1 1 1 3 655 1 1 15 LEU CD2 C 3.991 6.812 -1.542 1.00 . A A . 15 LEU CD2 1 1 3 656 1 1 15 LEU CG C 4.430 6.706 -2.995 1.00 . A A . 15 LEU CG 1 1 3 657 1 1 15 LEU H H 2.285 4.067 -2.064 1.00 . A A . 15 LEU H 1 1 3 658 1 1 15 LEU HA H 1.987 6.329 -3.878 1.00 . A A . 15 LEU HA 1 1 3 659 1 1 15 LEU HB2 H 4.233 4.583 -3.009 1.00 . A A . 15 LEU HB2 1 1 3 660 1 1 15 LEU HB3 H 4.340 5.310 -4.601 1.00 . A A . 15 LEU HB3 1 1 3 661 1 1 15 LEU HD11 H 2.957 8.182 -3.469 1.00 . A A . 15 LEU HD11 1 1 3 662 1 1 15 LEU HD12 H 3.940 7.669 -4.840 1.00 . A A . 15 LEU HD12 1 1 3 663 1 1 15 LEU HD13 H 4.623 8.742 -3.618 1.00 . A A . 15 LEU HD13 1 1 3 664 1 1 15 LEU HD21 H 4.359 7.737 -1.122 1.00 . A A . 15 LEU HD21 1 1 3 665 1 1 15 LEU HD22 H 4.390 5.979 -0.983 1.00 . A A . 15 LEU HD22 1 1 3 666 1 1 15 LEU HD23 H 2.912 6.798 -1.490 1.00 . A A . 15 LEU HD23 1 1 3 667 1 1 15 LEU HG H 5.510 6.696 -3.019 1.00 . A A . 15 LEU HG 1 1 3 668 1 1 15 LEU N N 1.794 4.760 -2.552 1.00 . A A . 15 LEU N 1 1 3 669 1 1 15 LEU O O 1.782 3.301 -4.890 1.00 . A A . 15 LEU O 1 1 3 670 1 1 16 ALA C C 2.865 4.274 -8.251 1.00 . A A . 16 ALA C 1 1 3 671 1 1 16 ALA CA C 1.626 4.487 -7.388 1.00 . A A . 16 ALA CA 1 1 3 672 1 1 16 ALA CB C 0.580 5.285 -8.152 1.00 . A A . 16 ALA CB 1 1 3 673 1 1 16 ALA H H 2.160 6.122 -6.155 1.00 . A A . 16 ALA H 1 1 3 674 1 1 16 ALA HA H 1.201 3.525 -7.142 1.00 . A A . 16 ALA HA 1 1 3 675 1 1 16 ALA HB1 H -0.033 5.836 -7.454 1.00 . A A . 16 ALA HB1 1 1 3 676 1 1 16 ALA HB2 H -0.042 4.611 -8.722 1.00 . A A . 16 ALA HB2 1 1 3 677 1 1 16 ALA HB3 H 1.071 5.975 -8.821 1.00 . A A . 16 ALA HB3 1 1 3 678 1 1 16 ALA N N 1.965 5.161 -6.141 1.00 . A A . 16 ALA N 1 1 3 679 1 1 16 ALA O O 2.961 3.291 -8.986 1.00 . A A . 16 ALA O 1 1 3 680 1 1 17 GLY C C 6.262 5.487 -8.139 1.00 . A A . 17 GLY C 1 1 3 681 1 1 17 GLY CA C 5.032 5.097 -8.934 1.00 . A A . 17 GLY CA 1 1 3 682 1 1 17 GLY H H 3.680 5.964 -7.555 1.00 . A A . 17 GLY H 1 1 3 683 1 1 17 GLY HA2 H 5.144 4.077 -9.272 1.00 . A A . 17 GLY HA2 1 1 3 684 1 1 17 GLY HA3 H 4.954 5.744 -9.796 1.00 . A A . 17 GLY HA3 1 1 3 685 1 1 17 GLY N N 3.812 5.202 -8.157 1.00 . A A . 17 GLY N 1 1 3 686 1 1 17 GLY O O 7.065 4.589 -7.808 1.00 . A A . 17 GLY O 1 1 3 687 1 1 17 GLY OXT O 6.424 6.691 -7.847 1.00 . A A . 17 GLY OXT 1 1 4 688 1 1 1 GLY C C 1.119 -3.237 1.255 1.00 . A A . 1 GLY C 1 1 4 689 1 1 1 GLY CA C 1.574 -2.819 -0.131 1.00 . A A . 1 GLY CA 1 1 4 690 1 1 1 GLY H1 H -0.305 -2.812 -1.091 1.00 . A A . 1 GLY H1 1 1 4 691 1 1 1 GLY HA2 H 2.509 -3.312 -0.354 1.00 . A A . 1 GLY HA2 1 1 4 692 1 1 1 GLY HA3 H 1.734 -1.751 -0.137 1.00 . A A . 1 GLY HA3 1 1 4 693 1 1 1 GLY N N 0.611 -3.153 -1.165 1.00 . A A . 1 GLY N 1 1 4 694 1 1 1 GLY O O 0.035 -3.799 1.411 1.00 . A A . 1 GLY O 1 1 4 695 1 1 2 PRO C C 0.541 -2.410 4.274 1.00 . A A . 2 PRO C 1 1 4 696 1 1 2 PRO CA C 1.602 -3.333 3.668 1.00 . A A . 2 PRO CA 1 1 4 697 1 1 2 PRO CB C 2.939 -3.206 4.403 1.00 . A A . 2 PRO CB 1 1 4 698 1 1 2 PRO CD C 3.249 -2.310 2.188 1.00 . A A . 2 PRO CD 1 1 4 699 1 1 2 PRO CG C 3.730 -2.218 3.613 1.00 . A A . 2 PRO CG 1 1 4 700 1 1 2 PRO HA H 1.254 -4.354 3.730 1.00 . A A . 2 PRO HA 1 1 4 701 1 1 2 PRO HB2 H 2.765 -2.856 5.411 1.00 . A A . 2 PRO HB2 1 1 4 702 1 1 2 PRO HB3 H 3.428 -4.168 4.432 1.00 . A A . 2 PRO HB3 1 1 4 703 1 1 2 PRO HD2 H 3.145 -1.322 1.763 1.00 . A A . 2 PRO HD2 1 1 4 704 1 1 2 PRO HD3 H 3.934 -2.902 1.599 1.00 . A A . 2 PRO HD3 1 1 4 705 1 1 2 PRO HG2 H 3.565 -1.224 3.998 1.00 . A A . 2 PRO HG2 1 1 4 706 1 1 2 PRO HG3 H 4.780 -2.468 3.667 1.00 . A A . 2 PRO HG3 1 1 4 707 1 1 2 PRO N N 1.936 -2.974 2.290 1.00 . A A . 2 PRO N 1 1 4 708 1 1 2 PRO O O -0.652 -2.699 4.200 1.00 . A A . 2 PRO O 1 1 4 709 1 1 3 LYS C C -0.392 0.708 4.480 1.00 . A A . 3 LYS C 1 1 4 710 1 1 3 LYS CA C 0.046 -0.355 5.484 1.00 . A A . 3 LYS CA 1 1 4 711 1 1 3 LYS CB C 0.692 0.308 6.704 1.00 . A A . 3 LYS CB 1 1 4 712 1 1 3 LYS CD C 0.371 -0.495 9.067 1.00 . A A . 3 LYS CD 1 1 4 713 1 1 3 LYS CE C 0.541 -1.951 8.667 1.00 . A A . 3 LYS CE 1 1 4 714 1 1 3 LYS CG C -0.209 0.332 7.929 1.00 . A A . 3 LYS CG 1 1 4 715 1 1 3 LYS H H 1.931 -1.116 4.908 1.00 . A A . 3 LYS H 1 1 4 716 1 1 3 LYS HA H -0.824 -0.907 5.806 1.00 . A A . 3 LYS HA 1 1 4 717 1 1 3 LYS HB2 H 1.594 -0.230 6.955 1.00 . A A . 3 LYS HB2 1 1 4 718 1 1 3 LYS HB3 H 0.949 1.327 6.453 1.00 . A A . 3 LYS HB3 1 1 4 719 1 1 3 LYS HD2 H 1.336 -0.091 9.337 1.00 . A A . 3 LYS HD2 1 1 4 720 1 1 3 LYS HD3 H -0.295 -0.439 9.915 1.00 . A A . 3 LYS HD3 1 1 4 721 1 1 3 LYS HE2 H -0.363 -2.286 8.180 1.00 . A A . 3 LYS HE2 1 1 4 722 1 1 3 LYS HE3 H 1.370 -2.027 7.977 1.00 . A A . 3 LYS HE3 1 1 4 723 1 1 3 LYS HG2 H -0.321 1.353 8.262 1.00 . A A . 3 LYS HG2 1 1 4 724 1 1 3 LYS HG3 H -1.175 -0.069 7.661 1.00 . A A . 3 LYS HG3 1 1 4 725 1 1 3 LYS HZ1 H -0.075 -3.269 10.166 1.00 . A A . 3 LYS HZ1 1 1 4 726 1 1 3 LYS HZ2 H 1.204 -2.261 10.623 1.00 . A A . 3 LYS HZ2 1 1 4 727 1 1 3 LYS HZ3 H 1.487 -3.569 9.589 1.00 . A A . 3 LYS HZ3 1 1 4 728 1 1 3 LYS N N 0.973 -1.302 4.874 1.00 . A A . 3 LYS N 1 1 4 729 1 1 3 LYS NZ N 0.808 -2.824 9.844 1.00 . A A . 3 LYS NZ 1 1 4 730 1 1 3 LYS O O 0.191 1.790 4.412 1.00 . A A . 3 LYS O 1 1 4 731 1 1 4 GLY C C -3.387 1.129 2.400 1.00 . A A . 4 GLY C 1 1 4 732 1 1 4 GLY CA C -1.917 1.331 2.711 1.00 . A A . 4 GLY CA 1 1 4 733 1 1 4 GLY H H -1.846 -0.486 3.797 1.00 . A A . 4 GLY H 1 1 4 734 1 1 4 GLY HA2 H -1.774 2.335 3.082 1.00 . A A . 4 GLY HA2 1 1 4 735 1 1 4 GLY HA3 H -1.348 1.212 1.801 1.00 . A A . 4 GLY HA3 1 1 4 736 1 1 4 GLY N N -1.421 0.392 3.700 1.00 . A A . 4 GLY N 1 1 4 737 1 1 4 GLY O O -4.050 0.294 3.015 1.00 . A A . 4 GLY O 1 1 4 738 1 1 5 ASP C C -5.441 1.119 -0.310 1.00 . A A . 5 ASP C 1 1 4 739 1 1 5 ASP CA C -5.300 1.799 1.048 1.00 . A A . 5 ASP CA 1 1 4 740 1 1 5 ASP CB C -5.935 3.190 1.003 1.00 . A A . 5 ASP CB 1 1 4 741 1 1 5 ASP CG C -5.637 4.003 2.248 1.00 . A A . 5 ASP CG 1 1 4 742 1 1 5 ASP H H -3.318 2.543 0.987 1.00 . A A . 5 ASP H 1 1 4 743 1 1 5 ASP HA H -5.811 1.205 1.790 1.00 . A A . 5 ASP HA 1 1 4 744 1 1 5 ASP HB2 H -5.553 3.726 0.146 1.00 . A A . 5 ASP HB2 1 1 4 745 1 1 5 ASP HB3 H -7.006 3.087 0.909 1.00 . A A . 5 ASP HB3 1 1 4 746 1 1 5 ASP N N -3.898 1.896 1.441 1.00 . A A . 5 ASP N 1 1 4 747 1 1 5 ASP O O -6.383 1.388 -1.056 1.00 . A A . 5 ASP O 1 1 4 748 1 1 5 ASP OD1 O -5.520 5.241 2.134 1.00 . A A . 5 ASP OD1 1 1 4 749 1 1 5 ASP OD2 O -5.522 3.401 3.336 1.00 . A A . 5 ASP OD2 1 1 4 750 1 1 6 PHE C C -3.878 -1.865 -1.734 1.00 . A A . 6 PHE C 1 1 4 751 1 1 6 PHE CA C -4.518 -0.487 -1.891 1.00 . A A . 6 PHE CA 1 1 4 752 1 1 6 PHE CB C -3.780 0.311 -2.969 1.00 . A A . 6 PHE CB 1 1 4 753 1 1 6 PHE CD1 C -5.148 2.391 -3.290 1.00 . A A . 6 PHE CD1 1 1 4 754 1 1 6 PHE CD2 C -5.065 0.803 -5.068 1.00 . A A . 6 PHE CD2 1 1 4 755 1 1 6 PHE CE1 C -5.977 3.198 -4.045 1.00 . A A . 6 PHE CE1 1 1 4 756 1 1 6 PHE CE2 C -5.894 1.606 -5.828 1.00 . A A . 6 PHE CE2 1 1 4 757 1 1 6 PHE CG C -4.683 1.186 -3.792 1.00 . A A . 6 PHE CG 1 1 4 758 1 1 6 PHE CZ C -6.351 2.805 -5.316 1.00 . A A . 6 PHE CZ 1 1 4 759 1 1 6 PHE H H -3.775 0.062 0.012 1.00 . A A . 6 PHE H 1 1 4 760 1 1 6 PHE HA H -5.548 -0.612 -2.188 1.00 . A A . 6 PHE HA 1 1 4 761 1 1 6 PHE HB2 H -3.045 0.945 -2.497 1.00 . A A . 6 PHE HB2 1 1 4 762 1 1 6 PHE HB3 H -3.281 -0.375 -3.637 1.00 . A A . 6 PHE HB3 1 1 4 763 1 1 6 PHE HD1 H -4.855 2.699 -2.297 1.00 . A A . 6 PHE HD1 1 1 4 764 1 1 6 PHE HD2 H -4.708 -0.134 -5.469 1.00 . A A . 6 PHE HD2 1 1 4 765 1 1 6 PHE HE1 H -6.333 4.135 -3.642 1.00 . A A . 6 PHE HE1 1 1 4 766 1 1 6 PHE HE2 H -6.185 1.296 -6.821 1.00 . A A . 6 PHE HE2 1 1 4 767 1 1 6 PHE HZ H -6.999 3.434 -5.908 1.00 . A A . 6 PHE HZ 1 1 4 768 1 1 6 PHE N N -4.500 0.235 -0.624 1.00 . A A . 6 PHE N 1 1 4 769 1 1 6 PHE O O -2.677 -2.028 -1.951 1.00 . A A . 6 PHE O 1 1 4 770 1 1 7 PRO C C -3.243 -4.695 -2.272 1.00 . A A . 7 PRO C 1 1 4 771 1 1 7 PRO CA C -4.182 -4.244 -1.156 1.00 . A A . 7 PRO CA 1 1 4 772 1 1 7 PRO CB C -5.464 -5.073 -1.165 1.00 . A A . 7 PRO CB 1 1 4 773 1 1 7 PRO CD C -6.120 -2.768 -1.066 1.00 . A A . 7 PRO CD 1 1 4 774 1 1 7 PRO CG C -6.504 -4.156 -0.620 1.00 . A A . 7 PRO CG 1 1 4 775 1 1 7 PRO HA H -3.685 -4.355 -0.204 1.00 . A A . 7 PRO HA 1 1 4 776 1 1 7 PRO HB2 H -5.692 -5.378 -2.176 1.00 . A A . 7 PRO HB2 1 1 4 777 1 1 7 PRO HB3 H -5.338 -5.944 -0.538 1.00 . A A . 7 PRO HB3 1 1 4 778 1 1 7 PRO HD2 H -6.666 -2.494 -1.956 1.00 . A A . 7 PRO HD2 1 1 4 779 1 1 7 PRO HD3 H -6.304 -2.055 -0.276 1.00 . A A . 7 PRO HD3 1 1 4 780 1 1 7 PRO HG2 H -7.472 -4.423 -1.019 1.00 . A A . 7 PRO HG2 1 1 4 781 1 1 7 PRO HG3 H -6.514 -4.213 0.458 1.00 . A A . 7 PRO HG3 1 1 4 782 1 1 7 PRO N N -4.675 -2.877 -1.349 1.00 . A A . 7 PRO N 1 1 4 783 1 1 7 PRO O O -3.680 -4.976 -3.388 1.00 . A A . 7 PRO O 1 1 4 784 1 1 8 ASP C C -0.100 -6.324 -2.387 1.00 . A A . 8 ASP C 1 1 4 785 1 1 8 ASP CA C -0.952 -5.181 -2.936 1.00 . A A . 8 ASP CA 1 1 4 786 1 1 8 ASP CB C -0.067 -3.992 -3.335 1.00 . A A . 8 ASP CB 1 1 4 787 1 1 8 ASP CG C 1.016 -3.683 -2.315 1.00 . A A . 8 ASP CG 1 1 4 788 1 1 8 ASP H H -1.666 -4.527 -1.053 1.00 . A A . 8 ASP H 1 1 4 789 1 1 8 ASP HA H -1.477 -5.533 -3.812 1.00 . A A . 8 ASP HA 1 1 4 790 1 1 8 ASP HB2 H 0.411 -4.211 -4.278 1.00 . A A . 8 ASP HB2 1 1 4 791 1 1 8 ASP HB3 H -0.688 -3.115 -3.449 1.00 . A A . 8 ASP HB3 1 1 4 792 1 1 8 ASP N N -1.952 -4.763 -1.961 1.00 . A A . 8 ASP N 1 1 4 793 1 1 8 ASP O O 0.153 -7.310 -3.079 1.00 . A A . 8 ASP O 1 1 4 794 1 1 8 ASP OD1 O 2.199 -3.913 -2.564 1.00 . A A . 8 ASP OD1 1 1 4 795 1 1 9 VAL C C 1.021 -7.129 1.025 1.00 . A A . 9 VAL C 1 1 4 796 1 1 9 VAL CA C 1.155 -7.203 -0.494 1.00 . A A . 9 VAL CA 1 1 4 797 1 1 9 VAL CB C 2.641 -7.060 -0.882 1.00 . A A . 9 VAL CB 1 1 4 798 1 1 9 VAL CG1 C 3.465 -8.187 -0.275 1.00 . A A . 9 VAL CG1 1 1 4 799 1 1 9 VAL CG2 C 2.800 -7.032 -2.394 1.00 . A A . 9 VAL CG2 1 1 4 800 1 1 9 VAL H H 0.098 -5.375 -0.639 1.00 . A A . 9 VAL H 1 1 4 801 1 1 9 VAL HA H 0.808 -8.170 -0.829 1.00 . A A . 9 VAL HA 1 1 4 802 1 1 9 VAL HB H 3.008 -6.124 -0.485 1.00 . A A . 9 VAL HB 1 1 4 803 1 1 9 VAL HG11 H 3.892 -7.858 0.660 1.00 . A A . 9 VAL HG11 1 1 4 804 1 1 9 VAL HG12 H 4.257 -8.461 -0.956 1.00 . A A . 9 VAL HG12 1 1 4 805 1 1 9 VAL HG13 H 2.830 -9.043 -0.100 1.00 . A A . 9 VAL HG13 1 1 4 806 1 1 9 VAL HG21 H 3.849 -7.053 -2.647 1.00 . A A . 9 VAL HG21 1 1 4 807 1 1 9 VAL HG22 H 2.353 -6.130 -2.786 1.00 . A A . 9 VAL HG22 1 1 4 808 1 1 9 VAL HG23 H 2.308 -7.892 -2.824 1.00 . A A . 9 VAL HG23 1 1 4 809 1 1 9 VAL N N 0.335 -6.184 -1.139 1.00 . A A . 9 VAL N 1 1 4 810 1 1 9 VAL O O 2.004 -6.926 1.739 1.00 . A A . 9 VAL O 1 1 4 811 1 1 10 GLY C C -1.786 -6.606 3.275 1.00 . A A . 10 GLY C 1 1 4 812 1 1 10 GLY CA C -0.450 -7.240 2.941 1.00 . A A . 10 GLY CA 1 1 4 813 1 1 10 GLY H H -0.950 -7.449 0.895 1.00 . A A . 10 GLY H 1 1 4 814 1 1 10 GLY HA2 H -0.431 -8.245 3.336 1.00 . A A . 10 GLY HA2 1 1 4 815 1 1 10 GLY HA3 H 0.336 -6.665 3.409 1.00 . A A . 10 GLY HA3 1 1 4 816 1 1 10 GLY N N -0.205 -7.292 1.512 1.00 . A A . 10 GLY N 1 1 4 817 1 1 10 GLY O O -2.826 -7.261 3.202 1.00 . A A . 10 GLY O 1 1 4 818 1 1 11 ASP C C -3.324 -3.585 2.904 1.00 . A A . 11 ASP C 1 1 4 819 1 1 11 ASP CA C -2.978 -4.606 3.984 1.00 . A A . 11 ASP CA 1 1 4 820 1 1 11 ASP CB C -2.819 -3.907 5.336 1.00 . A A . 11 ASP CB 1 1 4 821 1 1 11 ASP CG C -4.035 -4.082 6.224 1.00 . A A . 11 ASP CG 1 1 4 822 1 1 11 ASP H H -0.899 -4.860 3.678 1.00 . A A . 11 ASP H 1 1 4 823 1 1 11 ASP HA H -3.781 -5.325 4.053 1.00 . A A . 11 ASP HA 1 1 4 824 1 1 11 ASP HB2 H -1.962 -4.317 5.848 1.00 . A A . 11 ASP HB2 1 1 4 825 1 1 11 ASP HB3 H -2.664 -2.850 5.173 1.00 . A A . 11 ASP HB3 1 1 4 826 1 1 11 ASP N N -1.759 -5.329 3.640 1.00 . A A . 11 ASP N 1 1 4 827 1 1 11 ASP O O -4.497 -3.303 2.657 1.00 . A A . 11 ASP O 1 1 4 828 1 1 11 ASP OD1 O -5.149 -4.242 5.681 1.00 . A A . 11 ASP OD1 1 1 4 829 1 1 11 ASP OD2 O -3.875 -4.061 7.462 1.00 . A A . 11 ASP OD2 1 1 4 830 1 1 12 GLY C C -1.316 -1.149 1.009 1.00 . A A . 12 GLY C 1 1 4 831 1 1 12 GLY CA C -2.513 -2.056 1.218 1.00 . A A . 12 GLY CA 1 1 4 832 1 1 12 GLY H H -1.384 -3.302 2.503 1.00 . A A . 12 GLY H 1 1 4 833 1 1 12 GLY HA2 H -2.721 -2.575 0.294 1.00 . A A . 12 GLY HA2 1 1 4 834 1 1 12 GLY HA3 H -3.369 -1.450 1.478 1.00 . A A . 12 GLY HA3 1 1 4 835 1 1 12 GLY N N -2.297 -3.037 2.264 1.00 . A A . 12 GLY N 1 1 4 836 1 1 12 GLY O O -0.423 -1.084 1.854 1.00 . A A . 12 GLY O 1 1 4 837 1 1 13 ARG C C -0.696 1.904 -0.513 1.00 . A A . 13 ARG C 1 1 4 838 1 1 13 ARG CA C -0.202 0.462 -0.440 1.00 . A A . 13 ARG CA 1 1 4 839 1 1 13 ARG CB C 0.443 0.065 -1.770 1.00 . A A . 13 ARG CB 1 1 4 840 1 1 13 ARG CD C 2.604 -0.595 -2.868 1.00 . A A . 13 ARG CD 1 1 4 841 1 1 13 ARG CG C 1.949 0.266 -1.801 1.00 . A A . 13 ARG CG 1 1 4 842 1 1 13 ARG CZ C 3.577 0.990 -4.486 1.00 . A A . 13 ARG CZ 1 1 4 843 1 1 13 ARG H H -2.039 -0.542 -0.752 1.00 . A A . 13 ARG H 1 1 4 844 1 1 13 ARG HA H 0.534 0.385 0.345 1.00 . A A . 13 ARG HA 1 1 4 845 1 1 13 ARG HB2 H 0.237 -0.978 -1.958 1.00 . A A . 13 ARG HB2 1 1 4 846 1 1 13 ARG HB3 H 0.005 0.657 -2.560 1.00 . A A . 13 ARG HB3 1 1 4 847 1 1 13 ARG HD2 H 3.609 -0.833 -2.555 1.00 . A A . 13 ARG HD2 1 1 4 848 1 1 13 ARG HD3 H 2.035 -1.507 -2.975 1.00 . A A . 13 ARG HD3 1 1 4 849 1 1 13 ARG HE H 1.975 -0.151 -4.824 1.00 . A A . 13 ARG HE 1 1 4 850 1 1 13 ARG HG2 H 2.159 1.304 -2.011 1.00 . A A . 13 ARG HG2 1 1 4 851 1 1 13 ARG HG3 H 2.357 0.002 -0.837 1.00 . A A . 13 ARG HG3 1 1 4 852 1 1 13 ARG HH11 H 4.540 0.912 -2.708 1.00 . A A . 13 ARG HH11 1 1 4 853 1 1 13 ARG HH12 H 5.205 2.016 -3.864 1.00 . A A . 13 ARG HH12 1 1 4 854 1 1 13 ARG HH21 H 2.849 1.300 -6.345 1.00 . A A . 13 ARG HH21 1 1 4 855 1 1 13 ARG HH22 H 4.245 2.237 -5.929 1.00 . A A . 13 ARG HH22 1 1 4 856 1 1 13 ARG N N -1.297 -0.447 -0.119 1.00 . A A . 13 ARG N 1 1 4 857 1 1 13 ARG NE N 2.659 0.083 -4.162 1.00 . A A . 13 ARG NE 1 1 4 858 1 1 13 ARG NH1 N 4.518 1.334 -3.614 1.00 . A A . 13 ARG NH1 1 1 4 859 1 1 13 ARG NH2 N 3.556 1.555 -5.685 1.00 . A A . 13 ARG NH2 1 1 4 860 1 1 13 ARG O O -1.897 2.163 -0.439 1.00 . A A . 13 ARG O 1 1 4 861 1 1 14 ILE C C 0.811 4.982 -1.724 1.00 . A A . 14 ILE C 1 1 4 862 1 1 14 ILE CA C -0.102 4.253 -0.743 1.00 . A A . 14 ILE CA 1 1 4 863 1 1 14 ILE CB C -0.008 4.942 0.633 1.00 . A A . 14 ILE CB 1 1 4 864 1 1 14 ILE CD1 C 1.645 3.333 1.730 1.00 . A A . 14 ILE CD1 1 1 4 865 1 1 14 ILE CG1 C 1.385 4.742 1.239 1.00 . A A . 14 ILE CG1 1 1 4 866 1 1 14 ILE CG2 C -1.087 4.416 1.568 1.00 . A A . 14 ILE CG2 1 1 4 867 1 1 14 ILE H H 1.179 2.569 -0.713 1.00 . A A . 14 ILE H 1 1 4 868 1 1 14 ILE HA H -1.122 4.330 -1.091 1.00 . A A . 14 ILE HA 1 1 4 869 1 1 14 ILE HB H -0.180 5.999 0.490 1.00 . A A . 14 ILE HB 1 1 4 870 1 1 14 ILE HD11 H 1.935 3.362 2.770 1.00 . A A . 14 ILE HD11 1 1 4 871 1 1 14 ILE HD12 H 2.439 2.889 1.147 1.00 . A A . 14 ILE HD12 1 1 4 872 1 1 14 ILE HD13 H 0.747 2.742 1.622 1.00 . A A . 14 ILE HD13 1 1 4 873 1 1 14 ILE HG12 H 2.131 4.973 0.493 1.00 . A A . 14 ILE HG12 1 1 4 874 1 1 14 ILE HG13 H 1.504 5.413 2.077 1.00 . A A . 14 ILE HG13 1 1 4 875 1 1 14 ILE HG21 H -1.161 3.344 1.464 1.00 . A A . 14 ILE HG21 1 1 4 876 1 1 14 ILE HG22 H -2.035 4.868 1.316 1.00 . A A . 14 ILE HG22 1 1 4 877 1 1 14 ILE HG23 H -0.831 4.662 2.588 1.00 . A A . 14 ILE HG23 1 1 4 878 1 1 14 ILE N N 0.238 2.838 -0.659 1.00 . A A . 14 ILE N 1 1 4 879 1 1 14 ILE O O 1.065 6.177 -1.578 1.00 . A A . 14 ILE O 1 1 4 880 1 1 15 LEU C C 1.665 4.555 -5.135 1.00 . A A . 15 LEU C 1 1 4 881 1 1 15 LEU CA C 2.185 4.835 -3.728 1.00 . A A . 15 LEU CA 1 1 4 882 1 1 15 LEU CB C 3.603 4.278 -3.571 1.00 . A A . 15 LEU CB 1 1 4 883 1 1 15 LEU CD1 C 4.605 6.578 -3.600 1.00 . A A . 15 LEU CD1 1 1 4 884 1 1 15 LEU CD2 C 4.284 5.382 -1.425 1.00 . A A . 15 LEU CD2 1 1 4 885 1 1 15 LEU CG C 4.604 5.225 -2.904 1.00 . A A . 15 LEU CG 1 1 4 886 1 1 15 LEU H H 1.061 3.307 -2.787 1.00 . A A . 15 LEU H 1 1 4 887 1 1 15 LEU HA H 2.208 5.903 -3.571 1.00 . A A . 15 LEU HA 1 1 4 888 1 1 15 LEU HB2 H 3.548 3.374 -2.982 1.00 . A A . 15 LEU HB2 1 1 4 889 1 1 15 LEU HB3 H 3.981 4.025 -4.551 1.00 . A A . 15 LEU HB3 1 1 4 890 1 1 15 LEU HD11 H 5.590 7.017 -3.531 1.00 . A A . 15 LEU HD11 1 1 4 891 1 1 15 LEU HD12 H 3.887 7.229 -3.123 1.00 . A A . 15 LEU HD12 1 1 4 892 1 1 15 LEU HD13 H 4.340 6.450 -4.639 1.00 . A A . 15 LEU HD13 1 1 4 893 1 1 15 LEU HD21 H 4.459 6.405 -1.125 1.00 . A A . 15 LEU HD21 1 1 4 894 1 1 15 LEU HD22 H 4.917 4.725 -0.848 1.00 . A A . 15 LEU HD22 1 1 4 895 1 1 15 LEU HD23 H 3.249 5.128 -1.252 1.00 . A A . 15 LEU HD23 1 1 4 896 1 1 15 LEU HG H 5.596 4.806 -2.990 1.00 . A A . 15 LEU HG 1 1 4 897 1 1 15 LEU N N 1.300 4.255 -2.723 1.00 . A A . 15 LEU N 1 1 4 898 1 1 15 LEU O O 0.815 3.687 -5.332 1.00 . A A . 15 LEU O 1 1 4 899 1 1 16 ALA C C 2.965 5.220 -8.440 1.00 . A A . 16 ALA C 1 1 4 900 1 1 16 ALA CA C 1.770 5.129 -7.498 1.00 . A A . 16 ALA CA 1 1 4 901 1 1 16 ALA CB C 0.724 6.170 -7.867 1.00 . A A . 16 ALA CB 1 1 4 902 1 1 16 ALA H H 2.856 5.973 -5.889 1.00 . A A . 16 ALA H 1 1 4 903 1 1 16 ALA HA H 1.321 4.151 -7.596 1.00 . A A . 16 ALA HA 1 1 4 904 1 1 16 ALA HB1 H -0.263 5.764 -7.697 1.00 . A A . 16 ALA HB1 1 1 4 905 1 1 16 ALA HB2 H 0.830 6.434 -8.908 1.00 . A A . 16 ALA HB2 1 1 4 906 1 1 16 ALA HB3 H 0.861 7.050 -7.256 1.00 . A A . 16 ALA HB3 1 1 4 907 1 1 16 ALA N N 2.182 5.297 -6.109 1.00 . A A . 16 ALA N 1 1 4 908 1 1 16 ALA O O 3.347 4.235 -9.071 1.00 . A A . 16 ALA O 1 1 4 909 1 1 17 GLY C C 5.544 7.792 -8.981 1.00 . A A . 17 GLY C 1 1 4 910 1 1 17 GLY CA C 4.697 6.607 -9.399 1.00 . A A . 17 GLY CA 1 1 4 911 1 1 17 GLY H H 3.203 7.158 -8.004 1.00 . A A . 17 GLY H 1 1 4 912 1 1 17 GLY HA2 H 5.309 5.716 -9.378 1.00 . A A . 17 GLY HA2 1 1 4 913 1 1 17 GLY HA3 H 4.347 6.766 -10.408 1.00 . A A . 17 GLY HA3 1 1 4 914 1 1 17 GLY N N 3.552 6.409 -8.531 1.00 . A A . 17 GLY N 1 1 4 915 1 1 17 GLY O O 5.298 8.342 -7.886 1.00 . A A . 17 GLY O 1 1 4 916 1 1 17 GLY OXT O 6.455 8.172 -9.748 1.00 . A A . 17 GLY OXT 1 1 5 917 1 1 1 GLY C C 1.226 -3.162 1.217 1.00 . A A . 1 GLY C 1 1 5 918 1 1 1 GLY CA C 1.698 -2.725 -0.156 1.00 . A A . 1 GLY CA 1 1 5 919 1 1 1 GLY H1 H -0.177 -2.956 -1.123 1.00 . A A . 1 GLY H1 1 1 5 920 1 1 1 GLY HA2 H 2.666 -3.165 -0.348 1.00 . A A . 1 GLY HA2 1 1 5 921 1 1 1 GLY HA3 H 1.796 -1.650 -0.165 1.00 . A A . 1 GLY HA3 1 1 5 922 1 1 1 GLY N N 0.785 -3.122 -1.213 1.00 . A A . 1 GLY N 1 1 5 923 1 1 1 GLY O O 0.130 -3.705 1.354 1.00 . A A . 1 GLY O 1 1 5 924 1 1 2 PRO C C 0.599 -2.416 4.224 1.00 . A A . 2 PRO C 1 1 5 925 1 1 2 PRO CA C 1.683 -3.322 3.631 1.00 . A A . 2 PRO CA 1 1 5 926 1 1 2 PRO CB C 3.005 -3.189 4.393 1.00 . A A . 2 PRO CB 1 1 5 927 1 1 2 PRO CD C 3.368 -2.302 2.190 1.00 . A A . 2 PRO CD 1 1 5 928 1 1 2 PRO CG C 3.792 -2.178 3.629 1.00 . A A . 2 PRO CG 1 1 5 929 1 1 2 PRO HA H 1.346 -4.347 3.672 1.00 . A A . 2 PRO HA 1 1 5 930 1 1 2 PRO HB2 H 2.810 -2.858 5.403 1.00 . A A . 2 PRO HB2 1 1 5 931 1 1 2 PRO HB3 H 3.508 -4.144 4.414 1.00 . A A . 2 PRO HB3 1 1 5 932 1 1 2 PRO HD2 H 3.299 -1.326 1.733 1.00 . A A . 2 PRO HD2 1 1 5 933 1 1 2 PRO HD3 H 4.063 -2.924 1.646 1.00 . A A . 2 PRO HD3 1 1 5 934 1 1 2 PRO HG2 H 3.575 -1.187 3.998 1.00 . A A . 2 PRO HG2 1 1 5 935 1 1 2 PRO HG3 H 4.847 -2.389 3.726 1.00 . A A . 2 PRO HG3 1 1 5 936 1 1 2 PRO N N 2.040 -2.939 2.264 1.00 . A A . 2 PRO N 1 1 5 937 1 1 2 PRO O O -0.590 -2.695 4.078 1.00 . A A . 2 PRO O 1 1 5 938 1 1 3 LYS C C -0.328 0.697 4.508 1.00 . A A . 3 LYS C 1 1 5 939 1 1 3 LYS CA C 0.054 -0.407 5.489 1.00 . A A . 3 LYS CA 1 1 5 940 1 1 3 LYS CB C 0.640 0.206 6.761 1.00 . A A . 3 LYS CB 1 1 5 941 1 1 3 LYS CD C -0.167 0.669 9.097 1.00 . A A . 3 LYS CD 1 1 5 942 1 1 3 LYS CE C 1.042 1.425 9.622 1.00 . A A . 3 LYS CE 1 1 5 943 1 1 3 LYS CG C -0.388 0.930 7.616 1.00 . A A . 3 LYS CG 1 1 5 944 1 1 3 LYS H H 1.962 -1.155 4.975 1.00 . A A . 3 LYS H 1 1 5 945 1 1 3 LYS HA H -0.834 -0.965 5.746 1.00 . A A . 3 LYS HA 1 1 5 946 1 1 3 LYS HB2 H 1.082 -0.580 7.355 1.00 . A A . 3 LYS HB2 1 1 5 947 1 1 3 LYS HB3 H 1.409 0.912 6.486 1.00 . A A . 3 LYS HB3 1 1 5 948 1 1 3 LYS HD2 H -1.043 0.986 9.643 1.00 . A A . 3 LYS HD2 1 1 5 949 1 1 3 LYS HD3 H -0.011 -0.390 9.247 1.00 . A A . 3 LYS HD3 1 1 5 950 1 1 3 LYS HE2 H 1.891 0.758 9.635 1.00 . A A . 3 LYS HE2 1 1 5 951 1 1 3 LYS HE3 H 1.247 2.254 8.961 1.00 . A A . 3 LYS HE3 1 1 5 952 1 1 3 LYS HG2 H -0.311 1.991 7.433 1.00 . A A . 3 LYS HG2 1 1 5 953 1 1 3 LYS HG3 H -1.375 0.586 7.342 1.00 . A A . 3 LYS HG3 1 1 5 954 1 1 3 LYS HZ1 H 1.204 1.284 11.700 1.00 . A A . 3 LYS HZ1 1 1 5 955 1 1 3 LYS HZ2 H -0.201 2.065 11.174 1.00 . A A . 3 LYS HZ2 1 1 5 956 1 1 3 LYS HZ3 H 1.286 2.869 11.113 1.00 . A A . 3 LYS HZ3 1 1 5 957 1 1 3 LYS N N 1.006 -1.335 4.888 1.00 . A A . 3 LYS N 1 1 5 958 1 1 3 LYS NZ N 0.816 1.947 10.998 1.00 . A A . 3 LYS NZ 1 1 5 959 1 1 3 LYS O O 0.254 1.782 4.524 1.00 . A A . 3 LYS O 1 1 5 960 1 1 4 GLY C C -3.229 1.297 2.380 1.00 . A A . 4 GLY C 1 1 5 961 1 1 4 GLY CA C -1.746 1.397 2.682 1.00 . A A . 4 GLY CA 1 1 5 962 1 1 4 GLY H H -1.734 -0.466 3.687 1.00 . A A . 4 GLY H 1 1 5 963 1 1 4 GLY HA2 H -1.534 2.385 3.064 1.00 . A A . 4 GLY HA2 1 1 5 964 1 1 4 GLY HA3 H -1.193 1.252 1.766 1.00 . A A . 4 GLY HA3 1 1 5 965 1 1 4 GLY N N -1.307 0.415 3.655 1.00 . A A . 4 GLY N 1 1 5 966 1 1 4 GLY O O -3.997 0.761 3.178 1.00 . A A . 4 GLY O 1 1 5 967 1 1 5 ASP C C -5.237 0.909 -0.413 1.00 . A A . 5 ASP C 1 1 5 968 1 1 5 ASP CA C -5.033 1.790 0.819 1.00 . A A . 5 ASP CA 1 1 5 969 1 1 5 ASP CB C -5.529 3.208 0.532 1.00 . A A . 5 ASP CB 1 1 5 970 1 1 5 ASP CG C -5.174 4.180 1.640 1.00 . A A . 5 ASP CG 1 1 5 971 1 1 5 ASP H H -2.971 2.235 0.633 1.00 . A A . 5 ASP H 1 1 5 972 1 1 5 ASP HA H -5.605 1.379 1.637 1.00 . A A . 5 ASP HA 1 1 5 973 1 1 5 ASP HB2 H -5.083 3.560 -0.386 1.00 . A A . 5 ASP HB2 1 1 5 974 1 1 5 ASP HB3 H -6.603 3.192 0.422 1.00 . A A . 5 ASP HB3 1 1 5 975 1 1 5 ASP N N -3.632 1.819 1.225 1.00 . A A . 5 ASP N 1 1 5 976 1 1 5 ASP O O -6.362 0.516 -0.722 1.00 . A A . 5 ASP O 1 1 5 977 1 1 5 ASP OD1 O -6.098 4.812 2.194 1.00 . A A . 5 ASP OD1 1 1 5 978 1 1 5 ASP OD2 O -3.972 4.309 1.954 1.00 . A A . 5 ASP OD2 1 1 5 979 1 1 6 PHE C C -3.601 -1.602 -2.056 1.00 . A A . 6 PHE C 1 1 5 980 1 1 6 PHE CA C -4.220 -0.229 -2.312 1.00 . A A . 6 PHE CA 1 1 5 981 1 1 6 PHE CB C -3.504 0.456 -3.480 1.00 . A A . 6 PHE CB 1 1 5 982 1 1 6 PHE CD1 C -5.006 2.463 -3.329 1.00 . A A . 6 PHE CD1 1 1 5 983 1 1 6 PHE CD2 C -2.700 2.808 -3.830 1.00 . A A . 6 PHE CD2 1 1 5 984 1 1 6 PHE CE1 C -5.227 3.826 -3.389 1.00 . A A . 6 PHE CE1 1 1 5 985 1 1 6 PHE CE2 C -2.915 4.172 -3.892 1.00 . A A . 6 PHE CE2 1 1 5 986 1 1 6 PHE CG C -3.742 1.939 -3.548 1.00 . A A . 6 PHE CG 1 1 5 987 1 1 6 PHE CZ C -4.179 4.682 -3.671 1.00 . A A . 6 PHE CZ 1 1 5 988 1 1 6 PHE H H -3.278 0.946 -0.824 1.00 . A A . 6 PHE H 1 1 5 989 1 1 6 PHE HA H -5.261 -0.357 -2.565 1.00 . A A . 6 PHE HA 1 1 5 990 1 1 6 PHE HB2 H -2.441 0.295 -3.385 1.00 . A A . 6 PHE HB2 1 1 5 991 1 1 6 PHE HB3 H -3.848 0.021 -4.407 1.00 . A A . 6 PHE HB3 1 1 5 992 1 1 6 PHE HD1 H -5.825 1.795 -3.107 1.00 . A A . 6 PHE HD1 1 1 5 993 1 1 6 PHE HD2 H -1.711 2.411 -4.003 1.00 . A A . 6 PHE HD2 1 1 5 994 1 1 6 PHE HE1 H -6.217 4.222 -3.217 1.00 . A A . 6 PHE HE1 1 1 5 995 1 1 6 PHE HE2 H -2.094 4.839 -4.113 1.00 . A A . 6 PHE HE2 1 1 5 996 1 1 6 PHE HZ H -4.349 5.747 -3.719 1.00 . A A . 6 PHE HZ 1 1 5 997 1 1 6 PHE N N -4.149 0.603 -1.115 1.00 . A A . 6 PHE N 1 1 5 998 1 1 6 PHE O O -2.400 -1.794 -2.243 1.00 . A A . 6 PHE O 1 1 5 999 1 1 7 PRO C C -2.988 -4.469 -2.400 1.00 . A A . 7 PRO C 1 1 5 1000 1 1 7 PRO CA C -3.949 -3.940 -1.339 1.00 . A A . 7 PRO CA 1 1 5 1001 1 1 7 PRO CB C -5.241 -4.753 -1.334 1.00 . A A . 7 PRO CB 1 1 5 1002 1 1 7 PRO CD C -5.867 -2.437 -1.374 1.00 . A A . 7 PRO CD 1 1 5 1003 1 1 7 PRO CG C -6.283 -3.796 -0.869 1.00 . A A . 7 PRO CG 1 1 5 1004 1 1 7 PRO HA H -3.480 -4.002 -0.368 1.00 . A A . 7 PRO HA 1 1 5 1005 1 1 7 PRO HB2 H -5.448 -5.111 -2.332 1.00 . A A . 7 PRO HB2 1 1 5 1006 1 1 7 PRO HB3 H -5.142 -5.588 -0.658 1.00 . A A . 7 PRO HB3 1 1 5 1007 1 1 7 PRO HD2 H -6.392 -2.199 -2.287 1.00 . A A . 7 PRO HD2 1 1 5 1008 1 1 7 PRO HD3 H -6.055 -1.684 -0.623 1.00 . A A . 7 PRO HD3 1 1 5 1009 1 1 7 PRO HG2 H -7.242 -4.070 -1.281 1.00 . A A . 7 PRO HG2 1 1 5 1010 1 1 7 PRO HG3 H -6.324 -3.796 0.211 1.00 . A A . 7 PRO HG3 1 1 5 1011 1 1 7 PRO N N -4.418 -2.581 -1.623 1.00 . A A . 7 PRO N 1 1 5 1012 1 1 7 PRO O O -3.371 -4.675 -3.552 1.00 . A A . 7 PRO O 1 1 5 1013 1 1 8 ASP C C 0.075 -6.332 -2.263 1.00 . A A . 8 ASP C 1 1 5 1014 1 1 8 ASP CA C -0.724 -5.203 -2.914 1.00 . A A . 8 ASP CA 1 1 5 1015 1 1 8 ASP CB C 0.208 -4.071 -3.366 1.00 . A A . 8 ASP CB 1 1 5 1016 1 1 8 ASP CG C 1.244 -3.695 -2.321 1.00 . A A . 8 ASP CG 1 1 5 1017 1 1 8 ASP H H -1.497 -4.512 -1.068 1.00 . A A . 8 ASP H 1 1 5 1018 1 1 8 ASP HA H -1.235 -5.600 -3.780 1.00 . A A . 8 ASP HA 1 1 5 1019 1 1 8 ASP HB2 H 0.728 -4.380 -4.260 1.00 . A A . 8 ASP HB2 1 1 5 1020 1 1 8 ASP HB3 H -0.385 -3.196 -3.588 1.00 . A A . 8 ASP HB3 1 1 5 1021 1 1 8 ASP N N -1.740 -4.692 -2.000 1.00 . A A . 8 ASP N 1 1 5 1022 1 1 8 ASP O O 0.323 -7.367 -2.881 1.00 . A A . 8 ASP O 1 1 5 1023 1 1 8 ASP OD1 O 2.440 -3.915 -2.511 1.00 . A A . 8 ASP OD1 1 1 5 1024 1 1 9 VAL C C 0.852 -7.106 1.208 1.00 . A A . 9 VAL C 1 1 5 1025 1 1 9 VAL CA C 1.234 -7.120 -0.270 1.00 . A A . 9 VAL CA 1 1 5 1026 1 1 9 VAL CB C 2.753 -6.884 -0.407 1.00 . A A . 9 VAL CB 1 1 5 1027 1 1 9 VAL CG1 C 3.535 -7.967 0.323 1.00 . A A . 9 VAL CG1 1 1 5 1028 1 1 9 VAL CG2 C 3.157 -6.829 -1.873 1.00 . A A . 9 VAL CG2 1 1 5 1029 1 1 9 VAL H H 0.238 -5.280 -0.571 1.00 . A A . 9 VAL H 1 1 5 1030 1 1 9 VAL HA H 1.002 -8.092 -0.682 1.00 . A A . 9 VAL HA 1 1 5 1031 1 1 9 VAL HB H 2.991 -5.933 0.046 1.00 . A A . 9 VAL HB 1 1 5 1032 1 1 9 VAL HG11 H 4.465 -8.150 -0.193 1.00 . A A . 9 VAL HG11 1 1 5 1033 1 1 9 VAL HG12 H 2.953 -8.876 0.348 1.00 . A A . 9 VAL HG12 1 1 5 1034 1 1 9 VAL HG13 H 3.741 -7.643 1.333 1.00 . A A . 9 VAL HG13 1 1 5 1035 1 1 9 VAL HG21 H 4.188 -6.520 -1.951 1.00 . A A . 9 VAL HG21 1 1 5 1036 1 1 9 VAL HG22 H 2.529 -6.121 -2.393 1.00 . A A . 9 VAL HG22 1 1 5 1037 1 1 9 VAL HG23 H 3.040 -7.806 -2.316 1.00 . A A . 9 VAL HG23 1 1 5 1038 1 1 9 VAL N N 0.470 -6.124 -1.011 1.00 . A A . 9 VAL N 1 1 5 1039 1 1 9 VAL O O 1.706 -6.957 2.083 1.00 . A A . 9 VAL O 1 1 5 1040 1 1 10 GLY C C -2.198 -6.459 3.011 1.00 . A A . 10 GLY C 1 1 5 1041 1 1 10 GLY CA C -0.919 -7.257 2.848 1.00 . A A . 10 GLY CA 1 1 5 1042 1 1 10 GLY H H -1.076 -7.371 0.740 1.00 . A A . 10 GLY H 1 1 5 1043 1 1 10 GLY HA2 H -1.102 -8.277 3.156 1.00 . A A . 10 GLY HA2 1 1 5 1044 1 1 10 GLY HA3 H -0.158 -6.831 3.484 1.00 . A A . 10 GLY HA3 1 1 5 1045 1 1 10 GLY N N -0.441 -7.258 1.478 1.00 . A A . 10 GLY N 1 1 5 1046 1 1 10 GLY O O -3.295 -6.988 2.831 1.00 . A A . 10 GLY O 1 1 5 1047 1 1 11 ASP C C -3.351 -3.347 2.356 1.00 . A A . 11 ASP C 1 1 5 1048 1 1 11 ASP CA C -3.210 -4.308 3.533 1.00 . A A . 11 ASP CA 1 1 5 1049 1 1 11 ASP CB C -3.083 -3.522 4.839 1.00 . A A . 11 ASP CB 1 1 5 1050 1 1 11 ASP CG C -4.396 -3.437 5.593 1.00 . A A . 11 ASP CG 1 1 5 1051 1 1 11 ASP H H -1.156 -4.817 3.476 1.00 . A A . 11 ASP H 1 1 5 1052 1 1 11 ASP HA H -4.092 -4.930 3.581 1.00 . A A . 11 ASP HA 1 1 5 1053 1 1 11 ASP HB2 H -2.356 -4.007 5.474 1.00 . A A . 11 ASP HB2 1 1 5 1054 1 1 11 ASP HB3 H -2.749 -2.518 4.619 1.00 . A A . 11 ASP HB3 1 1 5 1055 1 1 11 ASP N N -2.057 -5.181 3.350 1.00 . A A . 11 ASP N 1 1 5 1056 1 1 11 ASP O O -4.457 -3.092 1.879 1.00 . A A . 11 ASP O 1 1 5 1057 1 1 11 ASP OD1 O -4.361 -3.234 6.825 1.00 . A A . 11 ASP OD1 1 1 5 1058 1 1 11 ASP OD2 O -5.458 -3.571 4.951 1.00 . A A . 11 ASP OD2 1 1 5 1059 1 1 12 GLY C C -1.024 -0.995 0.736 1.00 . A A . 12 GLY C 1 1 5 1060 1 1 12 GLY CA C -2.242 -1.898 0.771 1.00 . A A . 12 GLY CA 1 1 5 1061 1 1 12 GLY H H -1.370 -3.063 2.309 1.00 . A A . 12 GLY H 1 1 5 1062 1 1 12 GLY HA2 H -2.279 -2.466 -0.145 1.00 . A A . 12 GLY HA2 1 1 5 1063 1 1 12 GLY HA3 H -3.128 -1.285 0.838 1.00 . A A . 12 GLY HA3 1 1 5 1064 1 1 12 GLY N N -2.223 -2.820 1.891 1.00 . A A . 12 GLY N 1 1 5 1065 1 1 12 GLY O O -0.268 -0.921 1.704 1.00 . A A . 12 GLY O 1 1 5 1066 1 1 13 ARG C C -0.158 2.056 -0.480 1.00 . A A . 13 ARG C 1 1 5 1067 1 1 13 ARG CA C 0.298 0.601 -0.546 1.00 . A A . 13 ARG CA 1 1 5 1068 1 1 13 ARG CB C 1.007 0.338 -1.877 1.00 . A A . 13 ARG CB 1 1 5 1069 1 1 13 ARG CD C 0.810 -0.026 -4.356 1.00 . A A . 13 ARG CD 1 1 5 1070 1 1 13 ARG CG C 0.056 0.161 -3.049 1.00 . A A . 13 ARG CG 1 1 5 1071 1 1 13 ARG CZ C -1.056 -0.078 -5.964 1.00 . A A . 13 ARG CZ 1 1 5 1072 1 1 13 ARG H H -1.474 -0.405 -1.122 1.00 . A A . 13 ARG H 1 1 5 1073 1 1 13 ARG HA H 0.988 0.416 0.263 1.00 . A A . 13 ARG HA 1 1 5 1074 1 1 13 ARG HB2 H 1.661 1.170 -2.094 1.00 . A A . 13 ARG HB2 1 1 5 1075 1 1 13 ARG HB3 H 1.600 -0.560 -1.784 1.00 . A A . 13 ARG HB3 1 1 5 1076 1 1 13 ARG HD2 H 1.751 0.500 -4.292 1.00 . A A . 13 ARG HD2 1 1 5 1077 1 1 13 ARG HD3 H 0.998 -1.080 -4.500 1.00 . A A . 13 ARG HD3 1 1 5 1078 1 1 13 ARG HE H 0.401 1.286 -5.945 1.00 . A A . 13 ARG HE 1 1 5 1079 1 1 13 ARG HG2 H -0.559 -0.708 -2.873 1.00 . A A . 13 ARG HG2 1 1 5 1080 1 1 13 ARG HG3 H -0.570 1.038 -3.127 1.00 . A A . 13 ARG HG3 1 1 5 1081 1 1 13 ARG HH11 H -1.084 -1.571 -4.599 1.00 . A A . 13 ARG HH11 1 1 5 1082 1 1 13 ARG HH12 H -2.387 -1.583 -5.740 1.00 . A A . 13 ARG HH12 1 1 5 1083 1 1 13 ARG HH21 H -1.312 1.271 -7.446 1.00 . A A . 13 ARG HH21 1 1 5 1084 1 1 13 ARG HH22 H -2.516 0.029 -7.356 1.00 . A A . 13 ARG HH22 1 1 5 1085 1 1 13 ARG N N -0.835 -0.304 -0.385 1.00 . A A . 13 ARG N 1 1 5 1086 1 1 13 ARG NE N 0.058 0.483 -5.500 1.00 . A A . 13 ARG NE 1 1 5 1087 1 1 13 ARG NH1 N -1.549 -1.167 -5.387 1.00 . A A . 13 ARG NH1 1 1 5 1088 1 1 13 ARG NH2 N -1.679 0.451 -7.008 1.00 . A A . 13 ARG NH2 1 1 5 1089 1 1 13 ARG O O -1.312 2.368 -0.774 1.00 . A A . 13 ARG O 1 1 5 1090 1 1 14 ILE C C 0.798 5.099 -1.276 1.00 . A A . 14 ILE C 1 1 5 1091 1 1 14 ILE CA C 0.443 4.361 0.011 1.00 . A A . 14 ILE CA 1 1 5 1092 1 1 14 ILE CB C 1.189 5.014 1.193 1.00 . A A . 14 ILE CB 1 1 5 1093 1 1 14 ILE CD1 C -0.727 6.650 1.563 1.00 . A A . 14 ILE CD1 1 1 5 1094 1 1 14 ILE CG1 C 0.762 6.475 1.353 1.00 . A A . 14 ILE CG1 1 1 5 1095 1 1 14 ILE CG2 C 2.694 4.915 0.995 1.00 . A A . 14 ILE CG2 1 1 5 1096 1 1 14 ILE H H 1.657 2.631 0.129 1.00 . A A . 14 ILE H 1 1 5 1097 1 1 14 ILE HA H -0.619 4.457 0.187 1.00 . A A . 14 ILE HA 1 1 5 1098 1 1 14 ILE HB H 0.934 4.473 2.092 1.00 . A A . 14 ILE HB 1 1 5 1099 1 1 14 ILE HD11 H -1.222 6.693 0.604 1.00 . A A . 14 ILE HD11 1 1 5 1100 1 1 14 ILE HD12 H -0.908 7.567 2.103 1.00 . A A . 14 ILE HD12 1 1 5 1101 1 1 14 ILE HD13 H -1.111 5.816 2.130 1.00 . A A . 14 ILE HD13 1 1 5 1102 1 1 14 ILE HG12 H 1.268 6.900 2.207 1.00 . A A . 14 ILE HG12 1 1 5 1103 1 1 14 ILE HG13 H 1.040 7.024 0.465 1.00 . A A . 14 ILE HG13 1 1 5 1104 1 1 14 ILE HG21 H 2.984 3.875 0.954 1.00 . A A . 14 ILE HG21 1 1 5 1105 1 1 14 ILE HG22 H 3.199 5.396 1.820 1.00 . A A . 14 ILE HG22 1 1 5 1106 1 1 14 ILE HG23 H 2.969 5.402 0.072 1.00 . A A . 14 ILE HG23 1 1 5 1107 1 1 14 ILE N N 0.754 2.941 -0.093 1.00 . A A . 14 ILE N 1 1 5 1108 1 1 14 ILE O O 0.157 6.087 -1.634 1.00 . A A . 14 ILE O 1 1 5 1109 1 1 15 LEU C C 1.909 4.347 -4.410 1.00 . A A . 15 LEU C 1 1 5 1110 1 1 15 LEU CA C 2.263 5.227 -3.216 1.00 . A A . 15 LEU CA 1 1 5 1111 1 1 15 LEU CB C 3.773 5.480 -3.180 1.00 . A A . 15 LEU CB 1 1 5 1112 1 1 15 LEU CD1 C 5.681 6.940 -2.465 1.00 . A A . 15 LEU CD1 1 1 5 1113 1 1 15 LEU CD2 C 3.778 7.918 -3.761 1.00 . A A . 15 LEU CD2 1 1 5 1114 1 1 15 LEU CG C 4.183 6.881 -2.724 1.00 . A A . 15 LEU CG 1 1 5 1115 1 1 15 LEU H H 2.296 3.823 -1.632 1.00 . A A . 15 LEU H 1 1 5 1116 1 1 15 LEU HA H 1.752 6.173 -3.318 1.00 . A A . 15 LEU HA 1 1 5 1117 1 1 15 LEU HB2 H 4.221 4.759 -2.511 1.00 . A A . 15 LEU HB2 1 1 5 1118 1 1 15 LEU HB3 H 4.168 5.319 -4.172 1.00 . A A . 15 LEU HB3 1 1 5 1119 1 1 15 LEU HD11 H 5.873 6.754 -1.419 1.00 . A A . 15 LEU HD11 1 1 5 1120 1 1 15 LEU HD12 H 6.054 7.918 -2.731 1.00 . A A . 15 LEU HD12 1 1 5 1121 1 1 15 LEU HD13 H 6.179 6.190 -3.062 1.00 . A A . 15 LEU HD13 1 1 5 1122 1 1 15 LEU HD21 H 2.942 7.546 -4.334 1.00 . A A . 15 LEU HD21 1 1 5 1123 1 1 15 LEU HD22 H 4.610 8.110 -4.422 1.00 . A A . 15 LEU HD22 1 1 5 1124 1 1 15 LEU HD23 H 3.495 8.833 -3.263 1.00 . A A . 15 LEU HD23 1 1 5 1125 1 1 15 LEU HG H 3.676 7.114 -1.799 1.00 . A A . 15 LEU HG 1 1 5 1126 1 1 15 LEU N N 1.824 4.613 -1.968 1.00 . A A . 15 LEU N 1 1 5 1127 1 1 15 LEU O O 2.009 3.122 -4.343 1.00 . A A . 15 LEU O 1 1 5 1128 1 1 16 ALA C C 1.401 5.091 -7.958 1.00 . A A . 16 ALA C 1 1 5 1129 1 1 16 ALA CA C 1.125 4.256 -6.713 1.00 . A A . 16 ALA CA 1 1 5 1130 1 1 16 ALA CB C -0.341 3.853 -6.659 1.00 . A A . 16 ALA CB 1 1 5 1131 1 1 16 ALA H H 1.436 5.958 -5.495 1.00 . A A . 16 ALA H 1 1 5 1132 1 1 16 ALA HA H 1.720 3.355 -6.757 1.00 . A A . 16 ALA HA 1 1 5 1133 1 1 16 ALA HB1 H -0.959 4.725 -6.813 1.00 . A A . 16 ALA HB1 1 1 5 1134 1 1 16 ALA HB2 H -0.561 3.422 -5.694 1.00 . A A . 16 ALA HB2 1 1 5 1135 1 1 16 ALA HB3 H -0.543 3.127 -7.433 1.00 . A A . 16 ALA HB3 1 1 5 1136 1 1 16 ALA N N 1.495 4.980 -5.503 1.00 . A A . 16 ALA N 1 1 5 1137 1 1 16 ALA O O 0.499 5.728 -8.502 1.00 . A A . 16 ALA O 1 1 5 1138 1 1 17 GLY C C 4.389 6.492 -9.449 1.00 . A A . 17 GLY C 1 1 5 1139 1 1 17 GLY CA C 3.024 5.846 -9.582 1.00 . A A . 17 GLY CA 1 1 5 1140 1 1 17 GLY H H 3.330 4.559 -7.930 1.00 . A A . 17 GLY H 1 1 5 1141 1 1 17 GLY HA2 H 3.031 5.186 -10.436 1.00 . A A . 17 GLY HA2 1 1 5 1142 1 1 17 GLY HA3 H 2.286 6.619 -9.745 1.00 . A A . 17 GLY HA3 1 1 5 1143 1 1 17 GLY N N 2.653 5.085 -8.404 1.00 . A A . 17 GLY N 1 1 5 1144 1 1 17 GLY O O 5.256 6.229 -10.308 1.00 . A A . 17 GLY O 1 1 5 1145 1 1 17 GLY OXT O 4.590 7.263 -8.487 1.00 . A A . 17 GLY OXT 1 1 6 1146 1 1 1 GLY C C 1.118 -3.333 0.994 1.00 . A A . 1 GLY C 1 1 6 1147 1 1 1 GLY CA C 1.487 -2.984 -0.436 1.00 . A A . 1 GLY CA 1 1 6 1148 1 1 1 GLY H1 H -0.411 -2.931 -1.284 1.00 . A A . 1 GLY H1 1 1 6 1149 1 1 1 GLY HA2 H 2.406 -3.489 -0.691 1.00 . A A . 1 GLY HA2 1 1 6 1150 1 1 1 GLY HA3 H 1.645 -1.918 -0.505 1.00 . A A . 1 GLY HA3 1 1 6 1151 1 1 1 GLY N N 0.460 -3.370 -1.387 1.00 . A A . 1 GLY N 1 1 6 1152 1 1 1 GLY O O 0.121 -4.015 1.230 1.00 . A A . 1 GLY O 1 1 6 1153 1 1 2 PRO C C 0.739 -2.102 4.020 1.00 . A A . 2 PRO C 1 1 6 1154 1 1 2 PRO CA C 1.656 -3.143 3.384 1.00 . A A . 2 PRO CA 1 1 6 1155 1 1 2 PRO CB C 3.056 -3.096 4.001 1.00 . A A . 2 PRO CB 1 1 6 1156 1 1 2 PRO CD C 3.115 -2.055 1.797 1.00 . A A . 2 PRO CD 1 1 6 1157 1 1 2 PRO CG C 3.887 -2.248 3.083 1.00 . A A . 2 PRO CG 1 1 6 1158 1 1 2 PRO HA H 1.232 -4.124 3.527 1.00 . A A . 2 PRO HA 1 1 6 1159 1 1 2 PRO HB2 H 2.997 -2.662 4.988 1.00 . A A . 2 PRO HB2 1 1 6 1160 1 1 2 PRO HB3 H 3.450 -4.099 4.070 1.00 . A A . 2 PRO HB3 1 1 6 1161 1 1 2 PRO HD2 H 2.854 -1.015 1.668 1.00 . A A . 2 PRO HD2 1 1 6 1162 1 1 2 PRO HD3 H 3.694 -2.405 0.955 1.00 . A A . 2 PRO HD3 1 1 6 1163 1 1 2 PRO HG2 H 4.074 -1.291 3.546 1.00 . A A . 2 PRO HG2 1 1 6 1164 1 1 2 PRO HG3 H 4.824 -2.748 2.881 1.00 . A A . 2 PRO HG3 1 1 6 1165 1 1 2 PRO N N 1.909 -2.874 1.978 1.00 . A A . 2 PRO N 1 1 6 1166 1 1 2 PRO O O -0.449 -2.351 4.221 1.00 . A A . 2 PRO O 1 1 6 1167 1 1 3 LYS C C -0.092 1.046 3.887 1.00 . A A . 3 LYS C 1 1 6 1168 1 1 3 LYS CA C 0.520 0.137 4.948 1.00 . A A . 3 LYS CA 1 1 6 1169 1 1 3 LYS CB C 1.403 0.955 5.891 1.00 . A A . 3 LYS CB 1 1 6 1170 1 1 3 LYS CD C 1.406 2.509 7.864 1.00 . A A . 3 LYS CD 1 1 6 1171 1 1 3 LYS CE C 2.579 2.050 8.717 1.00 . A A . 3 LYS CE 1 1 6 1172 1 1 3 LYS CG C 0.714 1.336 7.190 1.00 . A A . 3 LYS CG 1 1 6 1173 1 1 3 LYS H H 2.243 -0.795 4.151 1.00 . A A . 3 LYS H 1 1 6 1174 1 1 3 LYS HA H -0.277 -0.315 5.520 1.00 . A A . 3 LYS HA 1 1 6 1175 1 1 3 LYS HB2 H 2.285 0.379 6.131 1.00 . A A . 3 LYS HB2 1 1 6 1176 1 1 3 LYS HB3 H 1.704 1.863 5.388 1.00 . A A . 3 LYS HB3 1 1 6 1177 1 1 3 LYS HD2 H 1.770 3.185 7.105 1.00 . A A . 3 LYS HD2 1 1 6 1178 1 1 3 LYS HD3 H 0.693 3.021 8.494 1.00 . A A . 3 LYS HD3 1 1 6 1179 1 1 3 LYS HE2 H 2.196 1.549 9.593 1.00 . A A . 3 LYS HE2 1 1 6 1180 1 1 3 LYS HE3 H 3.177 1.360 8.141 1.00 . A A . 3 LYS HE3 1 1 6 1181 1 1 3 LYS HG2 H -0.309 1.608 6.978 1.00 . A A . 3 LYS HG2 1 1 6 1182 1 1 3 LYS HG3 H 0.732 0.487 7.858 1.00 . A A . 3 LYS HG3 1 1 6 1183 1 1 3 LYS HZ1 H 2.866 3.881 9.680 1.00 . A A . 3 LYS HZ1 1 1 6 1184 1 1 3 LYS HZ2 H 3.843 3.665 8.317 1.00 . A A . 3 LYS HZ2 1 1 6 1185 1 1 3 LYS HZ3 H 4.206 2.851 9.754 1.00 . A A . 3 LYS HZ3 1 1 6 1186 1 1 3 LYS N N 1.293 -0.937 4.335 1.00 . A A . 3 LYS N 1 1 6 1187 1 1 3 LYS NZ N 3.433 3.192 9.147 1.00 . A A . 3 LYS NZ 1 1 6 1188 1 1 3 LYS O O 0.560 1.965 3.393 1.00 . A A . 3 LYS O 1 1 6 1189 1 1 4 GLY C C -3.512 1.295 2.466 1.00 . A A . 4 GLY C 1 1 6 1190 1 1 4 GLY CA C -2.027 1.593 2.544 1.00 . A A . 4 GLY CA 1 1 6 1191 1 1 4 GLY H H -1.821 0.041 3.970 1.00 . A A . 4 GLY H 1 1 6 1192 1 1 4 GLY HA2 H -1.893 2.636 2.789 1.00 . A A . 4 GLY HA2 1 1 6 1193 1 1 4 GLY HA3 H -1.581 1.401 1.579 1.00 . A A . 4 GLY HA3 1 1 6 1194 1 1 4 GLY N N -1.350 0.786 3.542 1.00 . A A . 4 GLY N 1 1 6 1195 1 1 4 GLY O O -4.084 0.716 3.390 1.00 . A A . 4 GLY O 1 1 6 1196 1 1 5 ASP C C -5.832 0.733 -0.147 1.00 . A A . 5 ASP C 1 1 6 1197 1 1 5 ASP CA C -5.566 1.463 1.167 1.00 . A A . 5 ASP CA 1 1 6 1198 1 1 5 ASP CB C -6.323 2.792 1.188 1.00 . A A . 5 ASP CB 1 1 6 1199 1 1 5 ASP CG C -7.815 2.604 1.381 1.00 . A A . 5 ASP CG 1 1 6 1200 1 1 5 ASP H H -3.627 2.148 0.660 1.00 . A A . 5 ASP H 1 1 6 1201 1 1 5 ASP HA H -5.916 0.848 1.983 1.00 . A A . 5 ASP HA 1 1 6 1202 1 1 5 ASP HB2 H -5.949 3.400 1.999 1.00 . A A . 5 ASP HB2 1 1 6 1203 1 1 5 ASP HB3 H -6.161 3.307 0.253 1.00 . A A . 5 ASP HB3 1 1 6 1204 1 1 5 ASP N N -4.137 1.691 1.361 1.00 . A A . 5 ASP N 1 1 6 1205 1 1 5 ASP O O -6.899 0.877 -0.743 1.00 . A A . 5 ASP O 1 1 6 1206 1 1 5 ASP OD1 O -8.579 3.534 1.047 1.00 . A A . 5 ASP OD1 1 1 6 1207 1 1 5 ASP OD2 O -8.220 1.526 1.865 1.00 . A A . 5 ASP OD2 1 1 6 1208 1 1 6 PHE C C -4.228 -2.132 -1.736 1.00 . A A . 6 PHE C 1 1 6 1209 1 1 6 PHE CA C -4.983 -0.808 -1.833 1.00 . A A . 6 PHE CA 1 1 6 1210 1 1 6 PHE CB C -4.454 0.012 -3.012 1.00 . A A . 6 PHE CB 1 1 6 1211 1 1 6 PHE CD1 C -4.869 -0.205 -5.477 1.00 . A A . 6 PHE CD1 1 1 6 1212 1 1 6 PHE CD2 C -6.731 0.213 -4.047 1.00 . A A . 6 PHE CD2 1 1 6 1213 1 1 6 PHE CE1 C -5.709 -0.210 -6.575 1.00 . A A . 6 PHE CE1 1 1 6 1214 1 1 6 PHE CE2 C -7.576 0.209 -5.141 1.00 . A A . 6 PHE CE2 1 1 6 1215 1 1 6 PHE CG C -5.369 0.007 -4.203 1.00 . A A . 6 PHE CG 1 1 6 1216 1 1 6 PHE CZ C -7.064 -0.003 -6.406 1.00 . A A . 6 PHE CZ 1 1 6 1217 1 1 6 PHE H H -4.029 -0.126 -0.071 1.00 . A A . 6 PHE H 1 1 6 1218 1 1 6 PHE HA H -6.031 -1.013 -1.989 1.00 . A A . 6 PHE HA 1 1 6 1219 1 1 6 PHE HB2 H -4.323 1.037 -2.699 1.00 . A A . 6 PHE HB2 1 1 6 1220 1 1 6 PHE HB3 H -3.501 -0.389 -3.323 1.00 . A A . 6 PHE HB3 1 1 6 1221 1 1 6 PHE HD1 H -3.809 -0.367 -5.610 1.00 . A A . 6 PHE HD1 1 1 6 1222 1 1 6 PHE HD2 H -7.132 0.379 -3.058 1.00 . A A . 6 PHE HD2 1 1 6 1223 1 1 6 PHE HE1 H -5.306 -0.376 -7.563 1.00 . A A . 6 PHE HE1 1 1 6 1224 1 1 6 PHE HE2 H -8.635 0.371 -5.006 1.00 . A A . 6 PHE HE2 1 1 6 1225 1 1 6 PHE HZ H -7.722 -0.006 -7.262 1.00 . A A . 6 PHE HZ 1 1 6 1226 1 1 6 PHE N N -4.855 -0.051 -0.592 1.00 . A A . 6 PHE N 1 1 6 1227 1 1 6 PHE O O -3.028 -2.190 -2.005 1.00 . A A . 6 PHE O 1 1 6 1228 1 1 7 PRO C C -3.374 -4.886 -2.361 1.00 . A A . 7 PRO C 1 1 6 1229 1 1 7 PRO CA C -4.309 -4.541 -1.204 1.00 . A A . 7 PRO CA 1 1 6 1230 1 1 7 PRO CB C -5.516 -5.475 -1.194 1.00 . A A . 7 PRO CB 1 1 6 1231 1 1 7 PRO CD C -6.357 -3.236 -0.996 1.00 . A A . 7 PRO CD 1 1 6 1232 1 1 7 PRO CG C -6.609 -4.665 -0.586 1.00 . A A . 7 PRO CG 1 1 6 1233 1 1 7 PRO HA H -3.773 -4.633 -0.271 1.00 . A A . 7 PRO HA 1 1 6 1234 1 1 7 PRO HB2 H -5.756 -5.770 -2.206 1.00 . A A . 7 PRO HB2 1 1 6 1235 1 1 7 PRO HB3 H -5.296 -6.349 -0.600 1.00 . A A . 7 PRO HB3 1 1 6 1236 1 1 7 PRO HD2 H -6.962 -2.978 -1.853 1.00 . A A . 7 PRO HD2 1 1 6 1237 1 1 7 PRO HD3 H -6.562 -2.567 -0.174 1.00 . A A . 7 PRO HD3 1 1 6 1238 1 1 7 PRO HG2 H -7.565 -4.998 -0.962 1.00 . A A . 7 PRO HG2 1 1 6 1239 1 1 7 PRO HG3 H -6.577 -4.756 0.489 1.00 . A A . 7 PRO HG3 1 1 6 1240 1 1 7 PRO N N -4.921 -3.216 -1.342 1.00 . A A . 7 PRO N 1 1 6 1241 1 1 7 PRO O O -3.787 -4.909 -3.520 1.00 . A A . 7 PRO O 1 1 6 1242 1 1 8 ASP C C -0.156 -6.567 -2.510 1.00 . A A . 8 ASP C 1 1 6 1243 1 1 8 ASP CA C -1.119 -5.504 -3.041 1.00 . A A . 8 ASP CA 1 1 6 1244 1 1 8 ASP CB C -0.353 -4.250 -3.493 1.00 . A A . 8 ASP CB 1 1 6 1245 1 1 8 ASP CG C 0.794 -3.880 -2.568 1.00 . A A . 8 ASP CG 1 1 6 1246 1 1 8 ASP H H -1.848 -5.123 -1.091 1.00 . A A . 8 ASP H 1 1 6 1247 1 1 8 ASP HA H -1.646 -5.914 -3.891 1.00 . A A . 8 ASP HA 1 1 6 1248 1 1 8 ASP HB2 H 0.051 -4.422 -4.479 1.00 . A A . 8 ASP HB2 1 1 6 1249 1 1 8 ASP HB3 H -1.040 -3.417 -3.534 1.00 . A A . 8 ASP HB3 1 1 6 1250 1 1 8 ASP N N -2.114 -5.156 -2.033 1.00 . A A . 8 ASP N 1 1 6 1251 1 1 8 ASP O O 0.142 -7.546 -3.194 1.00 . A A . 8 ASP O 1 1 6 1252 1 1 8 ASP OD1 O 1.963 -4.049 -2.915 1.00 . A A . 8 ASP OD1 1 1 6 1253 1 1 9 VAL C C 1.173 -7.187 0.867 1.00 . A A . 9 VAL C 1 1 6 1254 1 1 9 VAL CA C 1.243 -7.305 -0.654 1.00 . A A . 9 VAL CA 1 1 6 1255 1 1 9 VAL CB C 2.696 -7.070 -1.120 1.00 . A A . 9 VAL CB 1 1 6 1256 1 1 9 VAL CG1 C 3.629 -8.115 -0.527 1.00 . A A . 9 VAL CG1 1 1 6 1257 1 1 9 VAL CG2 C 2.780 -7.081 -2.639 1.00 . A A . 9 VAL CG2 1 1 6 1258 1 1 9 VAL H H 0.041 -5.569 -0.789 1.00 . A A . 9 VAL H 1 1 6 1259 1 1 9 VAL HA H 0.950 -8.305 -0.942 1.00 . A A . 9 VAL HA 1 1 6 1260 1 1 9 VAL HB H 3.012 -6.098 -0.771 1.00 . A A . 9 VAL HB 1 1 6 1261 1 1 9 VAL HG11 H 4.050 -7.740 0.395 1.00 . A A . 9 VAL HG11 1 1 6 1262 1 1 9 VAL HG12 H 4.425 -8.326 -1.226 1.00 . A A . 9 VAL HG12 1 1 6 1263 1 1 9 VAL HG13 H 3.076 -9.021 -0.328 1.00 . A A . 9 VAL HG13 1 1 6 1264 1 1 9 VAL HG21 H 2.251 -6.228 -3.036 1.00 . A A . 9 VAL HG21 1 1 6 1265 1 1 9 VAL HG22 H 2.334 -7.989 -3.018 1.00 . A A . 9 VAL HG22 1 1 6 1266 1 1 9 VAL HG23 H 3.816 -7.035 -2.942 1.00 . A A . 9 VAL HG23 1 1 6 1267 1 1 9 VAL N N 0.321 -6.367 -1.285 1.00 . A A . 9 VAL N 1 1 6 1268 1 1 9 VAL O O 2.188 -7.270 1.558 1.00 . A A . 9 VAL O 1 1 6 1269 1 1 10 GLY C C -1.572 -6.261 3.166 1.00 . A A . 10 GLY C 1 1 6 1270 1 1 10 GLY CA C -0.225 -6.860 2.813 1.00 . A A . 10 GLY CA 1 1 6 1271 1 1 10 GLY H H -0.809 -6.929 0.780 1.00 . A A . 10 GLY H 1 1 6 1272 1 1 10 GLY HA2 H -0.147 -7.837 3.266 1.00 . A A . 10 GLY HA2 1 1 6 1273 1 1 10 GLY HA3 H 0.554 -6.226 3.212 1.00 . A A . 10 GLY HA3 1 1 6 1274 1 1 10 GLY N N -0.037 -6.990 1.380 1.00 . A A . 10 GLY N 1 1 6 1275 1 1 10 GLY O O -2.606 -6.915 3.023 1.00 . A A . 10 GLY O 1 1 6 1276 1 1 11 ASP C C -3.228 -3.359 2.900 1.00 . A A . 11 ASP C 1 1 6 1277 1 1 11 ASP CA C -2.795 -4.328 3.997 1.00 . A A . 11 ASP CA 1 1 6 1278 1 1 11 ASP CB C -2.612 -3.577 5.318 1.00 . A A . 11 ASP CB 1 1 6 1279 1 1 11 ASP CG C -3.793 -3.755 6.252 1.00 . A A . 11 ASP CG 1 1 6 1280 1 1 11 ASP H H -0.708 -4.544 3.716 1.00 . A A . 11 ASP H 1 1 6 1281 1 1 11 ASP HA H -3.564 -5.076 4.122 1.00 . A A . 11 ASP HA 1 1 6 1282 1 1 11 ASP HB2 H -1.727 -3.946 5.814 1.00 . A A . 11 ASP HB2 1 1 6 1283 1 1 11 ASP HB3 H -2.493 -2.523 5.113 1.00 . A A . 11 ASP HB3 1 1 6 1284 1 1 11 ASP N N -1.563 -5.014 3.626 1.00 . A A . 11 ASP N 1 1 6 1285 1 1 11 ASP O O -4.419 -3.118 2.707 1.00 . A A . 11 ASP O 1 1 6 1286 1 1 11 ASP OD1 O -3.650 -4.477 7.260 1.00 . A A . 11 ASP OD1 1 1 6 1287 1 1 11 ASP OD2 O -4.862 -3.170 5.975 1.00 . A A . 11 ASP OD2 1 1 6 1288 1 1 12 GLY C C -1.401 -0.947 0.793 1.00 . A A . 12 GLY C 1 1 6 1289 1 1 12 GLY CA C -2.558 -1.875 1.113 1.00 . A A . 12 GLY CA 1 1 6 1290 1 1 12 GLY H H -1.320 -3.038 2.379 1.00 . A A . 12 GLY H 1 1 6 1291 1 1 12 GLY HA2 H -2.809 -2.436 0.226 1.00 . A A . 12 GLY HA2 1 1 6 1292 1 1 12 GLY HA3 H -3.411 -1.281 1.404 1.00 . A A . 12 GLY HA3 1 1 6 1293 1 1 12 GLY N N -2.252 -2.808 2.182 1.00 . A A . 12 GLY N 1 1 6 1294 1 1 12 GLY O O -0.448 -0.842 1.565 1.00 . A A . 12 GLY O 1 1 6 1295 1 1 13 ARG C C -1.026 2.027 -1.096 1.00 . A A . 13 ARG C 1 1 6 1296 1 1 13 ARG CA C -0.442 0.653 -0.775 1.00 . A A . 13 ARG CA 1 1 6 1297 1 1 13 ARG CB C 0.292 0.098 -2.000 1.00 . A A . 13 ARG CB 1 1 6 1298 1 1 13 ARG CD C 0.001 -0.881 -4.298 1.00 . A A . 13 ARG CD 1 1 6 1299 1 1 13 ARG CG C -0.549 0.092 -3.268 1.00 . A A . 13 ARG CG 1 1 6 1300 1 1 13 ARG CZ C -0.767 -1.881 -6.415 1.00 . A A . 13 ARG CZ 1 1 6 1301 1 1 13 ARG H H -2.272 -0.400 -0.922 1.00 . A A . 13 ARG H 1 1 6 1302 1 1 13 ARG HA H 0.261 0.755 0.038 1.00 . A A . 13 ARG HA 1 1 6 1303 1 1 13 ARG HB2 H 1.171 0.698 -2.180 1.00 . A A . 13 ARG HB2 1 1 6 1304 1 1 13 ARG HB3 H 0.596 -0.917 -1.793 1.00 . A A . 13 ARG HB3 1 1 6 1305 1 1 13 ARG HD2 H 0.789 -0.393 -4.851 1.00 . A A . 13 ARG HD2 1 1 6 1306 1 1 13 ARG HD3 H 0.403 -1.741 -3.783 1.00 . A A . 13 ARG HD3 1 1 6 1307 1 1 13 ARG HE H -1.965 -1.208 -4.968 1.00 . A A . 13 ARG HE 1 1 6 1308 1 1 13 ARG HG2 H -1.558 -0.197 -3.017 1.00 . A A . 13 ARG HG2 1 1 6 1309 1 1 13 ARG HG3 H -0.551 1.086 -3.690 1.00 . A A . 13 ARG HG3 1 1 6 1310 1 1 13 ARG HH11 H 1.243 -1.778 -6.218 1.00 . A A . 13 ARG HH11 1 1 6 1311 1 1 13 ARG HH12 H 0.678 -2.476 -7.699 1.00 . A A . 13 ARG HH12 1 1 6 1312 1 1 13 ARG HH21 H -2.711 -2.128 -6.913 1.00 . A A . 13 ARG HH21 1 1 6 1313 1 1 13 ARG HH22 H -1.567 -2.674 -8.093 1.00 . A A . 13 ARG HH22 1 1 6 1314 1 1 13 ARG N N -1.487 -0.273 -0.350 1.00 . A A . 13 ARG N 1 1 6 1315 1 1 13 ARG NE N -1.029 -1.328 -5.234 1.00 . A A . 13 ARG NE 1 1 6 1316 1 1 13 ARG NH1 N 0.487 -2.059 -6.810 1.00 . A A . 13 ARG NH1 1 1 6 1317 1 1 13 ARG NH2 N -1.763 -2.259 -7.205 1.00 . A A . 13 ARG NH2 1 1 6 1318 1 1 13 ARG O O -2.225 2.159 -1.342 1.00 . A A . 13 ARG O 1 1 6 1319 1 1 14 ILE C C 0.555 5.253 -1.912 1.00 . A A . 14 ILE C 1 1 6 1320 1 1 14 ILE CA C -0.602 4.406 -1.390 1.00 . A A . 14 ILE CA 1 1 6 1321 1 1 14 ILE CB C -1.207 5.093 -0.148 1.00 . A A . 14 ILE CB 1 1 6 1322 1 1 14 ILE CD1 C 0.335 3.943 1.524 1.00 . A A . 14 ILE CD1 1 1 6 1323 1 1 14 ILE CG1 C -0.151 5.256 0.949 1.00 . A A . 14 ILE CG1 1 1 6 1324 1 1 14 ILE CG2 C -2.397 4.300 0.368 1.00 . A A . 14 ILE CG2 1 1 6 1325 1 1 14 ILE H H 0.773 2.875 -0.894 1.00 . A A . 14 ILE H 1 1 6 1326 1 1 14 ILE HA H -1.367 4.354 -2.152 1.00 . A A . 14 ILE HA 1 1 6 1327 1 1 14 ILE HB H -1.561 6.070 -0.444 1.00 . A A . 14 ILE HB 1 1 6 1328 1 1 14 ILE HD11 H 0.527 4.062 2.580 1.00 . A A . 14 ILE HD11 1 1 6 1329 1 1 14 ILE HD12 H 1.246 3.647 1.024 1.00 . A A . 14 ILE HD12 1 1 6 1330 1 1 14 ILE HD13 H -0.419 3.184 1.378 1.00 . A A . 14 ILE HD13 1 1 6 1331 1 1 14 ILE HG12 H 0.704 5.775 0.542 1.00 . A A . 14 ILE HG12 1 1 6 1332 1 1 14 ILE HG13 H -0.569 5.838 1.757 1.00 . A A . 14 ILE HG13 1 1 6 1333 1 1 14 ILE HG21 H -3.072 4.090 -0.449 1.00 . A A . 14 ILE HG21 1 1 6 1334 1 1 14 ILE HG22 H -2.913 4.875 1.122 1.00 . A A . 14 ILE HG22 1 1 6 1335 1 1 14 ILE HG23 H -2.052 3.371 0.796 1.00 . A A . 14 ILE HG23 1 1 6 1336 1 1 14 ILE N N -0.171 3.045 -1.095 1.00 . A A . 14 ILE N 1 1 6 1337 1 1 14 ILE O O 0.550 6.477 -1.776 1.00 . A A . 14 ILE O 1 1 6 1338 1 1 15 LEU C C 3.161 4.665 -4.362 1.00 . A A . 15 LEU C 1 1 6 1339 1 1 15 LEU CA C 2.708 5.294 -3.048 1.00 . A A . 15 LEU CA 1 1 6 1340 1 1 15 LEU CB C 3.857 5.276 -2.036 1.00 . A A . 15 LEU CB 1 1 6 1341 1 1 15 LEU CD1 C 4.498 4.972 0.368 1.00 . A A . 15 LEU CD1 1 1 6 1342 1 1 15 LEU CD2 C 3.222 7.005 -0.338 1.00 . A A . 15 LEU CD2 1 1 6 1343 1 1 15 LEU CG C 3.446 5.520 -0.584 1.00 . A A . 15 LEU CG 1 1 6 1344 1 1 15 LEU H H 1.495 3.621 -2.588 1.00 . A A . 15 LEU H 1 1 6 1345 1 1 15 LEU HA H 2.421 6.318 -3.234 1.00 . A A . 15 LEU HA 1 1 6 1346 1 1 15 LEU HB2 H 4.344 4.313 -2.094 1.00 . A A . 15 LEU HB2 1 1 6 1347 1 1 15 LEU HB3 H 4.568 6.038 -2.318 1.00 . A A . 15 LEU HB3 1 1 6 1348 1 1 15 LEU HD11 H 5.286 5.699 0.491 1.00 . A A . 15 LEU HD11 1 1 6 1349 1 1 15 LEU HD12 H 4.910 4.059 -0.037 1.00 . A A . 15 LEU HD12 1 1 6 1350 1 1 15 LEU HD13 H 4.044 4.767 1.327 1.00 . A A . 15 LEU HD13 1 1 6 1351 1 1 15 LEU HD21 H 3.555 7.260 0.657 1.00 . A A . 15 LEU HD21 1 1 6 1352 1 1 15 LEU HD22 H 2.171 7.231 -0.434 1.00 . A A . 15 LEU HD22 1 1 6 1353 1 1 15 LEU HD23 H 3.781 7.578 -1.062 1.00 . A A . 15 LEU HD23 1 1 6 1354 1 1 15 LEU HG H 2.518 5.004 -0.388 1.00 . A A . 15 LEU HG 1 1 6 1355 1 1 15 LEU N N 1.546 4.596 -2.508 1.00 . A A . 15 LEU N 1 1 6 1356 1 1 15 LEU O O 4.309 4.240 -4.497 1.00 . A A . 15 LEU O 1 1 6 1357 1 1 16 ALA C C 3.097 5.093 -7.590 1.00 . A A . 16 ALA C 1 1 6 1358 1 1 16 ALA CA C 2.560 4.033 -6.633 1.00 . A A . 16 ALA CA 1 1 6 1359 1 1 16 ALA CB C 1.325 3.365 -7.221 1.00 . A A . 16 ALA CB 1 1 6 1360 1 1 16 ALA H H 1.354 4.965 -5.164 1.00 . A A . 16 ALA H 1 1 6 1361 1 1 16 ALA HA H 3.316 3.275 -6.492 1.00 . A A . 16 ALA HA 1 1 6 1362 1 1 16 ALA HB1 H 0.824 4.056 -7.884 1.00 . A A . 16 ALA HB1 1 1 6 1363 1 1 16 ALA HB2 H 0.655 3.080 -6.424 1.00 . A A . 16 ALA HB2 1 1 6 1364 1 1 16 ALA HB3 H 1.621 2.486 -7.775 1.00 . A A . 16 ALA HB3 1 1 6 1365 1 1 16 ALA N N 2.252 4.609 -5.330 1.00 . A A . 16 ALA N 1 1 6 1366 1 1 16 ALA O O 2.436 5.460 -8.561 1.00 . A A . 16 ALA O 1 1 6 1367 1 1 17 GLY C C 4.069 7.852 -8.244 1.00 . A A . 17 GLY C 1 1 6 1368 1 1 17 GLY CA C 4.907 6.592 -8.155 1.00 . A A . 17 GLY CA 1 1 6 1369 1 1 17 GLY H H 4.782 5.249 -6.522 1.00 . A A . 17 GLY H 1 1 6 1370 1 1 17 GLY HA2 H 5.877 6.845 -7.755 1.00 . A A . 17 GLY HA2 1 1 6 1371 1 1 17 GLY HA3 H 5.033 6.186 -9.148 1.00 . A A . 17 GLY HA3 1 1 6 1372 1 1 17 GLY N N 4.301 5.580 -7.309 1.00 . A A . 17 GLY N 1 1 6 1373 1 1 17 GLY O O 4.384 8.715 -9.090 1.00 . A A . 17 GLY O 1 1 6 1374 1 1 17 GLY OXT O 3.098 7.975 -7.468 1.00 . A A . 17 GLY OXT 1 1 7 1375 1 1 1 GLY C C 1.300 -3.208 1.438 1.00 . A A . 1 GLY C 1 1 7 1376 1 1 1 GLY CA C 1.908 -2.854 0.094 1.00 . A A . 1 GLY CA 1 1 7 1377 1 1 1 GLY H1 H 0.240 -2.468 -1.085 1.00 . A A . 1 GLY H1 1 1 7 1378 1 1 1 GLY HA2 H 2.796 -3.451 -0.055 1.00 . A A . 1 GLY HA2 1 1 7 1379 1 1 1 GLY HA3 H 2.187 -1.811 0.101 1.00 . A A . 1 GLY HA3 1 1 7 1380 1 1 1 GLY N N 0.995 -3.089 -1.012 1.00 . A A . 1 GLY N 1 1 7 1381 1 1 1 GLY O O 0.206 -3.769 1.498 1.00 . A A . 1 GLY O 1 1 7 1382 1 1 2 PRO C C 0.380 -2.246 4.329 1.00 . A A . 2 PRO C 1 1 7 1383 1 1 2 PRO CA C 1.505 -3.191 3.891 1.00 . A A . 2 PRO CA 1 1 7 1384 1 1 2 PRO CB C 2.753 -3.026 4.763 1.00 . A A . 2 PRO CB 1 1 7 1385 1 1 2 PRO CD C 3.312 -2.227 2.565 1.00 . A A . 2 PRO CD 1 1 7 1386 1 1 2 PRO CG C 3.605 -2.044 4.032 1.00 . A A . 2 PRO CG 1 1 7 1387 1 1 2 PRO HA H 1.153 -4.210 3.959 1.00 . A A . 2 PRO HA 1 1 7 1388 1 1 2 PRO HB2 H 2.469 -2.657 5.737 1.00 . A A . 2 PRO HB2 1 1 7 1389 1 1 2 PRO HB3 H 3.251 -3.978 4.865 1.00 . A A . 2 PRO HB3 1 1 7 1390 1 1 2 PRO HD2 H 3.264 -1.269 2.069 1.00 . A A . 2 PRO HD2 1 1 7 1391 1 1 2 PRO HD3 H 4.064 -2.851 2.107 1.00 . A A . 2 PRO HD3 1 1 7 1392 1 1 2 PRO HG2 H 3.355 -1.040 4.339 1.00 . A A . 2 PRO HG2 1 1 7 1393 1 1 2 PRO HG3 H 4.647 -2.246 4.231 1.00 . A A . 2 PRO HG3 1 1 7 1394 1 1 2 PRO N N 1.995 -2.893 2.545 1.00 . A A . 2 PRO N 1 1 7 1395 1 1 2 PRO O O -0.789 -2.504 4.049 1.00 . A A . 2 PRO O 1 1 7 1396 1 1 3 LYS C C -0.518 0.888 4.433 1.00 . A A . 3 LYS C 1 1 7 1397 1 1 3 LYS CA C -0.275 -0.201 5.475 1.00 . A A . 3 LYS CA 1 1 7 1398 1 1 3 LYS CB C 0.163 0.429 6.799 1.00 . A A . 3 LYS CB 1 1 7 1399 1 1 3 LYS CD C -0.433 0.909 9.193 1.00 . A A . 3 LYS CD 1 1 7 1400 1 1 3 LYS CE C -0.147 2.397 9.317 1.00 . A A . 3 LYS CE 1 1 7 1401 1 1 3 LYS CG C -0.963 0.556 7.813 1.00 . A A . 3 LYS CG 1 1 7 1402 1 1 3 LYS H H 1.669 -0.991 5.214 1.00 . A A . 3 LYS H 1 1 7 1403 1 1 3 LYS HA H -1.196 -0.740 5.633 1.00 . A A . 3 LYS HA 1 1 7 1404 1 1 3 LYS HB2 H 0.943 -0.179 7.233 1.00 . A A . 3 LYS HB2 1 1 7 1405 1 1 3 LYS HB3 H 0.556 1.416 6.604 1.00 . A A . 3 LYS HB3 1 1 7 1406 1 1 3 LYS HD2 H -1.169 0.632 9.933 1.00 . A A . 3 LYS HD2 1 1 7 1407 1 1 3 LYS HD3 H 0.481 0.360 9.369 1.00 . A A . 3 LYS HD3 1 1 7 1408 1 1 3 LYS HE2 H 0.777 2.617 8.803 1.00 . A A . 3 LYS HE2 1 1 7 1409 1 1 3 LYS HE3 H -0.954 2.945 8.854 1.00 . A A . 3 LYS HE3 1 1 7 1410 1 1 3 LYS HG2 H -1.640 1.332 7.490 1.00 . A A . 3 LYS HG2 1 1 7 1411 1 1 3 LYS HG3 H -1.490 -0.385 7.870 1.00 . A A . 3 LYS HG3 1 1 7 1412 1 1 3 LYS HZ1 H -0.954 3.102 11.110 1.00 . A A . 3 LYS HZ1 1 1 7 1413 1 1 3 LYS HZ2 H 0.623 3.635 10.813 1.00 . A A . 3 LYS HZ2 1 1 7 1414 1 1 3 LYS HZ3 H 0.350 2.043 11.314 1.00 . A A . 3 LYS HZ3 1 1 7 1415 1 1 3 LYS N N 0.726 -1.157 5.014 1.00 . A A . 3 LYS N 1 1 7 1416 1 1 3 LYS NZ N -0.023 2.824 10.738 1.00 . A A . 3 LYS NZ 1 1 7 1417 1 1 3 LYS O O 0.096 1.954 4.481 1.00 . A A . 3 LYS O 1 1 7 1418 1 1 4 GLY C C -3.216 1.676 2.176 1.00 . A A . 4 GLY C 1 1 7 1419 1 1 4 GLY CA C -1.729 1.585 2.461 1.00 . A A . 4 GLY CA 1 1 7 1420 1 1 4 GLY H H -1.881 -0.249 3.507 1.00 . A A . 4 GLY H 1 1 7 1421 1 1 4 GLY HA2 H -1.376 2.555 2.778 1.00 . A A . 4 GLY HA2 1 1 7 1422 1 1 4 GLY HA3 H -1.216 1.307 1.554 1.00 . A A . 4 GLY HA3 1 1 7 1423 1 1 4 GLY N N -1.421 0.615 3.495 1.00 . A A . 4 GLY N 1 1 7 1424 1 1 4 GLY O O -4.037 1.534 3.081 1.00 . A A . 4 GLY O 1 1 7 1425 1 1 5 ASP C C -5.346 0.974 -0.510 1.00 . A A . 5 ASP C 1 1 7 1426 1 1 5 ASP CA C -4.963 2.037 0.519 1.00 . A A . 5 ASP CA 1 1 7 1427 1 1 5 ASP CB C -5.235 3.431 -0.049 1.00 . A A . 5 ASP CB 1 1 7 1428 1 1 5 ASP CG C -5.677 4.413 1.018 1.00 . A A . 5 ASP CG 1 1 7 1429 1 1 5 ASP H H -2.863 2.030 0.239 1.00 . A A . 5 ASP H 1 1 7 1430 1 1 5 ASP HA H -5.569 1.898 1.402 1.00 . A A . 5 ASP HA 1 1 7 1431 1 1 5 ASP HB2 H -4.333 3.809 -0.507 1.00 . A A . 5 ASP HB2 1 1 7 1432 1 1 5 ASP HB3 H -6.012 3.364 -0.796 1.00 . A A . 5 ASP HB3 1 1 7 1433 1 1 5 ASP N N -3.563 1.920 0.916 1.00 . A A . 5 ASP N 1 1 7 1434 1 1 5 ASP O O -6.515 0.605 -0.624 1.00 . A A . 5 ASP O 1 1 7 1435 1 1 5 ASP OD1 O -5.291 4.229 2.191 1.00 . A A . 5 ASP OD1 1 1 7 1436 1 1 5 ASP OD2 O -6.409 5.367 0.680 1.00 . A A . 5 ASP OD2 1 1 7 1437 1 1 6 PHE C C -3.829 -1.808 -1.981 1.00 . A A . 6 PHE C 1 1 7 1438 1 1 6 PHE CA C -4.611 -0.528 -2.279 1.00 . A A . 6 PHE CA 1 1 7 1439 1 1 6 PHE CB C -4.228 0.005 -3.661 1.00 . A A . 6 PHE CB 1 1 7 1440 1 1 6 PHE CD1 C -6.146 1.616 -3.824 1.00 . A A . 6 PHE CD1 1 1 7 1441 1 1 6 PHE CD2 C -5.692 0.201 -5.690 1.00 . A A . 6 PHE CD2 1 1 7 1442 1 1 6 PHE CE1 C -7.205 2.183 -4.507 1.00 . A A . 6 PHE CE1 1 1 7 1443 1 1 6 PHE CE2 C -6.750 0.765 -6.378 1.00 . A A . 6 PHE CE2 1 1 7 1444 1 1 6 PHE CG C -5.379 0.620 -4.407 1.00 . A A . 6 PHE CG 1 1 7 1445 1 1 6 PHE CZ C -7.507 1.757 -5.786 1.00 . A A . 6 PHE CZ 1 1 7 1446 1 1 6 PHE H H -3.450 0.819 -1.129 1.00 . A A . 6 PHE H 1 1 7 1447 1 1 6 PHE HA H -5.666 -0.752 -2.272 1.00 . A A . 6 PHE HA 1 1 7 1448 1 1 6 PHE HB2 H -3.464 0.760 -3.549 1.00 . A A . 6 PHE HB2 1 1 7 1449 1 1 6 PHE HB3 H -3.840 -0.807 -4.258 1.00 . A A . 6 PHE HB3 1 1 7 1450 1 1 6 PHE HD1 H -5.910 1.950 -2.824 1.00 . A A . 6 PHE HD1 1 1 7 1451 1 1 6 PHE HD2 H -5.101 -0.574 -6.154 1.00 . A A . 6 PHE HD2 1 1 7 1452 1 1 6 PHE HE1 H -7.796 2.958 -4.042 1.00 . A A . 6 PHE HE1 1 1 7 1453 1 1 6 PHE HE2 H -6.985 0.430 -7.378 1.00 . A A . 6 PHE HE2 1 1 7 1454 1 1 6 PHE HZ H -8.334 2.199 -6.322 1.00 . A A . 6 PHE HZ 1 1 7 1455 1 1 6 PHE N N -4.362 0.488 -1.260 1.00 . A A . 6 PHE N 1 1 7 1456 1 1 6 PHE O O -2.613 -1.856 -2.165 1.00 . A A . 6 PHE O 1 1 7 1457 1 1 7 PRO C C -2.920 -4.617 -2.287 1.00 . A A . 7 PRO C 1 1 7 1458 1 1 7 PRO CA C -3.880 -4.150 -1.197 1.00 . A A . 7 PRO CA 1 1 7 1459 1 1 7 PRO CB C -5.065 -5.109 -1.083 1.00 . A A . 7 PRO CB 1 1 7 1460 1 1 7 PRO CD C -5.975 -2.903 -1.270 1.00 . A A . 7 PRO CD 1 1 7 1461 1 1 7 PRO CG C -6.199 -4.252 -0.641 1.00 . A A . 7 PRO CG 1 1 7 1462 1 1 7 PRO HA H -3.359 -4.108 -0.253 1.00 . A A . 7 PRO HA 1 1 7 1463 1 1 7 PRO HB2 H -5.260 -5.561 -2.045 1.00 . A A . 7 PRO HB2 1 1 7 1464 1 1 7 PRO HB3 H -4.843 -5.876 -0.357 1.00 . A A . 7 PRO HB3 1 1 7 1465 1 1 7 PRO HD2 H -6.525 -2.824 -2.197 1.00 . A A . 7 PRO HD2 1 1 7 1466 1 1 7 PRO HD3 H -6.268 -2.117 -0.590 1.00 . A A . 7 PRO HD3 1 1 7 1467 1 1 7 PRO HG2 H -7.133 -4.675 -0.982 1.00 . A A . 7 PRO HG2 1 1 7 1468 1 1 7 PRO HG3 H -6.197 -4.168 0.436 1.00 . A A . 7 PRO HG3 1 1 7 1469 1 1 7 PRO N N -4.519 -2.868 -1.517 1.00 . A A . 7 PRO N 1 1 7 1470 1 1 7 PRO O O -3.339 -4.947 -3.396 1.00 . A A . 7 PRO O 1 1 7 1471 1 1 8 ASP C C 0.125 -6.310 -2.400 1.00 . A A . 8 ASP C 1 1 7 1472 1 1 8 ASP CA C -0.612 -5.075 -2.914 1.00 . A A . 8 ASP CA 1 1 7 1473 1 1 8 ASP CB C 0.375 -3.935 -3.196 1.00 . A A . 8 ASP CB 1 1 7 1474 1 1 8 ASP CG C 1.403 -3.746 -2.093 1.00 . A A . 8 ASP CG 1 1 7 1475 1 1 8 ASP H H -1.357 -4.372 -1.061 1.00 . A A . 8 ASP H 1 1 7 1476 1 1 8 ASP HA H -1.115 -5.335 -3.835 1.00 . A A . 8 ASP HA 1 1 7 1477 1 1 8 ASP HB2 H 0.902 -4.145 -4.114 1.00 . A A . 8 ASP HB2 1 1 7 1478 1 1 8 ASP HB3 H -0.177 -3.013 -3.308 1.00 . A A . 8 ASP HB3 1 1 7 1479 1 1 8 ASP N N -1.630 -4.644 -1.962 1.00 . A A . 8 ASP N 1 1 7 1480 1 1 8 ASP O O 0.340 -7.271 -3.139 1.00 . A A . 8 ASP O 1 1 7 1481 1 1 8 ASP OD1 O 2.548 -4.181 -2.217 1.00 . A A . 8 ASP OD1 1 1 7 1482 1 1 9 VAL C C 1.003 -7.393 1.006 1.00 . A A . 9 VAL C 1 1 7 1483 1 1 9 VAL CA C 1.212 -7.393 -0.507 1.00 . A A . 9 VAL CA 1 1 7 1484 1 1 9 VAL CB C 2.723 -7.347 -0.815 1.00 . A A . 9 VAL CB 1 1 7 1485 1 1 9 VAL CG1 C 3.432 -8.553 -0.215 1.00 . A A . 9 VAL CG1 1 1 7 1486 1 1 9 VAL CG2 C 2.961 -7.278 -2.316 1.00 . A A . 9 VAL CG2 1 1 7 1487 1 1 9 VAL H H 0.301 -5.484 -0.588 1.00 . A A . 9 VAL H 1 1 7 1488 1 1 9 VAL HA H 0.810 -8.309 -0.915 1.00 . A A . 9 VAL HA 1 1 7 1489 1 1 9 VAL HB H 3.136 -6.455 -0.366 1.00 . A A . 9 VAL HB 1 1 7 1490 1 1 9 VAL HG11 H 2.733 -9.371 -0.121 1.00 . A A . 9 VAL HG11 1 1 7 1491 1 1 9 VAL HG12 H 3.818 -8.296 0.760 1.00 . A A . 9 VAL HG12 1 1 7 1492 1 1 9 VAL HG13 H 4.247 -8.849 -0.858 1.00 . A A . 9 VAL HG13 1 1 7 1493 1 1 9 VAL HG21 H 2.594 -6.337 -2.697 1.00 . A A . 9 VAL HG21 1 1 7 1494 1 1 9 VAL HG22 H 2.439 -8.090 -2.801 1.00 . A A . 9 VAL HG22 1 1 7 1495 1 1 9 VAL HG23 H 4.019 -7.360 -2.518 1.00 . A A . 9 VAL HG23 1 1 7 1496 1 1 9 VAL N N 0.505 -6.277 -1.127 1.00 . A A . 9 VAL N 1 1 7 1497 1 1 9 VAL O O 1.962 -7.398 1.778 1.00 . A A . 9 VAL O 1 1 7 1498 1 1 10 GLY C C -1.897 -6.695 3.126 1.00 . A A . 10 GLY C 1 1 7 1499 1 1 10 GLY CA C -0.579 -7.383 2.835 1.00 . A A . 10 GLY CA 1 1 7 1500 1 1 10 GLY H H -0.982 -7.381 0.757 1.00 . A A . 10 GLY H 1 1 7 1501 1 1 10 GLY HA2 H -0.633 -8.404 3.183 1.00 . A A . 10 GLY HA2 1 1 7 1502 1 1 10 GLY HA3 H 0.208 -6.872 3.370 1.00 . A A . 10 GLY HA3 1 1 7 1503 1 1 10 GLY N N -0.259 -7.386 1.420 1.00 . A A . 10 GLY N 1 1 7 1504 1 1 10 GLY O O -2.936 -7.347 3.233 1.00 . A A . 10 GLY O 1 1 7 1505 1 1 11 ASP C C -3.300 -3.561 2.428 1.00 . A A . 11 ASP C 1 1 7 1506 1 1 11 ASP CA C -3.059 -4.594 3.527 1.00 . A A . 11 ASP CA 1 1 7 1507 1 1 11 ASP CB C -2.945 -3.901 4.888 1.00 . A A . 11 ASP CB 1 1 7 1508 1 1 11 ASP CG C -4.032 -4.337 5.851 1.00 . A A . 11 ASP CG 1 1 7 1509 1 1 11 ASP H H -0.999 -4.909 3.152 1.00 . A A . 11 ASP H 1 1 7 1510 1 1 11 ASP HA H -3.896 -5.276 3.550 1.00 . A A . 11 ASP HA 1 1 7 1511 1 1 11 ASP HB2 H -1.987 -4.138 5.326 1.00 . A A . 11 ASP HB2 1 1 7 1512 1 1 11 ASP HB3 H -3.019 -2.832 4.751 1.00 . A A . 11 ASP HB3 1 1 7 1513 1 1 11 ASP N N -1.857 -5.372 3.251 1.00 . A A . 11 ASP N 1 1 7 1514 1 1 11 ASP O O -4.438 -3.336 2.015 1.00 . A A . 11 ASP O 1 1 7 1515 1 1 11 ASP OD1 O -4.102 -5.545 6.160 1.00 . A A . 11 ASP OD1 1 1 7 1516 1 1 11 ASP OD2 O -4.813 -3.470 6.297 1.00 . A A . 11 ASP OD2 1 1 7 1517 1 1 12 GLY C C -1.139 -1.026 0.824 1.00 . A A . 12 GLY C 1 1 7 1518 1 1 12 GLY CA C -2.345 -1.941 0.910 1.00 . A A . 12 GLY CA 1 1 7 1519 1 1 12 GLY H H -1.341 -3.158 2.322 1.00 . A A . 12 GLY H 1 1 7 1520 1 1 12 GLY HA2 H -2.463 -2.445 -0.036 1.00 . A A . 12 GLY HA2 1 1 7 1521 1 1 12 GLY HA3 H -3.224 -1.343 1.098 1.00 . A A . 12 GLY HA3 1 1 7 1522 1 1 12 GLY N N -2.223 -2.938 1.958 1.00 . A A . 12 GLY N 1 1 7 1523 1 1 12 GLY O O -0.303 -1.002 1.727 1.00 . A A . 12 GLY O 1 1 7 1524 1 1 13 ARG C C -0.459 2.061 -0.786 1.00 . A A . 13 ARG C 1 1 7 1525 1 1 13 ARG CA C 0.055 0.658 -0.473 1.00 . A A . 13 ARG CA 1 1 7 1526 1 1 13 ARG CB C 0.954 0.168 -1.610 1.00 . A A . 13 ARG CB 1 1 7 1527 1 1 13 ARG CD C 1.220 -0.158 -4.090 1.00 . A A . 13 ARG CD 1 1 7 1528 1 1 13 ARG CG C 0.239 0.055 -2.947 1.00 . A A . 13 ARG CG 1 1 7 1529 1 1 13 ARG CZ C 1.747 -1.960 -5.689 1.00 . A A . 13 ARG CZ 1 1 7 1530 1 1 13 ARG H H -1.754 -0.333 -0.948 1.00 . A A . 13 ARG H 1 1 7 1531 1 1 13 ARG HA H 0.631 0.695 0.440 1.00 . A A . 13 ARG HA 1 1 7 1532 1 1 13 ARG HB2 H 1.778 0.857 -1.724 1.00 . A A . 13 ARG HB2 1 1 7 1533 1 1 13 ARG HB3 H 1.344 -0.804 -1.351 1.00 . A A . 13 ARG HB3 1 1 7 1534 1 1 13 ARG HD2 H 1.201 0.711 -4.731 1.00 . A A . 13 ARG HD2 1 1 7 1535 1 1 13 ARG HD3 H 2.212 -0.281 -3.680 1.00 . A A . 13 ARG HD3 1 1 7 1536 1 1 13 ARG HE H -0.028 -1.686 -4.816 1.00 . A A . 13 ARG HE 1 1 7 1537 1 1 13 ARG HG2 H -0.442 -0.782 -2.910 1.00 . A A . 13 ARG HG2 1 1 7 1538 1 1 13 ARG HG3 H -0.315 0.965 -3.125 1.00 . A A . 13 ARG HG3 1 1 7 1539 1 1 13 ARG HH11 H 3.290 -0.713 -5.295 1.00 . A A . 13 ARG HH11 1 1 7 1540 1 1 13 ARG HH12 H 3.634 -1.989 -6.414 1.00 . A A . 13 ARG HH12 1 1 7 1541 1 1 13 ARG HH21 H 0.423 -3.364 -6.289 1.00 . A A . 13 ARG HH21 1 1 7 1542 1 1 13 ARG HH22 H 2.007 -3.493 -6.979 1.00 . A A . 13 ARG HH22 1 1 7 1543 1 1 13 ARG N N -1.053 -0.268 -0.266 1.00 . A A . 13 ARG N 1 1 7 1544 1 1 13 ARG NE N 0.886 -1.338 -4.885 1.00 . A A . 13 ARG NE 1 1 7 1545 1 1 13 ARG NH1 N 2.992 -1.517 -5.809 1.00 . A A . 13 ARG NH1 1 1 7 1546 1 1 13 ARG NH2 N 1.360 -3.027 -6.375 1.00 . A A . 13 ARG NH2 1 1 7 1547 1 1 13 ARG O O -1.556 2.225 -1.319 1.00 . A A . 13 ARG O 1 1 7 1548 1 1 14 ILE C C 1.069 5.202 -1.445 1.00 . A A . 14 ILE C 1 1 7 1549 1 1 14 ILE CA C -0.033 4.457 -0.698 1.00 . A A . 14 ILE CA 1 1 7 1550 1 1 14 ILE CB C -0.341 5.205 0.616 1.00 . A A . 14 ILE CB 1 1 7 1551 1 1 14 ILE CD1 C 2.059 5.221 1.470 1.00 . A A . 14 ILE CD1 1 1 7 1552 1 1 14 ILE CG1 C 0.633 4.781 1.719 1.00 . A A . 14 ILE CG1 1 1 7 1553 1 1 14 ILE CG2 C -1.779 4.955 1.045 1.00 . A A . 14 ILE CG2 1 1 7 1554 1 1 14 ILE H H 1.204 2.874 -0.029 1.00 . A A . 14 ILE H 1 1 7 1555 1 1 14 ILE HA H -0.927 4.457 -1.305 1.00 . A A . 14 ILE HA 1 1 7 1556 1 1 14 ILE HB H -0.227 6.264 0.434 1.00 . A A . 14 ILE HB 1 1 7 1557 1 1 14 ILE HD11 H 2.475 5.628 2.379 1.00 . A A . 14 ILE HD11 1 1 7 1558 1 1 14 ILE HD12 H 2.074 5.975 0.697 1.00 . A A . 14 ILE HD12 1 1 7 1559 1 1 14 ILE HD13 H 2.648 4.372 1.154 1.00 . A A . 14 ILE HD13 1 1 7 1560 1 1 14 ILE HG12 H 0.314 5.211 2.656 1.00 . A A . 14 ILE HG12 1 1 7 1561 1 1 14 ILE HG13 H 0.626 3.704 1.800 1.00 . A A . 14 ILE HG13 1 1 7 1562 1 1 14 ILE HG21 H -1.793 4.251 1.864 1.00 . A A . 14 ILE HG21 1 1 7 1563 1 1 14 ILE HG22 H -2.339 4.552 0.215 1.00 . A A . 14 ILE HG22 1 1 7 1564 1 1 14 ILE HG23 H -2.227 5.885 1.363 1.00 . A A . 14 ILE HG23 1 1 7 1565 1 1 14 ILE N N 0.341 3.068 -0.451 1.00 . A A . 14 ILE N 1 1 7 1566 1 1 14 ILE O O 1.185 6.423 -1.341 1.00 . A A . 14 ILE O 1 1 7 1567 1 1 15 LEU C C 3.251 4.249 -4.225 1.00 . A A . 15 LEU C 1 1 7 1568 1 1 15 LEU CA C 2.968 5.056 -2.961 1.00 . A A . 15 LEU CA 1 1 7 1569 1 1 15 LEU CB C 4.235 5.150 -2.104 1.00 . A A . 15 LEU CB 1 1 7 1570 1 1 15 LEU CD1 C 4.934 2.781 -1.671 1.00 . A A . 15 LEU CD1 1 1 7 1571 1 1 15 LEU CD2 C 5.308 4.532 0.075 1.00 . A A . 15 LEU CD2 1 1 7 1572 1 1 15 LEU CG C 4.394 4.057 -1.044 1.00 . A A . 15 LEU CG 1 1 7 1573 1 1 15 LEU H H 1.734 3.493 -2.242 1.00 . A A . 15 LEU H 1 1 7 1574 1 1 15 LEU HA H 2.665 6.052 -3.248 1.00 . A A . 15 LEU HA 1 1 7 1575 1 1 15 LEU HB2 H 5.090 5.110 -2.762 1.00 . A A . 15 LEU HB2 1 1 7 1576 1 1 15 LEU HB3 H 4.233 6.107 -1.603 1.00 . A A . 15 LEU HB3 1 1 7 1577 1 1 15 LEU HD11 H 5.526 2.246 -0.943 1.00 . A A . 15 LEU HD11 1 1 7 1578 1 1 15 LEU HD12 H 5.550 3.031 -2.522 1.00 . A A . 15 LEU HD12 1 1 7 1579 1 1 15 LEU HD13 H 4.111 2.161 -1.992 1.00 . A A . 15 LEU HD13 1 1 7 1580 1 1 15 LEU HD21 H 6.025 5.237 -0.321 1.00 . A A . 15 LEU HD21 1 1 7 1581 1 1 15 LEU HD22 H 5.830 3.687 0.497 1.00 . A A . 15 LEU HD22 1 1 7 1582 1 1 15 LEU HD23 H 4.718 5.012 0.842 1.00 . A A . 15 LEU HD23 1 1 7 1583 1 1 15 LEU HG H 3.428 3.835 -0.616 1.00 . A A . 15 LEU HG 1 1 7 1584 1 1 15 LEU N N 1.876 4.461 -2.198 1.00 . A A . 15 LEU N 1 1 7 1585 1 1 15 LEU O O 4.069 3.329 -4.216 1.00 . A A . 15 LEU O 1 1 7 1586 1 1 16 ALA C C 3.052 4.898 -7.705 1.00 . A A . 16 ALA C 1 1 7 1587 1 1 16 ALA CA C 2.748 3.911 -6.583 1.00 . A A . 16 ALA CA 1 1 7 1588 1 1 16 ALA CB C 1.509 3.094 -6.917 1.00 . A A . 16 ALA CB 1 1 7 1589 1 1 16 ALA H H 1.932 5.343 -5.255 1.00 . A A . 16 ALA H 1 1 7 1590 1 1 16 ALA HA H 3.582 3.231 -6.479 1.00 . A A . 16 ALA HA 1 1 7 1591 1 1 16 ALA HB1 H 0.636 3.727 -6.864 1.00 . A A . 16 ALA HB1 1 1 7 1592 1 1 16 ALA HB2 H 1.410 2.284 -6.209 1.00 . A A . 16 ALA HB2 1 1 7 1593 1 1 16 ALA HB3 H 1.602 2.691 -7.914 1.00 . A A . 16 ALA HB3 1 1 7 1594 1 1 16 ALA N N 2.570 4.601 -5.311 1.00 . A A . 16 ALA N 1 1 7 1595 1 1 16 ALA O O 4.195 5.020 -8.145 1.00 . A A . 16 ALA O 1 1 7 1596 1 1 17 GLY C C 0.937 7.361 -9.511 1.00 . A A . 17 GLY C 1 1 7 1597 1 1 17 GLY CA C 2.197 6.565 -9.233 1.00 . A A . 17 GLY CA 1 1 7 1598 1 1 17 GLY H H 1.132 5.458 -7.777 1.00 . A A . 17 GLY H 1 1 7 1599 1 1 17 GLY HA2 H 2.988 7.248 -8.959 1.00 . A A . 17 GLY HA2 1 1 7 1600 1 1 17 GLY HA3 H 2.485 6.042 -10.133 1.00 . A A . 17 GLY HA3 1 1 7 1601 1 1 17 GLY N N 2.020 5.599 -8.166 1.00 . A A . 17 GLY N 1 1 7 1602 1 1 17 GLY O O 1.016 8.356 -10.261 1.00 . A A . 17 GLY O 1 1 7 1603 1 1 17 GLY OXT O -0.130 6.988 -8.979 1.00 . A A . 17 GLY OXT 1 1 8 1604 1 1 1 GLY C C 1.252 -3.059 0.900 1.00 . A A . 1 GLY C 1 1 8 1605 1 1 1 GLY CA C 1.583 -2.648 -0.522 1.00 . A A . 1 GLY CA 1 1 8 1606 1 1 1 GLY H1 H -0.348 -3.055 -1.295 1.00 . A A . 1 GLY H1 1 1 8 1607 1 1 1 GLY HA2 H 2.557 -3.038 -0.780 1.00 . A A . 1 GLY HA2 1 1 8 1608 1 1 1 GLY HA3 H 1.612 -1.570 -0.575 1.00 . A A . 1 GLY HA3 1 1 8 1609 1 1 1 GLY N N 0.610 -3.141 -1.480 1.00 . A A . 1 GLY N 1 1 8 1610 1 1 1 GLY O O 0.224 -3.692 1.139 1.00 . A A . 1 GLY O 1 1 8 1611 1 1 2 PRO C C 0.760 -2.224 3.903 1.00 . A A . 2 PRO C 1 1 8 1612 1 1 2 PRO CA C 1.883 -3.056 3.276 1.00 . A A . 2 PRO CA 1 1 8 1613 1 1 2 PRO CB C 3.237 -2.767 3.932 1.00 . A A . 2 PRO CB 1 1 8 1614 1 1 2 PRO CD C 3.361 -1.954 1.679 1.00 . A A . 2 PRO CD 1 1 8 1615 1 1 2 PRO CG C 3.854 -1.710 3.081 1.00 . A A . 2 PRO CG 1 1 8 1616 1 1 2 PRO HA H 1.647 -4.105 3.385 1.00 . A A . 2 PRO HA 1 1 8 1617 1 1 2 PRO HB2 H 3.085 -2.424 4.945 1.00 . A A . 2 PRO HB2 1 1 8 1618 1 1 2 PRO HB3 H 3.835 -3.666 3.938 1.00 . A A . 2 PRO HB3 1 1 8 1619 1 1 2 PRO HD2 H 3.170 -1.016 1.179 1.00 . A A . 2 PRO HD2 1 1 8 1620 1 1 2 PRO HD3 H 4.081 -2.538 1.124 1.00 . A A . 2 PRO HD3 1 1 8 1621 1 1 2 PRO HG2 H 3.542 -0.734 3.422 1.00 . A A . 2 PRO HG2 1 1 8 1622 1 1 2 PRO HG3 H 4.930 -1.793 3.118 1.00 . A A . 2 PRO HG3 1 1 8 1623 1 1 2 PRO N N 2.109 -2.710 1.873 1.00 . A A . 2 PRO N 1 1 8 1624 1 1 2 PRO O O -0.412 -2.579 3.788 1.00 . A A . 2 PRO O 1 1 8 1625 1 1 3 LYS C C -0.359 0.827 4.224 1.00 . A A . 3 LYS C 1 1 8 1626 1 1 3 LYS CA C 0.116 -0.256 5.188 1.00 . A A . 3 LYS CA 1 1 8 1627 1 1 3 LYS CB C 0.694 0.384 6.451 1.00 . A A . 3 LYS CB 1 1 8 1628 1 1 3 LYS CD C 0.285 1.124 8.817 1.00 . A A . 3 LYS CD 1 1 8 1629 1 1 3 LYS CE C 1.070 -0.019 9.440 1.00 . A A . 3 LYS CE 1 1 8 1630 1 1 3 LYS CG C -0.355 0.711 7.502 1.00 . A A . 3 LYS CG 1 1 8 1631 1 1 3 LYS H H 2.056 -0.873 4.621 1.00 . A A . 3 LYS H 1 1 8 1632 1 1 3 LYS HA H -0.727 -0.872 5.462 1.00 . A A . 3 LYS HA 1 1 8 1633 1 1 3 LYS HB2 H 1.411 -0.294 6.889 1.00 . A A . 3 LYS HB2 1 1 8 1634 1 1 3 LYS HB3 H 1.197 1.300 6.179 1.00 . A A . 3 LYS HB3 1 1 8 1635 1 1 3 LYS HD2 H 0.956 1.950 8.636 1.00 . A A . 3 LYS HD2 1 1 8 1636 1 1 3 LYS HD3 H -0.491 1.432 9.503 1.00 . A A . 3 LYS HD3 1 1 8 1637 1 1 3 LYS HE2 H 1.988 -0.152 8.887 1.00 . A A . 3 LYS HE2 1 1 8 1638 1 1 3 LYS HE3 H 1.301 0.236 10.464 1.00 . A A . 3 LYS HE3 1 1 8 1639 1 1 3 LYS HG2 H -0.971 1.522 7.142 1.00 . A A . 3 LYS HG2 1 1 8 1640 1 1 3 LYS HG3 H -0.968 -0.163 7.669 1.00 . A A . 3 LYS HG3 1 1 8 1641 1 1 3 LYS HZ1 H -0.631 -1.159 9.856 1.00 . A A . 3 LYS HZ1 1 1 8 1642 1 1 3 LYS HZ2 H 0.817 -2.029 9.951 1.00 . A A . 3 LYS HZ2 1 1 8 1643 1 1 3 LYS HZ3 H 0.175 -1.621 8.441 1.00 . A A . 3 LYS HZ3 1 1 8 1644 1 1 3 LYS N N 1.111 -1.118 4.560 1.00 . A A . 3 LYS N 1 1 8 1645 1 1 3 LYS NZ N 0.304 -1.296 9.421 1.00 . A A . 3 LYS NZ 1 1 8 1646 1 1 3 LYS O O 0.169 1.939 4.218 1.00 . A A . 3 LYS O 1 1 8 1647 1 1 4 GLY C C -3.379 1.322 2.252 1.00 . A A . 4 GLY C 1 1 8 1648 1 1 4 GLY CA C -1.883 1.461 2.458 1.00 . A A . 4 GLY CA 1 1 8 1649 1 1 4 GLY H H -1.743 -0.402 3.459 1.00 . A A . 4 GLY H 1 1 8 1650 1 1 4 GLY HA2 H -1.673 2.457 2.818 1.00 . A A . 4 GLY HA2 1 1 8 1651 1 1 4 GLY HA3 H -1.386 1.321 1.510 1.00 . A A . 4 GLY HA3 1 1 8 1652 1 1 4 GLY N N -1.359 0.499 3.411 1.00 . A A . 4 GLY N 1 1 8 1653 1 1 4 GLY O O -4.089 0.819 3.123 1.00 . A A . 4 GLY O 1 1 8 1654 1 1 5 ASP C C -5.553 0.713 -0.350 1.00 . A A . 5 ASP C 1 1 8 1655 1 1 5 ASP CA C -5.283 1.705 0.780 1.00 . A A . 5 ASP CA 1 1 8 1656 1 1 5 ASP CB C -5.807 3.088 0.391 1.00 . A A . 5 ASP CB 1 1 8 1657 1 1 5 ASP CG C -7.313 3.106 0.216 1.00 . A A . 5 ASP CG 1 1 8 1658 1 1 5 ASP H H -3.244 2.169 0.445 1.00 . A A . 5 ASP H 1 1 8 1659 1 1 5 ASP HA H -5.802 1.371 1.665 1.00 . A A . 5 ASP HA 1 1 8 1660 1 1 5 ASP HB2 H -5.544 3.796 1.162 1.00 . A A . 5 ASP HB2 1 1 8 1661 1 1 5 ASP HB3 H -5.351 3.390 -0.541 1.00 . A A . 5 ASP HB3 1 1 8 1662 1 1 5 ASP N N -3.860 1.775 1.097 1.00 . A A . 5 ASP N 1 1 8 1663 1 1 5 ASP O O -6.671 0.220 -0.497 1.00 . A A . 5 ASP O 1 1 8 1664 1 1 5 ASP OD1 O -8.008 3.636 1.109 1.00 . A A . 5 ASP OD1 1 1 8 1665 1 1 5 ASP OD2 O -7.798 2.592 -0.813 1.00 . A A . 5 ASP OD2 1 1 8 1666 1 1 6 PHE C C -3.925 -1.810 -1.978 1.00 . A A . 6 PHE C 1 1 8 1667 1 1 6 PHE CA C -4.667 -0.505 -2.263 1.00 . A A . 6 PHE CA 1 1 8 1668 1 1 6 PHE CB C -4.136 0.127 -3.552 1.00 . A A . 6 PHE CB 1 1 8 1669 1 1 6 PHE CD1 C -5.938 1.777 -4.125 1.00 . A A . 6 PHE CD1 1 1 8 1670 1 1 6 PHE CD2 C -3.755 2.606 -3.639 1.00 . A A . 6 PHE CD2 1 1 8 1671 1 1 6 PHE CE1 C -6.386 3.069 -4.332 1.00 . A A . 6 PHE CE1 1 1 8 1672 1 1 6 PHE CE2 C -4.197 3.900 -3.845 1.00 . A A . 6 PHE CE2 1 1 8 1673 1 1 6 PHE CG C -4.620 1.532 -3.776 1.00 . A A . 6 PHE CG 1 1 8 1674 1 1 6 PHE CZ C -5.514 4.131 -4.192 1.00 . A A . 6 PHE CZ 1 1 8 1675 1 1 6 PHE H H -3.661 0.852 -0.986 1.00 . A A . 6 PHE H 1 1 8 1676 1 1 6 PHE HA H -5.717 -0.720 -2.386 1.00 . A A . 6 PHE HA 1 1 8 1677 1 1 6 PHE HB2 H -3.058 0.150 -3.516 1.00 . A A . 6 PHE HB2 1 1 8 1678 1 1 6 PHE HB3 H -4.451 -0.472 -4.394 1.00 . A A . 6 PHE HB3 1 1 8 1679 1 1 6 PHE HD1 H -6.621 0.948 -4.234 1.00 . A A . 6 PHE HD1 1 1 8 1680 1 1 6 PHE HD2 H -2.726 2.427 -3.368 1.00 . A A . 6 PHE HD2 1 1 8 1681 1 1 6 PHE HE1 H -7.416 3.247 -4.604 1.00 . A A . 6 PHE HE1 1 1 8 1682 1 1 6 PHE HE2 H -3.514 4.729 -3.734 1.00 . A A . 6 PHE HE2 1 1 8 1683 1 1 6 PHE HZ H -5.862 5.141 -4.353 1.00 . A A . 6 PHE HZ 1 1 8 1684 1 1 6 PHE N N -4.528 0.427 -1.149 1.00 . A A . 6 PHE N 1 1 8 1685 1 1 6 PHE O O -2.731 -1.926 -2.252 1.00 . A A . 6 PHE O 1 1 8 1686 1 1 7 PRO C C -3.161 -4.664 -2.218 1.00 . A A . 7 PRO C 1 1 8 1687 1 1 7 PRO CA C -4.029 -4.113 -1.091 1.00 . A A . 7 PRO CA 1 1 8 1688 1 1 7 PRO CB C -5.249 -5.006 -0.870 1.00 . A A . 7 PRO CB 1 1 8 1689 1 1 7 PRO CD C -6.057 -2.759 -1.053 1.00 . A A . 7 PRO CD 1 1 8 1690 1 1 7 PRO CG C -6.304 -4.080 -0.373 1.00 . A A . 7 PRO CG 1 1 8 1691 1 1 7 PRO HA H -3.448 -4.065 -0.182 1.00 . A A . 7 PRO HA 1 1 8 1692 1 1 7 PRO HB2 H -5.534 -5.468 -1.804 1.00 . A A . 7 PRO HB2 1 1 8 1693 1 1 7 PRO HB3 H -5.016 -5.766 -0.140 1.00 . A A . 7 PRO HB3 1 1 8 1694 1 1 7 PRO HD2 H -6.675 -2.668 -1.935 1.00 . A A . 7 PRO HD2 1 1 8 1695 1 1 7 PRO HD3 H -6.249 -1.944 -0.372 1.00 . A A . 7 PRO HD3 1 1 8 1696 1 1 7 PRO HG2 H -7.279 -4.460 -0.636 1.00 . A A . 7 PRO HG2 1 1 8 1697 1 1 7 PRO HG3 H -6.220 -3.969 0.698 1.00 . A A . 7 PRO HG3 1 1 8 1698 1 1 7 PRO N N -4.626 -2.813 -1.417 1.00 . A A . 7 PRO N 1 1 8 1699 1 1 7 PRO O O -3.643 -4.909 -3.324 1.00 . A A . 7 PRO O 1 1 8 1700 1 1 8 ASP C C -0.054 -6.469 -2.292 1.00 . A A . 8 ASP C 1 1 8 1701 1 1 8 ASP CA C -0.945 -5.393 -2.913 1.00 . A A . 8 ASP CA 1 1 8 1702 1 1 8 ASP CB C -0.092 -4.262 -3.507 1.00 . A A . 8 ASP CB 1 1 8 1703 1 1 8 ASP CG C 1.005 -3.788 -2.571 1.00 . A A . 8 ASP CG 1 1 8 1704 1 1 8 ASP H H -1.555 -4.654 -1.025 1.00 . A A . 8 ASP H 1 1 8 1705 1 1 8 ASP HA H -1.526 -5.843 -3.704 1.00 . A A . 8 ASP HA 1 1 8 1706 1 1 8 ASP HB2 H 0.369 -4.611 -4.418 1.00 . A A . 8 ASP HB2 1 1 8 1707 1 1 8 ASP HB3 H -0.733 -3.423 -3.734 1.00 . A A . 8 ASP HB3 1 1 8 1708 1 1 8 ASP N N -1.879 -4.864 -1.926 1.00 . A A . 8 ASP N 1 1 8 1709 1 1 8 ASP O O 0.124 -7.546 -2.861 1.00 . A A . 8 ASP O 1 1 8 1710 1 1 8 ASP OD1 O 2.190 -4.001 -2.828 1.00 . A A . 8 ASP OD1 1 1 8 1711 1 1 9 VAL C C 1.029 -7.137 1.076 1.00 . A A . 9 VAL C 1 1 8 1712 1 1 9 VAL CA C 1.363 -7.109 -0.413 1.00 . A A . 9 VAL CA 1 1 8 1713 1 1 9 VAL CB C 2.855 -6.753 -0.588 1.00 . A A . 9 VAL CB 1 1 8 1714 1 1 9 VAL CG1 C 3.741 -7.836 0.012 1.00 . A A . 9 VAL CG1 1 1 8 1715 1 1 9 VAL CG2 C 3.192 -6.537 -2.057 1.00 . A A . 9 VAL CG2 1 1 8 1716 1 1 9 VAL H H 0.312 -5.297 -0.713 1.00 . A A . 9 VAL H 1 1 8 1717 1 1 9 VAL HA H 1.196 -8.093 -0.828 1.00 . A A . 9 VAL HA 1 1 8 1718 1 1 9 VAL HB H 3.047 -5.831 -0.059 1.00 . A A . 9 VAL HB 1 1 8 1719 1 1 9 VAL HG11 H 3.123 -8.592 0.476 1.00 . A A . 9 VAL HG11 1 1 8 1720 1 1 9 VAL HG12 H 4.391 -7.399 0.755 1.00 . A A . 9 VAL HG12 1 1 8 1721 1 1 9 VAL HG13 H 4.337 -8.288 -0.766 1.00 . A A . 9 VAL HG13 1 1 8 1722 1 1 9 VAL HG21 H 3.529 -7.468 -2.489 1.00 . A A . 9 VAL HG21 1 1 8 1723 1 1 9 VAL HG22 H 3.974 -5.798 -2.141 1.00 . A A . 9 VAL HG22 1 1 8 1724 1 1 9 VAL HG23 H 2.316 -6.194 -2.583 1.00 . A A . 9 VAL HG23 1 1 8 1725 1 1 9 VAL N N 0.497 -6.170 -1.118 1.00 . A A . 9 VAL N 1 1 8 1726 1 1 9 VAL O O 1.901 -7.353 1.917 1.00 . A A . 9 VAL O 1 1 8 1727 1 1 10 GLY C C -1.983 -6.178 2.977 1.00 . A A . 10 GLY C 1 1 8 1728 1 1 10 GLY CA C -0.673 -6.915 2.780 1.00 . A A . 10 GLY CA 1 1 8 1729 1 1 10 GLY H H -0.892 -6.746 0.680 1.00 . A A . 10 GLY H 1 1 8 1730 1 1 10 GLY HA2 H -0.793 -7.937 3.108 1.00 . A A . 10 GLY HA2 1 1 8 1731 1 1 10 GLY HA3 H 0.088 -6.441 3.382 1.00 . A A . 10 GLY HA3 1 1 8 1732 1 1 10 GLY N N -0.242 -6.914 1.393 1.00 . A A . 10 GLY N 1 1 8 1733 1 1 10 GLY O O -3.052 -6.708 2.674 1.00 . A A . 10 GLY O 1 1 8 1734 1 1 11 ASP C C -3.326 -3.183 2.555 1.00 . A A . 11 ASP C 1 1 8 1735 1 1 11 ASP CA C -3.092 -4.142 3.718 1.00 . A A . 11 ASP CA 1 1 8 1736 1 1 11 ASP CB C -2.962 -3.358 5.027 1.00 . A A . 11 ASP CB 1 1 8 1737 1 1 11 ASP CG C -2.371 -4.190 6.148 1.00 . A A . 11 ASP CG 1 1 8 1738 1 1 11 ASP H H -1.021 -4.582 3.704 1.00 . A A . 11 ASP H 1 1 8 1739 1 1 11 ASP HA H -3.937 -4.811 3.791 1.00 . A A . 11 ASP HA 1 1 8 1740 1 1 11 ASP HB2 H -2.326 -2.502 4.866 1.00 . A A . 11 ASP HB2 1 1 8 1741 1 1 11 ASP HB3 H -3.942 -3.020 5.333 1.00 . A A . 11 ASP HB3 1 1 8 1742 1 1 11 ASP N N -1.901 -4.952 3.484 1.00 . A A . 11 ASP N 1 1 8 1743 1 1 11 ASP O O -4.468 -2.879 2.209 1.00 . A A . 11 ASP O 1 1 8 1744 1 1 11 ASP OD1 O -3.030 -4.323 7.201 1.00 . A A . 11 ASP OD1 1 1 8 1745 1 1 11 ASP OD2 O -1.248 -4.710 5.974 1.00 . A A . 11 ASP OD2 1 1 8 1746 1 1 12 GLY C C -1.101 -0.958 0.634 1.00 . A A . 12 GLY C 1 1 8 1747 1 1 12 GLY CA C -2.348 -1.798 0.832 1.00 . A A . 12 GLY CA 1 1 8 1748 1 1 12 GLY H H -1.353 -2.993 2.270 1.00 . A A . 12 GLY H 1 1 8 1749 1 1 12 GLY HA2 H -2.525 -2.369 -0.065 1.00 . A A . 12 GLY HA2 1 1 8 1750 1 1 12 GLY HA3 H -3.188 -1.140 1.000 1.00 . A A . 12 GLY HA3 1 1 8 1751 1 1 12 GLY N N -2.237 -2.713 1.953 1.00 . A A . 12 GLY N 1 1 8 1752 1 1 12 GLY O O -0.255 -0.870 1.524 1.00 . A A . 12 GLY O 1 1 8 1753 1 1 13 ARG C C -0.216 1.981 -0.789 1.00 . A A . 13 ARG C 1 1 8 1754 1 1 13 ARG CA C 0.160 0.503 -0.852 1.00 . A A . 13 ARG CA 1 1 8 1755 1 1 13 ARG CB C 0.706 0.161 -2.241 1.00 . A A . 13 ARG CB 1 1 8 1756 1 1 13 ARG CD C -0.310 -0.620 -4.407 1.00 . A A . 13 ARG CD 1 1 8 1757 1 1 13 ARG CG C -0.254 0.494 -3.372 1.00 . A A . 13 ARG CG 1 1 8 1758 1 1 13 ARG CZ C 0.265 -0.897 -6.787 1.00 . A A . 13 ARG CZ 1 1 8 1759 1 1 13 ARG H H -1.699 -0.446 -1.204 1.00 . A A . 13 ARG H 1 1 8 1760 1 1 13 ARG HA H 0.926 0.308 -0.116 1.00 . A A . 13 ARG HA 1 1 8 1761 1 1 13 ARG HB2 H 1.621 0.713 -2.401 1.00 . A A . 13 ARG HB2 1 1 8 1762 1 1 13 ARG HB3 H 0.922 -0.896 -2.280 1.00 . A A . 13 ARG HB3 1 1 8 1763 1 1 13 ARG HD2 H 0.445 -1.354 -4.170 1.00 . A A . 13 ARG HD2 1 1 8 1764 1 1 13 ARG HD3 H -1.286 -1.082 -4.366 1.00 . A A . 13 ARG HD3 1 1 8 1765 1 1 13 ARG HE H -0.184 0.840 -5.914 1.00 . A A . 13 ARG HE 1 1 8 1766 1 1 13 ARG HG2 H -1.241 0.640 -2.962 1.00 . A A . 13 ARG HG2 1 1 8 1767 1 1 13 ARG HG3 H 0.075 1.404 -3.853 1.00 . A A . 13 ARG HG3 1 1 8 1768 1 1 13 ARG HH11 H 0.275 -2.614 -5.718 1.00 . A A . 13 ARG HH11 1 1 8 1769 1 1 13 ARG HH12 H 0.676 -2.781 -7.394 1.00 . A A . 13 ARG HH12 1 1 8 1770 1 1 13 ARG HH21 H 0.343 0.622 -8.118 1.00 . A A . 13 ARG HH21 1 1 8 1771 1 1 13 ARG HH22 H 0.716 -0.944 -8.757 1.00 . A A . 13 ARG HH22 1 1 8 1772 1 1 13 ARG N N -0.990 -0.337 -0.537 1.00 . A A . 13 ARG N 1 1 8 1773 1 1 13 ARG NE N -0.078 -0.122 -5.761 1.00 . A A . 13 ARG NE 1 1 8 1774 1 1 13 ARG NH1 N 0.418 -2.204 -6.619 1.00 . A A . 13 ARG NH1 1 1 8 1775 1 1 13 ARG NH2 N 0.457 -0.362 -7.985 1.00 . A A . 13 ARG NH2 1 1 8 1776 1 1 13 ARG O O -1.260 2.387 -1.299 1.00 . A A . 13 ARG O 1 1 8 1777 1 1 14 ILE C C 0.911 4.971 -1.248 1.00 . A A . 14 ILE C 1 1 8 1778 1 1 14 ILE CA C 0.397 4.210 -0.031 1.00 . A A . 14 ILE CA 1 1 8 1779 1 1 14 ILE CB C 1.063 4.780 1.235 1.00 . A A . 14 ILE CB 1 1 8 1780 1 1 14 ILE CD1 C 3.349 5.186 2.279 1.00 . A A . 14 ILE CD1 1 1 8 1781 1 1 14 ILE CG1 C 2.540 4.385 1.283 1.00 . A A . 14 ILE CG1 1 1 8 1782 1 1 14 ILE CG2 C 0.337 4.293 2.481 1.00 . A A . 14 ILE CG2 1 1 8 1783 1 1 14 ILE H H 1.456 2.396 0.226 1.00 . A A . 14 ILE H 1 1 8 1784 1 1 14 ILE HA H -0.670 4.360 0.051 1.00 . A A . 14 ILE HA 1 1 8 1785 1 1 14 ILE HB H 0.986 5.857 1.202 1.00 . A A . 14 ILE HB 1 1 8 1786 1 1 14 ILE HD11 H 4.354 5.315 1.906 1.00 . A A . 14 ILE HD11 1 1 8 1787 1 1 14 ILE HD12 H 3.379 4.662 3.223 1.00 . A A . 14 ILE HD12 1 1 8 1788 1 1 14 ILE HD13 H 2.890 6.154 2.419 1.00 . A A . 14 ILE HD13 1 1 8 1789 1 1 14 ILE HG12 H 2.618 3.343 1.554 1.00 . A A . 14 ILE HG12 1 1 8 1790 1 1 14 ILE HG13 H 2.976 4.531 0.305 1.00 . A A . 14 ILE HG13 1 1 8 1791 1 1 14 ILE HG21 H 0.949 4.481 3.350 1.00 . A A . 14 ILE HG21 1 1 8 1792 1 1 14 ILE HG22 H 0.147 3.234 2.395 1.00 . A A . 14 ILE HG22 1 1 8 1793 1 1 14 ILE HG23 H -0.600 4.820 2.580 1.00 . A A . 14 ILE HG23 1 1 8 1794 1 1 14 ILE N N 0.641 2.779 -0.161 1.00 . A A . 14 ILE N 1 1 8 1795 1 1 14 ILE O O 0.335 5.982 -1.649 1.00 . A A . 14 ILE O 1 1 8 1796 1 1 15 LEU C C 2.258 4.339 -4.271 1.00 . A A . 15 LEU C 1 1 8 1797 1 1 15 LEU CA C 2.592 5.116 -3.002 1.00 . A A . 15 LEU CA 1 1 8 1798 1 1 15 LEU CB C 4.110 5.221 -2.839 1.00 . A A . 15 LEU CB 1 1 8 1799 1 1 15 LEU CD1 C 4.671 6.168 -5.091 1.00 . A A . 15 LEU CD1 1 1 8 1800 1 1 15 LEU CD2 C 4.110 7.701 -3.197 1.00 . A A . 15 LEU CD2 1 1 8 1801 1 1 15 LEU CG C 4.762 6.384 -3.589 1.00 . A A . 15 LEU CG 1 1 8 1802 1 1 15 LEU H H 2.415 3.672 -1.465 1.00 . A A . 15 LEU H 1 1 8 1803 1 1 15 LEU HA H 2.179 6.110 -3.083 1.00 . A A . 15 LEU HA 1 1 8 1804 1 1 15 LEU HB2 H 4.331 5.328 -1.787 1.00 . A A . 15 LEU HB2 1 1 8 1805 1 1 15 LEU HB3 H 4.553 4.302 -3.191 1.00 . A A . 15 LEU HB3 1 1 8 1806 1 1 15 LEU HD11 H 3.633 6.128 -5.387 1.00 . A A . 15 LEU HD11 1 1 8 1807 1 1 15 LEU HD12 H 5.156 5.239 -5.351 1.00 . A A . 15 LEU HD12 1 1 8 1808 1 1 15 LEU HD13 H 5.160 6.985 -5.602 1.00 . A A . 15 LEU HD13 1 1 8 1809 1 1 15 LEU HD21 H 4.788 8.515 -3.408 1.00 . A A . 15 LEU HD21 1 1 8 1810 1 1 15 LEU HD22 H 3.880 7.689 -2.142 1.00 . A A . 15 LEU HD22 1 1 8 1811 1 1 15 LEU HD23 H 3.200 7.834 -3.762 1.00 . A A . 15 LEU HD23 1 1 8 1812 1 1 15 LEU HG H 5.808 6.434 -3.322 1.00 . A A . 15 LEU HG 1 1 8 1813 1 1 15 LEU N N 2.000 4.480 -1.831 1.00 . A A . 15 LEU N 1 1 8 1814 1 1 15 LEU O O 2.686 3.198 -4.444 1.00 . A A . 15 LEU O 1 1 8 1815 1 1 16 ALA C C 1.713 5.064 -7.605 1.00 . A A . 16 ALA C 1 1 8 1816 1 1 16 ALA CA C 1.101 4.336 -6.413 1.00 . A A . 16 ALA CA 1 1 8 1817 1 1 16 ALA CB C -0.416 4.301 -6.534 1.00 . A A . 16 ALA CB 1 1 8 1818 1 1 16 ALA H H 1.182 5.876 -4.963 1.00 . A A . 16 ALA H 1 1 8 1819 1 1 16 ALA HA H 1.461 3.318 -6.401 1.00 . A A . 16 ALA HA 1 1 8 1820 1 1 16 ALA HB1 H -0.701 3.554 -7.259 1.00 . A A . 16 ALA HB1 1 1 8 1821 1 1 16 ALA HB2 H -0.774 5.269 -6.853 1.00 . A A . 16 ALA HB2 1 1 8 1822 1 1 16 ALA HB3 H -0.848 4.056 -5.575 1.00 . A A . 16 ALA HB3 1 1 8 1823 1 1 16 ALA N N 1.492 4.967 -5.158 1.00 . A A . 16 ALA N 1 1 8 1824 1 1 16 ALA O O 1.024 5.786 -8.326 1.00 . A A . 16 ALA O 1 1 8 1825 1 1 17 GLY C C 4.455 6.755 -8.479 1.00 . A A . 17 GLY C 1 1 8 1826 1 1 17 GLY CA C 3.696 5.516 -8.910 1.00 . A A . 17 GLY CA 1 1 8 1827 1 1 17 GLY H H 3.511 4.286 -7.198 1.00 . A A . 17 GLY H 1 1 8 1828 1 1 17 GLY HA2 H 4.392 4.815 -9.347 1.00 . A A . 17 GLY HA2 1 1 8 1829 1 1 17 GLY HA3 H 2.967 5.795 -9.657 1.00 . A A . 17 GLY HA3 1 1 8 1830 1 1 17 GLY N N 3.012 4.871 -7.805 1.00 . A A . 17 GLY N 1 1 8 1831 1 1 17 GLY O O 3.801 7.765 -8.142 1.00 . A A . 17 GLY O 1 1 8 1832 1 1 17 GLY OXT O 5.703 6.716 -8.475 1.00 . A A . 17 GLY OXT 1 1 9 1833 1 1 1 GLY C C 1.229 -3.246 1.327 1.00 . A A . 1 GLY C 1 1 9 1834 1 1 1 GLY CA C 1.694 -2.797 -0.045 1.00 . A A . 1 GLY CA 1 1 9 1835 1 1 1 GLY H1 H -0.131 -2.903 -1.094 1.00 . A A . 1 GLY H1 1 1 9 1836 1 1 1 GLY HA2 H 2.674 -3.210 -0.233 1.00 . A A . 1 GLY HA2 1 1 9 1837 1 1 1 GLY HA3 H 1.762 -1.720 -0.055 1.00 . A A . 1 GLY HA3 1 1 9 1838 1 1 1 GLY N N 0.796 -3.219 -1.104 1.00 . A A . 1 GLY N 1 1 9 1839 1 1 1 GLY O O 0.186 -3.889 1.451 1.00 . A A . 1 GLY O 1 1 9 1840 1 1 2 PRO C C 0.475 -2.472 4.313 1.00 . A A . 2 PRO C 1 1 9 1841 1 1 2 PRO CA C 1.635 -3.304 3.755 1.00 . A A . 2 PRO CA 1 1 9 1842 1 1 2 PRO CB C 2.931 -3.060 4.532 1.00 . A A . 2 PRO CB 1 1 9 1843 1 1 2 PRO CD C 3.250 -2.158 2.330 1.00 . A A . 2 PRO CD 1 1 9 1844 1 1 2 PRO CG C 3.632 -1.981 3.776 1.00 . A A . 2 PRO CG 1 1 9 1845 1 1 2 PRO HA H 1.375 -4.351 3.809 1.00 . A A . 2 PRO HA 1 1 9 1846 1 1 2 PRO HB2 H 2.698 -2.751 5.540 1.00 . A A . 2 PRO HB2 1 1 9 1847 1 1 2 PRO HB3 H 3.516 -3.967 4.554 1.00 . A A . 2 PRO HB3 1 1 9 1848 1 1 2 PRO HD2 H 3.096 -1.197 1.862 1.00 . A A . 2 PRO HD2 1 1 9 1849 1 1 2 PRO HD3 H 4.012 -2.715 1.805 1.00 . A A . 2 PRO HD3 1 1 9 1850 1 1 2 PRO HG2 H 3.310 -1.014 4.132 1.00 . A A . 2 PRO HG2 1 1 9 1851 1 1 2 PRO HG3 H 4.700 -2.087 3.895 1.00 . A A . 2 PRO HG3 1 1 9 1852 1 1 2 PRO N N 1.988 -2.920 2.387 1.00 . A A . 2 PRO N 1 1 9 1853 1 1 2 PRO O O -0.688 -2.818 4.112 1.00 . A A . 2 PRO O 1 1 9 1854 1 1 3 LYS C C -0.652 0.575 4.601 1.00 . A A . 3 LYS C 1 1 9 1855 1 1 3 LYS CA C -0.248 -0.523 5.581 1.00 . A A . 3 LYS CA 1 1 9 1856 1 1 3 LYS CB C 0.239 0.096 6.894 1.00 . A A . 3 LYS CB 1 1 9 1857 1 1 3 LYS CD C -0.004 -0.019 9.392 1.00 . A A . 3 LYS CD 1 1 9 1858 1 1 3 LYS CE C 0.450 -1.386 9.878 1.00 . A A . 3 LYS CE 1 1 9 1859 1 1 3 LYS CG C -0.720 -0.110 8.054 1.00 . A A . 3 LYS CG 1 1 9 1860 1 1 3 LYS H H 1.725 -1.142 5.144 1.00 . A A . 3 LYS H 1 1 9 1861 1 1 3 LYS HA H -1.111 -1.140 5.785 1.00 . A A . 3 LYS HA 1 1 9 1862 1 1 3 LYS HB2 H 1.189 -0.347 7.157 1.00 . A A . 3 LYS HB2 1 1 9 1863 1 1 3 LYS HB3 H 0.375 1.158 6.752 1.00 . A A . 3 LYS HB3 1 1 9 1864 1 1 3 LYS HD2 H 0.860 0.619 9.284 1.00 . A A . 3 LYS HD2 1 1 9 1865 1 1 3 LYS HD3 H -0.679 0.407 10.121 1.00 . A A . 3 LYS HD3 1 1 9 1866 1 1 3 LYS HE2 H 0.154 -1.504 10.909 1.00 . A A . 3 LYS HE2 1 1 9 1867 1 1 3 LYS HE3 H -0.030 -2.146 9.278 1.00 . A A . 3 LYS HE3 1 1 9 1868 1 1 3 LYS HG2 H -1.486 0.650 8.015 1.00 . A A . 3 LYS HG2 1 1 9 1869 1 1 3 LYS HG3 H -1.174 -1.086 7.964 1.00 . A A . 3 LYS HG3 1 1 9 1870 1 1 3 LYS HZ1 H 2.406 -0.810 10.328 1.00 . A A . 3 LYS HZ1 1 1 9 1871 1 1 3 LYS HZ2 H 2.227 -1.476 8.784 1.00 . A A . 3 LYS HZ2 1 1 9 1872 1 1 3 LYS HZ3 H 2.209 -2.481 10.144 1.00 . A A . 3 LYS HZ3 1 1 9 1873 1 1 3 LYS N N 0.786 -1.379 5.010 1.00 . A A . 3 LYS N 1 1 9 1874 1 1 3 LYS NZ N 1.926 -1.550 9.776 1.00 . A A . 3 LYS NZ 1 1 9 1875 1 1 3 LYS O O -0.118 1.683 4.641 1.00 . A A . 3 LYS O 1 1 9 1876 1 1 4 GLY C C -3.526 1.076 2.409 1.00 . A A . 4 GLY C 1 1 9 1877 1 1 4 GLY CA C -2.057 1.237 2.749 1.00 . A A . 4 GLY CA 1 1 9 1878 1 1 4 GLY H H -1.991 -0.636 3.736 1.00 . A A . 4 GLY H 1 1 9 1879 1 1 4 GLY HA2 H -1.898 2.228 3.148 1.00 . A A . 4 GLY HA2 1 1 9 1880 1 1 4 GLY HA3 H -1.475 1.128 1.845 1.00 . A A . 4 GLY HA3 1 1 9 1881 1 1 4 GLY N N -1.599 0.262 3.723 1.00 . A A . 4 GLY N 1 1 9 1882 1 1 4 GLY O O -4.303 0.560 3.213 1.00 . A A . 4 GLY O 1 1 9 1883 1 1 5 ASP C C -5.429 0.520 -0.452 1.00 . A A . 5 ASP C 1 1 9 1884 1 1 5 ASP CA C -5.295 1.427 0.771 1.00 . A A . 5 ASP CA 1 1 9 1885 1 1 5 ASP CB C -5.841 2.819 0.447 1.00 . A A . 5 ASP CB 1 1 9 1886 1 1 5 ASP CG C -4.899 3.620 -0.431 1.00 . A A . 5 ASP CG 1 1 9 1887 1 1 5 ASP H H -3.241 1.925 0.622 1.00 . A A . 5 ASP H 1 1 9 1888 1 1 5 ASP HA H -5.873 1.006 1.579 1.00 . A A . 5 ASP HA 1 1 9 1889 1 1 5 ASP HB2 H -6.785 2.718 -0.067 1.00 . A A . 5 ASP HB2 1 1 9 1890 1 1 5 ASP HB3 H -5.993 3.361 1.369 1.00 . A A . 5 ASP HB3 1 1 9 1891 1 1 5 ASP N N -3.908 1.521 1.216 1.00 . A A . 5 ASP N 1 1 9 1892 1 1 5 ASP O O -6.523 0.054 -0.769 1.00 . A A . 5 ASP O 1 1 9 1893 1 1 5 ASP OD1 O -4.861 3.359 -1.652 1.00 . A A . 5 ASP OD1 1 1 9 1894 1 1 5 ASP OD2 O -4.201 4.507 0.102 1.00 . A A . 5 ASP OD2 1 1 9 1895 1 1 6 PHE C C -3.680 -1.933 -2.025 1.00 . A A . 6 PHE C 1 1 9 1896 1 1 6 PHE CA C -4.320 -0.578 -2.324 1.00 . A A . 6 PHE CA 1 1 9 1897 1 1 6 PHE CB C -3.573 0.108 -3.470 1.00 . A A . 6 PHE CB 1 1 9 1898 1 1 6 PHE CD1 C -4.781 0.689 -5.591 1.00 . A A . 6 PHE CD1 1 1 9 1899 1 1 6 PHE CD2 C -3.915 -1.520 -5.350 1.00 . A A . 6 PHE CD2 1 1 9 1900 1 1 6 PHE CE1 C -5.266 0.366 -6.844 1.00 . A A . 6 PHE CE1 1 1 9 1901 1 1 6 PHE CE2 C -4.399 -1.849 -6.602 1.00 . A A . 6 PHE CE2 1 1 9 1902 1 1 6 PHE CG C -4.101 -0.248 -4.831 1.00 . A A . 6 PHE CG 1 1 9 1903 1 1 6 PHE CZ C -5.075 -0.905 -7.350 1.00 . A A . 6 PHE CZ 1 1 9 1904 1 1 6 PHE H H -3.471 0.672 -0.842 1.00 . A A . 6 PHE H 1 1 9 1905 1 1 6 PHE HA H -5.347 -0.732 -2.618 1.00 . A A . 6 PHE HA 1 1 9 1906 1 1 6 PHE HB2 H -3.652 1.178 -3.353 1.00 . A A . 6 PHE HB2 1 1 9 1907 1 1 6 PHE HB3 H -2.531 -0.177 -3.432 1.00 . A A . 6 PHE HB3 1 1 9 1908 1 1 6 PHE HD1 H -4.930 1.684 -5.197 1.00 . A A . 6 PHE HD1 1 1 9 1909 1 1 6 PHE HD2 H -3.387 -2.259 -4.766 1.00 . A A . 6 PHE HD2 1 1 9 1910 1 1 6 PHE HE1 H -5.795 1.106 -7.427 1.00 . A A . 6 PHE HE1 1 1 9 1911 1 1 6 PHE HE2 H -4.248 -2.844 -6.995 1.00 . A A . 6 PHE HE2 1 1 9 1912 1 1 6 PHE HZ H -5.453 -1.160 -8.329 1.00 . A A . 6 PHE HZ 1 1 9 1913 1 1 6 PHE N N -4.315 0.273 -1.138 1.00 . A A . 6 PHE N 1 1 9 1914 1 1 6 PHE O O -2.456 -2.064 -2.036 1.00 . A A . 6 PHE O 1 1 9 1915 1 1 7 PRO C C -2.952 -4.787 -2.441 1.00 . A A . 7 PRO C 1 1 9 1916 1 1 7 PRO CA C -4.001 -4.308 -1.443 1.00 . A A . 7 PRO CA 1 1 9 1917 1 1 7 PRO CB C -5.257 -5.175 -1.533 1.00 . A A . 7 PRO CB 1 1 9 1918 1 1 7 PRO CD C -5.974 -2.899 -1.710 1.00 . A A . 7 PRO CD 1 1 9 1919 1 1 7 PRO CG C -6.374 -4.253 -1.187 1.00 . A A . 7 PRO CG 1 1 9 1920 1 1 7 PRO HA H -3.596 -4.361 -0.444 1.00 . A A . 7 PRO HA 1 1 9 1921 1 1 7 PRO HB2 H -5.360 -5.563 -2.536 1.00 . A A . 7 PRO HB2 1 1 9 1922 1 1 7 PRO HB3 H -5.187 -5.990 -0.829 1.00 . A A . 7 PRO HB3 1 1 9 1923 1 1 7 PRO HD2 H -6.379 -2.743 -2.699 1.00 . A A . 7 PRO HD2 1 1 9 1924 1 1 7 PRO HD3 H -6.308 -2.123 -1.038 1.00 . A A . 7 PRO HD3 1 1 9 1925 1 1 7 PRO HG2 H -7.285 -4.585 -1.663 1.00 . A A . 7 PRO HG2 1 1 9 1926 1 1 7 PRO HG3 H -6.502 -4.217 -0.115 1.00 . A A . 7 PRO HG3 1 1 9 1927 1 1 7 PRO N N -4.500 -2.963 -1.749 1.00 . A A . 7 PRO N 1 1 9 1928 1 1 7 PRO O O -3.257 -5.034 -3.608 1.00 . A A . 7 PRO O 1 1 9 1929 1 1 8 ASP C C 0.216 -6.440 -2.112 1.00 . A A . 8 ASP C 1 1 9 1930 1 1 8 ASP CA C -0.622 -5.378 -2.824 1.00 . A A . 8 ASP CA 1 1 9 1931 1 1 8 ASP CB C 0.255 -4.194 -3.254 1.00 . A A . 8 ASP CB 1 1 9 1932 1 1 8 ASP CG C 1.275 -3.791 -2.204 1.00 . A A . 8 ASP CG 1 1 9 1933 1 1 8 ASP H H -1.535 -4.713 -1.033 1.00 . A A . 8 ASP H 1 1 9 1934 1 1 8 ASP HA H -1.060 -5.823 -3.705 1.00 . A A . 8 ASP HA 1 1 9 1935 1 1 8 ASP HB2 H 0.787 -4.460 -4.155 1.00 . A A . 8 ASP HB2 1 1 9 1936 1 1 8 ASP HB3 H -0.379 -3.343 -3.457 1.00 . A A . 8 ASP HB3 1 1 9 1937 1 1 8 ASP N N -1.715 -4.922 -1.973 1.00 . A A . 8 ASP N 1 1 9 1938 1 1 8 ASP O O 0.577 -7.458 -2.701 1.00 . A A . 8 ASP O 1 1 9 1939 1 1 8 ASP OD1 O 2.477 -3.989 -2.384 1.00 . A A . 8 ASP OD1 1 1 9 1940 1 1 9 VAL C C 1.019 -6.955 1.444 1.00 . A A . 9 VAL C 1 1 9 1941 1 1 9 VAL CA C 1.307 -7.127 -0.046 1.00 . A A . 9 VAL CA 1 1 9 1942 1 1 9 VAL CB C 2.817 -6.943 -0.298 1.00 . A A . 9 VAL CB 1 1 9 1943 1 1 9 VAL CG1 C 3.623 -7.965 0.491 1.00 . A A . 9 VAL CG1 1 1 9 1944 1 1 9 VAL CG2 C 3.128 -7.046 -1.784 1.00 . A A . 9 VAL CG2 1 1 9 1945 1 1 9 VAL H H 0.198 -5.367 -0.425 1.00 . A A . 9 VAL H 1 1 9 1946 1 1 9 VAL HA H 1.033 -8.130 -0.341 1.00 . A A . 9 VAL HA 1 1 9 1947 1 1 9 VAL HB H 3.101 -5.957 0.039 1.00 . A A . 9 VAL HB 1 1 9 1948 1 1 9 VAL HG11 H 3.924 -7.535 1.435 1.00 . A A . 9 VAL HG11 1 1 9 1949 1 1 9 VAL HG12 H 4.500 -8.245 -0.073 1.00 . A A . 9 VAL HG12 1 1 9 1950 1 1 9 VAL HG13 H 3.016 -8.840 0.671 1.00 . A A . 9 VAL HG13 1 1 9 1951 1 1 9 VAL HG21 H 4.198 -7.041 -1.930 1.00 . A A . 9 VAL HG21 1 1 9 1952 1 1 9 VAL HG22 H 2.690 -6.206 -2.303 1.00 . A A . 9 VAL HG22 1 1 9 1953 1 1 9 VAL HG23 H 2.716 -7.964 -2.175 1.00 . A A . 9 VAL HG23 1 1 9 1954 1 1 9 VAL N N 0.517 -6.194 -0.840 1.00 . A A . 9 VAL N 1 1 9 1955 1 1 9 VAL O O 1.926 -6.707 2.239 1.00 . A A . 9 VAL O 1 1 9 1956 1 1 10 GLY C C -1.999 -6.305 3.374 1.00 . A A . 10 GLY C 1 1 9 1957 1 1 10 GLY CA C -0.634 -6.944 3.209 1.00 . A A . 10 GLY CA 1 1 9 1958 1 1 10 GLY H H -0.932 -7.285 1.140 1.00 . A A . 10 GLY H 1 1 9 1959 1 1 10 GLY HA2 H -0.649 -7.921 3.669 1.00 . A A . 10 GLY HA2 1 1 9 1960 1 1 10 GLY HA3 H 0.101 -6.332 3.711 1.00 . A A . 10 GLY HA3 1 1 9 1961 1 1 10 GLY N N -0.251 -7.088 1.816 1.00 . A A . 10 GLY N 1 1 9 1962 1 1 10 GLY O O -3.024 -6.948 3.149 1.00 . A A . 10 GLY O 1 1 9 1963 1 1 11 ASP C C -3.515 -3.338 2.817 1.00 . A A . 11 ASP C 1 1 9 1964 1 1 11 ASP CA C -3.262 -4.310 3.966 1.00 . A A . 11 ASP CA 1 1 9 1965 1 1 11 ASP CB C -3.234 -3.554 5.297 1.00 . A A . 11 ASP CB 1 1 9 1966 1 1 11 ASP CG C -3.976 -4.289 6.395 1.00 . A A . 11 ASP CG 1 1 9 1967 1 1 11 ASP H H -1.162 -4.577 3.934 1.00 . A A . 11 ASP H 1 1 9 1968 1 1 11 ASP HA H -4.064 -5.033 3.992 1.00 . A A . 11 ASP HA 1 1 9 1969 1 1 11 ASP HB2 H -2.208 -3.423 5.608 1.00 . A A . 11 ASP HB2 1 1 9 1970 1 1 11 ASP HB3 H -3.692 -2.584 5.164 1.00 . A A . 11 ASP HB3 1 1 9 1971 1 1 11 ASP N N -2.013 -5.036 3.770 1.00 . A A . 11 ASP N 1 1 9 1972 1 1 11 ASP O O -4.662 -3.068 2.461 1.00 . A A . 11 ASP O 1 1 9 1973 1 1 11 ASP OD1 O -3.639 -4.082 7.580 1.00 . A A . 11 ASP OD1 1 1 9 1974 1 1 11 ASP OD2 O -4.895 -5.070 6.071 1.00 . A A . 11 ASP OD2 1 1 9 1975 1 1 12 GLY C C -1.276 -1.129 0.863 1.00 . A A . 12 GLY C 1 1 9 1976 1 1 12 GLY CA C -2.564 -1.881 1.139 1.00 . A A . 12 GLY CA 1 1 9 1977 1 1 12 GLY H H -1.547 -3.068 2.567 1.00 . A A . 12 GLY H 1 1 9 1978 1 1 12 GLY HA2 H -2.846 -2.426 0.251 1.00 . A A . 12 GLY HA2 1 1 9 1979 1 1 12 GLY HA3 H -3.341 -1.169 1.374 1.00 . A A . 12 GLY HA3 1 1 9 1980 1 1 12 GLY N N -2.437 -2.816 2.241 1.00 . A A . 12 GLY N 1 1 9 1981 1 1 12 GLY O O -0.379 -1.091 1.705 1.00 . A A . 12 GLY O 1 1 9 1982 1 1 13 ARG C C -0.265 1.723 -0.676 1.00 . A A . 13 ARG C 1 1 9 1983 1 1 13 ARG CA C 0.003 0.222 -0.709 1.00 . A A . 13 ARG CA 1 1 9 1984 1 1 13 ARG CB C 0.457 -0.195 -2.109 1.00 . A A . 13 ARG CB 1 1 9 1985 1 1 13 ARG CD C 2.395 -0.638 -3.648 1.00 . A A . 13 ARG CD 1 1 9 1986 1 1 13 ARG CG C 1.936 0.043 -2.368 1.00 . A A . 13 ARG CG 1 1 9 1987 1 1 13 ARG CZ C 0.829 -0.062 -5.467 1.00 . A A . 13 ARG CZ 1 1 9 1988 1 1 13 ARG H H -1.933 -0.597 -0.948 1.00 . A A . 13 ARG H 1 1 9 1989 1 1 13 ARG HA H 0.786 -0.007 -0.003 1.00 . A A . 13 ARG HA 1 1 9 1990 1 1 13 ARG HB2 H 0.256 -1.248 -2.241 1.00 . A A . 13 ARG HB2 1 1 9 1991 1 1 13 ARG HB3 H -0.108 0.365 -2.840 1.00 . A A . 13 ARG HB3 1 1 9 1992 1 1 13 ARG HD2 H 3.472 -0.715 -3.632 1.00 . A A . 13 ARG HD2 1 1 9 1993 1 1 13 ARG HD3 H 1.966 -1.628 -3.689 1.00 . A A . 13 ARG HD3 1 1 9 1994 1 1 13 ARG HE H 2.624 0.768 -5.193 1.00 . A A . 13 ARG HE 1 1 9 1995 1 1 13 ARG HG2 H 2.110 1.104 -2.455 1.00 . A A . 13 ARG HG2 1 1 9 1996 1 1 13 ARG HG3 H 2.504 -0.351 -1.538 1.00 . A A . 13 ARG HG3 1 1 9 1997 1 1 13 ARG HH11 H 0.146 -1.491 -4.209 1.00 . A A . 13 ARG HH11 1 1 9 1998 1 1 13 ARG HH12 H -0.926 -1.064 -5.499 1.00 . A A . 13 ARG HH12 1 1 9 1999 1 1 13 ARG HH21 H 1.210 1.326 -6.886 1.00 . A A . 13 ARG HH21 1 1 9 2000 1 1 13 ARG HH22 H -0.324 0.533 -7.017 1.00 . A A . 13 ARG HH22 1 1 9 2001 1 1 13 ARG N N -1.184 -0.531 -0.320 1.00 . A A . 13 ARG N 1 1 9 2002 1 1 13 ARG NE N 1.992 0.107 -4.840 1.00 . A A . 13 ARG NE 1 1 9 2003 1 1 13 ARG NH1 N -0.056 -0.945 -5.021 1.00 . A A . 13 ARG NH1 1 1 9 2004 1 1 13 ARG NH2 N 0.548 0.658 -6.545 1.00 . A A . 13 ARG NH2 1 1 9 2005 1 1 13 ARG O O -1.415 2.158 -0.608 1.00 . A A . 13 ARG O 1 1 9 2006 1 1 14 ILE C C 1.767 4.606 -1.575 1.00 . A A . 14 ILE C 1 1 9 2007 1 1 14 ILE CA C 0.692 3.962 -0.706 1.00 . A A . 14 ILE CA 1 1 9 2008 1 1 14 ILE CB C 0.799 4.523 0.728 1.00 . A A . 14 ILE CB 1 1 9 2009 1 1 14 ILE CD1 C 2.061 4.290 2.928 1.00 . A A . 14 ILE CD1 1 1 9 2010 1 1 14 ILE CG1 C 1.811 3.719 1.549 1.00 . A A . 14 ILE CG1 1 1 9 2011 1 1 14 ILE CG2 C -0.565 4.515 1.402 1.00 . A A . 14 ILE CG2 1 1 9 2012 1 1 14 ILE H H 1.695 2.100 -0.781 1.00 . A A . 14 ILE H 1 1 9 2013 1 1 14 ILE HA H -0.279 4.225 -1.101 1.00 . A A . 14 ILE HA 1 1 9 2014 1 1 14 ILE HB H 1.133 5.548 0.664 1.00 . A A . 14 ILE HB 1 1 9 2015 1 1 14 ILE HD11 H 1.370 3.849 3.631 1.00 . A A . 14 ILE HD11 1 1 9 2016 1 1 14 ILE HD12 H 1.918 5.360 2.905 1.00 . A A . 14 ILE HD12 1 1 9 2017 1 1 14 ILE HD13 H 3.074 4.069 3.231 1.00 . A A . 14 ILE HD13 1 1 9 2018 1 1 14 ILE HG12 H 1.445 2.710 1.671 1.00 . A A . 14 ILE HG12 1 1 9 2019 1 1 14 ILE HG13 H 2.754 3.694 1.023 1.00 . A A . 14 ILE HG13 1 1 9 2020 1 1 14 ILE HG21 H -0.451 4.250 2.443 1.00 . A A . 14 ILE HG21 1 1 9 2021 1 1 14 ILE HG22 H -1.203 3.793 0.915 1.00 . A A . 14 ILE HG22 1 1 9 2022 1 1 14 ILE HG23 H -1.010 5.496 1.327 1.00 . A A . 14 ILE HG23 1 1 9 2023 1 1 14 ILE N N 0.805 2.508 -0.727 1.00 . A A . 14 ILE N 1 1 9 2024 1 1 14 ILE O O 2.251 5.698 -1.276 1.00 . A A . 14 ILE O 1 1 9 2025 1 1 15 LEU C C 2.696 4.292 -5.016 1.00 . A A . 15 LEU C 1 1 9 2026 1 1 15 LEU CA C 3.155 4.423 -3.567 1.00 . A A . 15 LEU CA 1 1 9 2027 1 1 15 LEU CB C 4.469 3.666 -3.365 1.00 . A A . 15 LEU CB 1 1 9 2028 1 1 15 LEU CD1 C 6.562 3.315 -2.030 1.00 . A A . 15 LEU CD1 1 1 9 2029 1 1 15 LEU CD2 C 5.901 5.622 -2.732 1.00 . A A . 15 LEU CD2 1 1 9 2030 1 1 15 LEU CG C 5.396 4.254 -2.300 1.00 . A A . 15 LEU CG 1 1 9 2031 1 1 15 LEU H H 1.714 3.055 -2.836 1.00 . A A . 15 LEU H 1 1 9 2032 1 1 15 LEU HA H 3.313 5.467 -3.345 1.00 . A A . 15 LEU HA 1 1 9 2033 1 1 15 LEU HB2 H 4.234 2.648 -3.087 1.00 . A A . 15 LEU HB2 1 1 9 2034 1 1 15 LEU HB3 H 5.000 3.651 -4.305 1.00 . A A . 15 LEU HB3 1 1 9 2035 1 1 15 LEU HD11 H 6.800 3.330 -0.977 1.00 . A A . 15 LEU HD11 1 1 9 2036 1 1 15 LEU HD12 H 7.422 3.636 -2.598 1.00 . A A . 15 LEU HD12 1 1 9 2037 1 1 15 LEU HD13 H 6.291 2.311 -2.324 1.00 . A A . 15 LEU HD13 1 1 9 2038 1 1 15 LEU HD21 H 5.223 6.043 -3.459 1.00 . A A . 15 LEU HD21 1 1 9 2039 1 1 15 LEU HD22 H 6.882 5.522 -3.171 1.00 . A A . 15 LEU HD22 1 1 9 2040 1 1 15 LEU HD23 H 5.956 6.273 -1.872 1.00 . A A . 15 LEU HD23 1 1 9 2041 1 1 15 LEU HG H 4.845 4.374 -1.379 1.00 . A A . 15 LEU HG 1 1 9 2042 1 1 15 LEU N N 2.136 3.920 -2.652 1.00 . A A . 15 LEU N 1 1 9 2043 1 1 15 LEU O O 2.852 3.239 -5.635 1.00 . A A . 15 LEU O 1 1 9 2044 1 1 16 ALA C C 2.044 6.661 -7.642 1.00 . A A . 16 ALA C 1 1 9 2045 1 1 16 ALA CA C 1.648 5.374 -6.927 1.00 . A A . 16 ALA CA 1 1 9 2046 1 1 16 ALA CB C 0.138 5.194 -6.957 1.00 . A A . 16 ALA CB 1 1 9 2047 1 1 16 ALA H H 2.033 6.178 -5.008 1.00 . A A . 16 ALA H 1 1 9 2048 1 1 16 ALA HA H 2.097 4.536 -7.441 1.00 . A A . 16 ALA HA 1 1 9 2049 1 1 16 ALA HB1 H -0.116 4.216 -6.577 1.00 . A A . 16 ALA HB1 1 1 9 2050 1 1 16 ALA HB2 H -0.216 5.289 -7.973 1.00 . A A . 16 ALA HB2 1 1 9 2051 1 1 16 ALA HB3 H -0.326 5.951 -6.342 1.00 . A A . 16 ALA HB3 1 1 9 2052 1 1 16 ALA N N 2.130 5.368 -5.551 1.00 . A A . 16 ALA N 1 1 9 2053 1 1 16 ALA O O 1.620 7.751 -7.260 1.00 . A A . 16 ALA O 1 1 9 2054 1 1 17 GLY C C 2.458 7.928 -10.673 1.00 . A A . 17 GLY C 1 1 9 2055 1 1 17 GLY CA C 3.299 7.687 -9.435 1.00 . A A . 17 GLY CA 1 1 9 2056 1 1 17 GLY H H 3.166 5.632 -8.942 1.00 . A A . 17 GLY H 1 1 9 2057 1 1 17 GLY HA2 H 3.240 8.558 -8.799 1.00 . A A . 17 GLY HA2 1 1 9 2058 1 1 17 GLY HA3 H 4.327 7.541 -9.734 1.00 . A A . 17 GLY HA3 1 1 9 2059 1 1 17 GLY N N 2.860 6.527 -8.683 1.00 . A A . 17 GLY N 1 1 9 2060 1 1 17 GLY O O 2.514 7.092 -11.600 1.00 . A A . 17 GLY O 1 1 9 2061 1 1 17 GLY OXT O 1.744 8.951 -10.716 1.00 . A A . 17 GLY OXT 1 1 10 2062 1 1 1 GLY C C 1.169 -2.890 0.680 1.00 . A A . 1 GLY C 1 1 10 2063 1 1 1 GLY CA C 1.469 -2.379 -0.716 1.00 . A A . 1 GLY CA 1 1 10 2064 1 1 1 GLY H1 H -0.459 -2.287 -1.554 1.00 . A A . 1 GLY H1 1 1 10 2065 1 1 1 GLY HA2 H 2.396 -2.816 -1.056 1.00 . A A . 1 GLY HA2 1 1 10 2066 1 1 1 GLY HA3 H 1.583 -1.306 -0.678 1.00 . A A . 1 GLY HA3 1 1 10 2067 1 1 1 GLY N N 0.420 -2.705 -1.667 1.00 . A A . 1 GLY N 1 1 10 2068 1 1 1 GLY O O 0.165 -3.570 0.892 1.00 . A A . 1 GLY O 1 1 10 2069 1 1 2 PRO C C 0.743 -2.224 3.766 1.00 . A A . 2 PRO C 1 1 10 2070 1 1 2 PRO CA C 1.840 -3.016 3.045 1.00 . A A . 2 PRO CA 1 1 10 2071 1 1 2 PRO CB C 3.214 -2.782 3.679 1.00 . A A . 2 PRO CB 1 1 10 2072 1 1 2 PRO CD C 3.256 -1.772 1.498 1.00 . A A . 2 PRO CD 1 1 10 2073 1 1 2 PRO CG C 3.815 -1.666 2.893 1.00 . A A . 2 PRO CG 1 1 10 2074 1 1 2 PRO HA H 1.600 -4.069 3.088 1.00 . A A . 2 PRO HA 1 1 10 2075 1 1 2 PRO HB2 H 3.093 -2.515 4.719 1.00 . A A . 2 PRO HB2 1 1 10 2076 1 1 2 PRO HB3 H 3.806 -3.681 3.601 1.00 . A A . 2 PRO HB3 1 1 10 2077 1 1 2 PRO HD2 H 3.021 -0.791 1.112 1.00 . A A . 2 PRO HD2 1 1 10 2078 1 1 2 PRO HD3 H 3.959 -2.273 0.849 1.00 . A A . 2 PRO HD3 1 1 10 2079 1 1 2 PRO HG2 H 3.542 -0.718 3.332 1.00 . A A . 2 PRO HG2 1 1 10 2080 1 1 2 PRO HG3 H 4.890 -1.772 2.873 1.00 . A A . 2 PRO HG3 1 1 10 2081 1 1 2 PRO N N 2.030 -2.576 1.663 1.00 . A A . 2 PRO N 1 1 10 2082 1 1 2 PRO O O -0.430 -2.588 3.698 1.00 . A A . 2 PRO O 1 1 10 2083 1 1 3 LYS C C -0.390 0.794 4.290 1.00 . A A . 3 LYS C 1 1 10 2084 1 1 3 LYS CA C 0.152 -0.327 5.175 1.00 . A A . 3 LYS CA 1 1 10 2085 1 1 3 LYS CB C 0.791 0.262 6.435 1.00 . A A . 3 LYS CB 1 1 10 2086 1 1 3 LYS CD C 1.159 -0.886 8.647 1.00 . A A . 3 LYS CD 1 1 10 2087 1 1 3 LYS CE C 1.496 0.001 9.836 1.00 . A A . 3 LYS CE 1 1 10 2088 1 1 3 LYS CG C 0.146 -0.224 7.724 1.00 . A A . 3 LYS CG 1 1 10 2089 1 1 3 LYS H H 2.063 -0.896 4.479 1.00 . A A . 3 LYS H 1 1 10 2090 1 1 3 LYS HA H -0.669 -0.965 5.466 1.00 . A A . 3 LYS HA 1 1 10 2091 1 1 3 LYS HB2 H 1.836 -0.010 6.454 1.00 . A A . 3 LYS HB2 1 1 10 2092 1 1 3 LYS HB3 H 0.709 1.338 6.401 1.00 . A A . 3 LYS HB3 1 1 10 2093 1 1 3 LYS HD2 H 0.746 -1.814 9.011 1.00 . A A . 3 LYS HD2 1 1 10 2094 1 1 3 LYS HD3 H 2.063 -1.085 8.090 1.00 . A A . 3 LYS HD3 1 1 10 2095 1 1 3 LYS HE2 H 2.559 -0.052 10.018 1.00 . A A . 3 LYS HE2 1 1 10 2096 1 1 3 LYS HE3 H 1.223 1.019 9.599 1.00 . A A . 3 LYS HE3 1 1 10 2097 1 1 3 LYS HG2 H -0.293 0.620 8.235 1.00 . A A . 3 LYS HG2 1 1 10 2098 1 1 3 LYS HG3 H -0.626 -0.939 7.480 1.00 . A A . 3 LYS HG3 1 1 10 2099 1 1 3 LYS HZ1 H -0.086 -0.952 10.812 1.00 . A A . 3 LYS HZ1 1 1 10 2100 1 1 3 LYS HZ2 H 0.498 0.411 11.624 1.00 . A A . 3 LYS HZ2 1 1 10 2101 1 1 3 LYS HZ3 H 1.383 -1.030 11.649 1.00 . A A . 3 LYS HZ3 1 1 10 2102 1 1 3 LYS N N 1.119 -1.146 4.454 1.00 . A A . 3 LYS N 1 1 10 2103 1 1 3 LYS NZ N 0.772 -0.422 11.066 1.00 . A A . 3 LYS NZ 1 1 10 2104 1 1 3 LYS O O 0.131 1.909 4.299 1.00 . A A . 3 LYS O 1 1 10 2105 1 1 4 GLY C C -3.540 1.365 2.577 1.00 . A A . 4 GLY C 1 1 10 2106 1 1 4 GLY CA C -2.031 1.487 2.658 1.00 . A A . 4 GLY CA 1 1 10 2107 1 1 4 GLY H H -1.814 -0.413 3.567 1.00 . A A . 4 GLY H 1 1 10 2108 1 1 4 GLY HA2 H -1.780 2.470 3.029 1.00 . A A . 4 GLY HA2 1 1 10 2109 1 1 4 GLY HA3 H -1.618 1.374 1.667 1.00 . A A . 4 GLY HA3 1 1 10 2110 1 1 4 GLY N N -1.438 0.492 3.532 1.00 . A A . 4 GLY N 1 1 10 2111 1 1 4 GLY O O -4.178 0.851 3.496 1.00 . A A . 4 GLY O 1 1 10 2112 1 1 5 ASP C C -5.926 0.839 0.141 1.00 . A A . 5 ASP C 1 1 10 2113 1 1 5 ASP CA C -5.557 1.788 1.280 1.00 . A A . 5 ASP CA 1 1 10 2114 1 1 5 ASP CB C -6.104 3.187 0.989 1.00 . A A . 5 ASP CB 1 1 10 2115 1 1 5 ASP CG C -5.626 4.214 1.996 1.00 . A A . 5 ASP CG 1 1 10 2116 1 1 5 ASP H H -3.550 2.243 0.781 1.00 . A A . 5 ASP H 1 1 10 2117 1 1 5 ASP HA H -6.001 1.422 2.193 1.00 . A A . 5 ASP HA 1 1 10 2118 1 1 5 ASP HB2 H -5.779 3.496 0.007 1.00 . A A . 5 ASP HB2 1 1 10 2119 1 1 5 ASP HB3 H -7.183 3.158 1.015 1.00 . A A . 5 ASP HB3 1 1 10 2120 1 1 5 ASP N N -4.112 1.843 1.476 1.00 . A A . 5 ASP N 1 1 10 2121 1 1 5 ASP O O -7.050 0.342 0.077 1.00 . A A . 5 ASP O 1 1 10 2122 1 1 5 ASP OD1 O -5.725 3.945 3.212 1.00 . A A . 5 ASP OD1 1 1 10 2123 1 1 5 ASP OD2 O -5.153 5.288 1.570 1.00 . A A . 5 ASP OD2 1 1 10 2124 1 1 6 PHE C C -4.378 -1.571 -1.767 1.00 . A A . 6 PHE C 1 1 10 2125 1 1 6 PHE CA C -5.211 -0.296 -1.891 1.00 . A A . 6 PHE CA 1 1 10 2126 1 1 6 PHE CB C -4.876 0.419 -3.202 1.00 . A A . 6 PHE CB 1 1 10 2127 1 1 6 PHE CD1 C -6.517 2.083 -4.115 1.00 . A A . 6 PHE CD1 1 1 10 2128 1 1 6 PHE CD2 C -4.894 2.839 -2.541 1.00 . A A . 6 PHE CD2 1 1 10 2129 1 1 6 PHE CE1 C -7.039 3.360 -4.196 1.00 . A A . 6 PHE CE1 1 1 10 2130 1 1 6 PHE CE2 C -5.411 4.118 -2.617 1.00 . A A . 6 PHE CE2 1 1 10 2131 1 1 6 PHE CG C -5.440 1.808 -3.288 1.00 . A A . 6 PHE CG 1 1 10 2132 1 1 6 PHE CZ C -6.485 4.379 -3.446 1.00 . A A . 6 PHE CZ 1 1 10 2133 1 1 6 PHE H H -4.099 1.017 -0.657 1.00 . A A . 6 PHE H 1 1 10 2134 1 1 6 PHE HA H -6.257 -0.560 -1.894 1.00 . A A . 6 PHE HA 1 1 10 2135 1 1 6 PHE HB2 H -3.804 0.489 -3.303 1.00 . A A . 6 PHE HB2 1 1 10 2136 1 1 6 PHE HB3 H -5.274 -0.154 -4.027 1.00 . A A . 6 PHE HB3 1 1 10 2137 1 1 6 PHE HD1 H -6.951 1.286 -4.702 1.00 . A A . 6 PHE HD1 1 1 10 2138 1 1 6 PHE HD2 H -4.054 2.636 -1.893 1.00 . A A . 6 PHE HD2 1 1 10 2139 1 1 6 PHE HE1 H -7.878 3.561 -4.845 1.00 . A A . 6 PHE HE1 1 1 10 2140 1 1 6 PHE HE2 H -4.976 4.914 -2.030 1.00 . A A . 6 PHE HE2 1 1 10 2141 1 1 6 PHE HZ H -6.891 5.378 -3.508 1.00 . A A . 6 PHE HZ 1 1 10 2142 1 1 6 PHE N N -4.976 0.592 -0.757 1.00 . A A . 6 PHE N 1 1 10 2143 1 1 6 PHE O O -3.193 -1.580 -2.099 1.00 . A A . 6 PHE O 1 1 10 2144 1 1 7 PRO C C -3.489 -4.348 -2.348 1.00 . A A . 7 PRO C 1 1 10 2145 1 1 7 PRO CA C -4.294 -3.950 -1.115 1.00 . A A . 7 PRO CA 1 1 10 2146 1 1 7 PRO CB C -5.437 -4.937 -0.882 1.00 . A A . 7 PRO CB 1 1 10 2147 1 1 7 PRO CD C -6.401 -2.747 -0.860 1.00 . A A . 7 PRO CD 1 1 10 2148 1 1 7 PRO CG C -6.514 -4.121 -0.255 1.00 . A A . 7 PRO CG 1 1 10 2149 1 1 7 PRO HA H -3.645 -3.938 -0.252 1.00 . A A . 7 PRO HA 1 1 10 2150 1 1 7 PRO HB2 H -5.755 -5.354 -1.826 1.00 . A A . 7 PRO HB2 1 1 10 2151 1 1 7 PRO HB3 H -5.108 -5.727 -0.224 1.00 . A A . 7 PRO HB3 1 1 10 2152 1 1 7 PRO HD2 H -7.063 -2.655 -1.708 1.00 . A A . 7 PRO HD2 1 1 10 2153 1 1 7 PRO HD3 H -6.624 -1.991 -0.122 1.00 . A A . 7 PRO HD3 1 1 10 2154 1 1 7 PRO HG2 H -7.479 -4.552 -0.479 1.00 . A A . 7 PRO HG2 1 1 10 2155 1 1 7 PRO HG3 H -6.363 -4.073 0.813 1.00 . A A . 7 PRO HG3 1 1 10 2156 1 1 7 PRO N N -4.988 -2.669 -1.283 1.00 . A A . 7 PRO N 1 1 10 2157 1 1 7 PRO O O -4.051 -4.583 -3.419 1.00 . A A . 7 PRO O 1 1 10 2158 1 1 8 ASP C C -0.381 -5.959 -2.889 1.00 . A A . 8 ASP C 1 1 10 2159 1 1 8 ASP CA C -1.290 -4.800 -3.291 1.00 . A A . 8 ASP CA 1 1 10 2160 1 1 8 ASP CB C -0.456 -3.594 -3.742 1.00 . A A . 8 ASP CB 1 1 10 2161 1 1 8 ASP CG C 0.714 -3.300 -2.818 1.00 . A A . 8 ASP CG 1 1 10 2162 1 1 8 ASP H H -1.783 -4.229 -1.312 1.00 . A A . 8 ASP H 1 1 10 2163 1 1 8 ASP HA H -1.912 -5.120 -4.114 1.00 . A A . 8 ASP HA 1 1 10 2164 1 1 8 ASP HB2 H -0.066 -3.785 -4.730 1.00 . A A . 8 ASP HB2 1 1 10 2165 1 1 8 ASP HB3 H -1.090 -2.720 -3.776 1.00 . A A . 8 ASP HB3 1 1 10 2166 1 1 8 ASP N N -2.171 -4.426 -2.190 1.00 . A A . 8 ASP N 1 1 10 2167 1 1 8 ASP O O -0.205 -6.915 -3.645 1.00 . A A . 8 ASP O 1 1 10 2168 1 1 8 ASP OD1 O 1.863 -3.603 -3.140 1.00 . A A . 8 ASP OD1 1 1 10 2169 1 1 9 VAL C C 1.166 -6.863 0.336 1.00 . A A . 9 VAL C 1 1 10 2170 1 1 9 VAL CA C 1.080 -6.907 -1.188 1.00 . A A . 9 VAL CA 1 1 10 2171 1 1 9 VAL CB C 2.497 -6.776 -1.784 1.00 . A A . 9 VAL CB 1 1 10 2172 1 1 9 VAL CG1 C 3.141 -5.463 -1.362 1.00 . A A . 9 VAL CG1 1 1 10 2173 1 1 9 VAL CG2 C 3.361 -7.960 -1.374 1.00 . A A . 9 VAL CG2 1 1 10 2174 1 1 9 VAL H H 0.012 -5.081 -1.136 1.00 . A A . 9 VAL H 1 1 10 2175 1 1 9 VAL HA H 0.675 -7.863 -1.487 1.00 . A A . 9 VAL HA 1 1 10 2176 1 1 9 VAL HB H 2.412 -6.777 -2.861 1.00 . A A . 9 VAL HB 1 1 10 2177 1 1 9 VAL HG11 H 3.607 -4.999 -2.219 1.00 . A A . 9 VAL HG11 1 1 10 2178 1 1 9 VAL HG12 H 3.887 -5.654 -0.605 1.00 . A A . 9 VAL HG12 1 1 10 2179 1 1 9 VAL HG13 H 2.384 -4.802 -0.964 1.00 . A A . 9 VAL HG13 1 1 10 2180 1 1 9 VAL HG21 H 3.409 -8.669 -2.188 1.00 . A A . 9 VAL HG21 1 1 10 2181 1 1 9 VAL HG22 H 2.929 -8.437 -0.507 1.00 . A A . 9 VAL HG22 1 1 10 2182 1 1 9 VAL HG23 H 4.357 -7.616 -1.137 1.00 . A A . 9 VAL HG23 1 1 10 2183 1 1 9 VAL N N 0.192 -5.867 -1.693 1.00 . A A . 9 VAL N 1 1 10 2184 1 1 9 VAL O O 2.256 -6.844 0.909 1.00 . A A . 9 VAL O 1 1 10 2185 1 1 10 GLY C C -1.358 -6.292 2.963 1.00 . A A . 10 GLY C 1 1 10 2186 1 1 10 GLY CA C -0.032 -6.803 2.436 1.00 . A A . 10 GLY CA 1 1 10 2187 1 1 10 GLY H H -0.830 -6.862 0.476 1.00 . A A . 10 GLY H 1 1 10 2188 1 1 10 GLY HA2 H 0.137 -7.798 2.819 1.00 . A A . 10 GLY HA2 1 1 10 2189 1 1 10 GLY HA3 H 0.757 -6.154 2.787 1.00 . A A . 10 GLY HA3 1 1 10 2190 1 1 10 GLY N N 0.007 -6.846 0.986 1.00 . A A . 10 GLY N 1 1 10 2191 1 1 10 GLY O O -2.331 -7.042 3.044 1.00 . A A . 10 GLY O 1 1 10 2192 1 1 11 ASP C C -3.016 -3.173 3.018 1.00 . A A . 11 ASP C 1 1 10 2193 1 1 11 ASP CA C -2.619 -4.401 3.837 1.00 . A A . 11 ASP CA 1 1 10 2194 1 1 11 ASP CB C -2.436 -4.010 5.306 1.00 . A A . 11 ASP CB 1 1 10 2195 1 1 11 ASP CG C -1.798 -5.115 6.125 1.00 . A A . 11 ASP CG 1 1 10 2196 1 1 11 ASP H H -0.592 -4.464 3.228 1.00 . A A . 11 ASP H 1 1 10 2197 1 1 11 ASP HA H -3.409 -5.134 3.768 1.00 . A A . 11 ASP HA 1 1 10 2198 1 1 11 ASP HB2 H -1.805 -3.136 5.363 1.00 . A A . 11 ASP HB2 1 1 10 2199 1 1 11 ASP HB3 H -3.401 -3.781 5.733 1.00 . A A . 11 ASP HB3 1 1 10 2200 1 1 11 ASP N N -1.399 -5.012 3.319 1.00 . A A . 11 ASP N 1 1 10 2201 1 1 11 ASP O O -3.969 -2.473 3.361 1.00 . A A . 11 ASP O 1 1 10 2202 1 1 11 ASP OD1 O -2.436 -6.177 6.287 1.00 . A A . 11 ASP OD1 1 1 10 2203 1 1 11 ASP OD2 O -0.662 -4.919 6.604 1.00 . A A . 11 ASP OD2 1 1 10 2204 1 1 12 GLY C C -1.371 -0.916 0.806 1.00 . A A . 12 GLY C 1 1 10 2205 1 1 12 GLY CA C -2.589 -1.772 1.093 1.00 . A A . 12 GLY CA 1 1 10 2206 1 1 12 GLY H H -1.539 -3.505 1.703 1.00 . A A . 12 GLY H 1 1 10 2207 1 1 12 GLY HA2 H -2.991 -2.128 0.157 1.00 . A A . 12 GLY HA2 1 1 10 2208 1 1 12 GLY HA3 H -3.334 -1.165 1.585 1.00 . A A . 12 GLY HA3 1 1 10 2209 1 1 12 GLY N N -2.286 -2.915 1.934 1.00 . A A . 12 GLY N 1 1 10 2210 1 1 12 GLY O O -0.426 -0.884 1.594 1.00 . A A . 12 GLY O 1 1 10 2211 1 1 13 ARG C C -0.652 2.119 -0.512 1.00 . A A . 13 ARG C 1 1 10 2212 1 1 13 ARG CA C -0.289 0.652 -0.715 1.00 . A A . 13 ARG CA 1 1 10 2213 1 1 13 ARG CB C 0.092 0.409 -2.179 1.00 . A A . 13 ARG CB 1 1 10 2214 1 1 13 ARG CD C -0.832 0.769 -4.487 1.00 . A A . 13 ARG CD 1 1 10 2215 1 1 13 ARG CG C -1.104 0.218 -3.097 1.00 . A A . 13 ARG CG 1 1 10 2216 1 1 13 ARG CZ C -1.382 2.816 -5.744 1.00 . A A . 13 ARG CZ 1 1 10 2217 1 1 13 ARG H H -2.181 -0.281 -0.909 1.00 . A A . 13 ARG H 1 1 10 2218 1 1 13 ARG HA H 0.556 0.412 -0.088 1.00 . A A . 13 ARG HA 1 1 10 2219 1 1 13 ARG HB2 H 0.660 1.255 -2.535 1.00 . A A . 13 ARG HB2 1 1 10 2220 1 1 13 ARG HB3 H 0.707 -0.476 -2.237 1.00 . A A . 13 ARG HB3 1 1 10 2221 1 1 13 ARG HD2 H 0.217 0.647 -4.710 1.00 . A A . 13 ARG HD2 1 1 10 2222 1 1 13 ARG HD3 H -1.419 0.212 -5.202 1.00 . A A . 13 ARG HD3 1 1 10 2223 1 1 13 ARG HE H -1.261 2.691 -3.756 1.00 . A A . 13 ARG HE 1 1 10 2224 1 1 13 ARG HG2 H -1.322 -0.836 -3.175 1.00 . A A . 13 ARG HG2 1 1 10 2225 1 1 13 ARG HG3 H -1.954 0.734 -2.675 1.00 . A A . 13 ARG HG3 1 1 10 2226 1 1 13 ARG HH11 H -1.045 1.190 -6.899 1.00 . A A . 13 ARG HH11 1 1 10 2227 1 1 13 ARG HH12 H -1.433 2.643 -7.758 1.00 . A A . 13 ARG HH12 1 1 10 2228 1 1 13 ARG HH21 H -1.771 4.603 -4.883 1.00 . A A . 13 ARG HH21 1 1 10 2229 1 1 13 ARG HH22 H -1.844 4.581 -6.613 1.00 . A A . 13 ARG HH22 1 1 10 2230 1 1 13 ARG N N -1.397 -0.215 -0.324 1.00 . A A . 13 ARG N 1 1 10 2231 1 1 13 ARG NE N -1.177 2.185 -4.590 1.00 . A A . 13 ARG NE 1 1 10 2232 1 1 13 ARG NH1 N -1.278 2.162 -6.895 1.00 . A A . 13 ARG NH1 1 1 10 2233 1 1 13 ARG NH2 N -1.691 4.106 -5.747 1.00 . A A . 13 ARG NH2 1 1 10 2234 1 1 13 ARG O O -1.824 2.491 -0.562 1.00 . A A . 13 ARG O 1 1 10 2235 1 1 14 ILE C C 0.704 5.195 -1.234 1.00 . A A . 14 ILE C 1 1 10 2236 1 1 14 ILE CA C 0.146 4.377 -0.073 1.00 . A A . 14 ILE CA 1 1 10 2237 1 1 14 ILE CB C 0.794 4.865 1.239 1.00 . A A . 14 ILE CB 1 1 10 2238 1 1 14 ILE CD1 C 1.921 2.977 2.521 1.00 . A A . 14 ILE CD1 1 1 10 2239 1 1 14 ILE CG1 C 0.666 3.801 2.333 1.00 . A A . 14 ILE CG1 1 1 10 2240 1 1 14 ILE CG2 C 0.157 6.171 1.689 1.00 . A A . 14 ILE CG2 1 1 10 2241 1 1 14 ILE H H 1.274 2.594 -0.255 1.00 . A A . 14 ILE H 1 1 10 2242 1 1 14 ILE HA H -0.919 4.546 -0.008 1.00 . A A . 14 ILE HA 1 1 10 2243 1 1 14 ILE HB H 1.840 5.052 1.050 1.00 . A A . 14 ILE HB 1 1 10 2244 1 1 14 ILE HD11 H 2.073 2.788 3.574 1.00 . A A . 14 ILE HD11 1 1 10 2245 1 1 14 ILE HD12 H 2.769 3.517 2.126 1.00 . A A . 14 ILE HD12 1 1 10 2246 1 1 14 ILE HD13 H 1.817 2.038 1.998 1.00 . A A . 14 ILE HD13 1 1 10 2247 1 1 14 ILE HG12 H 0.442 4.283 3.272 1.00 . A A . 14 ILE HG12 1 1 10 2248 1 1 14 ILE HG13 H -0.139 3.127 2.077 1.00 . A A . 14 ILE HG13 1 1 10 2249 1 1 14 ILE HG21 H -0.807 5.968 2.132 1.00 . A A . 14 ILE HG21 1 1 10 2250 1 1 14 ILE HG22 H 0.030 6.822 0.836 1.00 . A A . 14 ILE HG22 1 1 10 2251 1 1 14 ILE HG23 H 0.794 6.651 2.417 1.00 . A A . 14 ILE HG23 1 1 10 2252 1 1 14 ILE N N 0.361 2.949 -0.283 1.00 . A A . 14 ILE N 1 1 10 2253 1 1 14 ILE O O 0.204 6.277 -1.538 1.00 . A A . 14 ILE O 1 1 10 2254 1 1 15 LEU C C 2.025 4.656 -4.320 1.00 . A A . 15 LEU C 1 1 10 2255 1 1 15 LEU CA C 2.363 5.355 -3.008 1.00 . A A . 15 LEU CA 1 1 10 2256 1 1 15 LEU CB C 3.882 5.418 -2.827 1.00 . A A . 15 LEU CB 1 1 10 2257 1 1 15 LEU CD1 C 3.567 6.829 -0.771 1.00 . A A . 15 LEU CD1 1 1 10 2258 1 1 15 LEU CD2 C 4.264 4.436 -0.552 1.00 . A A . 15 LEU CD2 1 1 10 2259 1 1 15 LEU CG C 4.363 5.695 -1.400 1.00 . A A . 15 LEU CG 1 1 10 2260 1 1 15 LEU H H 2.096 3.803 -1.593 1.00 . A A . 15 LEU H 1 1 10 2261 1 1 15 LEU HA H 1.972 6.361 -3.040 1.00 . A A . 15 LEU HA 1 1 10 2262 1 1 15 LEU HB2 H 4.300 4.475 -3.148 1.00 . A A . 15 LEU HB2 1 1 10 2263 1 1 15 LEU HB3 H 4.267 6.197 -3.468 1.00 . A A . 15 LEU HB3 1 1 10 2264 1 1 15 LEU HD11 H 2.793 6.418 -0.140 1.00 . A A . 15 LEU HD11 1 1 10 2265 1 1 15 LEU HD12 H 3.116 7.427 -1.550 1.00 . A A . 15 LEU HD12 1 1 10 2266 1 1 15 LEU HD13 H 4.225 7.446 -0.178 1.00 . A A . 15 LEU HD13 1 1 10 2267 1 1 15 LEU HD21 H 4.432 3.569 -1.174 1.00 . A A . 15 LEU HD21 1 1 10 2268 1 1 15 LEU HD22 H 3.281 4.376 -0.110 1.00 . A A . 15 LEU HD22 1 1 10 2269 1 1 15 LEU HD23 H 5.009 4.468 0.229 1.00 . A A . 15 LEU HD23 1 1 10 2270 1 1 15 LEU HG H 5.401 5.996 -1.430 1.00 . A A . 15 LEU HG 1 1 10 2271 1 1 15 LEU N N 1.741 4.670 -1.880 1.00 . A A . 15 LEU N 1 1 10 2272 1 1 15 LEU O O 1.741 3.459 -4.343 1.00 . A A . 15 LEU O 1 1 10 2273 1 1 16 ALA C C 3.000 4.844 -7.612 1.00 . A A . 16 ALA C 1 1 10 2274 1 1 16 ALA CA C 1.757 4.867 -6.730 1.00 . A A . 16 ALA CA 1 1 10 2275 1 1 16 ALA CB C 0.650 5.674 -7.392 1.00 . A A . 16 ALA CB 1 1 10 2276 1 1 16 ALA H H 2.292 6.361 -5.330 1.00 . A A . 16 ALA H 1 1 10 2277 1 1 16 ALA HA H 1.403 3.855 -6.598 1.00 . A A . 16 ALA HA 1 1 10 2278 1 1 16 ALA HB1 H -0.207 5.715 -6.736 1.00 . A A . 16 ALA HB1 1 1 10 2279 1 1 16 ALA HB2 H 0.368 5.203 -8.322 1.00 . A A . 16 ALA HB2 1 1 10 2280 1 1 16 ALA HB3 H 1.003 6.675 -7.588 1.00 . A A . 16 ALA HB3 1 1 10 2281 1 1 16 ALA N N 2.059 5.413 -5.412 1.00 . A A . 16 ALA N 1 1 10 2282 1 1 16 ALA O O 3.113 5.616 -8.565 1.00 . A A . 16 ALA O 1 1 10 2283 1 1 17 GLY C C 5.687 2.429 -8.112 1.00 . A A . 17 GLY C 1 1 10 2284 1 1 17 GLY CA C 5.157 3.848 -8.060 1.00 . A A . 17 GLY CA 1 1 10 2285 1 1 17 GLY H H 3.789 3.366 -6.518 1.00 . A A . 17 GLY H 1 1 10 2286 1 1 17 GLY HA2 H 4.964 4.186 -9.068 1.00 . A A . 17 GLY HA2 1 1 10 2287 1 1 17 GLY HA3 H 5.907 4.486 -7.616 1.00 . A A . 17 GLY HA3 1 1 10 2288 1 1 17 GLY N N 3.933 3.955 -7.288 1.00 . A A . 17 GLY N 1 1 10 2289 1 1 17 GLY O O 6.912 2.247 -7.947 1.00 . A A . 17 GLY O 1 1 10 2290 1 1 17 GLY OXT O 4.878 1.500 -8.317 1.00 . A A . 17 GLY OXT 1 1 11 2291 1 1 1 GLY C C 1.571 -3.379 1.390 1.00 . A A . 1 GLY C 1 1 11 2292 1 1 1 GLY CA C 2.198 -3.011 0.058 1.00 . A A . 1 GLY CA 1 1 11 2293 1 1 1 GLY H1 H 0.382 -2.977 -0.794 1.00 . A A . 1 GLY H1 1 1 11 2294 1 1 1 GLY HA2 H 3.079 -3.617 -0.091 1.00 . A A . 1 GLY HA2 1 1 11 2295 1 1 1 GLY HA3 H 2.491 -1.972 0.088 1.00 . A A . 1 GLY HA3 1 1 11 2296 1 1 1 GLY N N 1.295 -3.212 -1.061 1.00 . A A . 1 GLY N 1 1 11 2297 1 1 1 GLY O O 0.550 -4.065 1.428 1.00 . A A . 1 GLY O 1 1 11 2298 1 1 2 PRO C C 0.488 -2.321 4.239 1.00 . A A . 2 PRO C 1 1 11 2299 1 1 2 PRO CA C 1.656 -3.232 3.845 1.00 . A A . 2 PRO CA 1 1 11 2300 1 1 2 PRO CB C 2.877 -3.006 4.739 1.00 . A A . 2 PRO CB 1 1 11 2301 1 1 2 PRO CD C 3.393 -2.115 2.553 1.00 . A A . 2 PRO CD 1 1 11 2302 1 1 2 PRO CG C 3.701 -1.984 4.025 1.00 . A A . 2 PRO CG 1 1 11 2303 1 1 2 PRO HA H 1.340 -4.262 3.921 1.00 . A A . 2 PRO HA 1 1 11 2304 1 1 2 PRO HB2 H 2.556 -2.650 5.707 1.00 . A A . 2 PRO HB2 1 1 11 2305 1 1 2 PRO HB3 H 3.416 -3.934 4.853 1.00 . A A . 2 PRO HB3 1 1 11 2306 1 1 2 PRO HD2 H 3.216 -1.143 2.120 1.00 . A A . 2 PRO HD2 1 1 11 2307 1 1 2 PRO HD3 H 4.206 -2.612 2.044 1.00 . A A . 2 PRO HD3 1 1 11 2308 1 1 2 PRO HG2 H 3.440 -0.996 4.372 1.00 . A A . 2 PRO HG2 1 1 11 2309 1 1 2 PRO HG3 H 4.749 -2.175 4.203 1.00 . A A . 2 PRO HG3 1 1 11 2310 1 1 2 PRO N N 2.168 -2.936 2.509 1.00 . A A . 2 PRO N 1 1 11 2311 1 1 2 PRO O O -0.665 -2.627 3.942 1.00 . A A . 2 PRO O 1 1 11 2312 1 1 3 LYS C C -0.510 0.786 4.260 1.00 . A A . 3 LYS C 1 1 11 2313 1 1 3 LYS CA C -0.259 -0.274 5.328 1.00 . A A . 3 LYS CA 1 1 11 2314 1 1 3 LYS CB C 0.129 0.396 6.647 1.00 . A A . 3 LYS CB 1 1 11 2315 1 1 3 LYS CD C -1.358 -0.634 8.390 1.00 . A A . 3 LYS CD 1 1 11 2316 1 1 3 LYS CE C -0.383 -0.811 9.543 1.00 . A A . 3 LYS CE 1 1 11 2317 1 1 3 LYS CG C -1.047 0.616 7.584 1.00 . A A . 3 LYS CG 1 1 11 2318 1 1 3 LYS H H 1.713 -1.003 5.123 1.00 . A A . 3 LYS H 1 1 11 2319 1 1 3 LYS HA H -1.167 -0.839 5.477 1.00 . A A . 3 LYS HA 1 1 11 2320 1 1 3 LYS HB2 H 0.854 -0.224 7.153 1.00 . A A . 3 LYS HB2 1 1 11 2321 1 1 3 LYS HB3 H 0.576 1.355 6.432 1.00 . A A . 3 LYS HB3 1 1 11 2322 1 1 3 LYS HD2 H -2.359 -0.555 8.787 1.00 . A A . 3 LYS HD2 1 1 11 2323 1 1 3 LYS HD3 H -1.294 -1.495 7.740 1.00 . A A . 3 LYS HD3 1 1 11 2324 1 1 3 LYS HE2 H -0.519 -1.795 9.965 1.00 . A A . 3 LYS HE2 1 1 11 2325 1 1 3 LYS HE3 H 0.624 -0.719 9.163 1.00 . A A . 3 LYS HE3 1 1 11 2326 1 1 3 LYS HG2 H -0.808 1.420 8.263 1.00 . A A . 3 LYS HG2 1 1 11 2327 1 1 3 LYS HG3 H -1.915 0.883 6.999 1.00 . A A . 3 LYS HG3 1 1 11 2328 1 1 3 LYS HZ1 H 0.062 1.003 10.478 1.00 . A A . 3 LYS HZ1 1 1 11 2329 1 1 3 LYS HZ2 H -0.425 -0.216 11.545 1.00 . A A . 3 LYS HZ2 1 1 11 2330 1 1 3 LYS HZ3 H -1.570 0.565 10.575 1.00 . A A . 3 LYS HZ3 1 1 11 2331 1 1 3 LYS N N 0.782 -1.206 4.908 1.00 . A A . 3 LYS N 1 1 11 2332 1 1 3 LYS NZ N -0.594 0.207 10.610 1.00 . A A . 3 LYS NZ 1 1 11 2333 1 1 3 LYS O O 0.136 1.833 4.249 1.00 . A A . 3 LYS O 1 1 11 2334 1 1 4 GLY C C -3.241 1.443 1.942 1.00 . A A . 4 GLY C 1 1 11 2335 1 1 4 GLY CA C -1.770 1.454 2.309 1.00 . A A . 4 GLY CA 1 1 11 2336 1 1 4 GLY H H -1.938 -0.340 3.422 1.00 . A A . 4 GLY H 1 1 11 2337 1 1 4 GLY HA2 H -1.501 2.447 2.638 1.00 . A A . 4 GLY HA2 1 1 11 2338 1 1 4 GLY HA3 H -1.190 1.207 1.433 1.00 . A A . 4 GLY HA3 1 1 11 2339 1 1 4 GLY N N -1.453 0.510 3.365 1.00 . A A . 4 GLY N 1 1 11 2340 1 1 4 GLY O O -4.092 1.117 2.770 1.00 . A A . 4 GLY O 1 1 11 2341 1 1 5 ASP C C -5.168 0.757 -0.830 1.00 . A A . 5 ASP C 1 1 11 2342 1 1 5 ASP CA C -4.920 1.836 0.222 1.00 . A A . 5 ASP CA 1 1 11 2343 1 1 5 ASP CB C -5.246 3.213 -0.359 1.00 . A A . 5 ASP CB 1 1 11 2344 1 1 5 ASP CG C -4.816 4.344 0.554 1.00 . A A . 5 ASP CG 1 1 11 2345 1 1 5 ASP H H -2.818 2.053 0.086 1.00 . A A . 5 ASP H 1 1 11 2346 1 1 5 ASP HA H -5.566 1.651 1.067 1.00 . A A . 5 ASP HA 1 1 11 2347 1 1 5 ASP HB2 H -4.737 3.326 -1.305 1.00 . A A . 5 ASP HB2 1 1 11 2348 1 1 5 ASP HB3 H -6.311 3.287 -0.518 1.00 . A A . 5 ASP HB3 1 1 11 2349 1 1 5 ASP N N -3.541 1.802 0.698 1.00 . A A . 5 ASP N 1 1 11 2350 1 1 5 ASP O O -6.302 0.323 -1.029 1.00 . A A . 5 ASP O 1 1 11 2351 1 1 5 ASP OD1 O -4.843 4.153 1.788 1.00 . A A . 5 ASP OD1 1 1 11 2352 1 1 5 ASP OD2 O -4.452 5.420 0.036 1.00 . A A . 5 ASP OD2 1 1 11 2353 1 1 6 PHE C C -3.556 -1.995 -2.082 1.00 . A A . 6 PHE C 1 1 11 2354 1 1 6 PHE CA C -4.213 -0.694 -2.537 1.00 . A A . 6 PHE CA 1 1 11 2355 1 1 6 PHE CB C -3.566 -0.217 -3.843 1.00 . A A . 6 PHE CB 1 1 11 2356 1 1 6 PHE CD1 C -4.561 1.987 -4.523 1.00 . A A . 6 PHE CD1 1 1 11 2357 1 1 6 PHE CD2 C -2.376 1.976 -3.569 1.00 . A A . 6 PHE CD2 1 1 11 2358 1 1 6 PHE CE1 C -4.502 3.362 -4.650 1.00 . A A . 6 PHE CE1 1 1 11 2359 1 1 6 PHE CE2 C -2.311 3.351 -3.694 1.00 . A A . 6 PHE CE2 1 1 11 2360 1 1 6 PHE CG C -3.500 1.279 -3.982 1.00 . A A . 6 PHE CG 1 1 11 2361 1 1 6 PHE CZ C -3.375 4.045 -4.235 1.00 . A A . 6 PHE CZ 1 1 11 2362 1 1 6 PHE H H -3.224 0.715 -1.303 1.00 . A A . 6 PHE H 1 1 11 2363 1 1 6 PHE HA H -5.263 -0.876 -2.712 1.00 . A A . 6 PHE HA 1 1 11 2364 1 1 6 PHE HB2 H -2.558 -0.598 -3.896 1.00 . A A . 6 PHE HB2 1 1 11 2365 1 1 6 PHE HB3 H -4.134 -0.603 -4.677 1.00 . A A . 6 PHE HB3 1 1 11 2366 1 1 6 PHE HD1 H -5.443 1.454 -4.848 1.00 . A A . 6 PHE HD1 1 1 11 2367 1 1 6 PHE HD2 H -1.543 1.435 -3.145 1.00 . A A . 6 PHE HD2 1 1 11 2368 1 1 6 PHE HE1 H -5.336 3.902 -5.074 1.00 . A A . 6 PHE HE1 1 1 11 2369 1 1 6 PHE HE2 H -1.429 3.882 -3.368 1.00 . A A . 6 PHE HE2 1 1 11 2370 1 1 6 PHE HZ H -3.327 5.119 -4.334 1.00 . A A . 6 PHE HZ 1 1 11 2371 1 1 6 PHE N N -4.103 0.331 -1.503 1.00 . A A . 6 PHE N 1 1 11 2372 1 1 6 PHE O O -2.362 -2.203 -2.295 1.00 . A A . 6 PHE O 1 1 11 2373 1 1 7 PRO C C -2.927 -4.880 -1.979 1.00 . A A . 7 PRO C 1 1 11 2374 1 1 7 PRO CA C -3.821 -4.179 -0.960 1.00 . A A . 7 PRO CA 1 1 11 2375 1 1 7 PRO CB C -5.095 -4.986 -0.720 1.00 . A A . 7 PRO CB 1 1 11 2376 1 1 7 PRO CD C -5.770 -2.727 -1.154 1.00 . A A . 7 PRO CD 1 1 11 2377 1 1 7 PRO CG C -6.121 -3.965 -0.370 1.00 . A A . 7 PRO CG 1 1 11 2378 1 1 7 PRO HA H -3.284 -4.066 -0.030 1.00 . A A . 7 PRO HA 1 1 11 2379 1 1 7 PRO HB2 H -5.359 -5.523 -1.619 1.00 . A A . 7 PRO HB2 1 1 11 2380 1 1 7 PRO HB3 H -4.938 -5.681 0.091 1.00 . A A . 7 PRO HB3 1 1 11 2381 1 1 7 PRO HD2 H -6.345 -2.684 -2.067 1.00 . A A . 7 PRO HD2 1 1 11 2382 1 1 7 PRO HD3 H -5.941 -1.843 -0.558 1.00 . A A . 7 PRO HD3 1 1 11 2383 1 1 7 PRO HG2 H -7.102 -4.320 -0.651 1.00 . A A . 7 PRO HG2 1 1 11 2384 1 1 7 PRO HG3 H -6.086 -3.758 0.690 1.00 . A A . 7 PRO HG3 1 1 11 2385 1 1 7 PRO N N -4.332 -2.894 -1.447 1.00 . A A . 7 PRO N 1 1 11 2386 1 1 7 PRO O O -3.413 -5.570 -2.875 1.00 . A A . 7 PRO O 1 1 11 2387 1 1 8 ASP C C -0.107 -6.612 -2.150 1.00 . A A . 8 ASP C 1 1 11 2388 1 1 8 ASP CA C -0.657 -5.315 -2.739 1.00 . A A . 8 ASP CA 1 1 11 2389 1 1 8 ASP CB C 0.487 -4.340 -3.046 1.00 . A A . 8 ASP CB 1 1 11 2390 1 1 8 ASP CG C 1.485 -4.219 -1.908 1.00 . A A . 8 ASP CG 1 1 11 2391 1 1 8 ASP H H -1.291 -4.138 -1.098 1.00 . A A . 8 ASP H 1 1 11 2392 1 1 8 ASP HA H -1.174 -5.546 -3.659 1.00 . A A . 8 ASP HA 1 1 11 2393 1 1 8 ASP HB2 H 1.014 -4.681 -3.924 1.00 . A A . 8 ASP HB2 1 1 11 2394 1 1 8 ASP HB3 H 0.072 -3.361 -3.241 1.00 . A A . 8 ASP HB3 1 1 11 2395 1 1 8 ASP N N -1.618 -4.699 -1.833 1.00 . A A . 8 ASP N 1 1 11 2396 1 1 8 ASP O O -0.028 -7.632 -2.834 1.00 . A A . 8 ASP O 1 1 11 2397 1 1 8 ASP OD1 O 2.414 -5.019 -1.797 1.00 . A A . 8 ASP OD1 1 1 11 2398 1 1 9 VAL C C 0.408 -7.740 1.280 1.00 . A A . 9 VAL C 1 1 11 2399 1 1 9 VAL CA C 0.809 -7.732 -0.193 1.00 . A A . 9 VAL CA 1 1 11 2400 1 1 9 VAL CB C 2.347 -7.787 -0.304 1.00 . A A . 9 VAL CB 1 1 11 2401 1 1 9 VAL CG1 C 2.983 -6.600 0.404 1.00 . A A . 9 VAL CG1 1 1 11 2402 1 1 9 VAL CG2 C 2.877 -9.099 0.255 1.00 . A A . 9 VAL CG2 1 1 11 2403 1 1 9 VAL H H 0.181 -5.720 -0.383 1.00 . A A . 9 VAL H 1 1 11 2404 1 1 9 VAL HA H 0.403 -8.612 -0.670 1.00 . A A . 9 VAL HA 1 1 11 2405 1 1 9 VAL HB H 2.612 -7.735 -1.350 1.00 . A A . 9 VAL HB 1 1 11 2406 1 1 9 VAL HG11 H 3.808 -6.228 -0.186 1.00 . A A . 9 VAL HG11 1 1 11 2407 1 1 9 VAL HG12 H 3.346 -6.912 1.373 1.00 . A A . 9 VAL HG12 1 1 11 2408 1 1 9 VAL HG13 H 2.248 -5.819 0.529 1.00 . A A . 9 VAL HG13 1 1 11 2409 1 1 9 VAL HG21 H 3.780 -9.375 -0.270 1.00 . A A . 9 VAL HG21 1 1 11 2410 1 1 9 VAL HG22 H 2.134 -9.872 0.125 1.00 . A A . 9 VAL HG22 1 1 11 2411 1 1 9 VAL HG23 H 3.094 -8.981 1.306 1.00 . A A . 9 VAL HG23 1 1 11 2412 1 1 9 VAL N N 0.269 -6.563 -0.876 1.00 . A A . 9 VAL N 1 1 11 2413 1 1 9 VAL O O 1.212 -8.066 2.154 1.00 . A A . 9 VAL O 1 1 11 2414 1 1 10 GLY C C -2.520 -6.426 3.087 1.00 . A A . 10 GLY C 1 1 11 2415 1 1 10 GLY CA C -1.331 -7.351 2.914 1.00 . A A . 10 GLY CA 1 1 11 2416 1 1 10 GLY H H -1.439 -7.129 0.812 1.00 . A A . 10 GLY H 1 1 11 2417 1 1 10 GLY HA2 H -1.621 -8.350 3.201 1.00 . A A . 10 GLY HA2 1 1 11 2418 1 1 10 GLY HA3 H -0.533 -7.019 3.563 1.00 . A A . 10 GLY HA3 1 1 11 2419 1 1 10 GLY N N -0.843 -7.379 1.548 1.00 . A A . 10 GLY N 1 1 11 2420 1 1 10 GLY O O -3.667 -6.843 2.927 1.00 . A A . 10 GLY O 1 1 11 2421 1 1 11 ASP C C -3.327 -3.176 2.459 1.00 . A A . 11 ASP C 1 1 11 2422 1 1 11 ASP CA C -3.303 -4.181 3.607 1.00 . A A . 11 ASP CA 1 1 11 2423 1 1 11 ASP CB C -3.113 -3.452 4.939 1.00 . A A . 11 ASP CB 1 1 11 2424 1 1 11 ASP CG C -4.405 -3.338 5.724 1.00 . A A . 11 ASP CG 1 1 11 2425 1 1 11 ASP H H -1.311 -4.894 3.526 1.00 . A A . 11 ASP H 1 1 11 2426 1 1 11 ASP HA H -4.246 -4.707 3.627 1.00 . A A . 11 ASP HA 1 1 11 2427 1 1 11 ASP HB2 H -2.396 -3.993 5.539 1.00 . A A . 11 ASP HB2 1 1 11 2428 1 1 11 ASP HB3 H -2.739 -2.457 4.749 1.00 . A A . 11 ASP HB3 1 1 11 2429 1 1 11 ASP N N -2.246 -5.167 3.413 1.00 . A A . 11 ASP N 1 1 11 2430 1 1 11 ASP O O -4.383 -2.660 2.095 1.00 . A A . 11 ASP O 1 1 11 2431 1 1 11 ASP OD1 O -4.547 -2.366 6.495 1.00 . A A . 11 ASP OD1 1 1 11 2432 1 1 11 ASP OD2 O -5.274 -4.221 5.568 1.00 . A A . 11 ASP OD2 1 1 11 2433 1 1 12 GLY C C -0.786 -1.155 0.813 1.00 . A A . 12 GLY C 1 1 11 2434 1 1 12 GLY CA C -2.067 -1.964 0.790 1.00 . A A . 12 GLY CA 1 1 11 2435 1 1 12 GLY H H -1.346 -3.347 2.222 1.00 . A A . 12 GLY H 1 1 11 2436 1 1 12 GLY HA2 H -2.114 -2.512 -0.138 1.00 . A A . 12 GLY HA2 1 1 11 2437 1 1 12 GLY HA3 H -2.908 -1.288 0.840 1.00 . A A . 12 GLY HA3 1 1 11 2438 1 1 12 GLY N N -2.156 -2.905 1.891 1.00 . A A . 12 GLY N 1 1 11 2439 1 1 12 GLY O O -0.033 -1.196 1.786 1.00 . A A . 12 GLY O 1 1 11 2440 1 1 13 ARG C C 0.299 1.888 -0.447 1.00 . A A . 13 ARG C 1 1 11 2441 1 1 13 ARG CA C 0.661 0.408 -0.371 1.00 . A A . 13 ARG CA 1 1 11 2442 1 1 13 ARG CB C 1.478 0.007 -1.602 1.00 . A A . 13 ARG CB 1 1 11 2443 1 1 13 ARG CD C 1.393 -0.752 -3.998 1.00 . A A . 13 ARG CD 1 1 11 2444 1 1 13 ARG CG C 0.683 0.023 -2.899 1.00 . A A . 13 ARG CG 1 1 11 2445 1 1 13 ARG CZ C 2.966 -0.249 -5.827 1.00 . A A . 13 ARG CZ 1 1 11 2446 1 1 13 ARG H H -1.178 -0.427 -1.007 1.00 . A A . 13 ARG H 1 1 11 2447 1 1 13 ARG HA H 1.256 0.242 0.514 1.00 . A A . 13 ARG HA 1 1 11 2448 1 1 13 ARG HB2 H 2.307 0.690 -1.707 1.00 . A A . 13 ARG HB2 1 1 11 2449 1 1 13 ARG HB3 H 1.862 -0.990 -1.455 1.00 . A A . 13 ARG HB3 1 1 11 2450 1 1 13 ARG HD2 H 2.159 -1.367 -3.550 1.00 . A A . 13 ARG HD2 1 1 11 2451 1 1 13 ARG HD3 H 0.673 -1.382 -4.498 1.00 . A A . 13 ARG HD3 1 1 11 2452 1 1 13 ARG HE H 1.700 1.063 -5.014 1.00 . A A . 13 ARG HE 1 1 11 2453 1 1 13 ARG HG2 H -0.283 -0.426 -2.724 1.00 . A A . 13 ARG HG2 1 1 11 2454 1 1 13 ARG HG3 H 0.554 1.047 -3.218 1.00 . A A . 13 ARG HG3 1 1 11 2455 1 1 13 ARG HH11 H 3.036 -2.158 -5.163 1.00 . A A . 13 ARG HH11 1 1 11 2456 1 1 13 ARG HH12 H 4.131 -1.780 -6.450 1.00 . A A . 13 ARG HH12 1 1 11 2457 1 1 13 ARG HH21 H 3.139 1.562 -6.708 1.00 . A A . 13 ARG HH21 1 1 11 2458 1 1 13 ARG HH22 H 4.190 0.332 -7.327 1.00 . A A . 13 ARG HH22 1 1 11 2459 1 1 13 ARG N N -0.538 -0.417 -0.265 1.00 . A A . 13 ARG N 1 1 11 2460 1 1 13 ARG NE N 2.012 0.134 -4.981 1.00 . A A . 13 ARG NE 1 1 11 2461 1 1 13 ARG NH1 N 3.414 -1.498 -5.812 1.00 . A A . 13 ARG NH1 1 1 11 2462 1 1 13 ARG NH2 N 3.473 0.619 -6.691 1.00 . A A . 13 ARG NH2 1 1 11 2463 1 1 13 ARG O O -0.857 2.244 -0.680 1.00 . A A . 13 ARG O 1 1 11 2464 1 1 14 ILE C C 1.837 4.818 -1.463 1.00 . A A . 14 ILE C 1 1 11 2465 1 1 14 ILE CA C 1.082 4.189 -0.296 1.00 . A A . 14 ILE CA 1 1 11 2466 1 1 14 ILE CB C 1.524 4.870 1.016 1.00 . A A . 14 ILE CB 1 1 11 2467 1 1 14 ILE CD1 C 3.997 4.455 0.569 1.00 . A A . 14 ILE CD1 1 1 11 2468 1 1 14 ILE CG1 C 2.837 4.268 1.522 1.00 . A A . 14 ILE CG1 1 1 11 2469 1 1 14 ILE CG2 C 0.436 4.742 2.071 1.00 . A A . 14 ILE CG2 1 1 11 2470 1 1 14 ILE H H 2.193 2.402 -0.068 1.00 . A A . 14 ILE H 1 1 11 2471 1 1 14 ILE HA H 0.024 4.365 -0.429 1.00 . A A . 14 ILE HA 1 1 11 2472 1 1 14 ILE HB H 1.673 5.921 0.816 1.00 . A A . 14 ILE HB 1 1 11 2473 1 1 14 ILE HD11 H 4.062 5.495 0.282 1.00 . A A . 14 ILE HD11 1 1 11 2474 1 1 14 ILE HD12 H 3.842 3.848 -0.311 1.00 . A A . 14 ILE HD12 1 1 11 2475 1 1 14 ILE HD13 H 4.914 4.158 1.055 1.00 . A A . 14 ILE HD13 1 1 11 2476 1 1 14 ILE HG12 H 3.102 4.733 2.460 1.00 . A A . 14 ILE HG12 1 1 11 2477 1 1 14 ILE HG13 H 2.703 3.207 1.678 1.00 . A A . 14 ILE HG13 1 1 11 2478 1 1 14 ILE HG21 H 0.519 3.781 2.558 1.00 . A A . 14 ILE HG21 1 1 11 2479 1 1 14 ILE HG22 H -0.533 4.825 1.602 1.00 . A A . 14 ILE HG22 1 1 11 2480 1 1 14 ILE HG23 H 0.550 5.527 2.804 1.00 . A A . 14 ILE HG23 1 1 11 2481 1 1 14 ILE N N 1.294 2.747 -0.250 1.00 . A A . 14 ILE N 1 1 11 2482 1 1 14 ILE O O 2.354 5.930 -1.355 1.00 . A A . 14 ILE O 1 1 11 2483 1 1 15 LEU C C 1.593 4.968 -4.858 1.00 . A A . 15 LEU C 1 1 11 2484 1 1 15 LEU CA C 2.588 4.585 -3.766 1.00 . A A . 15 LEU CA 1 1 11 2485 1 1 15 LEU CB C 3.554 3.521 -4.290 1.00 . A A . 15 LEU CB 1 1 11 2486 1 1 15 LEU CD1 C 4.998 5.233 -5.417 1.00 . A A . 15 LEU CD1 1 1 11 2487 1 1 15 LEU CD2 C 5.296 2.807 -5.945 1.00 . A A . 15 LEU CD2 1 1 11 2488 1 1 15 LEU CG C 4.297 3.893 -5.575 1.00 . A A . 15 LEU CG 1 1 11 2489 1 1 15 LEU H H 1.464 3.219 -2.603 1.00 . A A . 15 LEU H 1 1 11 2490 1 1 15 LEU HA H 3.151 5.462 -3.485 1.00 . A A . 15 LEU HA 1 1 11 2491 1 1 15 LEU HB2 H 4.286 3.320 -3.521 1.00 . A A . 15 LEU HB2 1 1 11 2492 1 1 15 LEU HB3 H 2.994 2.616 -4.475 1.00 . A A . 15 LEU HB3 1 1 11 2493 1 1 15 LEU HD11 H 5.898 5.241 -6.014 1.00 . A A . 15 LEU HD11 1 1 11 2494 1 1 15 LEU HD12 H 5.253 5.386 -4.379 1.00 . A A . 15 LEU HD12 1 1 11 2495 1 1 15 LEU HD13 H 4.340 6.024 -5.746 1.00 . A A . 15 LEU HD13 1 1 11 2496 1 1 15 LEU HD21 H 5.288 2.660 -7.015 1.00 . A A . 15 LEU HD21 1 1 11 2497 1 1 15 LEU HD22 H 5.025 1.884 -5.453 1.00 . A A . 15 LEU HD22 1 1 11 2498 1 1 15 LEU HD23 H 6.285 3.105 -5.630 1.00 . A A . 15 LEU HD23 1 1 11 2499 1 1 15 LEU HG H 3.584 3.982 -6.382 1.00 . A A . 15 LEU HG 1 1 11 2500 1 1 15 LEU N N 1.896 4.098 -2.578 1.00 . A A . 15 LEU N 1 1 11 2501 1 1 15 LEU O O 0.917 4.110 -5.424 1.00 . A A . 15 LEU O 1 1 11 2502 1 1 16 ALA C C 1.278 6.805 -7.536 1.00 . A A . 16 ALA C 1 1 11 2503 1 1 16 ALA CA C 0.599 6.760 -6.171 1.00 . A A . 16 ALA CA 1 1 11 2504 1 1 16 ALA CB C 0.080 8.139 -5.790 1.00 . A A . 16 ALA CB 1 1 11 2505 1 1 16 ALA H H 2.076 6.899 -4.661 1.00 . A A . 16 ALA H 1 1 11 2506 1 1 16 ALA HA H -0.244 6.086 -6.222 1.00 . A A . 16 ALA HA 1 1 11 2507 1 1 16 ALA HB1 H -0.954 8.230 -6.089 1.00 . A A . 16 ALA HB1 1 1 11 2508 1 1 16 ALA HB2 H 0.667 8.896 -6.289 1.00 . A A . 16 ALA HB2 1 1 11 2509 1 1 16 ALA HB3 H 0.158 8.270 -4.721 1.00 . A A . 16 ALA HB3 1 1 11 2510 1 1 16 ALA N N 1.510 6.263 -5.148 1.00 . A A . 16 ALA N 1 1 11 2511 1 1 16 ALA O O 1.268 7.832 -8.214 1.00 . A A . 16 ALA O 1 1 11 2512 1 1 17 GLY C C 3.760 6.516 -9.281 1.00 . A A . 17 GLY C 1 1 11 2513 1 1 17 GLY CA C 2.543 5.614 -9.217 1.00 . A A . 17 GLY CA 1 1 11 2514 1 1 17 GLY H H 1.844 4.894 -7.353 1.00 . A A . 17 GLY H 1 1 11 2515 1 1 17 GLY HA2 H 2.854 4.595 -9.394 1.00 . A A . 17 GLY HA2 1 1 11 2516 1 1 17 GLY HA3 H 1.851 5.907 -9.992 1.00 . A A . 17 GLY HA3 1 1 11 2517 1 1 17 GLY N N 1.868 5.682 -7.935 1.00 . A A . 17 GLY N 1 1 11 2518 1 1 17 GLY O O 3.754 7.569 -8.609 1.00 . A A . 17 GLY O 1 1 11 2519 1 1 17 GLY OXT O 4.719 6.168 -10.001 1.00 . A A . 17 GLY OXT 1 1 12 2520 1 1 1 GLY C C 1.578 -3.137 1.525 1.00 . A A . 1 GLY C 1 1 12 2521 1 1 1 GLY CA C 2.293 -2.570 0.313 1.00 . A A . 1 GLY CA 1 1 12 2522 1 1 1 GLY H1 H 0.825 -1.997 -1.088 1.00 . A A . 1 GLY H1 1 1 12 2523 1 1 1 GLY HA2 H 3.221 -3.105 0.175 1.00 . A A . 1 GLY HA2 1 1 12 2524 1 1 1 GLY HA3 H 2.515 -1.529 0.495 1.00 . A A . 1 GLY HA3 1 1 12 2525 1 1 1 GLY N N 1.507 -2.674 -0.903 1.00 . A A . 1 GLY N 1 1 12 2526 1 1 1 GLY O O 0.563 -3.820 1.387 1.00 . A A . 1 GLY O 1 1 12 2527 1 1 2 PRO C C 0.283 -2.536 4.417 1.00 . A A . 2 PRO C 1 1 12 2528 1 1 2 PRO CA C 1.492 -3.368 3.974 1.00 . A A . 2 PRO CA 1 1 12 2529 1 1 2 PRO CB C 2.640 -3.273 4.981 1.00 . A A . 2 PRO CB 1 1 12 2530 1 1 2 PRO CD C 3.304 -2.070 2.993 1.00 . A A . 2 PRO CD 1 1 12 2531 1 1 2 PRO CG C 3.507 -2.161 4.486 1.00 . A A . 2 PRO CG 1 1 12 2532 1 1 2 PRO HA H 1.189 -4.400 3.872 1.00 . A A . 2 PRO HA 1 1 12 2533 1 1 2 PRO HB2 H 2.244 -3.059 5.962 1.00 . A A . 2 PRO HB2 1 1 12 2534 1 1 2 PRO HB3 H 3.179 -4.209 5.003 1.00 . A A . 2 PRO HB3 1 1 12 2535 1 1 2 PRO HD2 H 3.150 -1.042 2.698 1.00 . A A . 2 PRO HD2 1 1 12 2536 1 1 2 PRO HD3 H 4.155 -2.485 2.473 1.00 . A A . 2 PRO HD3 1 1 12 2537 1 1 2 PRO HG2 H 3.217 -1.234 4.957 1.00 . A A . 2 PRO HG2 1 1 12 2538 1 1 2 PRO HG3 H 4.541 -2.382 4.707 1.00 . A A . 2 PRO HG3 1 1 12 2539 1 1 2 PRO N N 2.093 -2.871 2.739 1.00 . A A . 2 PRO N 1 1 12 2540 1 1 2 PRO O O -0.844 -2.819 4.016 1.00 . A A . 2 PRO O 1 1 12 2541 1 1 3 LYS C C -0.792 0.526 4.792 1.00 . A A . 3 LYS C 1 1 12 2542 1 1 3 LYS CA C -0.570 -0.664 5.722 1.00 . A A . 3 LYS CA 1 1 12 2543 1 1 3 LYS CB C -0.266 -0.168 7.137 1.00 . A A . 3 LYS CB 1 1 12 2544 1 1 3 LYS CD C -1.781 1.421 8.367 1.00 . A A . 3 LYS CD 1 1 12 2545 1 1 3 LYS CE C -0.794 1.943 9.400 1.00 . A A . 3 LYS CE 1 1 12 2546 1 1 3 LYS CG C -1.503 -0.032 8.012 1.00 . A A . 3 LYS CG 1 1 12 2547 1 1 3 LYS H H 1.427 -1.329 5.535 1.00 . A A . 3 LYS H 1 1 12 2548 1 1 3 LYS HA H -1.471 -1.258 5.746 1.00 . A A . 3 LYS HA 1 1 12 2549 1 1 3 LYS HB2 H 0.409 -0.863 7.612 1.00 . A A . 3 LYS HB2 1 1 12 2550 1 1 3 LYS HB3 H 0.213 0.798 7.073 1.00 . A A . 3 LYS HB3 1 1 12 2551 1 1 3 LYS HD2 H -1.701 2.021 7.473 1.00 . A A . 3 LYS HD2 1 1 12 2552 1 1 3 LYS HD3 H -2.781 1.498 8.766 1.00 . A A . 3 LYS HD3 1 1 12 2553 1 1 3 LYS HE2 H -0.033 1.194 9.565 1.00 . A A . 3 LYS HE2 1 1 12 2554 1 1 3 LYS HE3 H -0.336 2.843 9.018 1.00 . A A . 3 LYS HE3 1 1 12 2555 1 1 3 LYS HG2 H -2.354 -0.430 7.479 1.00 . A A . 3 LYS HG2 1 1 12 2556 1 1 3 LYS HG3 H -1.351 -0.593 8.922 1.00 . A A . 3 LYS HG3 1 1 12 2557 1 1 3 LYS HZ1 H -1.938 1.402 11.063 1.00 . A A . 3 LYS HZ1 1 1 12 2558 1 1 3 LYS HZ2 H -2.163 3.004 10.568 1.00 . A A . 3 LYS HZ2 1 1 12 2559 1 1 3 LYS HZ3 H -0.754 2.565 11.394 1.00 . A A . 3 LYS HZ3 1 1 12 2560 1 1 3 LYS N N 0.514 -1.515 5.242 1.00 . A A . 3 LYS N 1 1 12 2561 1 1 3 LYS NZ N -1.459 2.250 10.697 1.00 . A A . 3 LYS NZ 1 1 12 2562 1 1 3 LYS O O -0.189 1.584 4.971 1.00 . A A . 3 LYS O 1 1 12 2563 1 1 4 GLY C C -3.380 1.404 2.381 1.00 . A A . 4 GLY C 1 1 12 2564 1 1 4 GLY CA C -1.944 1.423 2.867 1.00 . A A . 4 GLY CA 1 1 12 2565 1 1 4 GLY H H -2.115 -0.513 3.705 1.00 . A A . 4 GLY H 1 1 12 2566 1 1 4 GLY HA2 H -1.752 2.368 3.353 1.00 . A A . 4 GLY HA2 1 1 12 2567 1 1 4 GLY HA3 H -1.286 1.327 2.017 1.00 . A A . 4 GLY HA3 1 1 12 2568 1 1 4 GLY N N -1.662 0.350 3.802 1.00 . A A . 4 GLY N 1 1 12 2569 1 1 4 GLY O O -4.266 0.882 3.059 1.00 . A A . 4 GLY O 1 1 12 2570 1 1 5 ASP C C -5.039 1.150 -0.627 1.00 . A A . 5 ASP C 1 1 12 2571 1 1 5 ASP CA C -4.949 2.022 0.624 1.00 . A A . 5 ASP CA 1 1 12 2572 1 1 5 ASP CB C -5.325 3.465 0.281 1.00 . A A . 5 ASP CB 1 1 12 2573 1 1 5 ASP CG C -4.225 4.186 -0.474 1.00 . A A . 5 ASP CG 1 1 12 2574 1 1 5 ASP H H -2.863 2.373 0.712 1.00 . A A . 5 ASP H 1 1 12 2575 1 1 5 ASP HA H -5.643 1.646 1.361 1.00 . A A . 5 ASP HA 1 1 12 2576 1 1 5 ASP HB2 H -6.214 3.463 -0.332 1.00 . A A . 5 ASP HB2 1 1 12 2577 1 1 5 ASP HB3 H -5.524 4.006 1.195 1.00 . A A . 5 ASP HB3 1 1 12 2578 1 1 5 ASP N N -3.611 1.974 1.203 1.00 . A A . 5 ASP N 1 1 12 2579 1 1 5 ASP O O -6.123 0.715 -1.015 1.00 . A A . 5 ASP O 1 1 12 2580 1 1 5 ASP OD1 O -3.426 4.893 0.175 1.00 . A A . 5 ASP OD1 1 1 12 2581 1 1 5 ASP OD2 O -4.162 4.041 -1.712 1.00 . A A . 5 ASP OD2 1 1 12 2582 1 1 6 PHE C C -3.201 -1.276 -2.180 1.00 . A A . 6 PHE C 1 1 12 2583 1 1 6 PHE CA C -3.842 0.082 -2.464 1.00 . A A . 6 PHE CA 1 1 12 2584 1 1 6 PHE CB C -3.054 0.804 -3.559 1.00 . A A . 6 PHE CB 1 1 12 2585 1 1 6 PHE CD1 C -4.897 2.451 -3.993 1.00 . A A . 6 PHE CD1 1 1 12 2586 1 1 6 PHE CD2 C -2.651 3.251 -3.937 1.00 . A A . 6 PHE CD2 1 1 12 2587 1 1 6 PHE CE1 C -5.350 3.732 -4.248 1.00 . A A . 6 PHE CE1 1 1 12 2588 1 1 6 PHE CE2 C -3.098 4.534 -4.192 1.00 . A A . 6 PHE CE2 1 1 12 2589 1 1 6 PHE CG C -3.544 2.197 -3.835 1.00 . A A . 6 PHE CG 1 1 12 2590 1 1 6 PHE CZ C -4.449 4.774 -4.347 1.00 . A A . 6 PHE CZ 1 1 12 2591 1 1 6 PHE H H -3.063 1.278 -0.898 1.00 . A A . 6 PHE H 1 1 12 2592 1 1 6 PHE HA H -4.855 -0.071 -2.804 1.00 . A A . 6 PHE HA 1 1 12 2593 1 1 6 PHE HB2 H -2.017 0.871 -3.263 1.00 . A A . 6 PHE HB2 1 1 12 2594 1 1 6 PHE HB3 H -3.124 0.238 -4.476 1.00 . A A . 6 PHE HB3 1 1 12 2595 1 1 6 PHE HD1 H -5.602 1.637 -3.915 1.00 . A A . 6 PHE HD1 1 1 12 2596 1 1 6 PHE HD2 H -1.594 3.063 -3.816 1.00 . A A . 6 PHE HD2 1 1 12 2597 1 1 6 PHE HE1 H -6.407 3.917 -4.370 1.00 . A A . 6 PHE HE1 1 1 12 2598 1 1 6 PHE HE2 H -2.391 5.347 -4.269 1.00 . A A . 6 PHE HE2 1 1 12 2599 1 1 6 PHE HZ H -4.801 5.776 -4.547 1.00 . A A . 6 PHE HZ 1 1 12 2600 1 1 6 PHE N N -3.893 0.901 -1.255 1.00 . A A . 6 PHE N 1 1 12 2601 1 1 6 PHE O O -1.977 -1.404 -2.190 1.00 . A A . 6 PHE O 1 1 12 2602 1 1 7 PRO C C -2.460 -4.114 -2.642 1.00 . A A . 7 PRO C 1 1 12 2603 1 1 7 PRO CA C -3.517 -3.662 -1.639 1.00 . A A . 7 PRO CA 1 1 12 2604 1 1 7 PRO CB C -4.769 -4.531 -1.755 1.00 . A A . 7 PRO CB 1 1 12 2605 1 1 7 PRO CD C -5.494 -2.253 -1.893 1.00 . A A . 7 PRO CD 1 1 12 2606 1 1 7 PRO CG C -5.894 -3.620 -1.404 1.00 . A A . 7 PRO CG 1 1 12 2607 1 1 7 PRO HA H -3.117 -3.733 -0.639 1.00 . A A . 7 PRO HA 1 1 12 2608 1 1 7 PRO HB2 H -4.861 -4.903 -2.765 1.00 . A A . 7 PRO HB2 1 1 12 2609 1 1 7 PRO HB3 H -4.702 -5.359 -1.065 1.00 . A A . 7 PRO HB3 1 1 12 2610 1 1 7 PRO HD2 H -5.893 -2.075 -2.880 1.00 . A A . 7 PRO HD2 1 1 12 2611 1 1 7 PRO HD3 H -5.833 -1.493 -1.205 1.00 . A A . 7 PRO HD3 1 1 12 2612 1 1 7 PRO HG2 H -6.797 -3.945 -1.898 1.00 . A A . 7 PRO HG2 1 1 12 2613 1 1 7 PRO HG3 H -6.035 -3.608 -0.333 1.00 . A A . 7 PRO HG3 1 1 12 2614 1 1 7 PRO N N -4.019 -2.313 -1.924 1.00 . A A . 7 PRO N 1 1 12 2615 1 1 7 PRO O O -2.765 -4.370 -3.807 1.00 . A A . 7 PRO O 1 1 12 2616 1 1 8 ASP C C 0.474 -5.959 -2.573 1.00 . A A . 8 ASP C 1 1 12 2617 1 1 8 ASP CA C -0.115 -4.631 -3.046 1.00 . A A . 8 ASP CA 1 1 12 2618 1 1 8 ASP CB C 0.970 -3.548 -3.098 1.00 . A A . 8 ASP CB 1 1 12 2619 1 1 8 ASP CG C 1.855 -3.526 -1.864 1.00 . A A . 8 ASP CG 1 1 12 2620 1 1 8 ASP H H -1.031 -3.992 -1.246 1.00 . A A . 8 ASP H 1 1 12 2621 1 1 8 ASP HA H -0.515 -4.769 -4.040 1.00 . A A . 8 ASP HA 1 1 12 2622 1 1 8 ASP HB2 H 1.596 -3.720 -3.959 1.00 . A A . 8 ASP HB2 1 1 12 2623 1 1 8 ASP HB3 H 0.496 -2.582 -3.194 1.00 . A A . 8 ASP HB3 1 1 12 2624 1 1 8 ASP N N -1.214 -4.210 -2.184 1.00 . A A . 8 ASP N 1 1 12 2625 1 1 8 ASP O O 0.742 -6.851 -3.378 1.00 . A A . 8 ASP O 1 1 12 2626 1 1 8 ASP OD1 O 2.841 -4.258 -1.783 1.00 . A A . 8 ASP OD1 1 1 12 2627 1 1 9 VAL C C 0.853 -7.430 0.787 1.00 . A A . 9 VAL C 1 1 12 2628 1 1 9 VAL CA C 1.221 -7.304 -0.689 1.00 . A A . 9 VAL CA 1 1 12 2629 1 1 9 VAL CB C 2.755 -7.357 -0.838 1.00 . A A . 9 VAL CB 1 1 12 2630 1 1 9 VAL CG1 C 3.418 -6.257 -0.022 1.00 . A A . 9 VAL CG1 1 1 12 2631 1 1 9 VAL CG2 C 3.285 -8.724 -0.433 1.00 . A A . 9 VAL CG2 1 1 12 2632 1 1 9 VAL H H 0.433 -5.340 -0.672 1.00 . A A . 9 VAL H 1 1 12 2633 1 1 9 VAL HA H 0.800 -8.143 -1.225 1.00 . A A . 9 VAL HA 1 1 12 2634 1 1 9 VAL HB H 2.999 -7.196 -1.878 1.00 . A A . 9 VAL HB 1 1 12 2635 1 1 9 VAL HG11 H 4.238 -5.836 -0.584 1.00 . A A . 9 VAL HG11 1 1 12 2636 1 1 9 VAL HG12 H 3.790 -6.670 0.904 1.00 . A A . 9 VAL HG12 1 1 12 2637 1 1 9 VAL HG13 H 2.695 -5.484 0.194 1.00 . A A . 9 VAL HG13 1 1 12 2638 1 1 9 VAL HG21 H 4.082 -9.014 -1.101 1.00 . A A . 9 VAL HG21 1 1 12 2639 1 1 9 VAL HG22 H 2.487 -9.450 -0.488 1.00 . A A . 9 VAL HG22 1 1 12 2640 1 1 9 VAL HG23 H 3.661 -8.679 0.579 1.00 . A A . 9 VAL HG23 1 1 12 2641 1 1 9 VAL N N 0.669 -6.084 -1.264 1.00 . A A . 9 VAL N 1 1 12 2642 1 1 9 VAL O O 1.635 -7.936 1.592 1.00 . A A . 9 VAL O 1 1 12 2643 1 1 10 GLY C C -2.161 -6.414 2.706 1.00 . A A . 10 GLY C 1 1 12 2644 1 1 10 GLY CA C -0.793 -7.036 2.511 1.00 . A A . 10 GLY CA 1 1 12 2645 1 1 10 GLY H H -0.924 -6.574 0.450 1.00 . A A . 10 GLY H 1 1 12 2646 1 1 10 GLY HA2 H -0.836 -8.073 2.813 1.00 . A A . 10 GLY HA2 1 1 12 2647 1 1 10 GLY HA3 H -0.082 -6.519 3.138 1.00 . A A . 10 GLY HA3 1 1 12 2648 1 1 10 GLY N N -0.343 -6.967 1.134 1.00 . A A . 10 GLY N 1 1 12 2649 1 1 10 GLY O O -3.181 -7.033 2.405 1.00 . A A . 10 GLY O 1 1 12 2650 1 1 11 ASP C C -3.593 -3.303 2.486 1.00 . A A . 11 ASP C 1 1 12 2651 1 1 11 ASP CA C -3.437 -4.478 3.447 1.00 . A A . 11 ASP CA 1 1 12 2652 1 1 11 ASP CB C -3.504 -3.982 4.892 1.00 . A A . 11 ASP CB 1 1 12 2653 1 1 11 ASP CG C -3.169 -5.071 5.893 1.00 . A A . 11 ASP CG 1 1 12 2654 1 1 11 ASP H H -1.337 -4.743 3.432 1.00 . A A . 11 ASP H 1 1 12 2655 1 1 11 ASP HA H -4.245 -5.174 3.278 1.00 . A A . 11 ASP HA 1 1 12 2656 1 1 11 ASP HB2 H -2.802 -3.172 5.022 1.00 . A A . 11 ASP HB2 1 1 12 2657 1 1 11 ASP HB3 H -4.502 -3.624 5.098 1.00 . A A . 11 ASP HB3 1 1 12 2658 1 1 11 ASP N N -2.183 -5.185 3.211 1.00 . A A . 11 ASP N 1 1 12 2659 1 1 11 ASP O O -4.710 -2.916 2.142 1.00 . A A . 11 ASP O 1 1 12 2660 1 1 11 ASP OD1 O -4.109 -5.698 6.424 1.00 . A A . 11 ASP OD1 1 1 12 2661 1 1 11 ASP OD2 O -1.967 -5.297 6.144 1.00 . A A . 11 ASP OD2 1 1 12 2662 1 1 12 GLY C C -1.167 -0.928 0.987 1.00 . A A . 12 GLY C 1 1 12 2663 1 1 12 GLY CA C -2.511 -1.615 1.139 1.00 . A A . 12 GLY CA 1 1 12 2664 1 1 12 GLY H H -1.606 -3.087 2.361 1.00 . A A . 12 GLY H 1 1 12 2665 1 1 12 GLY HA2 H -2.832 -1.968 0.171 1.00 . A A . 12 GLY HA2 1 1 12 2666 1 1 12 GLY HA3 H -3.231 -0.897 1.502 1.00 . A A . 12 GLY HA3 1 1 12 2667 1 1 12 GLY N N -2.469 -2.739 2.055 1.00 . A A . 12 GLY N 1 1 12 2668 1 1 12 GLY O O -0.265 -1.121 1.802 1.00 . A A . 12 GLY O 1 1 12 2669 1 1 13 ARG C C 0.018 2.097 -0.086 1.00 . A A . 13 ARG C 1 1 12 2670 1 1 13 ARG CA C 0.197 0.602 -0.336 1.00 . A A . 13 ARG CA 1 1 12 2671 1 1 13 ARG CB C 0.634 0.370 -1.783 1.00 . A A . 13 ARG CB 1 1 12 2672 1 1 13 ARG CD C 2.640 1.024 -3.147 1.00 . A A . 13 ARG CD 1 1 12 2673 1 1 13 ARG CG C 2.138 0.230 -1.952 1.00 . A A . 13 ARG CG 1 1 12 2674 1 1 13 ARG CZ C 4.930 0.228 -3.588 1.00 . A A . 13 ARG CZ 1 1 12 2675 1 1 13 ARG H H -1.794 -0.015 -0.673 1.00 . A A . 13 ARG H 1 1 12 2676 1 1 13 ARG HA H 0.960 0.224 0.328 1.00 . A A . 13 ARG HA 1 1 12 2677 1 1 13 ARG HB2 H 0.167 -0.531 -2.149 1.00 . A A . 13 ARG HB2 1 1 12 2678 1 1 13 ARG HB3 H 0.303 1.204 -2.385 1.00 . A A . 13 ARG HB3 1 1 12 2679 1 1 13 ARG HD2 H 1.802 1.249 -3.790 1.00 . A A . 13 ARG HD2 1 1 12 2680 1 1 13 ARG HD3 H 3.077 1.945 -2.792 1.00 . A A . 13 ARG HD3 1 1 12 2681 1 1 13 ARG HE H 3.335 -0.185 -4.718 1.00 . A A . 13 ARG HE 1 1 12 2682 1 1 13 ARG HG2 H 2.626 0.593 -1.060 1.00 . A A . 13 ARG HG2 1 1 12 2683 1 1 13 ARG HG3 H 2.379 -0.814 -2.097 1.00 . A A . 13 ARG HG3 1 1 12 2684 1 1 13 ARG HH11 H 4.746 1.365 -1.924 1.00 . A A . 13 ARG HH11 1 1 12 2685 1 1 13 ARG HH12 H 6.347 0.800 -2.264 1.00 . A A . 13 ARG HH12 1 1 12 2686 1 1 13 ARG HH21 H 5.443 -0.927 -5.165 1.00 . A A . 13 ARG HH21 1 1 12 2687 1 1 13 ARG HH22 H 6.743 -0.500 -4.103 1.00 . A A . 13 ARG HH22 1 1 12 2688 1 1 13 ARG N N -1.038 -0.123 -0.064 1.00 . A A . 13 ARG N 1 1 12 2689 1 1 13 ARG NE N 3.640 0.288 -3.914 1.00 . A A . 13 ARG NE 1 1 12 2690 1 1 13 ARG NH1 N 5.377 0.849 -2.503 1.00 . A A . 13 ARG NH1 1 1 12 2691 1 1 13 ARG NH2 N 5.774 -0.456 -4.348 1.00 . A A . 13 ARG NH2 1 1 12 2692 1 1 13 ARG O O -1.085 2.561 0.201 1.00 . A A . 13 ARG O 1 1 12 2693 1 1 14 ILE C C 1.374 5.035 -1.291 1.00 . A A . 14 ILE C 1 1 12 2694 1 1 14 ILE CA C 1.074 4.288 0.004 1.00 . A A . 14 ILE CA 1 1 12 2695 1 1 14 ILE CB C 2.083 4.727 1.082 1.00 . A A . 14 ILE CB 1 1 12 2696 1 1 14 ILE CD1 C 0.568 3.958 2.978 1.00 . A A . 14 ILE CD1 1 1 12 2697 1 1 14 ILE CG1 C 1.935 3.861 2.334 1.00 . A A . 14 ILE CG1 1 1 12 2698 1 1 14 ILE CG2 C 1.889 6.198 1.421 1.00 . A A . 14 ILE CG2 1 1 12 2699 1 1 14 ILE H H 1.960 2.418 -0.439 1.00 . A A . 14 ILE H 1 1 12 2700 1 1 14 ILE HA H 0.082 4.553 0.340 1.00 . A A . 14 ILE HA 1 1 12 2701 1 1 14 ILE HB H 3.079 4.604 0.683 1.00 . A A . 14 ILE HB 1 1 12 2702 1 1 14 ILE HD11 H 0.655 4.451 3.934 1.00 . A A . 14 ILE HD11 1 1 12 2703 1 1 14 ILE HD12 H 0.166 2.965 3.120 1.00 . A A . 14 ILE HD12 1 1 12 2704 1 1 14 ILE HD13 H -0.091 4.525 2.339 1.00 . A A . 14 ILE HD13 1 1 12 2705 1 1 14 ILE HG12 H 2.104 2.828 2.071 1.00 . A A . 14 ILE HG12 1 1 12 2706 1 1 14 ILE HG13 H 2.669 4.167 3.065 1.00 . A A . 14 ILE HG13 1 1 12 2707 1 1 14 ILE HG21 H 0.864 6.367 1.716 1.00 . A A . 14 ILE HG21 1 1 12 2708 1 1 14 ILE HG22 H 2.119 6.801 0.555 1.00 . A A . 14 ILE HG22 1 1 12 2709 1 1 14 ILE HG23 H 2.547 6.469 2.234 1.00 . A A . 14 ILE HG23 1 1 12 2710 1 1 14 ILE N N 1.110 2.845 -0.204 1.00 . A A . 14 ILE N 1 1 12 2711 1 1 14 ILE O O 0.767 6.067 -1.580 1.00 . A A . 14 ILE O 1 1 12 2712 1 1 15 LEU C C 2.524 4.142 -4.491 1.00 . A A . 15 LEU C 1 1 12 2713 1 1 15 LEU CA C 2.695 5.123 -3.336 1.00 . A A . 15 LEU CA 1 1 12 2714 1 1 15 LEU CB C 4.144 5.610 -3.275 1.00 . A A . 15 LEU CB 1 1 12 2715 1 1 15 LEU CD1 C 3.963 6.785 -5.482 1.00 . A A . 15 LEU CD1 1 1 12 2716 1 1 15 LEU CD2 C 3.747 8.083 -3.355 1.00 . A A . 15 LEU CD2 1 1 12 2717 1 1 15 LEU CG C 4.426 6.905 -4.038 1.00 . A A . 15 LEU CG 1 1 12 2718 1 1 15 LEU H H 2.761 3.683 -1.785 1.00 . A A . 15 LEU H 1 1 12 2719 1 1 15 LEU HA H 2.046 5.971 -3.500 1.00 . A A . 15 LEU HA 1 1 12 2720 1 1 15 LEU HB2 H 4.407 5.763 -2.238 1.00 . A A . 15 LEU HB2 1 1 12 2721 1 1 15 LEU HB3 H 4.779 4.836 -3.679 1.00 . A A . 15 LEU HB3 1 1 12 2722 1 1 15 LEU HD11 H 4.487 7.508 -6.089 1.00 . A A . 15 LEU HD11 1 1 12 2723 1 1 15 LEU HD12 H 2.901 6.972 -5.537 1.00 . A A . 15 LEU HD12 1 1 12 2724 1 1 15 LEU HD13 H 4.173 5.790 -5.846 1.00 . A A . 15 LEU HD13 1 1 12 2725 1 1 15 LEU HD21 H 4.315 8.982 -3.540 1.00 . A A . 15 LEU HD21 1 1 12 2726 1 1 15 LEU HD22 H 3.697 7.901 -2.291 1.00 . A A . 15 LEU HD22 1 1 12 2727 1 1 15 LEU HD23 H 2.748 8.200 -3.748 1.00 . A A . 15 LEU HD23 1 1 12 2728 1 1 15 LEU HG H 5.490 7.088 -4.043 1.00 . A A . 15 LEU HG 1 1 12 2729 1 1 15 LEU N N 2.314 4.507 -2.069 1.00 . A A . 15 LEU N 1 1 12 2730 1 1 15 LEU O O 3.320 3.217 -4.656 1.00 . A A . 15 LEU O 1 1 12 2731 1 1 16 ALA C C 0.858 4.301 -7.668 1.00 . A A . 16 ALA C 1 1 12 2732 1 1 16 ALA CA C 1.207 3.483 -6.429 1.00 . A A . 16 ALA CA 1 1 12 2733 1 1 16 ALA CB C 0.080 2.518 -6.097 1.00 . A A . 16 ALA CB 1 1 12 2734 1 1 16 ALA H H 0.883 5.104 -5.106 1.00 . A A . 16 ALA H 1 1 12 2735 1 1 16 ALA HA H 2.097 2.905 -6.630 1.00 . A A . 16 ALA HA 1 1 12 2736 1 1 16 ALA HB1 H 0.364 1.909 -5.251 1.00 . A A . 16 ALA HB1 1 1 12 2737 1 1 16 ALA HB2 H -0.113 1.882 -6.949 1.00 . A A . 16 ALA HB2 1 1 12 2738 1 1 16 ALA HB3 H -0.813 3.075 -5.856 1.00 . A A . 16 ALA HB3 1 1 12 2739 1 1 16 ALA N N 1.482 4.350 -5.289 1.00 . A A . 16 ALA N 1 1 12 2740 1 1 16 ALA O O -0.194 4.938 -7.728 1.00 . A A . 16 ALA O 1 1 12 2741 1 1 17 GLY C C 1.955 6.467 -9.775 1.00 . A A . 17 GLY C 1 1 12 2742 1 1 17 GLY CA C 1.514 5.021 -9.880 1.00 . A A . 17 GLY CA 1 1 12 2743 1 1 17 GLY H H 2.568 3.752 -8.552 1.00 . A A . 17 GLY H 1 1 12 2744 1 1 17 GLY HA2 H 2.058 4.547 -10.684 1.00 . A A . 17 GLY HA2 1 1 12 2745 1 1 17 GLY HA3 H 0.459 4.993 -10.109 1.00 . A A . 17 GLY HA3 1 1 12 2746 1 1 17 GLY N N 1.747 4.278 -8.656 1.00 . A A . 17 GLY N 1 1 12 2747 1 1 17 GLY O O 3.036 6.718 -9.201 1.00 . A A . 17 GLY O 1 1 12 2748 1 1 17 GLY OXT O 1.220 7.349 -10.266 1.00 . A A . 17 GLY OXT 1 1 13 2749 1 1 1 GLY C C 1.276 -3.198 1.515 1.00 . A A . 1 GLY C 1 1 13 2750 1 1 1 GLY CA C 1.825 -2.630 0.220 1.00 . A A . 1 GLY CA 1 1 13 2751 1 1 1 GLY H1 H 0.170 -2.373 -1.006 1.00 . A A . 1 GLY H1 1 1 13 2752 1 1 1 GLY HA2 H 2.805 -3.048 0.044 1.00 . A A . 1 GLY HA2 1 1 13 2753 1 1 1 GLY HA3 H 1.916 -1.559 0.321 1.00 . A A . 1 GLY HA3 1 1 13 2754 1 1 1 GLY N N 0.977 -2.922 -0.923 1.00 . A A . 1 GLY N 1 1 13 2755 1 1 1 GLY O O 0.293 -3.938 1.503 1.00 . A A . 1 GLY O 1 1 13 2756 1 1 2 PRO C C 0.238 -2.589 4.490 1.00 . A A . 2 PRO C 1 1 13 2757 1 1 2 PRO CA C 1.457 -3.356 3.965 1.00 . A A . 2 PRO CA 1 1 13 2758 1 1 2 PRO CB C 2.687 -3.141 4.849 1.00 . A A . 2 PRO CB 1 1 13 2759 1 1 2 PRO CD C 3.080 -1.990 2.768 1.00 . A A . 2 PRO CD 1 1 13 2760 1 1 2 PRO CG C 3.399 -1.977 4.242 1.00 . A A . 2 PRO CG 1 1 13 2761 1 1 2 PRO HA H 1.221 -4.409 3.926 1.00 . A A . 2 PRO HA 1 1 13 2762 1 1 2 PRO HB2 H 2.375 -2.930 5.862 1.00 . A A . 2 PRO HB2 1 1 13 2763 1 1 2 PRO HB3 H 3.302 -4.028 4.835 1.00 . A A . 2 PRO HB3 1 1 13 2764 1 1 2 PRO HD2 H 2.848 -0.992 2.426 1.00 . A A . 2 PRO HD2 1 1 13 2765 1 1 2 PRO HD3 H 3.910 -2.395 2.208 1.00 . A A . 2 PRO HD3 1 1 13 2766 1 1 2 PRO HG2 H 3.051 -1.060 4.690 1.00 . A A . 2 PRO HG2 1 1 13 2767 1 1 2 PRO HG3 H 4.464 -2.084 4.393 1.00 . A A . 2 PRO HG3 1 1 13 2768 1 1 2 PRO N N 1.898 -2.867 2.661 1.00 . A A . 2 PRO N 1 1 13 2769 1 1 2 PRO O O -0.896 -2.935 4.168 1.00 . A A . 2 PRO O 1 1 13 2770 1 1 3 LYS C C -0.974 0.409 4.921 1.00 . A A . 3 LYS C 1 1 13 2771 1 1 3 LYS CA C -0.631 -0.760 5.839 1.00 . A A . 3 LYS CA 1 1 13 2772 1 1 3 LYS CB C -0.277 -0.243 7.233 1.00 . A A . 3 LYS CB 1 1 13 2773 1 1 3 LYS CD C -2.080 -1.294 8.631 1.00 . A A . 3 LYS CD 1 1 13 2774 1 1 3 LYS CE C -1.493 -1.669 9.983 1.00 . A A . 3 LYS CE 1 1 13 2775 1 1 3 LYS CG C -1.493 0.007 8.110 1.00 . A A . 3 LYS CG 1 1 13 2776 1 1 3 LYS H H 1.385 -1.310 5.523 1.00 . A A . 3 LYS H 1 1 13 2777 1 1 3 LYS HA H -1.494 -1.404 5.915 1.00 . A A . 3 LYS HA 1 1 13 2778 1 1 3 LYS HB2 H 0.354 -0.968 7.726 1.00 . A A . 3 LYS HB2 1 1 13 2779 1 1 3 LYS HB3 H 0.266 0.686 7.134 1.00 . A A . 3 LYS HB3 1 1 13 2780 1 1 3 LYS HD2 H -3.149 -1.181 8.734 1.00 . A A . 3 LYS HD2 1 1 13 2781 1 1 3 LYS HD3 H -1.867 -2.083 7.925 1.00 . A A . 3 LYS HD3 1 1 13 2782 1 1 3 LYS HE2 H -1.958 -2.583 10.322 1.00 . A A . 3 LYS HE2 1 1 13 2783 1 1 3 LYS HE3 H -0.431 -1.827 9.868 1.00 . A A . 3 LYS HE3 1 1 13 2784 1 1 3 LYS HG2 H -1.201 0.620 8.949 1.00 . A A . 3 LYS HG2 1 1 13 2785 1 1 3 LYS HG3 H -2.243 0.523 7.528 1.00 . A A . 3 LYS HG3 1 1 13 2786 1 1 3 LYS HZ1 H -1.759 -1.024 11.952 1.00 . A A . 3 LYS HZ1 1 1 13 2787 1 1 3 LYS HZ2 H -2.615 -0.114 10.812 1.00 . A A . 3 LYS HZ2 1 1 13 2788 1 1 3 LYS HZ3 H -0.943 0.088 10.970 1.00 . A A . 3 LYS HZ3 1 1 13 2789 1 1 3 LYS N N 0.466 -1.551 5.294 1.00 . A A . 3 LYS N 1 1 13 2790 1 1 3 LYS NZ N -1.718 -0.605 11.000 1.00 . A A . 3 LYS NZ 1 1 13 2791 1 1 3 LYS O O -0.409 1.496 5.047 1.00 . A A . 3 LYS O 1 1 13 2792 1 1 4 GLY C C -3.760 1.105 2.662 1.00 . A A . 4 GLY C 1 1 13 2793 1 1 4 GLY CA C -2.308 1.229 3.081 1.00 . A A . 4 GLY CA 1 1 13 2794 1 1 4 GLY H H -2.323 -0.702 3.948 1.00 . A A . 4 GLY H 1 1 13 2795 1 1 4 GLY HA2 H -2.164 2.187 3.559 1.00 . A A . 4 GLY HA2 1 1 13 2796 1 1 4 GLY HA3 H -1.685 1.181 2.201 1.00 . A A . 4 GLY HA3 1 1 13 2797 1 1 4 GLY N N -1.905 0.182 4.002 1.00 . A A . 4 GLY N 1 1 13 2798 1 1 4 GLY O O -4.559 0.467 3.348 1.00 . A A . 4 GLY O 1 1 13 2799 1 1 5 ASP C C -5.556 0.836 -0.249 1.00 . A A . 5 ASP C 1 1 13 2800 1 1 5 ASP CA C -5.468 1.677 1.023 1.00 . A A . 5 ASP CA 1 1 13 2801 1 1 5 ASP CB C -5.972 3.094 0.746 1.00 . A A . 5 ASP CB 1 1 13 2802 1 1 5 ASP CG C -6.549 3.756 1.982 1.00 . A A . 5 ASP CG 1 1 13 2803 1 1 5 ASP H H -3.419 2.212 1.033 1.00 . A A . 5 ASP H 1 1 13 2804 1 1 5 ASP HA H -6.090 1.226 1.781 1.00 . A A . 5 ASP HA 1 1 13 2805 1 1 5 ASP HB2 H -5.151 3.698 0.388 1.00 . A A . 5 ASP HB2 1 1 13 2806 1 1 5 ASP HB3 H -6.741 3.054 -0.012 1.00 . A A . 5 ASP HB3 1 1 13 2807 1 1 5 ASP N N -4.102 1.719 1.534 1.00 . A A . 5 ASP N 1 1 13 2808 1 1 5 ASP O O -6.632 0.364 -0.616 1.00 . A A . 5 ASP O 1 1 13 2809 1 1 5 ASP OD1 O -7.672 4.297 1.896 1.00 . A A . 5 ASP OD1 1 1 13 2810 1 1 5 ASP OD2 O -5.879 3.734 3.035 1.00 . A A . 5 ASP OD2 1 1 13 2811 1 1 6 PHE C C -3.612 -1.434 -1.931 1.00 . A A . 6 PHE C 1 1 13 2812 1 1 6 PHE CA C -4.379 -0.131 -2.147 1.00 . A A . 6 PHE CA 1 1 13 2813 1 1 6 PHE CB C -3.730 0.679 -3.272 1.00 . A A . 6 PHE CB 1 1 13 2814 1 1 6 PHE CD1 C -4.618 2.666 -4.521 1.00 . A A . 6 PHE CD1 1 1 13 2815 1 1 6 PHE CD2 C -5.766 0.587 -4.735 1.00 . A A . 6 PHE CD2 1 1 13 2816 1 1 6 PHE CE1 C -5.532 3.262 -5.370 1.00 . A A . 6 PHE CE1 1 1 13 2817 1 1 6 PHE CE2 C -6.683 1.177 -5.584 1.00 . A A . 6 PHE CE2 1 1 13 2818 1 1 6 PHE CG C -4.725 1.324 -4.194 1.00 . A A . 6 PHE CG 1 1 13 2819 1 1 6 PHE CZ C -6.566 2.517 -5.902 1.00 . A A . 6 PHE CZ 1 1 13 2820 1 1 6 PHE H H -3.594 1.053 -0.577 1.00 . A A . 6 PHE H 1 1 13 2821 1 1 6 PHE HA H -5.395 -0.366 -2.426 1.00 . A A . 6 PHE HA 1 1 13 2822 1 1 6 PHE HB2 H -3.123 1.460 -2.840 1.00 . A A . 6 PHE HB2 1 1 13 2823 1 1 6 PHE HB3 H -3.103 0.026 -3.862 1.00 . A A . 6 PHE HB3 1 1 13 2824 1 1 6 PHE HD1 H -3.809 3.250 -4.106 1.00 . A A . 6 PHE HD1 1 1 13 2825 1 1 6 PHE HD2 H -5.860 -0.460 -4.487 1.00 . A A . 6 PHE HD2 1 1 13 2826 1 1 6 PHE HE1 H -5.438 4.309 -5.616 1.00 . A A . 6 PHE HE1 1 1 13 2827 1 1 6 PHE HE2 H -7.491 0.592 -5.998 1.00 . A A . 6 PHE HE2 1 1 13 2828 1 1 6 PHE HZ H -7.281 2.980 -6.565 1.00 . A A . 6 PHE HZ 1 1 13 2829 1 1 6 PHE N N -4.421 0.653 -0.918 1.00 . A A . 6 PHE N 1 1 13 2830 1 1 6 PHE O O -2.390 -1.474 -2.069 1.00 . A A . 6 PHE O 1 1 13 2831 1 1 7 PRO C C -2.683 -4.203 -2.415 1.00 . A A . 7 PRO C 1 1 13 2832 1 1 7 PRO CA C -3.705 -3.831 -1.345 1.00 . A A . 7 PRO CA 1 1 13 2833 1 1 7 PRO CB C -4.896 -4.787 -1.386 1.00 . A A . 7 PRO CB 1 1 13 2834 1 1 7 PRO CD C -5.788 -2.563 -1.397 1.00 . A A . 7 PRO CD 1 1 13 2835 1 1 7 PRO CG C -6.048 -3.968 -0.918 1.00 . A A . 7 PRO CG 1 1 13 2836 1 1 7 PRO HA H -3.239 -3.875 -0.373 1.00 . A A . 7 PRO HA 1 1 13 2837 1 1 7 PRO HB2 H -5.043 -5.140 -2.396 1.00 . A A . 7 PRO HB2 1 1 13 2838 1 1 7 PRO HB3 H -4.713 -5.623 -0.728 1.00 . A A . 7 PRO HB3 1 1 13 2839 1 1 7 PRO HD2 H -6.301 -2.383 -2.331 1.00 . A A . 7 PRO HD2 1 1 13 2840 1 1 7 PRO HD3 H -6.100 -1.847 -0.651 1.00 . A A . 7 PRO HD3 1 1 13 2841 1 1 7 PRO HG2 H -6.965 -4.346 -1.347 1.00 . A A . 7 PRO HG2 1 1 13 2842 1 1 7 PRO HG3 H -6.101 -3.991 0.160 1.00 . A A . 7 PRO HG3 1 1 13 2843 1 1 7 PRO N N -4.324 -2.523 -1.585 1.00 . A A . 7 PRO N 1 1 13 2844 1 1 7 PRO O O -2.977 -4.165 -3.609 1.00 . A A . 7 PRO O 1 1 13 2845 1 1 8 ASP C C 0.372 -6.137 -2.352 1.00 . A A . 8 ASP C 1 1 13 2846 1 1 8 ASP CA C -0.415 -4.946 -2.894 1.00 . A A . 8 ASP CA 1 1 13 2847 1 1 8 ASP CB C 0.519 -3.757 -3.152 1.00 . A A . 8 ASP CB 1 1 13 2848 1 1 8 ASP CG C 1.486 -3.498 -2.009 1.00 . A A . 8 ASP CG 1 1 13 2849 1 1 8 ASP H H -1.308 -4.576 -1.011 1.00 . A A . 8 ASP H 1 1 13 2850 1 1 8 ASP HA H -0.876 -5.235 -3.827 1.00 . A A . 8 ASP HA 1 1 13 2851 1 1 8 ASP HB2 H 1.096 -3.949 -4.044 1.00 . A A . 8 ASP HB2 1 1 13 2852 1 1 8 ASP HB3 H -0.077 -2.868 -3.302 1.00 . A A . 8 ASP HB3 1 1 13 2853 1 1 8 ASP N N -1.481 -4.564 -1.975 1.00 . A A . 8 ASP N 1 1 13 2854 1 1 8 ASP O O 0.649 -7.093 -3.077 1.00 . A A . 8 ASP O 1 1 13 2855 1 1 8 ASP OD1 O 2.673 -3.808 -2.106 1.00 . A A . 8 ASP OD1 1 1 13 2856 1 1 9 VAL C C 1.102 -7.273 1.040 1.00 . A A . 9 VAL C 1 1 13 2857 1 1 9 VAL CA C 1.480 -7.144 -0.433 1.00 . A A . 9 VAL CA 1 1 13 2858 1 1 9 VAL CB C 3.000 -6.911 -0.554 1.00 . A A . 9 VAL CB 1 1 13 2859 1 1 9 VAL CG1 C 3.414 -5.649 0.189 1.00 . A A . 9 VAL CG1 1 1 13 2860 1 1 9 VAL CG2 C 3.771 -8.121 -0.044 1.00 . A A . 9 VAL CG2 1 1 13 2861 1 1 9 VAL H H 0.476 -5.285 -0.547 1.00 . A A . 9 VAL H 1 1 13 2862 1 1 9 VAL HA H 1.237 -8.067 -0.938 1.00 . A A . 9 VAL HA 1 1 13 2863 1 1 9 VAL HB H 3.238 -6.777 -1.600 1.00 . A A . 9 VAL HB 1 1 13 2864 1 1 9 VAL HG11 H 3.850 -5.918 1.140 1.00 . A A . 9 VAL HG11 1 1 13 2865 1 1 9 VAL HG12 H 2.546 -5.028 0.355 1.00 . A A . 9 VAL HG12 1 1 13 2866 1 1 9 VAL HG13 H 4.138 -5.106 -0.399 1.00 . A A . 9 VAL HG13 1 1 13 2867 1 1 9 VAL HG21 H 4.531 -7.798 0.652 1.00 . A A . 9 VAL HG21 1 1 13 2868 1 1 9 VAL HG22 H 4.237 -8.628 -0.876 1.00 . A A . 9 VAL HG22 1 1 13 2869 1 1 9 VAL HG23 H 3.092 -8.798 0.454 1.00 . A A . 9 VAL HG23 1 1 13 2870 1 1 9 VAL N N 0.727 -6.072 -1.073 1.00 . A A . 9 VAL N 1 1 13 2871 1 1 9 VAL O O 1.955 -7.516 1.894 1.00 . A A . 9 VAL O 1 1 13 2872 1 1 10 GLY C C -2.021 -6.573 2.889 1.00 . A A . 10 GLY C 1 1 13 2873 1 1 10 GLY CA C -0.656 -7.205 2.699 1.00 . A A . 10 GLY CA 1 1 13 2874 1 1 10 GLY H H -0.819 -6.913 0.609 1.00 . A A . 10 GLY H 1 1 13 2875 1 1 10 GLY HA2 H -0.714 -8.248 2.973 1.00 . A A . 10 GLY HA2 1 1 13 2876 1 1 10 GLY HA3 H 0.051 -6.711 3.349 1.00 . A A . 10 GLY HA3 1 1 13 2877 1 1 10 GLY N N -0.184 -7.106 1.330 1.00 . A A . 10 GLY N 1 1 13 2878 1 1 10 GLY O O -3.046 -7.236 2.738 1.00 . A A . 10 GLY O 1 1 13 2879 1 1 11 ASP C C -3.441 -3.445 2.400 1.00 . A A . 11 ASP C 1 1 13 2880 1 1 11 ASP CA C -3.283 -4.562 3.429 1.00 . A A . 11 ASP CA 1 1 13 2881 1 1 11 ASP CB C -3.330 -3.983 4.846 1.00 . A A . 11 ASP CB 1 1 13 2882 1 1 11 ASP CG C -4.400 -4.634 5.701 1.00 . A A . 11 ASP CG 1 1 13 2883 1 1 11 ASP H H -1.183 -4.810 3.324 1.00 . A A . 11 ASP H 1 1 13 2884 1 1 11 ASP HA H -4.096 -5.262 3.308 1.00 . A A . 11 ASP HA 1 1 13 2885 1 1 11 ASP HB2 H -2.374 -4.137 5.323 1.00 . A A . 11 ASP HB2 1 1 13 2886 1 1 11 ASP HB3 H -3.534 -2.923 4.792 1.00 . A A . 11 ASP HB3 1 1 13 2887 1 1 11 ASP N N -2.034 -5.285 3.220 1.00 . A A . 11 ASP N 1 1 13 2888 1 1 11 ASP O O -4.537 -3.200 1.898 1.00 . A A . 11 ASP O 1 1 13 2889 1 1 11 ASP OD1 O -5.474 -4.965 5.157 1.00 . A A . 11 ASP OD1 1 1 13 2890 1 1 11 ASP OD2 O -4.163 -4.812 6.915 1.00 . A A . 11 ASP OD2 1 1 13 2891 1 1 12 GLY C C -1.065 -0.924 1.064 1.00 . A A . 12 GLY C 1 1 13 2892 1 1 12 GLY CA C -2.371 -1.692 1.125 1.00 . A A . 12 GLY CA 1 1 13 2893 1 1 12 GLY H H -1.491 -3.014 2.523 1.00 . A A . 12 GLY H 1 1 13 2894 1 1 12 GLY HA2 H -2.577 -2.105 0.150 1.00 . A A . 12 GLY HA2 1 1 13 2895 1 1 12 GLY HA3 H -3.165 -1.011 1.391 1.00 . A A . 12 GLY HA3 1 1 13 2896 1 1 12 GLY N N -2.337 -2.773 2.091 1.00 . A A . 12 GLY N 1 1 13 2897 1 1 12 GLY O O -0.258 -0.984 1.991 1.00 . A A . 12 GLY O 1 1 13 2898 1 1 13 ARG C C 0.053 2.080 -0.176 1.00 . A A . 13 ARG C 1 1 13 2899 1 1 13 ARG CA C 0.358 0.587 -0.211 1.00 . A A . 13 ARG CA 1 1 13 2900 1 1 13 ARG CB C 1.034 0.228 -1.536 1.00 . A A . 13 ARG CB 1 1 13 2901 1 1 13 ARG CD C 0.707 0.580 -4.004 1.00 . A A . 13 ARG CD 1 1 13 2902 1 1 13 ARG CG C 0.066 0.122 -2.703 1.00 . A A . 13 ARG CG 1 1 13 2903 1 1 13 ARG CZ C -1.173 1.242 -5.455 1.00 . A A . 13 ARG CZ 1 1 13 2904 1 1 13 ARG H H -1.540 -0.190 -0.735 1.00 . A A . 13 ARG H 1 1 13 2905 1 1 13 ARG HA H 1.029 0.349 0.601 1.00 . A A . 13 ARG HA 1 1 13 2906 1 1 13 ARG HB2 H 1.765 0.987 -1.770 1.00 . A A . 13 ARG HB2 1 1 13 2907 1 1 13 ARG HB3 H 1.536 -0.721 -1.426 1.00 . A A . 13 ARG HB3 1 1 13 2908 1 1 13 ARG HD2 H 1.665 1.025 -3.783 1.00 . A A . 13 ARG HD2 1 1 13 2909 1 1 13 ARG HD3 H 0.849 -0.280 -4.642 1.00 . A A . 13 ARG HD3 1 1 13 2910 1 1 13 ARG HE H 0.125 2.505 -4.616 1.00 . A A . 13 ARG HE 1 1 13 2911 1 1 13 ARG HG2 H -0.244 -0.906 -2.810 1.00 . A A . 13 ARG HG2 1 1 13 2912 1 1 13 ARG HG3 H -0.796 0.741 -2.500 1.00 . A A . 13 ARG HG3 1 1 13 2913 1 1 13 ARG HH11 H -1.015 -0.751 -5.149 1.00 . A A . 13 ARG HH11 1 1 13 2914 1 1 13 ARG HH12 H -2.327 -0.258 -6.165 1.00 . A A . 13 ARG HH12 1 1 13 2915 1 1 13 ARG HH21 H -1.601 3.154 -5.953 1.00 . A A . 13 ARG HH21 1 1 13 2916 1 1 13 ARG HH22 H -2.660 1.957 -6.622 1.00 . A A . 13 ARG HH22 1 1 13 2917 1 1 13 ARG N N -0.858 -0.198 -0.031 1.00 . A A . 13 ARG N 1 1 13 2918 1 1 13 ARG NE N -0.119 1.560 -4.707 1.00 . A A . 13 ARG NE 1 1 13 2919 1 1 13 ARG NH1 N -1.534 -0.027 -5.601 1.00 . A A . 13 ARG NH1 1 1 13 2920 1 1 13 ARG NH2 N -1.868 2.196 -6.059 1.00 . A A . 13 ARG NH2 1 1 13 2921 1 1 13 ARG O O -1.095 2.486 0.003 1.00 . A A . 13 ARG O 1 1 13 2922 1 1 14 ILE C C 1.874 5.002 -1.348 1.00 . A A . 14 ILE C 1 1 13 2923 1 1 14 ILE CA C 0.935 4.343 -0.342 1.00 . A A . 14 ILE CA 1 1 13 2924 1 1 14 ILE CB C 1.202 4.932 1.058 1.00 . A A . 14 ILE CB 1 1 13 2925 1 1 14 ILE CD1 C 3.732 4.653 0.975 1.00 . A A . 14 ILE CD1 1 1 13 2926 1 1 14 ILE CG1 C 2.443 4.292 1.682 1.00 . A A . 14 ILE CG1 1 1 13 2927 1 1 14 ILE CG2 C -0.010 4.731 1.955 1.00 . A A . 14 ILE CG2 1 1 13 2928 1 1 14 ILE H H 1.980 2.509 -0.490 1.00 . A A . 14 ILE H 1 1 13 2929 1 1 14 ILE HA H -0.085 4.569 -0.616 1.00 . A A . 14 ILE HA 1 1 13 2930 1 1 14 ILE HB H 1.367 5.994 0.951 1.00 . A A . 14 ILE HB 1 1 13 2931 1 1 14 ILE HD11 H 3.727 5.705 0.732 1.00 . A A . 14 ILE HD11 1 1 13 2932 1 1 14 ILE HD12 H 3.818 4.074 0.068 1.00 . A A . 14 ILE HD12 1 1 13 2933 1 1 14 ILE HD13 H 4.569 4.436 1.621 1.00 . A A . 14 ILE HD13 1 1 13 2934 1 1 14 ILE HG12 H 2.529 4.614 2.709 1.00 . A A . 14 ILE HG12 1 1 13 2935 1 1 14 ILE HG13 H 2.338 3.217 1.655 1.00 . A A . 14 ILE HG13 1 1 13 2936 1 1 14 ILE HG21 H -0.057 5.529 2.682 1.00 . A A . 14 ILE HG21 1 1 13 2937 1 1 14 ILE HG22 H 0.074 3.784 2.467 1.00 . A A . 14 ILE HG22 1 1 13 2938 1 1 14 ILE HG23 H -0.908 4.738 1.355 1.00 . A A . 14 ILE HG23 1 1 13 2939 1 1 14 ILE N N 1.090 2.893 -0.350 1.00 . A A . 14 ILE N 1 1 13 2940 1 1 14 ILE O O 2.273 6.154 -1.177 1.00 . A A . 14 ILE O 1 1 13 2941 1 1 15 LEU C C 2.798 4.144 -4.785 1.00 . A A . 15 LEU C 1 1 13 2942 1 1 15 LEU CA C 3.112 4.777 -3.433 1.00 . A A . 15 LEU CA 1 1 13 2943 1 1 15 LEU CB C 4.574 4.515 -3.057 1.00 . A A . 15 LEU CB 1 1 13 2944 1 1 15 LEU CD1 C 6.471 2.911 -2.713 1.00 . A A . 15 LEU CD1 1 1 13 2945 1 1 15 LEU CD2 C 4.120 2.169 -2.294 1.00 . A A . 15 LEU CD2 1 1 13 2946 1 1 15 LEU CG C 5.020 3.053 -3.145 1.00 . A A . 15 LEU CG 1 1 13 2947 1 1 15 LEU H H 1.870 3.353 -2.481 1.00 . A A . 15 LEU H 1 1 13 2948 1 1 15 LEU HA H 2.955 5.843 -3.504 1.00 . A A . 15 LEU HA 1 1 13 2949 1 1 15 LEU HB2 H 5.201 5.100 -3.714 1.00 . A A . 15 LEU HB2 1 1 13 2950 1 1 15 LEU HB3 H 4.729 4.855 -2.044 1.00 . A A . 15 LEU HB3 1 1 13 2951 1 1 15 LEU HD11 H 6.692 3.640 -1.947 1.00 . A A . 15 LEU HD11 1 1 13 2952 1 1 15 LEU HD12 H 7.118 3.075 -3.563 1.00 . A A . 15 LEU HD12 1 1 13 2953 1 1 15 LEU HD13 H 6.635 1.918 -2.322 1.00 . A A . 15 LEU HD13 1 1 13 2954 1 1 15 LEU HD21 H 4.647 1.262 -2.036 1.00 . A A . 15 LEU HD21 1 1 13 2955 1 1 15 LEU HD22 H 3.228 1.922 -2.850 1.00 . A A . 15 LEU HD22 1 1 13 2956 1 1 15 LEU HD23 H 3.847 2.696 -1.391 1.00 . A A . 15 LEU HD23 1 1 13 2957 1 1 15 LEU HG H 4.943 2.721 -4.170 1.00 . A A . 15 LEU HG 1 1 13 2958 1 1 15 LEU N N 2.222 4.264 -2.398 1.00 . A A . 15 LEU N 1 1 13 2959 1 1 15 LEU O O 2.846 2.923 -4.935 1.00 . A A . 15 LEU O 1 1 13 2960 1 1 16 ALA C C 2.536 5.536 -8.161 1.00 . A A . 16 ALA C 1 1 13 2961 1 1 16 ALA CA C 2.155 4.505 -7.105 1.00 . A A . 16 ALA CA 1 1 13 2962 1 1 16 ALA CB C 0.675 4.168 -7.203 1.00 . A A . 16 ALA CB 1 1 13 2963 1 1 16 ALA H H 2.456 5.945 -5.583 1.00 . A A . 16 ALA H 1 1 13 2964 1 1 16 ALA HA H 2.718 3.599 -7.280 1.00 . A A . 16 ALA HA 1 1 13 2965 1 1 16 ALA HB1 H 0.351 3.694 -6.288 1.00 . A A . 16 ALA HB1 1 1 13 2966 1 1 16 ALA HB2 H 0.513 3.496 -8.033 1.00 . A A . 16 ALA HB2 1 1 13 2967 1 1 16 ALA HB3 H 0.109 5.075 -7.359 1.00 . A A . 16 ALA HB3 1 1 13 2968 1 1 16 ALA N N 2.477 4.982 -5.765 1.00 . A A . 16 ALA N 1 1 13 2969 1 1 16 ALA O O 3.203 6.527 -7.865 1.00 . A A . 16 ALA O 1 1 13 2970 1 1 17 GLY C C 1.165 6.731 -11.168 1.00 . A A . 17 GLY C 1 1 13 2971 1 1 17 GLY CA C 2.412 6.210 -10.480 1.00 . A A . 17 GLY CA 1 1 13 2972 1 1 17 GLY H H 1.579 4.488 -9.572 1.00 . A A . 17 GLY H 1 1 13 2973 1 1 17 GLY HA2 H 2.969 7.047 -10.086 1.00 . A A . 17 GLY HA2 1 1 13 2974 1 1 17 GLY HA3 H 3.022 5.696 -11.208 1.00 . A A . 17 GLY HA3 1 1 13 2975 1 1 17 GLY N N 2.107 5.295 -9.396 1.00 . A A . 17 GLY N 1 1 13 2976 1 1 17 GLY O O 0.663 7.799 -10.758 1.00 . A A . 17 GLY O 1 1 13 2977 1 1 17 GLY OXT O 0.690 6.071 -12.116 1.00 . A A . 17 GLY OXT 1 1 14 2978 1 1 1 GLY C C 1.158 -2.926 0.654 1.00 . A A . 1 GLY C 1 1 14 2979 1 1 1 GLY CA C 1.359 -2.463 -0.777 1.00 . A A . 1 GLY CA 1 1 14 2980 1 1 1 GLY H1 H -0.191 -2.098 -1.810 1.00 . A A . 1 GLY H1 1 1 14 2981 1 1 1 GLY HA2 H 2.309 -2.834 -1.132 1.00 . A A . 1 GLY HA2 1 1 14 2982 1 1 1 GLY HA3 H 1.378 -1.383 -0.794 1.00 . A A . 1 GLY HA3 1 1 14 2983 1 1 1 GLY N N 0.312 -2.926 -1.670 1.00 . A A . 1 GLY N 1 1 14 2984 1 1 1 GLY O O 0.196 -3.636 0.949 1.00 . A A . 1 GLY O 1 1 14 2985 1 1 2 PRO C C 0.890 -2.144 3.735 1.00 . A A . 2 PRO C 1 1 14 2986 1 1 2 PRO CA C 1.968 -2.928 2.979 1.00 . A A . 2 PRO CA 1 1 14 2987 1 1 2 PRO CB C 3.367 -2.625 3.521 1.00 . A A . 2 PRO CB 1 1 14 2988 1 1 2 PRO CD C 3.240 -1.695 1.303 1.00 . A A . 2 PRO CD 1 1 14 2989 1 1 2 PRO CG C 3.894 -1.533 2.651 1.00 . A A . 2 PRO CG 1 1 14 2990 1 1 2 PRO HA H 1.766 -3.985 3.077 1.00 . A A . 2 PRO HA 1 1 14 2991 1 1 2 PRO HB2 H 3.296 -2.310 4.551 1.00 . A A . 2 PRO HB2 1 1 14 2992 1 1 2 PRO HB3 H 3.980 -3.511 3.454 1.00 . A A . 2 PRO HB3 1 1 14 2993 1 1 2 PRO HD2 H 2.941 -0.733 0.913 1.00 . A A . 2 PRO HD2 1 1 14 2994 1 1 2 PRO HD3 H 3.913 -2.186 0.615 1.00 . A A . 2 PRO HD3 1 1 14 2995 1 1 2 PRO HG2 H 3.643 -0.573 3.073 1.00 . A A . 2 PRO HG2 1 1 14 2996 1 1 2 PRO HG3 H 4.966 -1.629 2.557 1.00 . A A . 2 PRO HG3 1 1 14 2997 1 1 2 PRO N N 2.060 -2.539 1.572 1.00 . A A . 2 PRO N 1 1 14 2998 1 1 2 PRO O O -0.265 -2.562 3.780 1.00 . A A . 2 PRO O 1 1 14 2999 1 1 3 LYS C C -0.341 0.849 4.170 1.00 . A A . 3 LYS C 1 1 14 3000 1 1 3 LYS CA C 0.317 -0.190 5.073 1.00 . A A . 3 LYS CA 1 1 14 3001 1 1 3 LYS CB C 1.019 0.504 6.241 1.00 . A A . 3 LYS CB 1 1 14 3002 1 1 3 LYS CD C -0.165 0.137 8.428 1.00 . A A . 3 LYS CD 1 1 14 3003 1 1 3 LYS CE C 0.527 0.625 9.691 1.00 . A A . 3 LYS CE 1 1 14 3004 1 1 3 LYS CG C 0.060 1.090 7.265 1.00 . A A . 3 LYS CG 1 1 14 3005 1 1 3 LYS H H 2.196 -0.719 4.265 1.00 . A A . 3 LYS H 1 1 14 3006 1 1 3 LYS HA H -0.449 -0.844 5.464 1.00 . A A . 3 LYS HA 1 1 14 3007 1 1 3 LYS HB2 H 1.653 -0.212 6.742 1.00 . A A . 3 LYS HB2 1 1 14 3008 1 1 3 LYS HB3 H 1.631 1.305 5.853 1.00 . A A . 3 LYS HB3 1 1 14 3009 1 1 3 LYS HD2 H -1.225 0.060 8.618 1.00 . A A . 3 LYS HD2 1 1 14 3010 1 1 3 LYS HD3 H 0.227 -0.835 8.167 1.00 . A A . 3 LYS HD3 1 1 14 3011 1 1 3 LYS HE2 H 1.578 0.759 9.482 1.00 . A A . 3 LYS HE2 1 1 14 3012 1 1 3 LYS HE3 H 0.095 1.572 9.980 1.00 . A A . 3 LYS HE3 1 1 14 3013 1 1 3 LYS HG2 H 0.473 2.014 7.642 1.00 . A A . 3 LYS HG2 1 1 14 3014 1 1 3 LYS HG3 H -0.887 1.287 6.784 1.00 . A A . 3 LYS HG3 1 1 14 3015 1 1 3 LYS HZ1 H -0.448 -0.085 11.396 1.00 . A A . 3 LYS HZ1 1 1 14 3016 1 1 3 LYS HZ2 H 1.226 -0.325 11.415 1.00 . A A . 3 LYS HZ2 1 1 14 3017 1 1 3 LYS HZ3 H 0.244 -1.302 10.445 1.00 . A A . 3 LYS HZ3 1 1 14 3018 1 1 3 LYS N N 1.265 -1.011 4.328 1.00 . A A . 3 LYS N 1 1 14 3019 1 1 3 LYS NZ N 0.377 -0.339 10.815 1.00 . A A . 3 LYS NZ 1 1 14 3020 1 1 3 LYS O O 0.126 1.983 4.072 1.00 . A A . 3 LYS O 1 1 14 3021 1 1 4 GLY C C -3.620 1.094 2.570 1.00 . A A . 4 GLY C 1 1 14 3022 1 1 4 GLY CA C -2.130 1.372 2.630 1.00 . A A . 4 GLY CA 1 1 14 3023 1 1 4 GLY H H -1.757 -0.459 3.630 1.00 . A A . 4 GLY H 1 1 14 3024 1 1 4 GLY HA2 H -1.978 2.381 2.983 1.00 . A A . 4 GLY HA2 1 1 14 3025 1 1 4 GLY HA3 H -1.718 1.285 1.636 1.00 . A A . 4 GLY HA3 1 1 14 3026 1 1 4 GLY N N -1.428 0.457 3.513 1.00 . A A . 4 GLY N 1 1 14 3027 1 1 4 GLY O O -4.178 0.471 3.474 1.00 . A A . 4 GLY O 1 1 14 3028 1 1 5 ASP C C -5.998 0.415 0.169 1.00 . A A . 5 ASP C 1 1 14 3029 1 1 5 ASP CA C -5.702 1.360 1.334 1.00 . A A . 5 ASP CA 1 1 14 3030 1 1 5 ASP CB C -6.400 2.702 1.105 1.00 . A A . 5 ASP CB 1 1 14 3031 1 1 5 ASP CG C -5.732 3.525 0.022 1.00 . A A . 5 ASP CG 1 1 14 3032 1 1 5 ASP H H -3.766 2.050 0.820 1.00 . A A . 5 ASP H 1 1 14 3033 1 1 5 ASP HA H -6.084 0.919 2.242 1.00 . A A . 5 ASP HA 1 1 14 3034 1 1 5 ASP HB2 H -7.424 2.523 0.814 1.00 . A A . 5 ASP HB2 1 1 14 3035 1 1 5 ASP HB3 H -6.385 3.269 2.024 1.00 . A A . 5 ASP HB3 1 1 14 3036 1 1 5 ASP N N -4.266 1.559 1.505 1.00 . A A . 5 ASP N 1 1 14 3037 1 1 5 ASP O O -7.102 -0.119 0.061 1.00 . A A . 5 ASP O 1 1 14 3038 1 1 5 ASP OD1 O -4.501 3.721 0.099 1.00 . A A . 5 ASP OD1 1 1 14 3039 1 1 5 ASP OD2 O -6.439 3.973 -0.905 1.00 . A A . 5 ASP OD2 1 1 14 3040 1 1 6 PHE C C -4.371 -1.957 -1.671 1.00 . A A . 6 PHE C 1 1 14 3041 1 1 6 PHE CA C -5.174 -0.669 -1.851 1.00 . A A . 6 PHE CA 1 1 14 3042 1 1 6 PHE CB C -4.729 0.042 -3.131 1.00 . A A . 6 PHE CB 1 1 14 3043 1 1 6 PHE CD1 C -4.611 2.548 -3.163 1.00 . A A . 6 PHE CD1 1 1 14 3044 1 1 6 PHE CD2 C -6.697 1.504 -3.656 1.00 . A A . 6 PHE CD2 1 1 14 3045 1 1 6 PHE CE1 C -5.188 3.792 -3.338 1.00 . A A . 6 PHE CE1 1 1 14 3046 1 1 6 PHE CE2 C -7.280 2.744 -3.833 1.00 . A A . 6 PHE CE2 1 1 14 3047 1 1 6 PHE CG C -5.358 1.392 -3.320 1.00 . A A . 6 PHE CG 1 1 14 3048 1 1 6 PHE CZ C -6.525 3.890 -3.674 1.00 . A A . 6 PHE CZ 1 1 14 3049 1 1 6 PHE H H -4.153 0.666 -0.564 1.00 . A A . 6 PHE H 1 1 14 3050 1 1 6 PHE HA H -6.221 -0.918 -1.934 1.00 . A A . 6 PHE HA 1 1 14 3051 1 1 6 PHE HB2 H -3.658 0.176 -3.106 1.00 . A A . 6 PHE HB2 1 1 14 3052 1 1 6 PHE HB3 H -4.990 -0.570 -3.983 1.00 . A A . 6 PHE HB3 1 1 14 3053 1 1 6 PHE HD1 H -3.566 2.473 -2.901 1.00 . A A . 6 PHE HD1 1 1 14 3054 1 1 6 PHE HD2 H -7.289 0.609 -3.780 1.00 . A A . 6 PHE HD2 1 1 14 3055 1 1 6 PHE HE1 H -4.595 4.686 -3.213 1.00 . A A . 6 PHE HE1 1 1 14 3056 1 1 6 PHE HE2 H -8.326 2.818 -4.095 1.00 . A A . 6 PHE HE2 1 1 14 3057 1 1 6 PHE HZ H -6.978 4.860 -3.812 1.00 . A A . 6 PHE HZ 1 1 14 3058 1 1 6 PHE N N -5.010 0.212 -0.699 1.00 . A A . 6 PHE N 1 1 14 3059 1 1 6 PHE O O -3.191 -2.013 -2.017 1.00 . A A . 6 PHE O 1 1 14 3060 1 1 7 PRO C C -3.532 -4.765 -2.108 1.00 . A A . 7 PRO C 1 1 14 3061 1 1 7 PRO CA C -4.333 -4.298 -0.896 1.00 . A A . 7 PRO CA 1 1 14 3062 1 1 7 PRO CB C -5.497 -5.250 -0.626 1.00 . A A . 7 PRO CB 1 1 14 3063 1 1 7 PRO CD C -6.407 -3.035 -0.676 1.00 . A A . 7 PRO CD 1 1 14 3064 1 1 7 PRO CG C -6.555 -4.388 -0.031 1.00 . A A . 7 PRO CG 1 1 14 3065 1 1 7 PRO HA H -3.686 -4.262 -0.032 1.00 . A A . 7 PRO HA 1 1 14 3066 1 1 7 PRO HB2 H -5.824 -5.696 -1.554 1.00 . A A . 7 PRO HB2 1 1 14 3067 1 1 7 PRO HB3 H -5.184 -6.022 0.061 1.00 . A A . 7 PRO HB3 1 1 14 3068 1 1 7 PRO HD2 H -7.079 -2.943 -1.517 1.00 . A A . 7 PRO HD2 1 1 14 3069 1 1 7 PRO HD3 H -6.594 -2.254 0.045 1.00 . A A . 7 PRO HD3 1 1 14 3070 1 1 7 PRO HG2 H -7.529 -4.801 -0.247 1.00 . A A . 7 PRO HG2 1 1 14 3071 1 1 7 PRO HG3 H -6.408 -4.312 1.036 1.00 . A A . 7 PRO HG3 1 1 14 3072 1 1 7 PRO N N -5.000 -3.012 -1.122 1.00 . A A . 7 PRO N 1 1 14 3073 1 1 7 PRO O O -4.093 -5.025 -3.173 1.00 . A A . 7 PRO O 1 1 14 3074 1 1 8 ASP C C -0.380 -6.391 -2.533 1.00 . A A . 8 ASP C 1 1 14 3075 1 1 8 ASP CA C -1.341 -5.308 -3.017 1.00 . A A . 8 ASP CA 1 1 14 3076 1 1 8 ASP CB C -0.562 -4.118 -3.590 1.00 . A A . 8 ASP CB 1 1 14 3077 1 1 8 ASP CG C 0.606 -3.692 -2.716 1.00 . A A . 8 ASP CG 1 1 14 3078 1 1 8 ASP H H -1.829 -4.651 -1.065 1.00 . A A . 8 ASP H 1 1 14 3079 1 1 8 ASP HA H -1.964 -5.724 -3.796 1.00 . A A . 8 ASP HA 1 1 14 3080 1 1 8 ASP HB2 H -0.176 -4.385 -4.562 1.00 . A A . 8 ASP HB2 1 1 14 3081 1 1 8 ASP HB3 H -1.232 -3.277 -3.696 1.00 . A A . 8 ASP HB3 1 1 14 3082 1 1 8 ASP N N -2.218 -4.870 -1.938 1.00 . A A . 8 ASP N 1 1 14 3083 1 1 8 ASP O O -0.187 -7.408 -3.200 1.00 . A A . 8 ASP O 1 1 14 3084 1 1 8 ASP OD1 O 1.754 -4.045 -2.984 1.00 . A A . 8 ASP OD1 1 1 14 3085 1 1 9 VAL C C 1.220 -6.980 0.726 1.00 . A A . 9 VAL C 1 1 14 3086 1 1 9 VAL CA C 1.158 -7.120 -0.794 1.00 . A A . 9 VAL CA 1 1 14 3087 1 1 9 VAL CB C 2.571 -6.940 -1.384 1.00 . A A . 9 VAL CB 1 1 14 3088 1 1 9 VAL CG1 C 3.118 -5.558 -1.060 1.00 . A A . 9 VAL CG1 1 1 14 3089 1 1 9 VAL CG2 C 3.507 -8.027 -0.876 1.00 . A A . 9 VAL CG2 1 1 14 3090 1 1 9 VAL H H 0.023 -5.336 -0.884 1.00 . A A . 9 VAL H 1 1 14 3091 1 1 9 VAL HA H 0.812 -8.115 -1.039 1.00 . A A . 9 VAL HA 1 1 14 3092 1 1 9 VAL HB H 2.502 -7.030 -2.459 1.00 . A A . 9 VAL HB 1 1 14 3093 1 1 9 VAL HG11 H 2.302 -4.899 -0.802 1.00 . A A . 9 VAL HG11 1 1 14 3094 1 1 9 VAL HG12 H 3.639 -5.166 -1.921 1.00 . A A . 9 VAL HG12 1 1 14 3095 1 1 9 VAL HG13 H 3.801 -5.628 -0.226 1.00 . A A . 9 VAL HG13 1 1 14 3096 1 1 9 VAL HG21 H 4.055 -7.660 -0.021 1.00 . A A . 9 VAL HG21 1 1 14 3097 1 1 9 VAL HG22 H 4.200 -8.299 -1.658 1.00 . A A . 9 VAL HG22 1 1 14 3098 1 1 9 VAL HG23 H 2.930 -8.894 -0.589 1.00 . A A . 9 VAL HG23 1 1 14 3099 1 1 9 VAL N N 0.218 -6.166 -1.368 1.00 . A A . 9 VAL N 1 1 14 3100 1 1 9 VAL O O 2.300 -6.947 1.316 1.00 . A A . 9 VAL O 1 1 14 3101 1 1 10 GLY C C -1.357 -6.245 3.267 1.00 . A A . 10 GLY C 1 1 14 3102 1 1 10 GLY CA C -0.011 -6.758 2.795 1.00 . A A . 10 GLY CA 1 1 14 3103 1 1 10 GLY H H -0.777 -6.926 0.829 1.00 . A A . 10 GLY H 1 1 14 3104 1 1 10 GLY HA2 H 0.173 -7.722 3.246 1.00 . A A . 10 GLY HA2 1 1 14 3105 1 1 10 GLY HA3 H 0.757 -6.070 3.114 1.00 . A A . 10 GLY HA3 1 1 14 3106 1 1 10 GLY N N 0.051 -6.896 1.352 1.00 . A A . 10 GLY N 1 1 14 3107 1 1 10 GLY O O -2.333 -6.992 3.311 1.00 . A A . 10 GLY O 1 1 14 3108 1 1 11 ASP C C -3.188 -3.362 3.058 1.00 . A A . 11 ASP C 1 1 14 3109 1 1 11 ASP CA C -2.647 -4.351 4.087 1.00 . A A . 11 ASP CA 1 1 14 3110 1 1 11 ASP CB C -2.423 -3.643 5.425 1.00 . A A . 11 ASP CB 1 1 14 3111 1 1 11 ASP CG C -1.606 -4.476 6.394 1.00 . A A . 11 ASP CG 1 1 14 3112 1 1 11 ASP H H -0.597 -4.418 3.560 1.00 . A A . 11 ASP H 1 1 14 3113 1 1 11 ASP HA H -3.373 -5.138 4.225 1.00 . A A . 11 ASP HA 1 1 14 3114 1 1 11 ASP HB2 H -1.903 -2.713 5.252 1.00 . A A . 11 ASP HB2 1 1 14 3115 1 1 11 ASP HB3 H -3.381 -3.434 5.879 1.00 . A A . 11 ASP HB3 1 1 14 3116 1 1 11 ASP N N -1.409 -4.964 3.619 1.00 . A A . 11 ASP N 1 1 14 3117 1 1 11 ASP O O -4.391 -3.103 3.006 1.00 . A A . 11 ASP O 1 1 14 3118 1 1 11 ASP OD1 O -0.361 -4.458 6.289 1.00 . A A . 11 ASP OD1 1 1 14 3119 1 1 11 ASP OD2 O -2.211 -5.147 7.256 1.00 . A A . 11 ASP OD2 1 1 14 3120 1 1 12 GLY C C -1.560 -0.994 0.740 1.00 . A A . 12 GLY C 1 1 14 3121 1 1 12 GLY CA C -2.705 -1.862 1.225 1.00 . A A . 12 GLY CA 1 1 14 3122 1 1 12 GLY H H -1.349 -3.057 2.326 1.00 . A A . 12 GLY H 1 1 14 3123 1 1 12 GLY HA2 H -3.111 -2.404 0.385 1.00 . A A . 12 GLY HA2 1 1 14 3124 1 1 12 GLY HA3 H -3.476 -1.226 1.635 1.00 . A A . 12 GLY HA3 1 1 14 3125 1 1 12 GLY N N -2.295 -2.813 2.240 1.00 . A A . 12 GLY N 1 1 14 3126 1 1 12 GLY O O -0.524 -0.897 1.397 1.00 . A A . 12 GLY O 1 1 14 3127 1 1 13 ARG C C -1.076 1.979 -0.758 1.00 . A A . 13 ARG C 1 1 14 3128 1 1 13 ARG CA C -0.730 0.510 -0.987 1.00 . A A . 13 ARG CA 1 1 14 3129 1 1 13 ARG CB C -0.584 0.236 -2.487 1.00 . A A . 13 ARG CB 1 1 14 3130 1 1 13 ARG CD C 1.277 0.978 -4.011 1.00 . A A . 13 ARG CD 1 1 14 3131 1 1 13 ARG CG C 0.854 0.000 -2.926 1.00 . A A . 13 ARG CG 1 1 14 3132 1 1 13 ARG CZ C -0.018 0.213 -5.963 1.00 . A A . 13 ARG CZ 1 1 14 3133 1 1 13 ARG H H -2.598 -0.474 -0.886 1.00 . A A . 13 ARG H 1 1 14 3134 1 1 13 ARG HA H 0.207 0.292 -0.497 1.00 . A A . 13 ARG HA 1 1 14 3135 1 1 13 ARG HB2 H -1.161 -0.642 -2.737 1.00 . A A . 13 ARG HB2 1 1 14 3136 1 1 13 ARG HB3 H -0.973 1.080 -3.037 1.00 . A A . 13 ARG HB3 1 1 14 3137 1 1 13 ARG HD2 H 1.467 1.939 -3.558 1.00 . A A . 13 ARG HD2 1 1 14 3138 1 1 13 ARG HD3 H 2.184 0.613 -4.471 1.00 . A A . 13 ARG HD3 1 1 14 3139 1 1 13 ARG HE H -0.262 1.968 -5.045 1.00 . A A . 13 ARG HE 1 1 14 3140 1 1 13 ARG HG2 H 1.504 0.123 -2.074 1.00 . A A . 13 ARG HG2 1 1 14 3141 1 1 13 ARG HG3 H 0.942 -1.007 -3.307 1.00 . A A . 13 ARG HG3 1 1 14 3142 1 1 13 ARG HH11 H 1.375 -1.103 -5.314 1.00 . A A . 13 ARG HH11 1 1 14 3143 1 1 13 ARG HH12 H 0.450 -1.617 -6.684 1.00 . A A . 13 ARG HH12 1 1 14 3144 1 1 13 ARG HH21 H -1.480 1.293 -6.845 1.00 . A A . 13 ARG HH21 1 1 14 3145 1 1 13 ARG HH22 H -1.171 -0.257 -7.555 1.00 . A A . 13 ARG HH22 1 1 14 3146 1 1 13 ARG N N -1.750 -0.358 -0.412 1.00 . A A . 13 ARG N 1 1 14 3147 1 1 13 ARG NE N 0.252 1.133 -5.041 1.00 . A A . 13 ARG NE 1 1 14 3148 1 1 13 ARG NH1 N 0.658 -0.930 -5.989 1.00 . A A . 13 ARG NH1 1 1 14 3149 1 1 13 ARG NH2 N -0.968 0.434 -6.861 1.00 . A A . 13 ARG NH2 1 1 14 3150 1 1 13 ARG O O -2.174 2.304 -0.305 1.00 . A A . 13 ARG O 1 1 14 3151 1 1 14 ILE C C 0.384 5.085 -1.991 1.00 . A A . 14 ILE C 1 1 14 3152 1 1 14 ILE CA C -0.340 4.294 -0.906 1.00 . A A . 14 ILE CA 1 1 14 3153 1 1 14 ILE CB C 0.144 4.769 0.479 1.00 . A A . 14 ILE CB 1 1 14 3154 1 1 14 ILE CD1 C -1.611 6.614 0.535 1.00 . A A . 14 ILE CD1 1 1 14 3155 1 1 14 ILE CG1 C -0.146 6.261 0.666 1.00 . A A . 14 ILE CG1 1 1 14 3156 1 1 14 ILE CG2 C 1.629 4.487 0.647 1.00 . A A . 14 ILE CG2 1 1 14 3157 1 1 14 ILE H H 0.719 2.539 -1.433 1.00 . A A . 14 ILE H 1 1 14 3158 1 1 14 ILE HA H -1.400 4.489 -0.980 1.00 . A A . 14 ILE HA 1 1 14 3159 1 1 14 ILE HB H -0.390 4.210 1.232 1.00 . A A . 14 ILE HB 1 1 14 3160 1 1 14 ILE HD11 H -1.740 7.676 0.682 1.00 . A A . 14 ILE HD11 1 1 14 3161 1 1 14 ILE HD12 H -2.180 6.076 1.279 1.00 . A A . 14 ILE HD12 1 1 14 3162 1 1 14 ILE HD13 H -1.960 6.342 -0.451 1.00 . A A . 14 ILE HD13 1 1 14 3163 1 1 14 ILE HG12 H 0.180 6.563 1.650 1.00 . A A . 14 ILE HG12 1 1 14 3164 1 1 14 ILE HG13 H 0.400 6.823 -0.077 1.00 . A A . 14 ILE HG13 1 1 14 3165 1 1 14 ILE HG21 H 1.913 4.655 1.676 1.00 . A A . 14 ILE HG21 1 1 14 3166 1 1 14 ILE HG22 H 2.195 5.146 0.006 1.00 . A A . 14 ILE HG22 1 1 14 3167 1 1 14 ILE HG23 H 1.833 3.461 0.380 1.00 . A A . 14 ILE HG23 1 1 14 3168 1 1 14 ILE N N -0.134 2.860 -1.076 1.00 . A A . 14 ILE N 1 1 14 3169 1 1 14 ILE O O -0.177 6.011 -2.578 1.00 . A A . 14 ILE O 1 1 14 3170 1 1 15 LEU C C 2.758 4.445 -4.421 1.00 . A A . 15 LEU C 1 1 14 3171 1 1 15 LEU CA C 2.435 5.391 -3.267 1.00 . A A . 15 LEU CA 1 1 14 3172 1 1 15 LEU CB C 3.729 5.927 -2.648 1.00 . A A . 15 LEU CB 1 1 14 3173 1 1 15 LEU CD1 C 3.517 8.137 -3.811 1.00 . A A . 15 LEU CD1 1 1 14 3174 1 1 15 LEU CD2 C 2.786 7.906 -1.431 1.00 . A A . 15 LEU CD2 1 1 14 3175 1 1 15 LEU CG C 3.785 7.447 -2.483 1.00 . A A . 15 LEU CG 1 1 14 3176 1 1 15 LEU H H 2.027 3.971 -1.752 1.00 . A A . 15 LEU H 1 1 14 3177 1 1 15 LEU HA H 1.858 6.220 -3.648 1.00 . A A . 15 LEU HA 1 1 14 3178 1 1 15 LEU HB2 H 3.851 5.475 -1.674 1.00 . A A . 15 LEU HB2 1 1 14 3179 1 1 15 LEU HB3 H 4.557 5.626 -3.272 1.00 . A A . 15 LEU HB3 1 1 14 3180 1 1 15 LEU HD11 H 3.745 7.460 -4.621 1.00 . A A . 15 LEU HD11 1 1 14 3181 1 1 15 LEU HD12 H 4.139 9.017 -3.891 1.00 . A A . 15 LEU HD12 1 1 14 3182 1 1 15 LEU HD13 H 2.478 8.425 -3.864 1.00 . A A . 15 LEU HD13 1 1 14 3183 1 1 15 LEU HD21 H 2.977 7.388 -0.503 1.00 . A A . 15 LEU HD21 1 1 14 3184 1 1 15 LEU HD22 H 1.784 7.687 -1.766 1.00 . A A . 15 LEU HD22 1 1 14 3185 1 1 15 LEU HD23 H 2.890 8.970 -1.277 1.00 . A A . 15 LEU HD23 1 1 14 3186 1 1 15 LEU HG H 4.774 7.730 -2.153 1.00 . A A . 15 LEU HG 1 1 14 3187 1 1 15 LEU N N 1.634 4.715 -2.253 1.00 . A A . 15 LEU N 1 1 14 3188 1 1 15 LEU O O 3.368 3.394 -4.222 1.00 . A A . 15 LEU O 1 1 14 3189 1 1 16 ALA C C 3.657 4.633 -7.700 1.00 . A A . 16 ALA C 1 1 14 3190 1 1 16 ALA CA C 2.589 4.007 -6.809 1.00 . A A . 16 ALA CA 1 1 14 3191 1 1 16 ALA CB C 1.298 3.810 -7.589 1.00 . A A . 16 ALA CB 1 1 14 3192 1 1 16 ALA H H 1.862 5.672 -5.721 1.00 . A A . 16 ALA H 1 1 14 3193 1 1 16 ALA HA H 2.933 3.038 -6.479 1.00 . A A . 16 ALA HA 1 1 14 3194 1 1 16 ALA HB1 H 0.792 2.926 -7.230 1.00 . A A . 16 ALA HB1 1 1 14 3195 1 1 16 ALA HB2 H 1.525 3.693 -8.638 1.00 . A A . 16 ALA HB2 1 1 14 3196 1 1 16 ALA HB3 H 0.660 4.670 -7.452 1.00 . A A . 16 ALA HB3 1 1 14 3197 1 1 16 ALA N N 2.344 4.824 -5.626 1.00 . A A . 16 ALA N 1 1 14 3198 1 1 16 ALA O O 3.632 4.474 -8.920 1.00 . A A . 16 ALA O 1 1 14 3199 1 1 17 GLY C C 5.160 7.147 -8.670 1.00 . A A . 17 GLY C 1 1 14 3200 1 1 17 GLY CA C 5.657 5.982 -7.836 1.00 . A A . 17 GLY CA 1 1 14 3201 1 1 17 GLY H H 4.564 5.437 -6.107 1.00 . A A . 17 GLY H 1 1 14 3202 1 1 17 GLY HA2 H 6.407 6.342 -7.147 1.00 . A A . 17 GLY HA2 1 1 14 3203 1 1 17 GLY HA3 H 6.107 5.251 -8.491 1.00 . A A . 17 GLY HA3 1 1 14 3204 1 1 17 GLY N N 4.594 5.345 -7.082 1.00 . A A . 17 GLY N 1 1 14 3205 1 1 17 GLY O O 4.642 8.120 -8.082 1.00 . A A . 17 GLY O 1 1 14 3206 1 1 17 GLY OXT O 5.289 7.086 -9.911 1.00 . A A . 17 GLY OXT 1 1 15 3207 1 1 1 GLY C C 1.060 -3.302 1.772 1.00 . A A . 1 GLY C 1 1 15 3208 1 1 1 GLY CA C 1.864 -2.899 0.549 1.00 . A A . 1 GLY CA 1 1 15 3209 1 1 1 GLY H1 H 0.824 -2.071 -0.751 1.00 . A A . 1 GLY H1 1 1 15 3210 1 1 1 GLY HA2 H 2.733 -3.537 0.480 1.00 . A A . 1 GLY HA2 1 1 15 3211 1 1 1 GLY HA3 H 2.191 -1.877 0.669 1.00 . A A . 1 GLY HA3 1 1 15 3212 1 1 1 GLY N N 1.104 -3.008 -0.684 1.00 . A A . 1 GLY N 1 1 15 3213 1 1 1 GLY O O -0.090 -3.724 1.650 1.00 . A A . 1 GLY O 1 1 15 3214 1 1 2 PRO C C -0.072 -2.504 4.650 1.00 . A A . 2 PRO C 1 1 15 3215 1 1 2 PRO CA C 0.968 -3.546 4.222 1.00 . A A . 2 PRO CA 1 1 15 3216 1 1 2 PRO CB C 2.114 -3.644 5.231 1.00 . A A . 2 PRO CB 1 1 15 3217 1 1 2 PRO CD C 3.018 -2.693 3.212 1.00 . A A . 2 PRO CD 1 1 15 3218 1 1 2 PRO CG C 3.170 -2.726 4.711 1.00 . A A . 2 PRO CG 1 1 15 3219 1 1 2 PRO HA H 0.485 -4.508 4.135 1.00 . A A . 2 PRO HA 1 1 15 3220 1 1 2 PRO HB2 H 1.766 -3.334 6.206 1.00 . A A . 2 PRO HB2 1 1 15 3221 1 1 2 PRO HB3 H 2.469 -4.662 5.278 1.00 . A A . 2 PRO HB3 1 1 15 3222 1 1 2 PRO HD2 H 3.131 -1.684 2.845 1.00 . A A . 2 PRO HD2 1 1 15 3223 1 1 2 PRO HD3 H 3.743 -3.345 2.747 1.00 . A A . 2 PRO HD3 1 1 15 3224 1 1 2 PRO HG2 H 3.031 -1.737 5.120 1.00 . A A . 2 PRO HG2 1 1 15 3225 1 1 2 PRO HG3 H 4.145 -3.105 4.978 1.00 . A A . 2 PRO HG3 1 1 15 3226 1 1 2 PRO N N 1.646 -3.184 2.977 1.00 . A A . 2 PRO N 1 1 15 3227 1 1 2 PRO O O -1.233 -2.588 4.255 1.00 . A A . 2 PRO O 1 1 15 3228 1 1 3 LYS C C -0.582 0.705 4.969 1.00 . A A . 3 LYS C 1 1 15 3229 1 1 3 LYS CA C -0.577 -0.489 5.920 1.00 . A A . 3 LYS CA 1 1 15 3230 1 1 3 LYS CB C -0.192 -0.032 7.328 1.00 . A A . 3 LYS CB 1 1 15 3231 1 1 3 LYS CD C -1.048 0.309 9.665 1.00 . A A . 3 LYS CD 1 1 15 3232 1 1 3 LYS CE C -0.627 1.670 10.194 1.00 . A A . 3 LYS CE 1 1 15 3233 1 1 3 LYS CG C -1.383 0.367 8.184 1.00 . A A . 3 LYS CG 1 1 15 3234 1 1 3 LYS H H 1.271 -1.502 5.748 1.00 . A A . 3 LYS H 1 1 15 3235 1 1 3 LYS HA H -1.569 -0.914 5.949 1.00 . A A . 3 LYS HA 1 1 15 3236 1 1 3 LYS HB2 H 0.329 -0.836 7.826 1.00 . A A . 3 LYS HB2 1 1 15 3237 1 1 3 LYS HB3 H 0.469 0.819 7.249 1.00 . A A . 3 LYS HB3 1 1 15 3238 1 1 3 LYS HD2 H -1.920 -0.023 10.209 1.00 . A A . 3 LYS HD2 1 1 15 3239 1 1 3 LYS HD3 H -0.239 -0.392 9.814 1.00 . A A . 3 LYS HD3 1 1 15 3240 1 1 3 LYS HE2 H -0.163 2.226 9.393 1.00 . A A . 3 LYS HE2 1 1 15 3241 1 1 3 LYS HE3 H -1.506 2.197 10.535 1.00 . A A . 3 LYS HE3 1 1 15 3242 1 1 3 LYS HG2 H -1.674 1.375 7.930 1.00 . A A . 3 LYS HG2 1 1 15 3243 1 1 3 LYS HG3 H -2.201 -0.309 7.982 1.00 . A A . 3 LYS HG3 1 1 15 3244 1 1 3 LYS HZ1 H -0.176 1.507 12.227 1.00 . A A . 3 LYS HZ1 1 1 15 3245 1 1 3 LYS HZ2 H 0.970 2.377 11.339 1.00 . A A . 3 LYS HZ2 1 1 15 3246 1 1 3 LYS HZ3 H 0.909 0.691 11.217 1.00 . A A . 3 LYS HZ3 1 1 15 3247 1 1 3 LYS N N 0.338 -1.527 5.457 1.00 . A A . 3 LYS N 1 1 15 3248 1 1 3 LYS NZ N 0.336 1.553 11.323 1.00 . A A . 3 LYS NZ 1 1 15 3249 1 1 3 LYS O O 0.158 1.668 5.168 1.00 . A A . 3 LYS O 1 1 15 3250 1 1 4 GLY C C -2.926 2.062 2.595 1.00 . A A . 4 GLY C 1 1 15 3251 1 1 4 GLY CA C -1.498 1.727 2.981 1.00 . A A . 4 GLY CA 1 1 15 3252 1 1 4 GLY H H -1.988 -0.151 3.826 1.00 . A A . 4 GLY H 1 1 15 3253 1 1 4 GLY HA2 H -1.039 2.604 3.412 1.00 . A A . 4 GLY HA2 1 1 15 3254 1 1 4 GLY HA3 H -0.952 1.449 2.092 1.00 . A A . 4 GLY HA3 1 1 15 3255 1 1 4 GLY N N -1.419 0.639 3.938 1.00 . A A . 4 GLY N 1 1 15 3256 1 1 4 GLY O O -3.615 2.792 3.308 1.00 . A A . 4 GLY O 1 1 15 3257 1 1 5 ASP C C -5.032 0.874 -0.220 1.00 . A A . 5 ASP C 1 1 15 3258 1 1 5 ASP CA C -4.721 1.770 0.975 1.00 . A A . 5 ASP CA 1 1 15 3259 1 1 5 ASP CB C -4.890 3.241 0.587 1.00 . A A . 5 ASP CB 1 1 15 3260 1 1 5 ASP CG C -5.737 4.009 1.583 1.00 . A A . 5 ASP CG 1 1 15 3261 1 1 5 ASP H H -2.769 0.955 0.942 1.00 . A A . 5 ASP H 1 1 15 3262 1 1 5 ASP HA H -5.408 1.536 1.773 1.00 . A A . 5 ASP HA 1 1 15 3263 1 1 5 ASP HB2 H -3.918 3.707 0.535 1.00 . A A . 5 ASP HB2 1 1 15 3264 1 1 5 ASP HB3 H -5.365 3.301 -0.382 1.00 . A A . 5 ASP HB3 1 1 15 3265 1 1 5 ASP N N -3.368 1.528 1.463 1.00 . A A . 5 ASP N 1 1 15 3266 1 1 5 ASP O O -6.149 0.376 -0.363 1.00 . A A . 5 ASP O 1 1 15 3267 1 1 5 ASP OD1 O -6.214 5.109 1.233 1.00 . A A . 5 ASP OD1 1 1 15 3268 1 1 5 ASP OD2 O -5.925 3.510 2.713 1.00 . A A . 5 ASP OD2 1 1 15 3269 1 1 6 PHE C C -3.486 -1.511 -2.053 1.00 . A A . 6 PHE C 1 1 15 3270 1 1 6 PHE CA C -4.191 -0.171 -2.253 1.00 . A A . 6 PHE CA 1 1 15 3271 1 1 6 PHE CB C -3.629 0.536 -3.488 1.00 . A A . 6 PHE CB 1 1 15 3272 1 1 6 PHE CD1 C -3.369 2.964 -4.064 1.00 . A A . 6 PHE CD1 1 1 15 3273 1 1 6 PHE CD2 C -5.550 2.152 -3.542 1.00 . A A . 6 PHE CD2 1 1 15 3274 1 1 6 PHE CE1 C -3.884 4.231 -4.263 1.00 . A A . 6 PHE CE1 1 1 15 3275 1 1 6 PHE CE2 C -6.071 3.417 -3.739 1.00 . A A . 6 PHE CE2 1 1 15 3276 1 1 6 PHE CG C -4.194 1.912 -3.702 1.00 . A A . 6 PHE CG 1 1 15 3277 1 1 6 PHE CZ C -5.237 4.457 -4.100 1.00 . A A . 6 PHE CZ 1 1 15 3278 1 1 6 PHE H H -3.167 1.091 -0.898 1.00 . A A . 6 PHE H 1 1 15 3279 1 1 6 PHE HA H -5.246 -0.347 -2.397 1.00 . A A . 6 PHE HA 1 1 15 3280 1 1 6 PHE HB2 H -2.559 0.630 -3.384 1.00 . A A . 6 PHE HB2 1 1 15 3281 1 1 6 PHE HB3 H -3.851 -0.056 -4.364 1.00 . A A . 6 PHE HB3 1 1 15 3282 1 1 6 PHE HD1 H -2.311 2.788 -4.192 1.00 . A A . 6 PHE HD1 1 1 15 3283 1 1 6 PHE HD2 H -6.202 1.339 -3.260 1.00 . A A . 6 PHE HD2 1 1 15 3284 1 1 6 PHE HE1 H -3.230 5.043 -4.544 1.00 . A A . 6 PHE HE1 1 1 15 3285 1 1 6 PHE HE2 H -7.129 3.591 -3.611 1.00 . A A . 6 PHE HE2 1 1 15 3286 1 1 6 PHE HZ H -5.643 5.446 -4.255 1.00 . A A . 6 PHE HZ 1 1 15 3287 1 1 6 PHE N N -4.033 0.669 -1.071 1.00 . A A . 6 PHE N 1 1 15 3288 1 1 6 PHE O O -2.274 -1.615 -2.243 1.00 . A A . 6 PHE O 1 1 15 3289 1 1 7 PRO C C -2.646 -4.299 -2.466 1.00 . A A . 7 PRO C 1 1 15 3290 1 1 7 PRO CA C -3.681 -3.892 -1.421 1.00 . A A . 7 PRO CA 1 1 15 3291 1 1 7 PRO CB C -4.912 -4.788 -1.509 1.00 . A A . 7 PRO CB 1 1 15 3292 1 1 7 PRO CD C -5.691 -2.518 -1.400 1.00 . A A . 7 PRO CD 1 1 15 3293 1 1 7 PRO CG C -6.029 -3.936 -1.010 1.00 . A A . 7 PRO CG 1 1 15 3294 1 1 7 PRO HA H -3.246 -3.971 -0.436 1.00 . A A . 7 PRO HA 1 1 15 3295 1 1 7 PRO HB2 H -5.070 -5.090 -2.534 1.00 . A A . 7 PRO HB2 1 1 15 3296 1 1 7 PRO HB3 H -4.773 -5.660 -0.887 1.00 . A A . 7 PRO HB3 1 1 15 3297 1 1 7 PRO HD2 H -6.231 -2.235 -2.291 1.00 . A A . 7 PRO HD2 1 1 15 3298 1 1 7 PRO HD3 H -5.920 -1.841 -0.589 1.00 . A A . 7 PRO HD3 1 1 15 3299 1 1 7 PRO HG2 H -6.956 -4.240 -1.473 1.00 . A A . 7 PRO HG2 1 1 15 3300 1 1 7 PRO HG3 H -6.102 -4.021 0.064 1.00 . A A . 7 PRO HG3 1 1 15 3301 1 1 7 PRO N N -4.237 -2.557 -1.657 1.00 . A A . 7 PRO N 1 1 15 3302 1 1 7 PRO O O -2.979 -4.530 -3.628 1.00 . A A . 7 PRO O 1 1 15 3303 1 1 8 ASP C C 0.324 -6.091 -2.502 1.00 . A A . 8 ASP C 1 1 15 3304 1 1 8 ASP CA C -0.303 -4.768 -2.938 1.00 . A A . 8 ASP CA 1 1 15 3305 1 1 8 ASP CB C 0.758 -3.662 -2.993 1.00 . A A . 8 ASP CB 1 1 15 3306 1 1 8 ASP CG C 1.630 -3.606 -1.749 1.00 . A A . 8 ASP CG 1 1 15 3307 1 1 8 ASP H H -1.186 -4.192 -1.102 1.00 . A A . 8 ASP H 1 1 15 3308 1 1 8 ASP HA H -0.724 -4.896 -3.924 1.00 . A A . 8 ASP HA 1 1 15 3309 1 1 8 ASP HB2 H 1.398 -3.831 -3.846 1.00 . A A . 8 ASP HB2 1 1 15 3310 1 1 8 ASP HB3 H 0.264 -2.707 -3.106 1.00 . A A . 8 ASP HB3 1 1 15 3311 1 1 8 ASP N N -1.388 -4.387 -2.041 1.00 . A A . 8 ASP N 1 1 15 3312 1 1 8 ASP O O 0.535 -6.987 -3.319 1.00 . A A . 8 ASP O 1 1 15 3313 1 1 8 ASP OD1 O 2.762 -4.089 -1.752 1.00 . A A . 8 ASP OD1 1 1 15 3314 1 1 9 VAL C C 0.904 -7.556 0.825 1.00 . A A . 9 VAL C 1 1 15 3315 1 1 9 VAL CA C 1.213 -7.420 -0.664 1.00 . A A . 9 VAL CA 1 1 15 3316 1 1 9 VAL CB C 2.742 -7.440 -0.868 1.00 . A A . 9 VAL CB 1 1 15 3317 1 1 9 VAL CG1 C 3.323 -8.777 -0.432 1.00 . A A . 9 VAL CG1 1 1 15 3318 1 1 9 VAL CG2 C 3.096 -7.150 -2.318 1.00 . A A . 9 VAL CG2 1 1 15 3319 1 1 9 VAL H H 0.420 -5.458 -0.608 1.00 . A A . 9 VAL H 1 1 15 3320 1 1 9 VAL HA H 0.789 -8.264 -1.188 1.00 . A A . 9 VAL HA 1 1 15 3321 1 1 9 VAL HB H 3.178 -6.667 -0.251 1.00 . A A . 9 VAL HB 1 1 15 3322 1 1 9 VAL HG11 H 3.652 -8.710 0.594 1.00 . A A . 9 VAL HG11 1 1 15 3323 1 1 9 VAL HG12 H 4.163 -9.028 -1.063 1.00 . A A . 9 VAL HG12 1 1 15 3324 1 1 9 VAL HG13 H 2.566 -9.543 -0.518 1.00 . A A . 9 VAL HG13 1 1 15 3325 1 1 9 VAL HG21 H 4.161 -7.260 -2.458 1.00 . A A . 9 VAL HG21 1 1 15 3326 1 1 9 VAL HG22 H 2.804 -6.140 -2.565 1.00 . A A . 9 VAL HG22 1 1 15 3327 1 1 9 VAL HG23 H 2.574 -7.843 -2.962 1.00 . A A . 9 VAL HG23 1 1 15 3328 1 1 9 VAL N N 0.615 -6.206 -1.210 1.00 . A A . 9 VAL N 1 1 15 3329 1 1 9 VAL O O 1.768 -7.927 1.620 1.00 . A A . 9 VAL O 1 1 15 3330 1 1 10 GLY C C -2.099 -6.731 2.842 1.00 . A A . 10 GLY C 1 1 15 3331 1 1 10 GLY CA C -0.737 -7.347 2.587 1.00 . A A . 10 GLY CA 1 1 15 3332 1 1 10 GLY H H -0.983 -6.962 0.520 1.00 . A A . 10 GLY H 1 1 15 3333 1 1 10 GLY HA2 H -0.766 -8.389 2.872 1.00 . A A . 10 GLY HA2 1 1 15 3334 1 1 10 GLY HA3 H -0.004 -6.839 3.197 1.00 . A A . 10 GLY HA3 1 1 15 3335 1 1 10 GLY N N -0.336 -7.253 1.196 1.00 . A A . 10 GLY N 1 1 15 3336 1 1 10 GLY O O -3.105 -7.438 2.902 1.00 . A A . 10 GLY O 1 1 15 3337 1 1 11 ASP C C -3.550 -3.538 2.270 1.00 . A A . 11 ASP C 1 1 15 3338 1 1 11 ASP CA C -3.380 -4.701 3.243 1.00 . A A . 11 ASP CA 1 1 15 3339 1 1 11 ASP CB C -3.418 -4.189 4.686 1.00 . A A . 11 ASP CB 1 1 15 3340 1 1 11 ASP CG C -4.568 -4.779 5.478 1.00 . A A . 11 ASP CG 1 1 15 3341 1 1 11 ASP H H -1.295 -4.902 2.935 1.00 . A A . 11 ASP H 1 1 15 3342 1 1 11 ASP HA H -4.191 -5.398 3.097 1.00 . A A . 11 ASP HA 1 1 15 3343 1 1 11 ASP HB2 H -2.494 -4.452 5.179 1.00 . A A . 11 ASP HB2 1 1 15 3344 1 1 11 ASP HB3 H -3.523 -3.114 4.679 1.00 . A A . 11 ASP HB3 1 1 15 3345 1 1 11 ASP N N -2.131 -5.411 2.993 1.00 . A A . 11 ASP N 1 1 15 3346 1 1 11 ASP O O -4.624 -3.344 1.701 1.00 . A A . 11 ASP O 1 1 15 3347 1 1 11 ASP OD1 O -4.311 -5.371 6.547 1.00 . A A . 11 ASP OD1 1 1 15 3348 1 1 11 ASP OD2 O -5.726 -4.650 5.029 1.00 . A A . 11 ASP OD2 1 1 15 3349 1 1 12 GLY C C -1.198 -0.932 1.046 1.00 . A A . 12 GLY C 1 1 15 3350 1 1 12 GLY CA C -2.535 -1.635 1.180 1.00 . A A . 12 GLY CA 1 1 15 3351 1 1 12 GLY H H -1.653 -2.971 2.564 1.00 . A A . 12 GLY H 1 1 15 3352 1 1 12 GLY HA2 H -2.844 -1.982 0.207 1.00 . A A . 12 GLY HA2 1 1 15 3353 1 1 12 GLY HA3 H -3.265 -0.929 1.547 1.00 . A A . 12 GLY HA3 1 1 15 3354 1 1 12 GLY N N -2.483 -2.768 2.083 1.00 . A A . 12 GLY N 1 1 15 3355 1 1 12 GLY O O -0.368 -0.985 1.954 1.00 . A A . 12 GLY O 1 1 15 3356 1 1 13 ARG C C 0.072 1.948 -0.141 1.00 . A A . 13 ARG C 1 1 15 3357 1 1 13 ARG CA C 0.255 0.446 -0.340 1.00 . A A . 13 ARG CA 1 1 15 3358 1 1 13 ARG CB C 0.751 0.165 -1.761 1.00 . A A . 13 ARG CB 1 1 15 3359 1 1 13 ARG CD C 2.888 0.495 -3.046 1.00 . A A . 13 ARG CD 1 1 15 3360 1 1 13 ARG CG C 2.236 -0.152 -1.834 1.00 . A A . 13 ARG CG 1 1 15 3361 1 1 13 ARG CZ C 4.270 -1.276 -4.060 1.00 . A A . 13 ARG CZ 1 1 15 3362 1 1 13 ARG H H -1.691 -0.266 -0.774 1.00 . A A . 13 ARG H 1 1 15 3363 1 1 13 ARG HA H 0.991 0.089 0.365 1.00 . A A . 13 ARG HA 1 1 15 3364 1 1 13 ARG HB2 H 0.205 -0.678 -2.160 1.00 . A A . 13 ARG HB2 1 1 15 3365 1 1 13 ARG HB3 H 0.558 1.031 -2.376 1.00 . A A . 13 ARG HB3 1 1 15 3366 1 1 13 ARG HD2 H 2.212 1.233 -3.452 1.00 . A A . 13 ARG HD2 1 1 15 3367 1 1 13 ARG HD3 H 3.801 0.978 -2.732 1.00 . A A . 13 ARG HD3 1 1 15 3368 1 1 13 ARG HE H 2.585 -0.550 -4.844 1.00 . A A . 13 ARG HE 1 1 15 3369 1 1 13 ARG HG2 H 2.717 0.216 -0.941 1.00 . A A . 13 ARG HG2 1 1 15 3370 1 1 13 ARG HG3 H 2.362 -1.223 -1.897 1.00 . A A . 13 ARG HG3 1 1 15 3371 1 1 13 ARG HH11 H 4.971 -0.572 -2.298 1.00 . A A . 13 ARG HH11 1 1 15 3372 1 1 13 ARG HH12 H 5.926 -1.815 -3.034 1.00 . A A . 13 ARG HH12 1 1 15 3373 1 1 13 ARG HH21 H 3.839 -2.184 -5.813 1.00 . A A . 13 ARG HH21 1 1 15 3374 1 1 13 ARG HH22 H 5.285 -2.729 -5.030 1.00 . A A . 13 ARG HH22 1 1 15 3375 1 1 13 ARG N N -0.990 -0.271 -0.089 1.00 . A A . 13 ARG N 1 1 15 3376 1 1 13 ARG NE N 3.201 -0.482 -4.086 1.00 . A A . 13 ARG NE 1 1 15 3377 1 1 13 ARG NH1 N 5.126 -1.216 -3.047 1.00 . A A . 13 ARG NH1 1 1 15 3378 1 1 13 ARG NH2 N 4.482 -2.133 -5.049 1.00 . A A . 13 ARG NH2 1 1 15 3379 1 1 13 ARG O O -1.040 2.424 0.088 1.00 . A A . 13 ARG O 1 1 15 3380 1 1 14 ILE C C 1.911 4.836 -1.175 1.00 . A A . 14 ILE C 1 1 15 3381 1 1 14 ILE CA C 1.136 4.136 -0.064 1.00 . A A . 14 ILE CA 1 1 15 3382 1 1 14 ILE CB C 1.719 4.561 1.299 1.00 . A A . 14 ILE CB 1 1 15 3383 1 1 14 ILE CD1 C 1.908 3.802 3.721 1.00 . A A . 14 ILE CD1 1 1 15 3384 1 1 14 ILE CG1 C 1.144 3.693 2.420 1.00 . A A . 14 ILE CG1 1 1 15 3385 1 1 14 ILE CG2 C 1.437 6.034 1.562 1.00 . A A . 14 ILE CG2 1 1 15 3386 1 1 14 ILE H H 2.029 2.250 -0.418 1.00 . A A . 14 ILE H 1 1 15 3387 1 1 14 ILE HA H 0.104 4.451 -0.104 1.00 . A A . 14 ILE HA 1 1 15 3388 1 1 14 ILE HB H 2.790 4.427 1.264 1.00 . A A . 14 ILE HB 1 1 15 3389 1 1 14 ILE HD11 H 1.231 3.658 4.550 1.00 . A A . 14 ILE HD11 1 1 15 3390 1 1 14 ILE HD12 H 2.361 4.780 3.792 1.00 . A A . 14 ILE HD12 1 1 15 3391 1 1 14 ILE HD13 H 2.678 3.045 3.750 1.00 . A A . 14 ILE HD13 1 1 15 3392 1 1 14 ILE HG12 H 0.124 3.992 2.609 1.00 . A A . 14 ILE HG12 1 1 15 3393 1 1 14 ILE HG13 H 1.159 2.659 2.110 1.00 . A A . 14 ILE HG13 1 1 15 3394 1 1 14 ILE HG21 H 2.343 6.520 1.894 1.00 . A A . 14 ILE HG21 1 1 15 3395 1 1 14 ILE HG22 H 0.680 6.125 2.327 1.00 . A A . 14 ILE HG22 1 1 15 3396 1 1 14 ILE HG23 H 1.089 6.503 0.654 1.00 . A A . 14 ILE HG23 1 1 15 3397 1 1 14 ILE N N 1.172 2.688 -0.232 1.00 . A A . 14 ILE N 1 1 15 3398 1 1 14 ILE O O 2.505 5.894 -0.962 1.00 . A A . 14 ILE O 1 1 15 3399 1 1 15 LEU C C 1.708 4.830 -4.741 1.00 . A A . 15 LEU C 1 1 15 3400 1 1 15 LEU CA C 2.606 4.807 -3.508 1.00 . A A . 15 LEU CA 1 1 15 3401 1 1 15 LEU CB C 3.876 4.005 -3.802 1.00 . A A . 15 LEU CB 1 1 15 3402 1 1 15 LEU CD1 C 6.067 3.319 -2.797 1.00 . A A . 15 LEU CD1 1 1 15 3403 1 1 15 LEU CD2 C 5.836 5.566 -3.871 1.00 . A A . 15 LEU CD2 1 1 15 3404 1 1 15 LEU CG C 5.129 4.485 -3.067 1.00 . A A . 15 LEU CG 1 1 15 3405 1 1 15 LEU H H 1.412 3.398 -2.472 1.00 . A A . 15 LEU H 1 1 15 3406 1 1 15 LEU HA H 2.881 5.821 -3.259 1.00 . A A . 15 LEU HA 1 1 15 3407 1 1 15 LEU HB2 H 3.696 2.975 -3.531 1.00 . A A . 15 LEU HB2 1 1 15 3408 1 1 15 LEU HB3 H 4.069 4.052 -4.863 1.00 . A A . 15 LEU HB3 1 1 15 3409 1 1 15 LEU HD11 H 6.637 3.102 -3.688 1.00 . A A . 15 LEU HD11 1 1 15 3410 1 1 15 LEU HD12 H 5.491 2.450 -2.517 1.00 . A A . 15 LEU HD12 1 1 15 3411 1 1 15 LEU HD13 H 6.741 3.578 -1.994 1.00 . A A . 15 LEU HD13 1 1 15 3412 1 1 15 LEU HD21 H 5.167 6.402 -4.016 1.00 . A A . 15 LEU HD21 1 1 15 3413 1 1 15 LEU HD22 H 6.127 5.167 -4.832 1.00 . A A . 15 LEU HD22 1 1 15 3414 1 1 15 LEU HD23 H 6.714 5.895 -3.336 1.00 . A A . 15 LEU HD23 1 1 15 3415 1 1 15 LEU HG H 4.840 4.908 -2.116 1.00 . A A . 15 LEU HG 1 1 15 3416 1 1 15 LEU N N 1.903 4.240 -2.363 1.00 . A A . 15 LEU N 1 1 15 3417 1 1 15 LEU O O 0.754 4.059 -4.841 1.00 . A A . 15 LEU O 1 1 15 3418 1 1 16 ALA C C 2.152 6.012 -8.115 1.00 . A A . 16 ALA C 1 1 15 3419 1 1 16 ALA CA C 1.242 5.846 -6.903 1.00 . A A . 16 ALA CA 1 1 15 3420 1 1 16 ALA CB C 0.279 7.019 -6.799 1.00 . A A . 16 ALA CB 1 1 15 3421 1 1 16 ALA H H 2.792 6.308 -5.539 1.00 . A A . 16 ALA H 1 1 15 3422 1 1 16 ALA HA H 0.661 4.943 -7.023 1.00 . A A . 16 ALA HA 1 1 15 3423 1 1 16 ALA HB1 H 0.147 7.464 -7.774 1.00 . A A . 16 ALA HB1 1 1 15 3424 1 1 16 ALA HB2 H 0.681 7.755 -6.119 1.00 . A A . 16 ALA HB2 1 1 15 3425 1 1 16 ALA HB3 H -0.674 6.670 -6.430 1.00 . A A . 16 ALA HB3 1 1 15 3426 1 1 16 ALA N N 2.020 5.721 -5.677 1.00 . A A . 16 ALA N 1 1 15 3427 1 1 16 ALA O O 3.266 6.524 -8.003 1.00 . A A . 16 ALA O 1 1 15 3428 1 1 17 GLY C C 2.398 4.426 -11.333 1.00 . A A . 17 GLY C 1 1 15 3429 1 1 17 GLY CA C 2.453 5.686 -10.491 1.00 . A A . 17 GLY CA 1 1 15 3430 1 1 17 GLY H H 0.776 5.177 -9.304 1.00 . A A . 17 GLY H 1 1 15 3431 1 1 17 GLY HA2 H 2.077 6.512 -11.076 1.00 . A A . 17 GLY HA2 1 1 15 3432 1 1 17 GLY HA3 H 3.482 5.884 -10.228 1.00 . A A . 17 GLY HA3 1 1 15 3433 1 1 17 GLY N N 1.670 5.576 -9.275 1.00 . A A . 17 GLY N 1 1 15 3434 1 1 17 GLY O O 1.306 4.101 -11.844 1.00 . A A . 17 GLY O 1 1 15 3435 1 1 17 GLY OXT O 3.447 3.764 -11.481 1.00 . A A . 17 GLY OXT 1 1 stop_ save_
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