NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
397916 | 1t51 | 6220 | cing | 4-filtered-FRED | STAR | entry | full | 109 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1t51 # This FRED archive file contains, for PDB entry <1t51>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend, # JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with # curated sets of experimental NMR restraints for over 4,000 protein and nucleic # acid PDB entries. (in preparation) save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_1t51 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1t51 _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 1504.86 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 $Cytotoxic_linear_peptide_IsCT A . 1 1 stop_ save_ save_Cytotoxic_linear_peptide_IsCT _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Cytotoxic linear peptide IsCT" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code ILGKIWEGIKSLFX _Entity.Number_of_monomers 14 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 ILE . 1 1 2 LEU . 1 1 3 GLY . 1 1 4 LYS . 1 1 5 ILE . 1 1 6 TRP . 1 1 7 GLU . 1 1 8 GLY . 1 1 9 ILE . 1 1 10 LYS . 1 1 11 SER . 1 1 12 LEU . 1 1 13 PHE . 1 1 14 NH2 $NH2 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 ILE 1 1 1 1 LEU 2 2 1 1 GLY 3 3 1 1 LYS 4 4 1 1 ILE 5 5 1 1 TRP 6 6 1 1 GLU 7 7 1 1 GLY 8 8 1 1 ILE 9 9 1 1 LYS 10 10 1 1 SER 11 11 1 1 LEU 12 12 1 1 PHE 13 13 1 1 NH2 14 14 1 1 stop_ save_ save_NH2 _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID NH2 _Chem_comp.Type non-polymer save_ save_CNS/XPLOR_distance_constraints_3_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 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 2 LEU H . 2 . HN 1 1 1 1 2 1 1 3 GLY H . 3 . HN 1 1 2 1 1 1 1 3 GLY H . 3 . HN 1 1 2 1 2 1 1 4 LYS H . 4 . HN 1 1 3 1 1 1 1 4 LYS H . 4 . HN 1 1 3 1 2 1 1 5 ILE H . 5 . HN 1 1 4 1 1 1 1 5 ILE H . 5 . HN 1 1 4 1 2 1 1 6 TRP H . 6 . HN 1 1 5 1 1 1 1 6 TRP H . 6 . HN 1 1 5 1 2 1 1 7 GLU H . 7 . HN 1 1 6 1 1 1 1 7 GLU H . 7 . HN 1 1 6 1 2 1 1 8 GLY H . 8 . HN 1 1 7 1 1 1 1 8 GLY H . 8 . HN 1 1 7 1 2 1 1 9 ILE H . 9 . HN 1 1 8 1 1 1 1 9 ILE H . 9 . HN 1 1 8 1 2 1 1 10 LYS H . 10 . HN 1 1 9 1 1 1 1 10 LYS H . 10 . HN 1 1 9 1 2 1 1 11 SER H . 11 . HN 1 1 10 1 1 1 1 11 SER H . 11 . HN 1 1 10 1 2 1 1 12 LEU H . 12 . HN 1 1 11 1 1 1 1 12 LEU H . 12 . HN 1 1 11 1 2 1 1 13 PHE H . 13 . HN 1 1 12 1 1 1 1 3 GLY H . 3 . HN 1 1 12 1 2 1 1 5 ILE H . 5 . HN 1 1 13 1 1 1 1 4 LYS H . 4 . HN 1 1 13 1 2 1 1 6 TRP H . 6 . HN 1 1 14 1 1 1 1 5 ILE H . 5 . HN 1 1 14 1 2 1 1 7 GLU H . 7 . HN 1 1 15 1 1 1 1 6 TRP H . 6 . HN 1 1 15 1 2 1 1 8 GLY H . 8 . HN 1 1 16 1 1 1 1 7 GLU H . 7 . HN 1 1 16 1 2 1 1 9 ILE H . 9 . HN 1 1 17 1 1 1 1 9 ILE H . 9 . HN 1 1 17 1 2 1 1 11 SER H . 11 . HN 1 1 18 1 1 1 1 10 LYS H . 10 . HN 1 1 18 1 2 1 1 12 LEU H . 12 . HN 1 1 19 1 1 1 1 3 GLY H . 3 . HN 1 1 19 1 2 1 1 6 TRP H . 6 . HN 1 1 20 1 1 1 1 2 LEU HA . 2 . HA 1 1 20 1 2 1 1 3 GLY H . 3 . HN 1 1 21 1 1 1 1 3 GLY HA3 . 3 . HA1 1 1 21 1 2 1 1 4 LYS H . 4 . HN 1 1 22 1 1 1 1 3 GLY HA2 . 3 . HA2 1 1 22 1 2 1 1 4 LYS H . 4 . HN 1 1 23 1 1 1 1 4 LYS HA . 4 . HA 1 1 23 1 2 1 1 5 ILE H . 5 . HN 1 1 24 1 1 1 1 5 ILE HA . 5 . HA 1 1 24 1 2 1 1 6 TRP H . 6 . HN 1 1 25 1 1 1 1 6 TRP HA . 6 . HA 1 1 25 1 2 1 1 7 GLU H . 7 . HN 1 1 26 1 1 1 1 7 GLU HA . 7 . HA 1 1 26 1 2 1 1 8 GLY H . 8 . HN 1 1 27 1 1 1 1 8 GLY HA2 . 8 . HA1 1 1 27 1 2 1 1 9 ILE H . 9 . HN 1 1 28 1 1 1 1 8 GLY HA3 . 8 . HA2 1 1 28 1 2 1 1 9 ILE H . 9 . HN 1 1 29 1 1 1 1 9 ILE HA . 9 . HA 1 1 29 1 2 1 1 10 LYS H . 10 . HN 1 1 30 1 1 1 1 10 LYS HA . 10 . HA 1 1 30 1 2 1 1 11 SER H . 11 . HN 1 1 31 1 1 1 1 11 SER HA . 11 . HA 1 1 31 1 2 1 1 12 LEU H . 12 . HN 1 1 32 1 1 1 1 12 LEU HA . 12 . HA 1 1 32 1 2 1 1 13 PHE H . 13 . HN 1 1 33 1 1 1 1 11 SER H . 11 . HN 1 1 33 1 2 1 1 13 PHE H . 13 . HN 1 1 34 1 1 1 1 3 GLY HA3 . 3 . HA1 1 1 34 1 2 1 1 6 TRP H . 6 . HN 1 1 35 1 1 1 1 3 GLY HA2 . 3 . HA2 1 1 35 1 2 1 1 6 TRP H . 6 . HN 1 1 36 1 1 1 1 4 LYS HA . 4 . HA 1 1 36 1 2 1 1 7 GLU H . 7 . HN 1 1 37 1 1 1 1 5 ILE HA . 5 . HA 1 1 37 1 2 1 1 8 GLY H . 8 . HN 1 1 38 1 1 1 1 6 TRP HA . 6 . HA 1 1 38 1 2 1 1 9 ILE H . 9 . HN 1 1 39 1 1 1 1 8 GLY HA2 . 8 . HA1 1 1 39 1 2 1 1 11 SER H . 11 . HN 1 1 40 1 1 1 1 8 GLY HA3 . 8 . HA2 1 1 40 1 2 1 1 11 SER H . 11 . HN 1 1 41 1 1 1 1 9 ILE HA . 9 . HA 1 1 41 1 2 1 1 12 LEU H . 12 . HN 1 1 42 1 1 1 1 10 LYS HA . 10 . HA 1 1 42 1 2 1 1 13 PHE H . 13 . HN 1 1 43 1 1 1 1 3 GLY HA3 . 3 . HA1 1 1 43 1 2 1 1 7 GLU H . 7 . HN 1 1 44 1 1 1 1 3 GLY HA2 . 3 . HA2 1 1 44 1 2 1 1 7 GLU H . 7 . HN 1 1 45 1 1 1 1 6 TRP HA . 6 . HA 1 1 45 1 2 1 1 10 LYS H . 10 . HN 1 1 46 1 1 1 1 9 ILE HA . 9 . HA 1 1 46 1 2 1 1 13 PHE H . 13 . HN 1 1 47 1 1 1 1 2 LEU HB3 . 2 . HB1 1 1 47 1 2 1 1 3 GLY H . 3 . HN 1 1 48 1 1 1 1 4 LYS H . 4 . HN 1 1 48 1 2 1 1 5 ILE HB . 5 . HB 1 1 49 1 1 1 1 4 LYS HB2 . 4 . HB1 1 1 49 1 2 1 1 5 ILE H . 5 . HN 1 1 50 1 1 1 1 4 LYS HB3 . 4 . HB2 1 1 50 1 2 1 1 5 ILE H . 5 . HN 1 1 51 1 1 1 1 5 ILE HB . 5 . HB 1 1 51 1 2 1 1 6 TRP H . 6 . HN 1 1 52 1 1 1 1 5 ILE MG . 5 . HG21 1 1 52 1 2 1 1 6 TRP H . 6 . HN 1 1 53 1 1 1 1 6 TRP HB3 . 6 . HB1 1 1 53 1 2 1 1 7 GLU H . 7 . HN 1 1 54 1 1 1 1 6 TRP HD1 . 6 . HD1 1 1 54 1 2 1 1 7 GLU H . 7 . HN 1 1 55 1 1 1 1 7 GLU HB3 . 7 . HB1 1 1 55 1 2 1 1 8 GLY H . 8 . HN 1 1 56 1 1 1 1 7 GLU HB2 . 7 . HB2 1 1 56 1 2 1 1 8 GLY H . 8 . HN 1 1 57 1 1 1 1 9 ILE HB . 9 . HB 1 1 57 1 2 1 1 10 LYS H . 10 . HN 1 1 58 1 1 1 1 10 LYS HB3 . 10 . HB1 1 1 58 1 2 1 1 11 SER H . 11 . HN 1 1 59 1 1 1 1 10 LYS HB2 . 10 . HB2 1 1 59 1 2 1 1 11 SER H . 11 . HN 1 1 60 1 1 1 1 11 SER H . 11 . HN 1 1 60 1 2 1 1 12 LEU HB2 . 12 . HB2 1 1 61 1 1 1 1 11 SER HB3 . 11 . HB1 1 1 61 1 2 1 1 12 LEU H . 12 . HN 1 1 62 1 1 1 1 12 LEU HB3 . 12 . HB1 1 1 62 1 2 1 1 13 PHE H . 13 . HN 1 1 63 1 1 1 1 12 LEU HG . 12 . HG 1 1 63 1 2 1 1 13 PHE H . 13 . HN 1 1 64 1 1 1 1 7 GLU HG3 . 7 . HG2 1 1 64 1 2 1 1 8 GLY H . 8 . HN 1 1 65 1 1 1 1 9 ILE MD . 9 . HD13 1 1 65 1 2 1 1 10 LYS H . 10 . HN 1 1 66 1 1 1 1 5 ILE HG12 . 5 . HG12 1 1 66 1 2 1 1 6 TRP H . 6 . HN 1 1 67 1 1 1 1 9 ILE HB . 9 . HB 1 1 67 1 2 1 1 11 SER H . 11 . HN 1 1 68 1 1 1 1 3 GLY HA2 . 3 . HA2 1 1 68 1 2 1 1 6 TRP HB3 . 6 . HB1 1 1 69 1 1 1 1 9 ILE HA . 9 . HA 1 1 69 1 2 1 1 12 LEU MD1 . 12 . HD11 1 1 70 1 1 1 1 6 TRP HB2 . 6 . HB2 1 1 70 1 2 1 1 9 ILE MD . 9 . HD11 1 1 71 1 1 1 1 1 ILE HG13 . 1 . HG11 1 1 71 1 2 1 1 4 LYS HA . 4 . HA 1 1 72 1 1 1 1 7 GLU HA . 7 . HA 1 1 72 1 2 1 1 10 LYS HB3 . 10 . HB1 1 1 73 1 1 1 1 9 ILE HA . 9 . HA 1 1 73 1 2 1 1 12 LEU HB2 . 12 . HB2 1 1 74 1 1 1 1 6 TRP HB2 . 6 . HB2 1 1 74 1 2 1 1 9 ILE HG13 . 9 . HG11 1 1 75 1 1 1 1 6 TRP HB2 . 6 . HB2 1 1 75 1 2 1 1 9 ILE HB . 9 . HB 1 1 76 1 1 1 1 5 ILE HB . 5 . HB 1 1 76 1 2 1 1 6 TRP HB2 . 6 . HB2 1 1 77 1 1 1 1 6 TRP HE1 . 6 . HE1 1 1 77 1 2 1 1 7 GLU HA . 7 . HA 1 1 78 1 1 1 1 6 TRP HE3 . 6 . HE3 1 1 78 1 2 1 1 9 ILE HB . 9 . HB 1 1 79 1 1 1 1 6 TRP HE3 . 6 . HE3 1 1 79 1 2 1 1 9 ILE MD . 9 . HD11 1 1 80 1 1 1 1 3 GLY HA2 . 3 . HA2 1 1 80 1 2 1 1 6 TRP HD1 . 6 . HD1 1 1 81 1 1 1 1 4 LYS H . 4 . HN 1 1 81 1 2 1 1 4 LYS HB2 . 4 . HB1 1 1 82 1 1 1 1 4 LYS H . 4 . HN 1 1 82 1 2 1 1 4 LYS HB3 . 4 . HB2 1 1 83 1 1 1 1 4 LYS H . 4 . HN 1 1 83 1 2 1 1 4 LYS HG2 . 4 . HG1 1 1 84 1 1 1 1 4 LYS H . 4 . HN 1 1 84 1 2 1 1 4 LYS HD3 . 4 . HD2 1 1 85 1 1 1 1 5 ILE H . 5 . HN 1 1 85 1 2 1 1 5 ILE HB . 5 . HB 1 1 86 1 1 1 1 5 ILE H . 5 . HN 1 1 86 1 2 1 1 5 ILE HG12 . 5 . HG12 1 1 87 1 1 1 1 5 ILE H . 5 . HN 1 1 87 1 2 1 1 5 ILE HG13 . 5 . HG11 1 1 88 1 1 1 1 5 ILE H . 5 . HN 1 1 88 1 2 1 1 5 ILE MG . 5 . HG21 1 1 89 1 1 1 1 6 TRP HA . 6 . HA 1 1 89 1 2 1 1 6 TRP HZ3 . 6 . HZ3 1 1 90 1 1 1 1 6 TRP HA . 6 . HA 1 1 90 1 2 1 1 6 TRP HD1 . 6 . HD1 1 1 91 1 1 1 1 7 GLU H . 7 . HN 1 1 91 1 2 1 1 7 GLU HB3 . 7 . HB1 1 1 92 1 1 1 1 7 GLU H . 7 . HN 1 1 92 1 2 1 1 7 GLU HB2 . 7 . HB2 1 1 93 1 1 1 1 9 ILE H . 9 . HN 1 1 93 1 2 1 1 9 ILE HB . 9 . HB 1 1 94 1 1 1 1 9 ILE H . 9 . HN 1 1 94 1 2 1 1 9 ILE MG . 9 . HG23 1 1 95 1 1 1 1 9 ILE H . 9 . HN 1 1 95 1 2 1 1 9 ILE HG13 . 9 . HG11 1 1 96 1 1 1 1 10 LYS H . 10 . HN 1 1 96 1 2 1 1 10 LYS HB3 . 10 . HB1 1 1 97 1 1 1 1 10 LYS H . 10 . HN 1 1 97 1 2 1 1 10 LYS HG2 . 10 . HG1 1 1 98 1 1 1 1 10 LYS H . 10 . HN 1 1 98 1 2 1 1 10 LYS HD3 . 10 . HD2 1 1 99 1 1 1 1 12 LEU H . 12 . HN 1 1 99 1 2 1 1 12 LEU HG . 12 . HG 1 1 100 1 1 1 1 12 LEU H . 12 . HN 1 1 100 1 2 1 1 12 LEU MD1 . 12 . HD11 1 1 101 1 1 1 1 13 PHE H . 13 . HN 1 1 101 1 2 1 1 13 PHE HD1 . 13 . HD1 1 1 102 1 1 1 1 13 PHE HA . 13 . HA 1 1 102 1 2 1 1 13 PHE HE1 . 13 . HE1 1 1 103 1 1 1 1 13 PHE HA . 13 . HA 1 1 103 1 2 1 1 13 PHE HD1 . 13 . HD1 1 1 104 1 1 1 1 13 PHE HB2 . 13 . HB2 1 1 104 1 2 1 1 13 PHE HE1 . 13 . HE1 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 3.0 1.8 3.5 1 1 2 1 . . . . . 3.0 1.8 3.5 1 1 3 1 . . . . . 2.5 1.8 2.7 1 1 4 1 . . . . . 2.5 1.8 2.7 1 1 5 1 . . . . . 3.0 1.8 3.5 1 1 6 1 . . . . . 3.0 1.8 3.5 1 1 7 1 . . . . . 3.0 1.8 3.5 1 1 8 1 . . . . . 3.0 1.8 3.5 1 1 9 1 . . . . . 2.5 1.8 3.0 1 1 10 1 . . . . . 2.5 1.8 2.7 1 1 11 1 . . . . . 2.5 1.8 2.7 1 1 12 1 . . . . . 4.0 1.8 6.0 1 1 13 1 . . . . . 4.0 1.8 6.0 1 1 14 1 . . . . . 4.0 1.8 6.0 1 1 15 1 . . . . . 4.0 1.8 6.0 1 1 16 1 . . . . . 4.0 1.8 6.0 1 1 17 1 . . . . . 4.0 1.8 6.0 1 1 18 1 . . . . . 4.0 1.8 6.0 1 1 19 1 . . . . . 4.0 1.8 6.0 1 1 20 1 . . . . . 3.0 1.8 3.5 1 1 21 1 . . . . . 3.0 1.8 3.5 1 1 22 1 . . . . . 2.5 1.8 2.7 1 1 23 1 . . . . . 3.0 1.8 3.5 1 1 24 1 . . . . . 3.0 1.8 3.5 1 1 25 1 . . . . . 3.0 1.8 3.5 1 1 26 1 . . . . . 3.0 1.8 3.5 1 1 27 1 . . . . . 3.0 1.8 3.5 1 1 28 1 . . . . . 3.0 1.8 3.5 1 1 29 1 . . . . . 3.0 1.8 4.0 1 1 30 1 . . . . . 3.0 1.8 3.5 1 1 31 1 . . . . . 3.0 1.8 3.5 1 1 32 1 . . . . . 3.0 1.8 3.5 1 1 33 1 . . . . . 4.0 1.8 6.0 1 1 34 1 . . . . . 3.0 1.8 3.5 1 1 35 1 . . . . . 3.0 1.8 3.5 1 1 36 1 . . . . . 3.0 1.8 3.5 1 1 37 1 . . . . . 4.0 1.8 6.0 1 1 38 1 . . . . . 3.0 1.8 3.5 1 1 39 1 . . . . . 4.0 1.8 6.0 1 1 40 1 . . . . . 4.0 1.8 6.0 1 1 41 1 . . . . . 3.0 1.8 3.5 1 1 42 1 . . . . . 4.0 1.8 6.0 1 1 43 1 . . . . . 4.0 1.8 6.0 1 1 44 1 . . . . . 4.0 1.8 6.0 1 1 45 1 . . . . . 3.0 1.8 4.0 1 1 46 1 . . . . . 4.0 1.8 6.0 1 1 47 1 . . . . . 3.0 1.8 3.5 1 1 48 1 . . . . . 3.0 1.8 4.5 1 1 49 1 . . . . . 3.0 1.8 3.5 1 1 50 1 . . . . . 3.0 1.8 3.5 1 1 51 1 . . . . . 3.0 1.8 3.5 1 1 52 1 . . . . . 4.0 1.8 5.0 1 1 53 1 . . . . . 3.0 1.8 3.5 1 1 54 1 . . . . . 4.0 1.8 5.0 1 1 55 1 . . . . . 3.0 1.8 3.5 1 1 56 1 . . . . . 3.0 1.8 3.5 1 1 57 1 . . . . . 3.0 1.8 3.5 1 1 58 1 . . . . . 4.0 1.8 5.0 1 1 59 1 . . . . . 4.0 1.8 5.0 1 1 60 1 . . . . . 4.0 1.8 5.0 1 1 61 1 . . . . . 3.0 1.8 3.5 1 1 62 1 . . . . . 3.0 1.8 3.5 1 1 63 1 . . . . . 4.0 1.8 5.0 1 1 64 1 . . . . . 4.0 1.8 5.0 1 1 65 1 . . . . . 4.0 1.8 5.0 1 1 66 1 . . . . . 4.0 1.8 5.0 1 1 67 1 . . . . . 4.0 1.8 5.0 1 1 68 1 . . . . . 3.0 1.8 3.5 1 1 69 1 . . . . . 4.0 1.8 5.0 1 1 70 1 . . . . . 4.0 1.8 5.0 1 1 71 1 . . . . . 4.0 1.8 5.0 1 1 72 1 . . . . . 4.0 1.8 5.0 1 1 73 1 . . . . . 4.0 1.8 5.0 1 1 74 1 . . . . . 4.0 1.8 5.0 1 1 75 1 . . . . . 4.0 1.8 5.0 1 1 76 1 . . . . . 4.0 1.8 5.0 1 1 77 1 . . . . . 4.0 1.8 5.0 1 1 78 1 . . . . . 3.0 1.8 3.5 1 1 79 1 . . . . . 4.0 1.8 5.0 1 1 80 1 . . . . . 4.0 1.8 5.0 1 1 81 1 . . . . . 3.0 1.8 3.5 1 1 82 1 . . . . . 3.0 1.8 3.5 1 1 83 1 . . . . . 4.0 1.8 5.0 1 1 84 1 . . . . . 4.0 1.8 5.0 1 1 85 1 . . . . . 3.0 1.8 3.5 1 1 86 1 . . . . . 2.5 1.8 2.7 1 1 87 1 . . . . . 3.0 1.8 3.5 1 1 88 1 . . . . . 4.0 1.8 5.0 1 1 89 1 . . . . . 4.0 1.8 5.0 1 1 90 1 . . . . . 4.0 1.8 5.0 1 1 91 1 . . . . . 3.0 1.8 3.5 1 1 92 1 . . . . . 2.5 1.8 2.7 1 1 93 1 . . . . . 2.5 1.8 2.7 1 1 94 1 . . . . . 4.0 1.8 5.0 1 1 95 1 . . . . . 3.0 1.8 3.5 1 1 96 1 . . . . . 2.5 1.8 2.7 1 1 97 1 . . . . . 3.0 1.8 3.5 1 1 98 1 . . . . . 4.0 1.8 5.0 1 1 99 1 . . . . . 4.0 1.8 5.0 1 1 100 1 . . . . . 4.0 1.8 5.0 1 1 101 1 . . . . . 4.0 1.8 5.0 1 1 102 1 . . . . . 3.0 1.8 4.0 1 1 103 1 . . . . . 4.0 1.8 5.0 1 1 104 1 . . . . . 4.0 1.8 5.0 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 2 _Distance_constraint_list.Constraint_type "hydrogen bond" _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 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 5 ILE O . 5 . O 1 2 1 1 2 1 1 9 ILE N . 9 . N 1 2 2 1 1 1 1 6 TRP O . 6 . O 1 2 2 1 2 1 1 10 LYS N . 10 . N 1 2 3 1 1 1 1 7 GLU O . 7 . O 1 2 3 1 2 1 1 11 SER N . 11 . N 1 2 4 1 1 1 1 8 GLY O . 8 . O 1 2 4 1 2 1 1 12 LEU N . 12 . N 1 2 5 1 1 1 1 9 ILE O . 9 . O 1 2 5 1 2 1 1 13 PHE N . 13 . N 1 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 3.3 2.5 3.5 1 2 2 1 . . . . . 3.3 2.5 3.5 1 2 3 1 . . . . . 3.3 2.5 3.5 1 2 4 1 . . . . . 3.3 2.5 3.5 1 2 5 1 . . . . . 3.3 2.5 3.5 1 2 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 ILE C C -9.015 -3.076 2.468 1.00 . A A . 1 ILE C 1 1 1 2 1 1 1 ILE CA C -9.338 -3.595 1.065 1.00 . A A . 1 ILE CA 1 1 1 3 1 1 1 ILE CB C -9.357 -2.446 0.058 1.00 . A A . 1 ILE CB 1 1 1 4 1 1 1 ILE CD1 C -9.114 -4.230 -1.674 1.00 . A A . 1 ILE CD1 1 1 1 5 1 1 1 ILE CG1 C -9.871 -2.958 -1.290 1.00 . A A . 1 ILE CG1 1 1 1 6 1 1 1 ILE CG2 C -7.940 -1.894 -0.114 1.00 . A A . 1 ILE CG2 1 1 1 7 1 1 1 ILE H1 H -10.907 -4.668 1.919 1.00 . A A . 1 ILE H1 1 1 1 8 1 1 1 ILE H2 H -10.802 -4.822 0.230 1.00 . A A . 1 ILE H2 1 1 1 9 1 1 1 ILE H3 H -11.406 -3.392 0.919 1.00 . A A . 1 ILE H3 1 1 1 10 1 1 1 ILE HA H -8.617 -4.339 0.763 1.00 . A A . 1 ILE HA 1 1 1 11 1 1 1 ILE HB H -10.007 -1.662 0.419 1.00 . A A . 1 ILE HB 1 1 1 12 1 1 1 ILE HD11 H -9.697 -5.096 -1.394 1.00 . A A . 1 ILE HD11 1 1 1 13 1 1 1 ILE HD12 H -8.164 -4.254 -1.161 1.00 . A A . 1 ILE HD12 1 1 1 14 1 1 1 ILE HD13 H -8.946 -4.240 -2.742 1.00 . A A . 1 ILE HD13 1 1 1 15 1 1 1 ILE HG12 H -10.926 -3.176 -1.212 1.00 . A A . 1 ILE HG12 1 1 1 16 1 1 1 ILE HG13 H -9.713 -2.205 -2.046 1.00 . A A . 1 ILE HG13 1 1 1 17 1 1 1 ILE HG21 H -7.861 -0.944 0.392 1.00 . A A . 1 ILE HG21 1 1 1 18 1 1 1 ILE HG22 H -7.732 -1.760 -1.166 1.00 . A A . 1 ILE HG22 1 1 1 19 1 1 1 ILE HG23 H -7.230 -2.588 0.308 1.00 . A A . 1 ILE HG23 1 1 1 20 1 1 1 ILE N N -10.718 -4.162 1.031 1.00 . A A . 1 ILE N 1 1 1 21 1 1 1 ILE O O -9.557 -2.084 2.913 1.00 . A A . 1 ILE O 1 1 1 22 1 1 2 LEU C C -6.707 -2.190 4.475 1.00 . A A . 2 LEU C 1 1 1 23 1 1 2 LEU CA C -7.777 -3.282 4.542 1.00 . A A . 2 LEU CA 1 1 1 24 1 1 2 LEU CB C -7.232 -4.526 5.243 1.00 . A A . 2 LEU CB 1 1 1 25 1 1 2 LEU CD1 C -7.269 -5.861 7.354 1.00 . A A . 2 LEU CD1 1 1 1 26 1 1 2 LEU CD2 C -7.337 -3.365 7.452 1.00 . A A . 2 LEU CD2 1 1 1 27 1 1 2 LEU CG C -7.790 -4.597 6.665 1.00 . A A . 2 LEU CG 1 1 1 28 1 1 2 LEU H H -7.710 -4.536 2.792 1.00 . A A . 2 LEU H 1 1 1 29 1 1 2 LEU HA H -8.653 -2.922 5.060 1.00 . A A . 2 LEU HA 1 1 1 30 1 1 2 LEU HB2 H -7.529 -5.408 4.694 1.00 . A A . 2 LEU HB2 1 1 1 31 1 1 2 LEU HB3 H -6.154 -4.473 5.283 1.00 . A A . 2 LEU HB3 1 1 1 32 1 1 2 LEU HD11 H -6.743 -6.471 6.637 1.00 . A A . 2 LEU HD11 1 1 1 33 1 1 2 LEU HD12 H -8.100 -6.417 7.761 1.00 . A A . 2 LEU HD12 1 1 1 34 1 1 2 LEU HD13 H -6.597 -5.583 8.154 1.00 . A A . 2 LEU HD13 1 1 1 35 1 1 2 LEU HD21 H -7.467 -3.545 8.509 1.00 . A A . 2 LEU HD21 1 1 1 36 1 1 2 LEU HD22 H -7.928 -2.512 7.155 1.00 . A A . 2 LEU HD22 1 1 1 37 1 1 2 LEU HD23 H -6.295 -3.170 7.246 1.00 . A A . 2 LEU HD23 1 1 1 38 1 1 2 LEU HG H -8.869 -4.627 6.627 1.00 . A A . 2 LEU HG 1 1 1 39 1 1 2 LEU N N -8.135 -3.738 3.168 1.00 . A A . 2 LEU N 1 1 1 40 1 1 2 LEU O O -6.326 -1.618 5.476 1.00 . A A . 2 LEU O 1 1 1 41 1 1 3 GLY C C -4.955 -0.515 1.696 1.00 . A A . 3 GLY C 1 1 1 42 1 1 3 GLY CA C -5.170 -0.846 3.172 1.00 . A A . 3 GLY CA 1 1 1 43 1 1 3 GLY H H -6.537 -2.372 2.506 1.00 . A A . 3 GLY H 1 1 1 44 1 1 3 GLY HA2 H -5.486 0.044 3.698 1.00 . A A . 3 GLY HA2 1 1 1 45 1 1 3 GLY HA3 H -4.244 -1.204 3.593 1.00 . A A . 3 GLY HA3 1 1 1 46 1 1 3 GLY N N -6.217 -1.898 3.301 1.00 . A A . 3 GLY N 1 1 1 47 1 1 3 GLY O O -4.063 -1.033 1.056 1.00 . A A . 3 GLY O 1 1 1 48 1 1 4 LYS C C -4.320 1.536 -0.458 1.00 . A A . 4 LYS C 1 1 1 49 1 1 4 LYS CA C -5.598 0.721 -0.283 1.00 . A A . 4 LYS CA 1 1 1 50 1 1 4 LYS CB C -6.829 1.562 -0.623 1.00 . A A . 4 LYS CB 1 1 1 51 1 1 4 LYS CD C -5.933 1.525 -2.956 1.00 . A A . 4 LYS CD 1 1 1 52 1 1 4 LYS CE C -6.329 1.953 -4.370 1.00 . A A . 4 LYS CE 1 1 1 53 1 1 4 LYS CG C -7.189 1.370 -2.098 1.00 . A A . 4 LYS CG 1 1 1 54 1 1 4 LYS H H -6.472 0.763 1.687 1.00 . A A . 4 LYS H 1 1 1 55 1 1 4 LYS HA H -5.568 -0.160 -0.898 1.00 . A A . 4 LYS HA 1 1 1 56 1 1 4 LYS HB2 H -7.659 1.252 -0.005 1.00 . A A . 4 LYS HB2 1 1 1 57 1 1 4 LYS HB3 H -6.614 2.605 -0.441 1.00 . A A . 4 LYS HB3 1 1 1 58 1 1 4 LYS HD2 H -5.288 2.275 -2.518 1.00 . A A . 4 LYS HD2 1 1 1 59 1 1 4 LYS HD3 H -5.408 0.582 -3.001 1.00 . A A . 4 LYS HD3 1 1 1 60 1 1 4 LYS HE2 H -5.687 1.479 -5.099 1.00 . A A . 4 LYS HE2 1 1 1 61 1 1 4 LYS HE3 H -7.362 1.711 -4.562 1.00 . A A . 4 LYS HE3 1 1 1 62 1 1 4 LYS HG2 H -7.604 0.382 -2.239 1.00 . A A . 4 LYS HG2 1 1 1 63 1 1 4 LYS HG3 H -7.916 2.112 -2.390 1.00 . A A . 4 LYS HG3 1 1 1 64 1 1 4 LYS HZ1 H -5.166 3.652 -4.682 1.00 . A A . 4 LYS HZ1 1 1 1 65 1 1 4 LYS HZ2 H -6.314 3.817 -3.441 1.00 . A A . 4 LYS HZ2 1 1 1 66 1 1 4 LYS HZ3 H -6.805 3.857 -5.067 1.00 . A A . 4 LYS HZ3 1 1 1 67 1 1 4 LYS N N -5.763 0.351 1.151 1.00 . A A . 4 LYS N 1 1 1 68 1 1 4 LYS NZ N -6.140 3.430 -4.392 1.00 . A A . 4 LYS NZ 1 1 1 69 1 1 4 LYS O O -3.485 1.238 -1.288 1.00 . A A . 4 LYS O 1 1 1 70 1 1 5 ILE C C -1.718 2.570 0.672 1.00 . A A . 5 ILE C 1 1 1 71 1 1 5 ILE CA C -2.929 3.391 0.227 1.00 . A A . 5 ILE CA 1 1 1 72 1 1 5 ILE CB C -3.166 4.563 1.177 1.00 . A A . 5 ILE CB 1 1 1 73 1 1 5 ILE CD1 C -3.457 6.291 -0.607 1.00 . A A . 5 ILE CD1 1 1 1 74 1 1 5 ILE CG1 C -4.150 5.545 0.535 1.00 . A A . 5 ILE CG1 1 1 1 75 1 1 5 ILE CG2 C -1.840 5.276 1.452 1.00 . A A . 5 ILE CG2 1 1 1 76 1 1 5 ILE H H -4.842 2.772 0.998 1.00 . A A . 5 ILE H 1 1 1 77 1 1 5 ILE HA H -2.797 3.750 -0.781 1.00 . A A . 5 ILE HA 1 1 1 78 1 1 5 ILE HB H -3.576 4.196 2.107 1.00 . A A . 5 ILE HB 1 1 1 79 1 1 5 ILE HD11 H -2.941 7.154 -0.213 1.00 . A A . 5 ILE HD11 1 1 1 80 1 1 5 ILE HD12 H -4.195 6.611 -1.327 1.00 . A A . 5 ILE HD12 1 1 1 81 1 1 5 ILE HD13 H -2.746 5.635 -1.087 1.00 . A A . 5 ILE HD13 1 1 1 82 1 1 5 ILE HG12 H -5.000 5.001 0.149 1.00 . A A . 5 ILE HG12 1 1 1 83 1 1 5 ILE HG13 H -4.485 6.255 1.276 1.00 . A A . 5 ILE HG13 1 1 1 84 1 1 5 ILE HG21 H -1.142 4.579 1.894 1.00 . A A . 5 ILE HG21 1 1 1 85 1 1 5 ILE HG22 H -2.007 6.098 2.132 1.00 . A A . 5 ILE HG22 1 1 1 86 1 1 5 ILE HG23 H -1.434 5.652 0.524 1.00 . A A . 5 ILE HG23 1 1 1 87 1 1 5 ILE N N -4.159 2.558 0.330 1.00 . A A . 5 ILE N 1 1 1 88 1 1 5 ILE O O -0.594 2.852 0.306 1.00 . A A . 5 ILE O 1 1 1 89 1 1 6 TRP C C -0.336 -0.208 0.788 1.00 . A A . 6 TRP C 1 1 1 90 1 1 6 TRP CA C -0.809 0.703 1.923 1.00 . A A . 6 TRP CA 1 1 1 91 1 1 6 TRP CB C -1.382 -0.122 3.077 1.00 . A A . 6 TRP CB 1 1 1 92 1 1 6 TRP CD1 C -0.737 -2.565 3.056 1.00 . A A . 6 TRP CD1 1 1 1 93 1 1 6 TRP CD2 C 0.825 -1.268 4.025 1.00 . A A . 6 TRP CD2 1 1 1 94 1 1 6 TRP CE2 C 1.308 -2.598 4.080 1.00 . A A . 6 TRP CE2 1 1 1 95 1 1 6 TRP CE3 C 1.624 -0.249 4.572 1.00 . A A . 6 TRP CE3 1 1 1 96 1 1 6 TRP CG C -0.477 -1.275 3.369 1.00 . A A . 6 TRP CG 1 1 1 97 1 1 6 TRP CH2 C 3.323 -1.879 5.196 1.00 . A A . 6 TRP CH2 1 1 1 98 1 1 6 TRP CZ2 C 2.540 -2.904 4.658 1.00 . A A . 6 TRP CZ2 1 1 1 99 1 1 6 TRP CZ3 C 2.865 -0.554 5.154 1.00 . A A . 6 TRP CZ3 1 1 1 100 1 1 6 TRP H H -2.859 1.340 1.736 1.00 . A A . 6 TRP H 1 1 1 101 1 1 6 TRP HA H 0.001 1.319 2.275 1.00 . A A . 6 TRP HA 1 1 1 102 1 1 6 TRP HB2 H -1.467 0.500 3.956 1.00 . A A . 6 TRP HB2 1 1 1 103 1 1 6 TRP HB3 H -2.360 -0.492 2.803 1.00 . A A . 6 TRP HB3 1 1 1 104 1 1 6 TRP HD1 H -1.626 -2.923 2.557 1.00 . A A . 6 TRP HD1 1 1 1 105 1 1 6 TRP HE1 H 0.381 -4.323 3.369 1.00 . A A . 6 TRP HE1 1 1 1 106 1 1 6 TRP HE3 H 1.281 0.775 4.545 1.00 . A A . 6 TRP HE3 1 1 1 107 1 1 6 TRP HH2 H 4.278 -2.108 5.645 1.00 . A A . 6 TRP HH2 1 1 1 108 1 1 6 TRP HZ2 H 2.888 -3.926 4.688 1.00 . A A . 6 TRP HZ2 1 1 1 109 1 1 6 TRP HZ3 H 3.472 0.236 5.571 1.00 . A A . 6 TRP HZ3 1 1 1 110 1 1 6 TRP N N -1.943 1.551 1.457 1.00 . A A . 6 TRP N 1 1 1 111 1 1 6 TRP NE1 N 0.320 -3.351 3.476 1.00 . A A . 6 TRP NE1 1 1 1 112 1 1 6 TRP O O 0.822 -0.565 0.707 1.00 . A A . 6 TRP O 1 1 1 113 1 1 7 GLU C C 0.361 -0.858 -1.973 1.00 . A A . 7 GLU C 1 1 1 114 1 1 7 GLU CA C -0.822 -1.470 -1.221 1.00 . A A . 7 GLU CA 1 1 1 115 1 1 7 GLU CB C -2.053 -1.545 -2.125 1.00 . A A . 7 GLU CB 1 1 1 116 1 1 7 GLU CD C -1.785 -3.098 -4.064 1.00 . A A . 7 GLU CD 1 1 1 117 1 1 7 GLU CG C -2.245 -2.983 -2.610 1.00 . A A . 7 GLU CG 1 1 1 118 1 1 7 GLU H H -2.153 -0.283 -0.010 1.00 . A A . 7 GLU H 1 1 1 119 1 1 7 GLU HA H -0.570 -2.451 -0.859 1.00 . A A . 7 GLU HA 1 1 1 120 1 1 7 GLU HB2 H -2.926 -1.233 -1.568 1.00 . A A . 7 GLU HB2 1 1 1 121 1 1 7 GLU HB3 H -1.916 -0.895 -2.975 1.00 . A A . 7 GLU HB3 1 1 1 122 1 1 7 GLU HG2 H -1.662 -3.652 -1.993 1.00 . A A . 7 GLU HG2 1 1 1 123 1 1 7 GLU HG3 H -3.289 -3.250 -2.543 1.00 . A A . 7 GLU HG3 1 1 1 124 1 1 7 GLU N N -1.224 -0.584 -0.091 1.00 . A A . 7 GLU N 1 1 1 125 1 1 7 GLU O O 1.269 -1.547 -2.396 1.00 . A A . 7 GLU O 1 1 1 126 1 1 7 GLU OE1 O -0.590 -3.214 -4.278 1.00 . A A . 7 GLU OE1 1 1 1 127 1 1 7 GLU OE2 O -2.635 -3.066 -4.938 1.00 . A A . 7 GLU OE2 1 1 1 128 1 1 8 GLY C C 2.682 1.228 -1.928 1.00 . A A . 8 GLY C 1 1 1 129 1 1 8 GLY CA C 1.479 1.097 -2.863 1.00 . A A . 8 GLY CA 1 1 1 130 1 1 8 GLY H H -0.384 0.968 -1.789 1.00 . A A . 8 GLY H 1 1 1 131 1 1 8 GLY HA2 H 1.752 0.503 -3.722 1.00 . A A . 8 GLY HA2 1 1 1 132 1 1 8 GLY HA3 H 1.170 2.079 -3.187 1.00 . A A . 8 GLY HA3 1 1 1 133 1 1 8 GLY N N 0.357 0.434 -2.141 1.00 . A A . 8 GLY N 1 1 1 134 1 1 8 GLY O O 3.819 1.139 -2.348 1.00 . A A . 8 GLY O 1 1 1 135 1 1 9 ILE C C 4.394 0.281 0.327 1.00 . A A . 9 ILE C 1 1 1 136 1 1 9 ILE CA C 3.572 1.572 0.297 1.00 . A A . 9 ILE CA 1 1 1 137 1 1 9 ILE CB C 2.911 1.823 1.654 1.00 . A A . 9 ILE CB 1 1 1 138 1 1 9 ILE CD1 C 1.773 3.549 3.057 1.00 . A A . 9 ILE CD1 1 1 1 139 1 1 9 ILE CG1 C 2.228 3.192 1.640 1.00 . A A . 9 ILE CG1 1 1 1 140 1 1 9 ILE CG2 C 3.975 1.797 2.752 1.00 . A A . 9 ILE CG2 1 1 1 141 1 1 9 ILE H H 1.517 1.504 -0.348 1.00 . A A . 9 ILE H 1 1 1 142 1 1 9 ILE HA H 4.195 2.410 0.031 1.00 . A A . 9 ILE HA 1 1 1 143 1 1 9 ILE HB H 2.178 1.052 1.844 1.00 . A A . 9 ILE HB 1 1 1 144 1 1 9 ILE HD11 H 1.107 4.399 3.016 1.00 . A A . 9 ILE HD11 1 1 1 145 1 1 9 ILE HD12 H 2.635 3.797 3.660 1.00 . A A . 9 ILE HD12 1 1 1 146 1 1 9 ILE HD13 H 1.257 2.708 3.493 1.00 . A A . 9 ILE HD13 1 1 1 147 1 1 9 ILE HG12 H 2.924 3.937 1.286 1.00 . A A . 9 ILE HG12 1 1 1 148 1 1 9 ILE HG13 H 1.370 3.159 0.986 1.00 . A A . 9 ILE HG13 1 1 1 149 1 1 9 ILE HG21 H 3.496 1.696 3.715 1.00 . A A . 9 ILE HG21 1 1 1 150 1 1 9 ILE HG22 H 4.541 2.716 2.726 1.00 . A A . 9 ILE HG22 1 1 1 151 1 1 9 ILE HG23 H 4.639 0.961 2.591 1.00 . A A . 9 ILE HG23 1 1 1 152 1 1 9 ILE N N 2.441 1.438 -0.665 1.00 . A A . 9 ILE N 1 1 1 153 1 1 9 ILE O O 5.590 0.290 0.113 1.00 . A A . 9 ILE O 1 1 1 154 1 1 10 LYS C C 5.201 -2.365 -0.719 1.00 . A A . 10 LYS C 1 1 1 155 1 1 10 LYS CA C 4.507 -2.120 0.623 1.00 . A A . 10 LYS CA 1 1 1 156 1 1 10 LYS CB C 3.443 -3.188 0.879 1.00 . A A . 10 LYS CB 1 1 1 157 1 1 10 LYS CD C 2.682 -4.653 -0.997 1.00 . A A . 10 LYS CD 1 1 1 158 1 1 10 LYS CE C 1.330 -5.367 -1.048 1.00 . A A . 10 LYS CE 1 1 1 159 1 1 10 LYS CG C 2.515 -3.285 -0.333 1.00 . A A . 10 LYS CG 1 1 1 160 1 1 10 LYS H H 2.796 -0.818 0.752 1.00 . A A . 10 LYS H 1 1 1 161 1 1 10 LYS HA H 5.227 -2.117 1.426 1.00 . A A . 10 LYS HA 1 1 1 162 1 1 10 LYS HB2 H 3.923 -4.142 1.044 1.00 . A A . 10 LYS HB2 1 1 1 163 1 1 10 LYS HB3 H 2.866 -2.920 1.751 1.00 . A A . 10 LYS HB3 1 1 1 164 1 1 10 LYS HD2 H 3.059 -4.521 -2.002 1.00 . A A . 10 LYS HD2 1 1 1 165 1 1 10 LYS HD3 H 3.380 -5.248 -0.427 1.00 . A A . 10 LYS HD3 1 1 1 166 1 1 10 LYS HE2 H 0.528 -4.645 -1.127 1.00 . A A . 10 LYS HE2 1 1 1 167 1 1 10 LYS HE3 H 1.298 -6.057 -1.878 1.00 . A A . 10 LYS HE3 1 1 1 168 1 1 10 LYS HG2 H 1.491 -3.163 -0.012 1.00 . A A . 10 LYS HG2 1 1 1 169 1 1 10 LYS HG3 H 2.765 -2.510 -1.042 1.00 . A A . 10 LYS HG3 1 1 1 170 1 1 10 LYS HZ1 H 0.444 -6.781 0.196 1.00 . A A . 10 LYS HZ1 1 1 1 171 1 1 10 LYS HZ2 H 1.084 -5.438 1.018 1.00 . A A . 10 LYS HZ2 1 1 1 172 1 1 10 LYS HZ3 H 2.121 -6.634 0.400 1.00 . A A . 10 LYS HZ3 1 1 1 173 1 1 10 LYS N N 3.761 -0.831 0.586 1.00 . A A . 10 LYS N 1 1 1 174 1 1 10 LYS NZ N 1.238 -6.111 0.239 1.00 . A A . 10 LYS NZ 1 1 1 175 1 1 10 LYS O O 6.162 -3.105 -0.807 1.00 . A A . 10 LYS O 1 1 1 176 1 1 11 SER C C 6.616 -1.087 -3.223 1.00 . A A . 11 SER C 1 1 1 177 1 1 11 SER CA C 5.356 -1.947 -3.101 1.00 . A A . 11 SER CA 1 1 1 178 1 1 11 SER CB C 4.300 -1.497 -4.111 1.00 . A A . 11 SER CB 1 1 1 179 1 1 11 SER H H 3.947 -1.156 -1.674 1.00 . A A . 11 SER H 1 1 1 180 1 1 11 SER HA H 5.593 -2.987 -3.255 1.00 . A A . 11 SER HA 1 1 1 181 1 1 11 SER HB2 H 3.399 -2.069 -3.973 1.00 . A A . 11 SER HB2 1 1 1 182 1 1 11 SER HB3 H 4.085 -0.447 -3.959 1.00 . A A . 11 SER HB3 1 1 1 183 1 1 11 SER HG H 4.084 -1.503 -6.044 1.00 . A A . 11 SER HG 1 1 1 184 1 1 11 SER N N 4.723 -1.749 -1.766 1.00 . A A . 11 SER N 1 1 1 185 1 1 11 SER O O 7.548 -1.430 -3.923 1.00 . A A . 11 SER O 1 1 1 186 1 1 11 SER OG O 4.792 -1.707 -5.428 1.00 . A A . 11 SER OG 1 1 1 187 1 1 12 LEU C C 9.024 0.277 -1.867 1.00 . A A . 12 LEU C 1 1 1 188 1 1 12 LEU CA C 7.853 0.909 -2.625 1.00 . A A . 12 LEU CA 1 1 1 189 1 1 12 LEU CB C 7.429 2.220 -1.962 1.00 . A A . 12 LEU CB 1 1 1 190 1 1 12 LEU CD1 C 7.311 4.309 -3.326 1.00 . A A . 12 LEU CD1 1 1 1 191 1 1 12 LEU CD2 C 8.911 4.154 -1.415 1.00 . A A . 12 LEU CD2 1 1 1 192 1 1 12 LEU CG C 8.240 3.375 -2.548 1.00 . A A . 12 LEU CG 1 1 1 193 1 1 12 LEU H H 5.890 0.286 -1.989 1.00 . A A . 12 LEU H 1 1 1 194 1 1 12 LEU HA H 8.122 1.088 -3.654 1.00 . A A . 12 LEU HA 1 1 1 195 1 1 12 LEU HB2 H 6.377 2.389 -2.140 1.00 . A A . 12 LEU HB2 1 1 1 196 1 1 12 LEU HB3 H 7.608 2.159 -0.898 1.00 . A A . 12 LEU HB3 1 1 1 197 1 1 12 LEU HD11 H 6.494 4.617 -2.690 1.00 . A A . 12 LEU HD11 1 1 1 198 1 1 12 LEU HD12 H 6.919 3.791 -4.189 1.00 . A A . 12 LEU HD12 1 1 1 199 1 1 12 LEU HD13 H 7.863 5.179 -3.649 1.00 . A A . 12 LEU HD13 1 1 1 200 1 1 12 LEU HD21 H 9.941 4.350 -1.673 1.00 . A A . 12 LEU HD21 1 1 1 201 1 1 12 LEU HD22 H 8.872 3.571 -0.505 1.00 . A A . 12 LEU HD22 1 1 1 202 1 1 12 LEU HD23 H 8.393 5.090 -1.265 1.00 . A A . 12 LEU HD23 1 1 1 203 1 1 12 LEU HG H 8.995 2.983 -3.215 1.00 . A A . 12 LEU HG 1 1 1 204 1 1 12 LEU N N 6.652 0.028 -2.547 1.00 . A A . 12 LEU N 1 1 1 205 1 1 12 LEU O O 10.163 0.671 -2.024 1.00 . A A . 12 LEU O 1 1 1 206 1 1 13 PHE C C 9.458 -2.788 0.091 1.00 . A A . 13 PHE C 1 1 1 207 1 1 13 PHE CA C 9.853 -1.357 -0.280 1.00 . A A . 13 PHE CA 1 1 1 208 1 1 13 PHE CB C 10.022 -0.503 0.977 1.00 . A A . 13 PHE CB 1 1 1 209 1 1 13 PHE CD1 C 12.315 0.084 0.117 1.00 . A A . 13 PHE CD1 1 1 1 210 1 1 13 PHE CD2 C 12.025 -0.288 2.495 1.00 . A A . 13 PHE CD2 1 1 1 211 1 1 13 PHE CE1 C 13.675 0.336 0.321 1.00 . A A . 13 PHE CE1 1 1 1 212 1 1 13 PHE CE2 C 13.387 -0.035 2.700 1.00 . A A . 13 PHE CE2 1 1 1 213 1 1 13 PHE CG C 11.490 -0.228 1.202 1.00 . A A . 13 PHE CG 1 1 1 214 1 1 13 PHE CZ C 14.212 0.276 1.612 1.00 . A A . 13 PHE CZ 1 1 1 215 1 1 13 PHE H H 7.829 -1.005 -0.933 1.00 . A A . 13 PHE H 1 1 1 216 1 1 13 PHE HA H 10.767 -1.354 -0.854 1.00 . A A . 13 PHE HA 1 1 1 217 1 1 13 PHE HB2 H 9.497 0.432 0.852 1.00 . A A . 13 PHE HB2 1 1 1 218 1 1 13 PHE HB3 H 9.622 -1.030 1.830 1.00 . A A . 13 PHE HB3 1 1 1 219 1 1 13 PHE HD1 H 11.902 0.130 -0.879 1.00 . A A . 13 PHE HD1 1 1 1 220 1 1 13 PHE HD2 H 11.388 -0.528 3.333 1.00 . A A . 13 PHE HD2 1 1 1 221 1 1 13 PHE HE1 H 14.308 0.574 -0.518 1.00 . A A . 13 PHE HE1 1 1 1 222 1 1 13 PHE HE2 H 13.800 -0.081 3.697 1.00 . A A . 13 PHE HE2 1 1 1 223 1 1 13 PHE HZ H 15.262 0.472 1.770 1.00 . A A . 13 PHE HZ 1 1 1 224 1 1 13 PHE N N 8.753 -0.701 -1.046 1.00 . A A . 13 PHE N 1 1 1 225 1 1 13 PHE O O 10.142 -3.732 -0.251 1.00 . A A . 13 PHE O 1 1 1 226 1 1 14 NH2 HN1 H 7.819 -2.231 1.063 1.00 . A A . 14 NH2 HN1 1 1 1 227 1 1 14 NH2 HN2 H 8.109 -3.903 1.030 1.00 . A A . 14 NH2 HN2 1 1 1 228 1 1 14 NH2 N N 8.372 -2.991 0.786 1.00 . A A . 14 NH2 N 1 1 2 229 1 1 1 ILE C C -8.727 -2.621 0.857 1.00 . A A . 1 ILE C 1 1 2 230 1 1 1 ILE CA C -8.573 -3.865 -0.022 1.00 . A A . 1 ILE CA 1 1 2 231 1 1 1 ILE CB C -7.194 -3.889 -0.680 1.00 . A A . 1 ILE CB 1 1 2 232 1 1 1 ILE CD1 C -5.848 -5.695 0.403 1.00 . A A . 1 ILE CD1 1 1 2 233 1 1 1 ILE CG1 C -6.130 -4.193 0.378 1.00 . A A . 1 ILE CG1 1 1 2 234 1 1 1 ILE CG2 C -6.906 -2.528 -1.316 1.00 . A A . 1 ILE CG2 1 1 2 235 1 1 1 ILE H1 H -9.735 -2.829 -1.407 1.00 . A A . 1 ILE H1 1 1 2 236 1 1 1 ILE H2 H -10.427 -4.287 -0.875 1.00 . A A . 1 ILE H2 1 1 2 237 1 1 1 ILE H3 H -9.136 -4.309 -1.979 1.00 . A A . 1 ILE H3 1 1 2 238 1 1 1 ILE HA H -8.719 -4.760 0.562 1.00 . A A . 1 ILE HA 1 1 2 239 1 1 1 ILE HB H -7.173 -4.654 -1.443 1.00 . A A . 1 ILE HB 1 1 2 240 1 1 1 ILE HD11 H -4.888 -5.874 0.865 1.00 . A A . 1 ILE HD11 1 1 2 241 1 1 1 ILE HD12 H -5.839 -6.078 -0.607 1.00 . A A . 1 ILE HD12 1 1 2 242 1 1 1 ILE HD13 H -6.619 -6.197 0.971 1.00 . A A . 1 ILE HD13 1 1 2 243 1 1 1 ILE HG12 H -5.222 -3.658 0.138 1.00 . A A . 1 ILE HG12 1 1 2 244 1 1 1 ILE HG13 H -6.487 -3.879 1.347 1.00 . A A . 1 ILE HG13 1 1 2 245 1 1 1 ILE HG21 H -5.899 -2.518 -1.706 1.00 . A A . 1 ILE HG21 1 1 2 246 1 1 1 ILE HG22 H -7.011 -1.754 -0.571 1.00 . A A . 1 ILE HG22 1 1 2 247 1 1 1 ILE HG23 H -7.605 -2.351 -2.120 1.00 . A A . 1 ILE HG23 1 1 2 248 1 1 1 ILE N N -9.541 -3.819 -1.156 1.00 . A A . 1 ILE N 1 1 2 249 1 1 1 ILE O O -8.904 -1.522 0.370 1.00 . A A . 1 ILE O 1 1 2 250 1 1 2 LEU C C -7.502 -0.817 3.106 1.00 . A A . 2 LEU C 1 1 2 251 1 1 2 LEU CA C -8.807 -1.615 3.062 1.00 . A A . 2 LEU CA 1 1 2 252 1 1 2 LEU CB C -9.117 -2.218 4.434 1.00 . A A . 2 LEU CB 1 1 2 253 1 1 2 LEU CD1 C -8.096 -0.413 5.833 1.00 . A A . 2 LEU CD1 1 1 2 254 1 1 2 LEU CD2 C -10.351 -0.073 4.812 1.00 . A A . 2 LEU CD2 1 1 2 255 1 1 2 LEU CG C -9.405 -1.100 5.441 1.00 . A A . 2 LEU CG 1 1 2 256 1 1 2 LEU H H -8.522 -3.682 2.522 1.00 . A A . 2 LEU H 1 1 2 257 1 1 2 LEU HA H -9.624 -0.987 2.742 1.00 . A A . 2 LEU HA 1 1 2 258 1 1 2 LEU HB2 H -9.980 -2.864 4.355 1.00 . A A . 2 LEU HB2 1 1 2 259 1 1 2 LEU HB3 H -8.268 -2.793 4.772 1.00 . A A . 2 LEU HB3 1 1 2 260 1 1 2 LEU HD11 H -7.262 -0.966 5.426 1.00 . A A . 2 LEU HD11 1 1 2 261 1 1 2 LEU HD12 H -8.016 -0.381 6.909 1.00 . A A . 2 LEU HD12 1 1 2 262 1 1 2 LEU HD13 H -8.086 0.593 5.442 1.00 . A A . 2 LEU HD13 1 1 2 263 1 1 2 LEU HD21 H -9.861 0.402 3.974 1.00 . A A . 2 LEU HD21 1 1 2 264 1 1 2 LEU HD22 H -10.611 0.674 5.547 1.00 . A A . 2 LEU HD22 1 1 2 265 1 1 2 LEU HD23 H -11.247 -0.571 4.470 1.00 . A A . 2 LEU HD23 1 1 2 266 1 1 2 LEU HG H -9.866 -1.522 6.322 1.00 . A A . 2 LEU HG 1 1 2 267 1 1 2 LEU N N -8.664 -2.787 2.150 1.00 . A A . 2 LEU N 1 1 2 268 1 1 2 LEU O O -7.488 0.350 3.442 1.00 . A A . 2 LEU O 1 1 2 269 1 1 3 GLY C C -4.713 -0.306 1.377 1.00 . A A . 3 GLY C 1 1 2 270 1 1 3 GLY CA C -5.102 -0.714 2.796 1.00 . A A . 3 GLY CA 1 1 2 271 1 1 3 GLY H H -6.436 -2.380 2.503 1.00 . A A . 3 GLY H 1 1 2 272 1 1 3 GLY HA2 H -5.192 0.167 3.414 1.00 . A A . 3 GLY HA2 1 1 2 273 1 1 3 GLY HA3 H -4.340 -1.358 3.199 1.00 . A A . 3 GLY HA3 1 1 2 274 1 1 3 GLY N N -6.405 -1.438 2.771 1.00 . A A . 3 GLY N 1 1 2 275 1 1 3 GLY O O -3.713 -0.742 0.844 1.00 . A A . 3 GLY O 1 1 2 276 1 1 4 LYS C C -3.861 1.770 -0.608 1.00 . A A . 4 LYS C 1 1 2 277 1 1 4 LYS CA C -5.166 0.980 -0.621 1.00 . A A . 4 LYS CA 1 1 2 278 1 1 4 LYS CB C -6.335 1.873 -1.043 1.00 . A A . 4 LYS CB 1 1 2 279 1 1 4 LYS CD C -7.739 2.590 -2.981 1.00 . A A . 4 LYS CD 1 1 2 280 1 1 4 LYS CE C -8.272 1.970 -4.275 1.00 . A A . 4 LYS CE 1 1 2 281 1 1 4 LYS CG C -6.448 1.881 -2.568 1.00 . A A . 4 LYS CG 1 1 2 282 1 1 4 LYS H H -6.291 0.879 1.215 1.00 . A A . 4 LYS H 1 1 2 283 1 1 4 LYS HA H -5.087 0.134 -1.281 1.00 . A A . 4 LYS HA 1 1 2 284 1 1 4 LYS HB2 H -7.251 1.492 -0.614 1.00 . A A . 4 LYS HB2 1 1 2 285 1 1 4 LYS HB3 H -6.164 2.879 -0.690 1.00 . A A . 4 LYS HB3 1 1 2 286 1 1 4 LYS HD2 H -8.476 2.480 -2.197 1.00 . A A . 4 LYS HD2 1 1 2 287 1 1 4 LYS HD3 H -7.538 3.638 -3.142 1.00 . A A . 4 LYS HD3 1 1 2 288 1 1 4 LYS HE2 H -8.810 2.711 -4.851 1.00 . A A . 4 LYS HE2 1 1 2 289 1 1 4 LYS HE3 H -7.462 1.554 -4.854 1.00 . A A . 4 LYS HE3 1 1 2 290 1 1 4 LYS HG2 H -5.599 2.401 -2.988 1.00 . A A . 4 LYS HG2 1 1 2 291 1 1 4 LYS HG3 H -6.465 0.864 -2.934 1.00 . A A . 4 LYS HG3 1 1 2 292 1 1 4 LYS HZ1 H -8.883 0.526 -2.906 1.00 . A A . 4 LYS HZ1 1 1 2 293 1 1 4 LYS HZ2 H -9.177 0.113 -4.528 1.00 . A A . 4 LYS HZ2 1 1 2 294 1 1 4 LYS HZ3 H -10.157 1.261 -3.750 1.00 . A A . 4 LYS HZ3 1 1 2 295 1 1 4 LYS N N -5.495 0.536 0.764 1.00 . A A . 4 LYS N 1 1 2 296 1 1 4 LYS NZ N -9.191 0.886 -3.831 1.00 . A A . 4 LYS NZ 1 1 2 297 1 1 4 LYS O O -2.993 1.578 -1.436 1.00 . A A . 4 LYS O 1 1 2 298 1 1 5 ILE C C -1.300 2.544 0.835 1.00 . A A . 5 ILE C 1 1 2 299 1 1 5 ILE CA C -2.462 3.452 0.427 1.00 . A A . 5 ILE CA 1 1 2 300 1 1 5 ILE CB C -2.740 4.492 1.511 1.00 . A A . 5 ILE CB 1 1 2 301 1 1 5 ILE CD1 C -2.834 6.483 -0.006 1.00 . A A . 5 ILE CD1 1 1 2 302 1 1 5 ILE CG1 C -3.642 5.591 0.939 1.00 . A A . 5 ILE CG1 1 1 2 303 1 1 5 ILE CG2 C -1.421 5.106 1.984 1.00 . A A . 5 ILE CG2 1 1 2 304 1 1 5 ILE H H -4.425 2.780 0.999 1.00 . A A . 5 ILE H 1 1 2 305 1 1 5 ILE HA H -2.254 3.938 -0.512 1.00 . A A . 5 ILE HA 1 1 2 306 1 1 5 ILE HB H -3.236 4.016 2.345 1.00 . A A . 5 ILE HB 1 1 2 307 1 1 5 ILE HD11 H -3.473 7.257 -0.404 1.00 . A A . 5 ILE HD11 1 1 2 308 1 1 5 ILE HD12 H -2.443 5.885 -0.816 1.00 . A A . 5 ILE HD12 1 1 2 309 1 1 5 ILE HD13 H -2.017 6.934 0.537 1.00 . A A . 5 ILE HD13 1 1 2 310 1 1 5 ILE HG12 H -4.460 5.138 0.397 1.00 . A A . 5 ILE HG12 1 1 2 311 1 1 5 ILE HG13 H -4.035 6.189 1.747 1.00 . A A . 5 ILE HG13 1 1 2 312 1 1 5 ILE HG21 H -0.645 4.891 1.265 1.00 . A A . 5 ILE HG21 1 1 2 313 1 1 5 ILE HG22 H -1.152 4.683 2.942 1.00 . A A . 5 ILE HG22 1 1 2 314 1 1 5 ILE HG23 H -1.535 6.175 2.082 1.00 . A A . 5 ILE HG23 1 1 2 315 1 1 5 ILE N N -3.713 2.651 0.339 1.00 . A A . 5 ILE N 1 1 2 316 1 1 5 ILE O O -0.157 2.792 0.504 1.00 . A A . 5 ILE O 1 1 2 317 1 1 6 TRP C C -0.021 -0.260 0.776 1.00 . A A . 6 TRP C 1 1 2 318 1 1 6 TRP CA C -0.508 0.557 1.976 1.00 . A A . 6 TRP CA 1 1 2 319 1 1 6 TRP CB C -1.163 -0.348 3.023 1.00 . A A . 6 TRP CB 1 1 2 320 1 1 6 TRP CD1 C -0.658 -2.812 2.786 1.00 . A A . 6 TRP CD1 1 1 2 321 1 1 6 TRP CD2 C 0.954 -1.705 3.897 1.00 . A A . 6 TRP CD2 1 1 2 322 1 1 6 TRP CE2 C 1.360 -3.058 3.836 1.00 . A A . 6 TRP CE2 1 1 2 323 1 1 6 TRP CE3 C 1.799 -0.788 4.549 1.00 . A A . 6 TRP CE3 1 1 2 324 1 1 6 TRP CG C -0.330 -1.575 3.222 1.00 . A A . 6 TRP CG 1 1 2 325 1 1 6 TRP CH2 C 3.387 -2.566 5.046 1.00 . A A . 6 TRP CH2 1 1 2 326 1 1 6 TRP CZ2 C 2.560 -3.488 4.402 1.00 . A A . 6 TRP CZ2 1 1 2 327 1 1 6 TRP CZ3 C 3.008 -1.217 5.120 1.00 . A A . 6 TRP CZ3 1 1 2 328 1 1 6 TRP H H -2.519 1.309 1.799 1.00 . A A . 6 TRP H 1 1 2 329 1 1 6 TRP HA H 0.310 1.105 2.418 1.00 . A A . 6 TRP HA 1 1 2 330 1 1 6 TRP HB2 H -1.245 0.187 3.958 1.00 . A A . 6 TRP HB2 1 1 2 331 1 1 6 TRP HB3 H -2.148 -0.632 2.685 1.00 . A A . 6 TRP HB3 1 1 2 332 1 1 6 TRP HD1 H -1.556 -3.070 2.243 1.00 . A A . 6 TRP HD1 1 1 2 333 1 1 6 TRP HE1 H 0.351 -4.654 2.954 1.00 . A A . 6 TRP HE1 1 1 2 334 1 1 6 TRP HE3 H 1.515 0.252 4.611 1.00 . A A . 6 TRP HE3 1 1 2 335 1 1 6 TRP HH2 H 4.319 -2.890 5.486 1.00 . A A . 6 TRP HH2 1 1 2 336 1 1 6 TRP HZ2 H 2.848 -4.528 4.342 1.00 . A A . 6 TRP HZ2 1 1 2 337 1 1 6 TRP HZ3 H 3.649 -0.505 5.618 1.00 . A A . 6 TRP HZ3 1 1 2 338 1 1 6 TRP N N -1.589 1.490 1.547 1.00 . A A . 6 TRP N 1 1 2 339 1 1 6 TRP NE1 N 0.344 -3.693 3.149 1.00 . A A . 6 TRP NE1 1 1 2 340 1 1 6 TRP O O 1.096 -0.738 0.751 1.00 . A A . 6 TRP O 1 1 2 341 1 1 7 GLU C C 0.717 -0.497 -2.138 1.00 . A A . 7 GLU C 1 1 2 342 1 1 7 GLU CA C -0.432 -1.207 -1.417 1.00 . A A . 7 GLU CA 1 1 2 343 1 1 7 GLU CB C -1.673 -1.260 -2.309 1.00 . A A . 7 GLU CB 1 1 2 344 1 1 7 GLU CD C -2.667 -3.265 -3.420 1.00 . A A . 7 GLU CD 1 1 2 345 1 1 7 GLU CG C -2.413 -2.579 -2.076 1.00 . A A . 7 GLU CG 1 1 2 346 1 1 7 GLU H H -1.747 -0.027 -0.181 1.00 . A A . 7 GLU H 1 1 2 347 1 1 7 GLU HA H -0.140 -2.204 -1.131 1.00 . A A . 7 GLU HA 1 1 2 348 1 1 7 GLU HB2 H -2.325 -0.433 -2.067 1.00 . A A . 7 GLU HB2 1 1 2 349 1 1 7 GLU HB3 H -1.375 -1.195 -3.344 1.00 . A A . 7 GLU HB3 1 1 2 350 1 1 7 GLU HG2 H -1.811 -3.223 -1.450 1.00 . A A . 7 GLU HG2 1 1 2 351 1 1 7 GLU HG3 H -3.356 -2.383 -1.590 1.00 . A A . 7 GLU HG3 1 1 2 352 1 1 7 GLU N N -0.850 -0.422 -0.220 1.00 . A A . 7 GLU N 1 1 2 353 1 1 7 GLU O O 1.539 -1.120 -2.779 1.00 . A A . 7 GLU O 1 1 2 354 1 1 7 GLU OE1 O -1.706 -3.500 -4.134 1.00 . A A . 7 GLU OE1 1 1 2 355 1 1 7 GLU OE2 O -3.818 -3.544 -3.712 1.00 . A A . 7 GLU OE2 1 1 2 356 1 1 8 GLY C C 3.120 1.546 -1.821 1.00 . A A . 8 GLY C 1 1 2 357 1 1 8 GLY CA C 1.876 1.551 -2.710 1.00 . A A . 8 GLY CA 1 1 2 358 1 1 8 GLY H H 0.107 1.283 -1.510 1.00 . A A . 8 GLY H 1 1 2 359 1 1 8 GLY HA2 H 2.104 1.081 -3.655 1.00 . A A . 8 GLY HA2 1 1 2 360 1 1 8 GLY HA3 H 1.563 2.570 -2.880 1.00 . A A . 8 GLY HA3 1 1 2 361 1 1 8 GLY N N 0.780 0.801 -2.033 1.00 . A A . 8 GLY N 1 1 2 362 1 1 8 GLY O O 4.237 1.574 -2.299 1.00 . A A . 8 GLY O 1 1 2 363 1 1 9 ILE C C 4.871 0.179 0.258 1.00 . A A . 9 ILE C 1 1 2 364 1 1 9 ILE CA C 4.109 1.501 0.389 1.00 . A A . 9 ILE CA 1 1 2 365 1 1 9 ILE CB C 3.514 1.640 1.791 1.00 . A A . 9 ILE CB 1 1 2 366 1 1 9 ILE CD1 C 2.175 3.119 3.297 1.00 . A A . 9 ILE CD1 1 1 2 367 1 1 9 ILE CG1 C 2.713 2.942 1.876 1.00 . A A . 9 ILE CG1 1 1 2 368 1 1 9 ILE CG2 C 4.640 1.667 2.825 1.00 . A A . 9 ILE CG2 1 1 2 369 1 1 9 ILE H H 2.027 1.487 -0.166 1.00 . A A . 9 ILE H 1 1 2 370 1 1 9 ILE HA H 4.760 2.335 0.180 1.00 . A A . 9 ILE HA 1 1 2 371 1 1 9 ILE HB H 2.863 0.801 1.990 1.00 . A A . 9 ILE HB 1 1 2 372 1 1 9 ILE HD11 H 1.474 3.941 3.318 1.00 . A A . 9 ILE HD11 1 1 2 373 1 1 9 ILE HD12 H 2.994 3.328 3.970 1.00 . A A . 9 ILE HD12 1 1 2 374 1 1 9 ILE HD13 H 1.675 2.213 3.609 1.00 . A A . 9 ILE HD13 1 1 2 375 1 1 9 ILE HG12 H 3.353 3.775 1.626 1.00 . A A . 9 ILE HG12 1 1 2 376 1 1 9 ILE HG13 H 1.887 2.902 1.183 1.00 . A A . 9 ILE HG13 1 1 2 377 1 1 9 ILE HG21 H 4.895 0.656 3.106 1.00 . A A . 9 ILE HG21 1 1 2 378 1 1 9 ILE HG22 H 4.313 2.212 3.698 1.00 . A A . 9 ILE HG22 1 1 2 379 1 1 9 ILE HG23 H 5.506 2.153 2.401 1.00 . A A . 9 ILE HG23 1 1 2 380 1 1 9 ILE N N 2.936 1.510 -0.530 1.00 . A A . 9 ILE N 1 1 2 381 1 1 9 ILE O O 5.946 0.124 -0.304 1.00 . A A . 9 ILE O 1 1 2 382 1 1 10 LYS C C 5.415 -2.485 -0.775 1.00 . A A . 10 LYS C 1 1 2 383 1 1 10 LYS CA C 5.013 -2.204 0.676 1.00 . A A . 10 LYS CA 1 1 2 384 1 1 10 LYS CB C 3.982 -3.228 1.154 1.00 . A A . 10 LYS CB 1 1 2 385 1 1 10 LYS CD C 3.238 -4.349 -0.952 1.00 . A A . 10 LYS CD 1 1 2 386 1 1 10 LYS CE C 2.406 -5.621 -0.777 1.00 . A A . 10 LYS CE 1 1 2 387 1 1 10 LYS CG C 2.853 -3.335 0.128 1.00 . A A . 10 LYS CG 1 1 2 388 1 1 10 LYS H H 3.451 -0.821 1.220 1.00 . A A . 10 LYS H 1 1 2 389 1 1 10 LYS HA H 5.878 -2.223 1.319 1.00 . A A . 10 LYS HA 1 1 2 390 1 1 10 LYS HB2 H 4.459 -4.190 1.268 1.00 . A A . 10 LYS HB2 1 1 2 391 1 1 10 LYS HB3 H 3.574 -2.912 2.103 1.00 . A A . 10 LYS HB3 1 1 2 392 1 1 10 LYS HD2 H 3.050 -3.925 -1.927 1.00 . A A . 10 LYS HD2 1 1 2 393 1 1 10 LYS HD3 H 4.286 -4.592 -0.860 1.00 . A A . 10 LYS HD3 1 1 2 394 1 1 10 LYS HE2 H 2.805 -6.417 -1.391 1.00 . A A . 10 LYS HE2 1 1 2 395 1 1 10 LYS HE3 H 2.384 -5.919 0.259 1.00 . A A . 10 LYS HE3 1 1 2 396 1 1 10 LYS HG2 H 1.948 -3.658 0.621 1.00 . A A . 10 LYS HG2 1 1 2 397 1 1 10 LYS HG3 H 2.690 -2.371 -0.329 1.00 . A A . 10 LYS HG3 1 1 2 398 1 1 10 LYS HZ1 H 0.336 -5.836 -0.734 1.00 . A A . 10 LYS HZ1 1 1 2 399 1 1 10 LYS HZ2 H 0.956 -5.408 -2.256 1.00 . A A . 10 LYS HZ2 1 1 2 400 1 1 10 LYS HZ3 H 0.860 -4.248 -1.018 1.00 . A A . 10 LYS HZ3 1 1 2 401 1 1 10 LYS N N 4.320 -0.887 0.772 1.00 . A A . 10 LYS N 1 1 2 402 1 1 10 LYS NZ N 1.036 -5.251 -1.231 1.00 . A A . 10 LYS NZ 1 1 2 403 1 1 10 LYS O O 6.289 -3.286 -1.042 1.00 . A A . 10 LYS O 1 1 2 404 1 1 11 SER C C 6.414 -1.309 -3.506 1.00 . A A . 11 SER C 1 1 2 405 1 1 11 SER CA C 5.132 -2.065 -3.144 1.00 . A A . 11 SER CA 1 1 2 406 1 1 11 SER CB C 3.945 -1.516 -3.934 1.00 . A A . 11 SER CB 1 1 2 407 1 1 11 SER H H 4.083 -1.192 -1.477 1.00 . A A . 11 SER H 1 1 2 408 1 1 11 SER HA H 5.249 -3.120 -3.338 1.00 . A A . 11 SER HA 1 1 2 409 1 1 11 SER HB2 H 3.122 -2.210 -3.879 1.00 . A A . 11 SER HB2 1 1 2 410 1 1 11 SER HB3 H 3.642 -0.567 -3.513 1.00 . A A . 11 SER HB3 1 1 2 411 1 1 11 SER HG H 4.866 -0.558 -5.356 1.00 . A A . 11 SER HG 1 1 2 412 1 1 11 SER N N 4.784 -1.833 -1.713 1.00 . A A . 11 SER N 1 1 2 413 1 1 11 SER O O 7.122 -1.671 -4.425 1.00 . A A . 11 SER O 1 1 2 414 1 1 11 SER OG O 4.323 -1.348 -5.294 1.00 . A A . 11 SER OG 1 1 2 415 1 1 12 LEU C C 9.087 0.095 -2.159 1.00 . A A . 12 LEU C 1 1 2 416 1 1 12 LEU CA C 7.953 0.516 -3.096 1.00 . A A . 12 LEU CA 1 1 2 417 1 1 12 LEU CB C 7.571 1.977 -2.853 1.00 . A A . 12 LEU CB 1 1 2 418 1 1 12 LEU CD1 C 7.417 4.033 -4.265 1.00 . A A . 12 LEU CD1 1 1 2 419 1 1 12 LEU CD2 C 9.582 3.422 -3.181 1.00 . A A . 12 LEU CD2 1 1 2 420 1 1 12 LEU CG C 8.318 2.870 -3.844 1.00 . A A . 12 LEU CG 1 1 2 421 1 1 12 LEU H H 6.133 0.015 -2.055 1.00 . A A . 12 LEU H 1 1 2 422 1 1 12 LEU HA H 8.242 0.377 -4.125 1.00 . A A . 12 LEU HA 1 1 2 423 1 1 12 LEU HB2 H 6.506 2.098 -2.989 1.00 . A A . 12 LEU HB2 1 1 2 424 1 1 12 LEU HB3 H 7.841 2.257 -1.846 1.00 . A A . 12 LEU HB3 1 1 2 425 1 1 12 LEU HD11 H 6.672 4.204 -3.501 1.00 . A A . 12 LEU HD11 1 1 2 426 1 1 12 LEU HD12 H 6.928 3.791 -5.196 1.00 . A A . 12 LEU HD12 1 1 2 427 1 1 12 LEU HD13 H 8.014 4.924 -4.391 1.00 . A A . 12 LEU HD13 1 1 2 428 1 1 12 LEU HD21 H 10.383 3.454 -3.903 1.00 . A A . 12 LEU HD21 1 1 2 429 1 1 12 LEU HD22 H 9.866 2.780 -2.359 1.00 . A A . 12 LEU HD22 1 1 2 430 1 1 12 LEU HD23 H 9.390 4.418 -2.811 1.00 . A A . 12 LEU HD23 1 1 2 431 1 1 12 LEU HG H 8.589 2.293 -4.716 1.00 . A A . 12 LEU HG 1 1 2 432 1 1 12 LEU N N 6.718 -0.261 -2.792 1.00 . A A . 12 LEU N 1 1 2 433 1 1 12 LEU O O 10.198 0.577 -2.258 1.00 . A A . 12 LEU O 1 1 2 434 1 1 13 PHE C C 10.139 -2.753 -0.480 1.00 . A A . 13 PHE C 1 1 2 435 1 1 13 PHE CA C 9.882 -1.253 -0.309 1.00 . A A . 13 PHE CA 1 1 2 436 1 1 13 PHE CB C 9.329 -0.958 1.086 1.00 . A A . 13 PHE CB 1 1 2 437 1 1 13 PHE CD1 C 10.898 1.007 1.110 1.00 . A A . 13 PHE CD1 1 1 2 438 1 1 13 PHE CD2 C 10.500 -0.189 3.181 1.00 . A A . 13 PHE CD2 1 1 2 439 1 1 13 PHE CE1 C 11.767 1.874 1.776 1.00 . A A . 13 PHE CE1 1 1 2 440 1 1 13 PHE CE2 C 11.371 0.681 3.849 1.00 . A A . 13 PHE CE2 1 1 2 441 1 1 13 PHE CG C 10.264 -0.024 1.810 1.00 . A A . 13 PHE CG 1 1 2 442 1 1 13 PHE CZ C 12.004 1.713 3.147 1.00 . A A . 13 PHE CZ 1 1 2 443 1 1 13 PHE H H 7.916 -1.180 -1.187 1.00 . A A . 13 PHE H 1 1 2 444 1 1 13 PHE HA H 10.791 -0.694 -0.471 1.00 . A A . 13 PHE HA 1 1 2 445 1 1 13 PHE HB2 H 8.357 -0.495 0.996 1.00 . A A . 13 PHE HB2 1 1 2 446 1 1 13 PHE HB3 H 9.239 -1.881 1.641 1.00 . A A . 13 PHE HB3 1 1 2 447 1 1 13 PHE HD1 H 10.716 1.132 0.053 1.00 . A A . 13 PHE HD1 1 1 2 448 1 1 13 PHE HD2 H 10.010 -0.985 3.721 1.00 . A A . 13 PHE HD2 1 1 2 449 1 1 13 PHE HE1 H 12.254 2.667 1.232 1.00 . A A . 13 PHE HE1 1 1 2 450 1 1 13 PHE HE2 H 11.553 0.555 4.906 1.00 . A A . 13 PHE HE2 1 1 2 451 1 1 13 PHE HZ H 12.676 2.383 3.662 1.00 . A A . 13 PHE HZ 1 1 2 452 1 1 13 PHE N N 8.818 -0.802 -1.250 1.00 . A A . 13 PHE N 1 1 2 453 1 1 13 PHE O O 10.281 -3.475 0.487 1.00 . A A . 13 PHE O 1 1 2 454 1 1 14 NH2 HN1 H 10.090 -2.675 -2.463 1.00 . A A . 14 NH2 HN1 1 1 2 455 1 1 14 NH2 HN2 H 10.369 -4.214 -1.805 1.00 . A A . 14 NH2 HN2 1 1 2 456 1 1 14 NH2 N N 10.204 -3.256 -1.683 1.00 . A A . 14 NH2 N 1 1 3 457 1 1 1 ILE C C -7.824 -3.487 1.305 1.00 . A A . 1 ILE C 1 1 3 458 1 1 1 ILE CA C -7.403 -4.862 0.779 1.00 . A A . 1 ILE CA 1 1 3 459 1 1 1 ILE CB C -8.106 -5.171 -0.543 1.00 . A A . 1 ILE CB 1 1 3 460 1 1 1 ILE CD1 C -6.476 -5.214 -2.437 1.00 . A A . 1 ILE CD1 1 1 3 461 1 1 1 ILE CG1 C -7.470 -4.346 -1.663 1.00 . A A . 1 ILE CG1 1 1 3 462 1 1 1 ILE CG2 C -9.590 -4.816 -0.429 1.00 . A A . 1 ILE CG2 1 1 3 463 1 1 1 ILE H1 H -7.834 -6.850 1.226 1.00 . A A . 1 ILE H1 1 1 3 464 1 1 1 ILE H2 H -8.817 -5.728 2.040 1.00 . A A . 1 ILE H2 1 1 3 465 1 1 1 ILE H3 H -7.209 -5.969 2.533 1.00 . A A . 1 ILE H3 1 1 3 466 1 1 1 ILE HA H -6.333 -4.903 0.644 1.00 . A A . 1 ILE HA 1 1 3 467 1 1 1 ILE HB H -8.004 -6.224 -0.766 1.00 . A A . 1 ILE HB 1 1 3 468 1 1 1 ILE HD11 H -6.839 -6.231 -2.473 1.00 . A A . 1 ILE HD11 1 1 3 469 1 1 1 ILE HD12 H -5.517 -5.192 -1.941 1.00 . A A . 1 ILE HD12 1 1 3 470 1 1 1 ILE HD13 H -6.371 -4.833 -3.442 1.00 . A A . 1 ILE HD13 1 1 3 471 1 1 1 ILE HG12 H -8.241 -3.996 -2.335 1.00 . A A . 1 ILE HG12 1 1 3 472 1 1 1 ILE HG13 H -6.951 -3.500 -1.238 1.00 . A A . 1 ILE HG13 1 1 3 473 1 1 1 ILE HG21 H -9.818 -4.004 -1.102 1.00 . A A . 1 ILE HG21 1 1 3 474 1 1 1 ILE HG22 H -9.811 -4.517 0.586 1.00 . A A . 1 ILE HG22 1 1 3 475 1 1 1 ILE HG23 H -10.187 -5.678 -0.688 1.00 . A A . 1 ILE HG23 1 1 3 476 1 1 1 ILE N N -7.850 -5.933 1.716 1.00 . A A . 1 ILE N 1 1 3 477 1 1 1 ILE O O -7.957 -2.539 0.556 1.00 . A A . 1 ILE O 1 1 3 478 1 1 2 LEU C C -7.239 -1.113 3.225 1.00 . A A . 2 LEU C 1 1 3 479 1 1 2 LEU CA C -8.444 -2.057 3.161 1.00 . A A . 2 LEU CA 1 1 3 480 1 1 2 LEU CB C -8.955 -2.382 4.568 1.00 . A A . 2 LEU CB 1 1 3 481 1 1 2 LEU CD1 C -9.860 -0.055 4.721 1.00 . A A . 2 LEU CD1 1 1 3 482 1 1 2 LEU CD2 C -9.581 -1.427 6.789 1.00 . A A . 2 LEU CD2 1 1 3 483 1 1 2 LEU CG C -8.991 -1.107 5.414 1.00 . A A . 2 LEU CG 1 1 3 484 1 1 2 LEU H H -7.919 -4.147 3.176 1.00 . A A . 2 LEU H 1 1 3 485 1 1 2 LEU HA H -9.235 -1.621 2.573 1.00 . A A . 2 LEU HA 1 1 3 486 1 1 2 LEU HB2 H -9.950 -2.798 4.500 1.00 . A A . 2 LEU HB2 1 1 3 487 1 1 2 LEU HB3 H -8.296 -3.100 5.032 1.00 . A A . 2 LEU HB3 1 1 3 488 1 1 2 LEU HD11 H -10.860 -0.089 5.129 1.00 . A A . 2 LEU HD11 1 1 3 489 1 1 2 LEU HD12 H -9.896 -0.258 3.662 1.00 . A A . 2 LEU HD12 1 1 3 490 1 1 2 LEU HD13 H -9.437 0.925 4.886 1.00 . A A . 2 LEU HD13 1 1 3 491 1 1 2 LEU HD21 H -10.604 -1.086 6.830 1.00 . A A . 2 LEU HD21 1 1 3 492 1 1 2 LEU HD22 H -9.004 -0.927 7.552 1.00 . A A . 2 LEU HD22 1 1 3 493 1 1 2 LEU HD23 H -9.551 -2.494 6.955 1.00 . A A . 2 LEU HD23 1 1 3 494 1 1 2 LEU HG H -7.988 -0.724 5.530 1.00 . A A . 2 LEU HG 1 1 3 495 1 1 2 LEU N N -8.033 -3.371 2.588 1.00 . A A . 2 LEU N 1 1 3 496 1 1 2 LEU O O -7.343 0.014 3.670 1.00 . A A . 2 LEU O 1 1 3 497 1 1 3 GLY C C -4.536 -0.258 1.395 1.00 . A A . 3 GLY C 1 1 3 498 1 1 3 GLY CA C -4.888 -0.695 2.815 1.00 . A A . 3 GLY CA 1 1 3 499 1 1 3 GLY H H -6.035 -2.474 2.426 1.00 . A A . 3 GLY H 1 1 3 500 1 1 3 GLY HA2 H -5.086 0.177 3.423 1.00 . A A . 3 GLY HA2 1 1 3 501 1 1 3 GLY HA3 H -4.061 -1.243 3.231 1.00 . A A . 3 GLY HA3 1 1 3 502 1 1 3 GLY N N -6.097 -1.564 2.782 1.00 . A A . 3 GLY N 1 1 3 503 1 1 3 GLY O O -3.518 -0.636 0.850 1.00 . A A . 3 GLY O 1 1 3 504 1 1 4 LYS C C -3.814 1.848 -0.607 1.00 . A A . 4 LYS C 1 1 3 505 1 1 4 LYS CA C -5.087 1.004 -0.597 1.00 . A A . 4 LYS CA 1 1 3 506 1 1 4 LYS CB C -6.300 1.848 -0.989 1.00 . A A . 4 LYS CB 1 1 3 507 1 1 4 LYS CD C -8.459 1.841 -2.250 1.00 . A A . 4 LYS CD 1 1 3 508 1 1 4 LYS CE C -8.772 1.448 -3.695 1.00 . A A . 4 LYS CE 1 1 3 509 1 1 4 LYS CG C -7.319 0.970 -1.720 1.00 . A A . 4 LYS CG 1 1 3 510 1 1 4 LYS H H -6.183 0.830 1.252 1.00 . A A . 4 LYS H 1 1 3 511 1 1 4 LYS HA H -4.989 0.165 -1.263 1.00 . A A . 4 LYS HA 1 1 3 512 1 1 4 LYS HB2 H -6.753 2.264 -0.101 1.00 . A A . 4 LYS HB2 1 1 3 513 1 1 4 LYS HB3 H -5.986 2.649 -1.641 1.00 . A A . 4 LYS HB3 1 1 3 514 1 1 4 LYS HD2 H -9.337 1.696 -1.637 1.00 . A A . 4 LYS HD2 1 1 3 515 1 1 4 LYS HD3 H -8.164 2.880 -2.217 1.00 . A A . 4 LYS HD3 1 1 3 516 1 1 4 LYS HE2 H -9.227 2.277 -4.219 1.00 . A A . 4 LYS HE2 1 1 3 517 1 1 4 LYS HE3 H -7.876 1.128 -4.201 1.00 . A A . 4 LYS HE3 1 1 3 518 1 1 4 LYS HG2 H -6.834 0.468 -2.544 1.00 . A A . 4 LYS HG2 1 1 3 519 1 1 4 LYS HG3 H -7.717 0.236 -1.035 1.00 . A A . 4 LYS HG3 1 1 3 520 1 1 4 LYS HZ1 H -9.647 -0.294 -4.426 1.00 . A A . 4 LYS HZ1 1 1 3 521 1 1 4 LYS HZ2 H -10.699 0.683 -3.517 1.00 . A A . 4 LYS HZ2 1 1 3 522 1 1 4 LYS HZ3 H -9.510 -0.245 -2.736 1.00 . A A . 4 LYS HZ3 1 1 3 523 1 1 4 LYS N N -5.372 0.537 0.791 1.00 . A A . 4 LYS N 1 1 3 524 1 1 4 LYS NZ N -9.729 0.313 -3.585 1.00 . A A . 4 LYS NZ 1 1 3 525 1 1 4 LYS O O -2.959 1.694 -1.455 1.00 . A A . 4 LYS O 1 1 3 526 1 1 5 ILE C C -1.245 2.734 0.733 1.00 . A A . 5 ILE C 1 1 3 527 1 1 5 ILE CA C -2.468 3.591 0.398 1.00 . A A . 5 ILE CA 1 1 3 528 1 1 5 ILE CB C -2.754 4.590 1.520 1.00 . A A . 5 ILE CB 1 1 3 529 1 1 5 ILE CD1 C -2.918 6.633 0.080 1.00 . A A . 5 ILE CD1 1 1 3 530 1 1 5 ILE CG1 C -3.692 5.683 0.998 1.00 . A A . 5 ILE CG1 1 1 3 531 1 1 5 ILE CG2 C -1.443 5.223 1.997 1.00 . A A . 5 ILE CG2 1 1 3 532 1 1 5 ILE H H -4.388 2.835 1.010 1.00 . A A . 5 ILE H 1 1 3 533 1 1 5 ILE HA H -2.323 4.112 -0.534 1.00 . A A . 5 ILE HA 1 1 3 534 1 1 5 ILE HB H -3.226 4.075 2.345 1.00 . A A . 5 ILE HB 1 1 3 535 1 1 5 ILE HD11 H -2.273 7.263 0.676 1.00 . A A . 5 ILE HD11 1 1 3 536 1 1 5 ILE HD12 H -3.614 7.250 -0.469 1.00 . A A . 5 ILE HD12 1 1 3 537 1 1 5 ILE HD13 H -2.321 6.059 -0.612 1.00 . A A . 5 ILE HD13 1 1 3 538 1 1 5 ILE HG12 H -4.501 5.227 0.445 1.00 . A A . 5 ILE HG12 1 1 3 539 1 1 5 ILE HG13 H -4.095 6.239 1.831 1.00 . A A . 5 ILE HG13 1 1 3 540 1 1 5 ILE HG21 H -1.656 5.967 2.749 1.00 . A A . 5 ILE HG21 1 1 3 541 1 1 5 ILE HG22 H -0.943 5.689 1.160 1.00 . A A . 5 ILE HG22 1 1 3 542 1 1 5 ILE HG23 H -0.807 4.459 2.416 1.00 . A A . 5 ILE HG23 1 1 3 543 1 1 5 ILE N N -3.685 2.735 0.336 1.00 . A A . 5 ILE N 1 1 3 544 1 1 5 ILE O O -0.133 3.042 0.354 1.00 . A A . 5 ILE O 1 1 3 545 1 1 6 TRP C C 0.131 -0.051 0.585 1.00 . A A . 6 TRP C 1 1 3 546 1 1 6 TRP CA C -0.300 0.774 1.801 1.00 . A A . 6 TRP CA 1 1 3 547 1 1 6 TRP CB C -0.839 -0.132 2.912 1.00 . A A . 6 TRP CB 1 1 3 548 1 1 6 TRP CD1 C -0.309 -2.598 2.771 1.00 . A A . 6 TRP CD1 1 1 3 549 1 1 6 TRP CD2 C 1.422 -1.386 3.544 1.00 . A A . 6 TRP CD2 1 1 3 550 1 1 6 TRP CE2 C 1.850 -2.734 3.516 1.00 . A A . 6 TRP CE2 1 1 3 551 1 1 6 TRP CE3 C 2.330 -0.410 3.995 1.00 . A A . 6 TRP CE3 1 1 3 552 1 1 6 TRP CG C 0.046 -1.326 3.067 1.00 . A A . 6 TRP CG 1 1 3 553 1 1 6 TRP CH2 C 4.024 -2.120 4.364 1.00 . A A . 6 TRP CH2 1 1 3 554 1 1 6 TRP CZ2 C 3.135 -3.102 3.919 1.00 . A A . 6 TRP CZ2 1 1 3 555 1 1 6 TRP CZ3 C 3.623 -0.777 4.402 1.00 . A A . 6 TRP CZ3 1 1 3 556 1 1 6 TRP H H -2.353 1.428 1.735 1.00 . A A . 6 TRP H 1 1 3 557 1 1 6 TRP HA H 0.525 1.360 2.172 1.00 . A A . 6 TRP HA 1 1 3 558 1 1 6 TRP HB2 H -0.866 0.418 3.842 1.00 . A A . 6 TRP HB2 1 1 3 559 1 1 6 TRP HB3 H -1.838 -0.455 2.659 1.00 . A A . 6 TRP HB3 1 1 3 560 1 1 6 TRP HD1 H -1.272 -2.908 2.391 1.00 . A A . 6 TRP HD1 1 1 3 561 1 1 6 TRP HE1 H 0.764 -4.406 2.909 1.00 . A A . 6 TRP HE1 1 1 3 562 1 1 6 TRP HE3 H 2.031 0.627 4.028 1.00 . A A . 6 TRP HE3 1 1 3 563 1 1 6 TRP HH2 H 5.019 -2.396 4.679 1.00 . A A . 6 TRP HH2 1 1 3 564 1 1 6 TRP HZ2 H 3.438 -4.138 3.889 1.00 . A A . 6 TRP HZ2 1 1 3 565 1 1 6 TRP HZ3 H 4.312 -0.020 4.746 1.00 . A A . 6 TRP HZ3 1 1 3 566 1 1 6 TRP N N -1.446 1.657 1.441 1.00 . A A . 6 TRP N 1 1 3 567 1 1 6 TRP NE1 N 0.760 -3.434 3.037 1.00 . A A . 6 TRP NE1 1 1 3 568 1 1 6 TRP O O 1.276 -0.437 0.459 1.00 . A A . 6 TRP O 1 1 3 569 1 1 7 GLU C C 0.734 -0.449 -2.268 1.00 . A A . 7 GLU C 1 1 3 570 1 1 7 GLU CA C -0.420 -1.121 -1.519 1.00 . A A . 7 GLU CA 1 1 3 571 1 1 7 GLU CB C -1.685 -1.133 -2.377 1.00 . A A . 7 GLU CB 1 1 3 572 1 1 7 GLU CD C -1.738 -3.629 -2.474 1.00 . A A . 7 GLU CD 1 1 3 573 1 1 7 GLU CG C -2.512 -2.378 -2.052 1.00 . A A . 7 GLU CG 1 1 3 574 1 1 7 GLU H H -1.696 0.000 -0.189 1.00 . A A . 7 GLU H 1 1 3 575 1 1 7 GLU HA H -0.153 -2.126 -1.239 1.00 . A A . 7 GLU HA 1 1 3 576 1 1 7 GLU HB2 H -2.269 -0.247 -2.170 1.00 . A A . 7 GLU HB2 1 1 3 577 1 1 7 GLU HB3 H -1.411 -1.148 -3.421 1.00 . A A . 7 GLU HB3 1 1 3 578 1 1 7 GLU HG2 H -2.703 -2.415 -0.989 1.00 . A A . 7 GLU HG2 1 1 3 579 1 1 7 GLU HG3 H -3.449 -2.339 -2.586 1.00 . A A . 7 GLU HG3 1 1 3 580 1 1 7 GLU N N -0.779 -0.322 -0.311 1.00 . A A . 7 GLU N 1 1 3 581 1 1 7 GLU O O 1.575 -1.105 -2.851 1.00 . A A . 7 GLU O 1 1 3 582 1 1 7 GLU OE1 O -1.301 -3.675 -3.612 1.00 . A A . 7 GLU OE1 1 1 3 583 1 1 7 GLU OE2 O -1.597 -4.520 -1.652 1.00 . A A . 7 GLU OE2 1 1 3 584 1 1 8 GLY C C 3.099 1.655 -2.052 1.00 . A A . 8 GLY C 1 1 3 585 1 1 8 GLY CA C 1.875 1.570 -2.963 1.00 . A A . 8 GLY CA 1 1 3 586 1 1 8 GLY H H 0.090 1.359 -1.776 1.00 . A A . 8 GLY H 1 1 3 587 1 1 8 GLY HA2 H 2.132 1.034 -3.865 1.00 . A A . 8 GLY HA2 1 1 3 588 1 1 8 GLY HA3 H 1.549 2.567 -3.217 1.00 . A A . 8 GLY HA3 1 1 3 589 1 1 8 GLY N N 0.778 0.853 -2.255 1.00 . A A . 8 GLY N 1 1 3 590 1 1 8 GLY O O 4.224 1.692 -2.507 1.00 . A A . 8 GLY O 1 1 3 591 1 1 9 ILE C C 4.797 0.437 0.203 1.00 . A A . 9 ILE C 1 1 3 592 1 1 9 ILE CA C 4.040 1.767 0.179 1.00 . A A . 9 ILE CA 1 1 3 593 1 1 9 ILE CB C 3.415 2.052 1.544 1.00 . A A . 9 ILE CB 1 1 3 594 1 1 9 ILE CD1 C 2.405 3.851 2.957 1.00 . A A . 9 ILE CD1 1 1 3 595 1 1 9 ILE CG1 C 2.771 3.441 1.530 1.00 . A A . 9 ILE CG1 1 1 3 596 1 1 9 ILE CG2 C 4.500 2.007 2.622 1.00 . A A . 9 ILE CG2 1 1 3 597 1 1 9 ILE H H 1.972 1.655 -0.417 1.00 . A A . 9 ILE H 1 1 3 598 1 1 9 ILE HA H 4.700 2.574 -0.100 1.00 . A A . 9 ILE HA 1 1 3 599 1 1 9 ILE HB H 2.664 1.307 1.759 1.00 . A A . 9 ILE HB 1 1 3 600 1 1 9 ILE HD11 H 1.461 4.377 2.951 1.00 . A A . 9 ILE HD11 1 1 3 601 1 1 9 ILE HD12 H 3.174 4.496 3.356 1.00 . A A . 9 ILE HD12 1 1 3 602 1 1 9 ILE HD13 H 2.320 2.969 3.575 1.00 . A A . 9 ILE HD13 1 1 3 603 1 1 9 ILE HG12 H 3.468 4.157 1.117 1.00 . A A . 9 ILE HG12 1 1 3 604 1 1 9 ILE HG13 H 1.878 3.418 0.924 1.00 . A A . 9 ILE HG13 1 1 3 605 1 1 9 ILE HG21 H 5.080 2.917 2.587 1.00 . A A . 9 ILE HG21 1 1 3 606 1 1 9 ILE HG22 H 5.147 1.161 2.445 1.00 . A A . 9 ILE HG22 1 1 3 607 1 1 9 ILE HG23 H 4.039 1.911 3.593 1.00 . A A . 9 ILE HG23 1 1 3 608 1 1 9 ILE N N 2.888 1.686 -0.764 1.00 . A A . 9 ILE N 1 1 3 609 1 1 9 ILE O O 6.012 0.405 0.207 1.00 . A A . 9 ILE O 1 1 3 610 1 1 10 LYS C C 5.450 -2.254 -1.102 1.00 . A A . 10 LYS C 1 1 3 611 1 1 10 LYS CA C 4.771 -1.985 0.243 1.00 . A A . 10 LYS CA 1 1 3 612 1 1 10 LYS CB C 3.655 -2.999 0.494 1.00 . A A . 10 LYS CB 1 1 3 613 1 1 10 LYS CD C 1.790 -4.223 -0.633 1.00 . A A . 10 LYS CD 1 1 3 614 1 1 10 LYS CE C 2.484 -5.361 -1.385 1.00 . A A . 10 LYS CE 1 1 3 615 1 1 10 LYS CG C 2.667 -2.971 -0.674 1.00 . A A . 10 LYS CG 1 1 3 616 1 1 10 LYS H H 3.111 -0.610 0.217 1.00 . A A . 10 LYS H 1 1 3 617 1 1 10 LYS HA H 5.492 -2.025 1.045 1.00 . A A . 10 LYS HA 1 1 3 618 1 1 10 LYS HB2 H 4.082 -3.988 0.582 1.00 . A A . 10 LYS HB2 1 1 3 619 1 1 10 LYS HB3 H 3.138 -2.748 1.407 1.00 . A A . 10 LYS HB3 1 1 3 620 1 1 10 LYS HD2 H 1.628 -4.515 0.395 1.00 . A A . 10 LYS HD2 1 1 3 621 1 1 10 LYS HD3 H 0.840 -4.013 -1.101 1.00 . A A . 10 LYS HD3 1 1 3 622 1 1 10 LYS HE2 H 2.242 -5.317 -2.438 1.00 . A A . 10 LYS HE2 1 1 3 623 1 1 10 LYS HE3 H 3.552 -5.312 -1.240 1.00 . A A . 10 LYS HE3 1 1 3 624 1 1 10 LYS HG2 H 2.045 -2.091 -0.597 1.00 . A A . 10 LYS HG2 1 1 3 625 1 1 10 LYS HG3 H 3.211 -2.947 -1.606 1.00 . A A . 10 LYS HG3 1 1 3 626 1 1 10 LYS HZ1 H 2.431 -6.796 0.122 1.00 . A A . 10 LYS HZ1 1 1 3 627 1 1 10 LYS HZ2 H 2.096 -7.406 -1.427 1.00 . A A . 10 LYS HZ2 1 1 3 628 1 1 10 LYS HZ3 H 0.926 -6.495 -0.598 1.00 . A A . 10 LYS HZ3 1 1 3 629 1 1 10 LYS N N 4.091 -0.659 0.220 1.00 . A A . 10 LYS N 1 1 3 630 1 1 10 LYS NZ N 1.943 -6.609 -0.776 1.00 . A A . 10 LYS NZ 1 1 3 631 1 1 10 LYS O O 6.401 -3.006 -1.190 1.00 . A A . 10 LYS O 1 1 3 632 1 1 11 SER C C 6.837 -0.990 -3.647 1.00 . A A . 11 SER C 1 1 3 633 1 1 11 SER CA C 5.591 -1.866 -3.490 1.00 . A A . 11 SER CA 1 1 3 634 1 1 11 SER CB C 4.517 -1.457 -4.496 1.00 . A A . 11 SER CB 1 1 3 635 1 1 11 SER H H 4.204 -1.041 -2.060 1.00 . A A . 11 SER H 1 1 3 636 1 1 11 SER HA H 5.842 -2.906 -3.621 1.00 . A A . 11 SER HA 1 1 3 637 1 1 11 SER HB2 H 3.615 -1.188 -3.972 1.00 . A A . 11 SER HB2 1 1 3 638 1 1 11 SER HB3 H 4.866 -0.607 -5.068 1.00 . A A . 11 SER HB3 1 1 3 639 1 1 11 SER HG H 3.981 -3.299 -4.824 1.00 . A A . 11 SER HG 1 1 3 640 1 1 11 SER N N 4.971 -1.644 -2.151 1.00 . A A . 11 SER N 1 1 3 641 1 1 11 SER O O 7.717 -1.280 -4.433 1.00 . A A . 11 SER O 1 1 3 642 1 1 11 SER OG O 4.246 -2.549 -5.364 1.00 . A A . 11 SER OG 1 1 3 643 1 1 12 LEU C C 9.221 0.491 -2.078 1.00 . A A . 12 LEU C 1 1 3 644 1 1 12 LEU CA C 8.107 0.975 -3.010 1.00 . A A . 12 LEU CA 1 1 3 645 1 1 12 LEU CB C 7.605 2.352 -2.576 1.00 . A A . 12 LEU CB 1 1 3 646 1 1 12 LEU CD1 C 6.355 3.213 -4.560 1.00 . A A . 12 LEU CD1 1 1 3 647 1 1 12 LEU CD2 C 7.833 4.745 -3.256 1.00 . A A . 12 LEU CD2 1 1 3 648 1 1 12 LEU CG C 7.657 3.313 -3.766 1.00 . A A . 12 LEU CG 1 1 3 649 1 1 12 LEU H H 6.198 0.296 -2.275 1.00 . A A . 12 LEU H 1 1 3 650 1 1 12 LEU HA H 8.457 1.015 -4.029 1.00 . A A . 12 LEU HA 1 1 3 651 1 1 12 LEU HB2 H 6.587 2.269 -2.223 1.00 . A A . 12 LEU HB2 1 1 3 652 1 1 12 LEU HB3 H 8.231 2.730 -1.782 1.00 . A A . 12 LEU HB3 1 1 3 653 1 1 12 LEU HD11 H 5.515 3.259 -3.882 1.00 . A A . 12 LEU HD11 1 1 3 654 1 1 12 LEU HD12 H 6.333 2.276 -5.098 1.00 . A A . 12 LEU HD12 1 1 3 655 1 1 12 LEU HD13 H 6.298 4.032 -5.261 1.00 . A A . 12 LEU HD13 1 1 3 656 1 1 12 LEU HD21 H 7.344 4.849 -2.299 1.00 . A A . 12 LEU HD21 1 1 3 657 1 1 12 LEU HD22 H 7.394 5.434 -3.962 1.00 . A A . 12 LEU HD22 1 1 3 658 1 1 12 LEU HD23 H 8.886 4.962 -3.148 1.00 . A A . 12 LEU HD23 1 1 3 659 1 1 12 LEU HG H 8.490 3.050 -4.402 1.00 . A A . 12 LEU HG 1 1 3 660 1 1 12 LEU N N 6.919 0.080 -2.903 1.00 . A A . 12 LEU N 1 1 3 661 1 1 12 LEU O O 10.385 0.770 -2.290 1.00 . A A . 12 LEU O 1 1 3 662 1 1 13 PHE C C 11.065 -1.377 -0.878 1.00 . A A . 13 PHE C 1 1 3 663 1 1 13 PHE CA C 9.915 -0.728 -0.103 1.00 . A A . 13 PHE CA 1 1 3 664 1 1 13 PHE CB C 9.201 -1.767 0.764 1.00 . A A . 13 PHE CB 1 1 3 665 1 1 13 PHE CD1 C 9.487 -0.162 2.682 1.00 . A A . 13 PHE CD1 1 1 3 666 1 1 13 PHE CD2 C 9.733 -2.535 3.105 1.00 . A A . 13 PHE CD2 1 1 3 667 1 1 13 PHE CE1 C 9.746 0.107 4.028 1.00 . A A . 13 PHE CE1 1 1 3 668 1 1 13 PHE CE2 C 9.993 -2.267 4.454 1.00 . A A . 13 PHE CE2 1 1 3 669 1 1 13 PHE CG C 9.480 -1.482 2.219 1.00 . A A . 13 PHE CG 1 1 3 670 1 1 13 PHE CZ C 9.999 -0.946 4.917 1.00 . A A . 13 PHE CZ 1 1 3 671 1 1 13 PHE H H 7.931 -0.442 -0.893 1.00 . A A . 13 PHE H 1 1 3 672 1 1 13 PHE HA H 10.284 0.077 0.514 1.00 . A A . 13 PHE HA 1 1 3 673 1 1 13 PHE HB2 H 8.137 -1.714 0.584 1.00 . A A . 13 PHE HB2 1 1 3 674 1 1 13 PHE HB3 H 9.560 -2.753 0.515 1.00 . A A . 13 PHE HB3 1 1 3 675 1 1 13 PHE HD1 H 9.291 0.651 1.998 1.00 . A A . 13 PHE HD1 1 1 3 676 1 1 13 PHE HD2 H 9.727 -3.555 2.747 1.00 . A A . 13 PHE HD2 1 1 3 677 1 1 13 PHE HE1 H 9.751 1.125 4.382 1.00 . A A . 13 PHE HE1 1 1 3 678 1 1 13 PHE HE2 H 10.189 -3.080 5.139 1.00 . A A . 13 PHE HE2 1 1 3 679 1 1 13 PHE HZ H 10.200 -0.739 5.957 1.00 . A A . 13 PHE HZ 1 1 3 680 1 1 13 PHE N N 8.875 -0.229 -1.046 1.00 . A A . 13 PHE N 1 1 3 681 1 1 13 PHE O O 12.221 -1.092 -0.635 1.00 . A A . 13 PHE O 1 1 3 682 1 1 14 NH2 HN1 H 9.862 -2.478 -2.010 1.00 . A A . 14 NH2 HN1 1 1 3 683 1 1 14 NH2 HN2 H 11.520 -2.670 -2.315 1.00 . A A . 14 NH2 HN2 1 1 3 684 1 1 14 NH2 N N 10.793 -2.247 -1.812 1.00 . A A . 14 NH2 N 1 1 4 685 1 1 1 ILE C C -9.151 -1.831 0.292 1.00 . A A . 1 ILE C 1 1 4 686 1 1 1 ILE CA C -9.587 -1.540 -1.146 1.00 . A A . 1 ILE CA 1 1 4 687 1 1 1 ILE CB C -8.413 -1.719 -2.109 1.00 . A A . 1 ILE CB 1 1 4 688 1 1 1 ILE CD1 C -7.678 -1.500 -4.489 1.00 . A A . 1 ILE CD1 1 1 4 689 1 1 1 ILE CG1 C -8.837 -1.280 -3.513 1.00 . A A . 1 ILE CG1 1 1 4 690 1 1 1 ILE CG2 C -7.998 -3.191 -2.140 1.00 . A A . 1 ILE CG2 1 1 4 691 1 1 1 ILE H1 H -9.134 0.477 -1.401 1.00 . A A . 1 ILE H1 1 1 4 692 1 1 1 ILE H2 H -10.500 0.192 -0.433 1.00 . A A . 1 ILE H2 1 1 4 693 1 1 1 ILE H3 H -10.595 0.003 -2.118 1.00 . A A . 1 ILE H3 1 1 4 694 1 1 1 ILE HA H -10.400 -2.186 -1.433 1.00 . A A . 1 ILE HA 1 1 4 695 1 1 1 ILE HB H -7.580 -1.118 -1.777 1.00 . A A . 1 ILE HB 1 1 4 696 1 1 1 ILE HD11 H -6.759 -1.621 -3.934 1.00 . A A . 1 ILE HD11 1 1 4 697 1 1 1 ILE HD12 H -7.593 -0.645 -5.144 1.00 . A A . 1 ILE HD12 1 1 4 698 1 1 1 ILE HD13 H -7.865 -2.386 -5.076 1.00 . A A . 1 ILE HD13 1 1 4 699 1 1 1 ILE HG12 H -9.690 -1.863 -3.830 1.00 . A A . 1 ILE HG12 1 1 4 700 1 1 1 ILE HG13 H -9.099 -0.234 -3.500 1.00 . A A . 1 ILE HG13 1 1 4 701 1 1 1 ILE HG21 H -7.424 -3.385 -3.035 1.00 . A A . 1 ILE HG21 1 1 4 702 1 1 1 ILE HG22 H -8.880 -3.815 -2.135 1.00 . A A . 1 ILE HG22 1 1 4 703 1 1 1 ILE HG23 H -7.395 -3.413 -1.272 1.00 . A A . 1 ILE HG23 1 1 4 704 1 1 1 ILE N N -9.984 -0.109 -1.285 1.00 . A A . 1 ILE N 1 1 4 705 1 1 1 ILE O O -9.037 -0.940 1.110 1.00 . A A . 1 ILE O 1 1 4 706 1 1 2 LEU C C -7.322 -2.519 2.432 1.00 . A A . 2 LEU C 1 1 4 707 1 1 2 LEU CA C -8.480 -3.421 1.994 1.00 . A A . 2 LEU CA 1 1 4 708 1 1 2 LEU CB C -8.025 -4.878 1.917 1.00 . A A . 2 LEU CB 1 1 4 709 1 1 2 LEU CD1 C -9.624 -6.797 1.840 1.00 . A A . 2 LEU CD1 1 1 4 710 1 1 2 LEU CD2 C -8.177 -6.456 3.848 1.00 . A A . 2 LEU CD2 1 1 4 711 1 1 2 LEU CG C -8.971 -5.751 2.744 1.00 . A A . 2 LEU CG 1 1 4 712 1 1 2 LEU H H -9.004 -3.780 -0.066 1.00 . A A . 2 LEU H 1 1 4 713 1 1 2 LEU HA H -9.308 -3.328 2.678 1.00 . A A . 2 LEU HA 1 1 4 714 1 1 2 LEU HB2 H -8.039 -5.206 0.887 1.00 . A A . 2 LEU HB2 1 1 4 715 1 1 2 LEU HB3 H -7.023 -4.964 2.309 1.00 . A A . 2 LEU HB3 1 1 4 716 1 1 2 LEU HD11 H -8.858 -7.340 1.307 1.00 . A A . 2 LEU HD11 1 1 4 717 1 1 2 LEU HD12 H -10.275 -6.304 1.133 1.00 . A A . 2 LEU HD12 1 1 4 718 1 1 2 LEU HD13 H -10.200 -7.484 2.442 1.00 . A A . 2 LEU HD13 1 1 4 719 1 1 2 LEU HD21 H -7.618 -7.275 3.421 1.00 . A A . 2 LEU HD21 1 1 4 720 1 1 2 LEU HD22 H -8.859 -6.835 4.595 1.00 . A A . 2 LEU HD22 1 1 4 721 1 1 2 LEU HD23 H -7.496 -5.754 4.305 1.00 . A A . 2 LEU HD23 1 1 4 722 1 1 2 LEU HG H -9.736 -5.131 3.189 1.00 . A A . 2 LEU HG 1 1 4 723 1 1 2 LEU N N -8.906 -3.074 0.608 1.00 . A A . 2 LEU N 1 1 4 724 1 1 2 LEU O O -7.086 -2.321 3.608 1.00 . A A . 2 LEU O 1 1 4 725 1 1 3 GLY C C -4.836 -0.502 0.590 1.00 . A A . 3 GLY C 1 1 4 726 1 1 3 GLY CA C -5.457 -1.082 1.859 1.00 . A A . 3 GLY CA 1 1 4 727 1 1 3 GLY H H -6.804 -2.141 0.553 1.00 . A A . 3 GLY H 1 1 4 728 1 1 3 GLY HA2 H -5.814 -0.278 2.487 1.00 . A A . 3 GLY HA2 1 1 4 729 1 1 3 GLY HA3 H -4.713 -1.650 2.390 1.00 . A A . 3 GLY HA3 1 1 4 730 1 1 3 GLY N N -6.597 -1.970 1.495 1.00 . A A . 3 GLY N 1 1 4 731 1 1 3 GLY O O -3.767 -0.901 0.171 1.00 . A A . 3 GLY O 1 1 4 732 1 1 4 LYS C C -3.712 1.893 -0.926 1.00 . A A . 4 LYS C 1 1 4 733 1 1 4 LYS CA C -4.941 1.050 -1.263 1.00 . A A . 4 LYS CA 1 1 4 734 1 1 4 LYS CB C -6.065 1.929 -1.812 1.00 . A A . 4 LYS CB 1 1 4 735 1 1 4 LYS CD C -4.771 2.037 -3.948 1.00 . A A . 4 LYS CD 1 1 4 736 1 1 4 LYS CE C -4.882 2.011 -5.474 1.00 . A A . 4 LYS CE 1 1 4 737 1 1 4 LYS CG C -6.145 1.769 -3.331 1.00 . A A . 4 LYS CG 1 1 4 738 1 1 4 LYS H H -6.352 0.746 0.337 1.00 . A A . 4 LYS H 1 1 4 739 1 1 4 LYS HA H -4.687 0.286 -1.977 1.00 . A A . 4 LYS HA 1 1 4 740 1 1 4 LYS HB2 H -7.004 1.631 -1.367 1.00 . A A . 4 LYS HB2 1 1 4 741 1 1 4 LYS HB3 H -5.865 2.962 -1.572 1.00 . A A . 4 LYS HB3 1 1 4 742 1 1 4 LYS HD2 H -4.417 3.006 -3.629 1.00 . A A . 4 LYS HD2 1 1 4 743 1 1 4 LYS HD3 H -4.077 1.276 -3.626 1.00 . A A . 4 LYS HD3 1 1 4 744 1 1 4 LYS HE2 H -3.980 1.600 -5.908 1.00 . A A . 4 LYS HE2 1 1 4 745 1 1 4 LYS HE3 H -5.744 1.437 -5.779 1.00 . A A . 4 LYS HE3 1 1 4 746 1 1 4 LYS HG2 H -6.458 0.761 -3.570 1.00 . A A . 4 LYS HG2 1 1 4 747 1 1 4 LYS HG3 H -6.860 2.472 -3.730 1.00 . A A . 4 LYS HG3 1 1 4 748 1 1 4 LYS HZ1 H -4.174 3.958 -5.671 1.00 . A A . 4 LYS HZ1 1 1 4 749 1 1 4 LYS HZ2 H -5.835 3.855 -5.333 1.00 . A A . 4 LYS HZ2 1 1 4 750 1 1 4 LYS HZ3 H -5.258 3.490 -6.889 1.00 . A A . 4 LYS HZ3 1 1 4 751 1 1 4 LYS N N -5.495 0.439 -0.022 1.00 . A A . 4 LYS N 1 1 4 752 1 1 4 LYS NZ N -5.050 3.436 -5.872 1.00 . A A . 4 LYS NZ 1 1 4 753 1 1 4 LYS O O -2.738 1.912 -1.652 1.00 . A A . 4 LYS O 1 1 4 754 1 1 5 ILE C C -1.443 2.532 1.059 1.00 . A A . 5 ILE C 1 1 4 755 1 1 5 ILE CA C -2.584 3.425 0.571 1.00 . A A . 5 ILE CA 1 1 4 756 1 1 5 ILE CB C -3.100 4.306 1.708 1.00 . A A . 5 ILE CB 1 1 4 757 1 1 5 ILE CD1 C -3.180 6.442 0.408 1.00 . A A . 5 ILE CD1 1 1 4 758 1 1 5 ILE CG1 C -4.018 5.389 1.135 1.00 . A A . 5 ILE CG1 1 1 4 759 1 1 5 ILE CG2 C -1.918 4.961 2.426 1.00 . A A . 5 ILE CG2 1 1 4 760 1 1 5 ILE H H -4.545 2.552 0.747 1.00 . A A . 5 ILE H 1 1 4 761 1 1 5 ILE HA H -2.261 4.037 -0.254 1.00 . A A . 5 ILE HA 1 1 4 762 1 1 5 ILE HB H -3.653 3.697 2.409 1.00 . A A . 5 ILE HB 1 1 4 763 1 1 5 ILE HD11 H -3.561 6.576 -0.595 1.00 . A A . 5 ILE HD11 1 1 4 764 1 1 5 ILE HD12 H -2.151 6.114 0.360 1.00 . A A . 5 ILE HD12 1 1 4 765 1 1 5 ILE HD13 H -3.234 7.378 0.942 1.00 . A A . 5 ILE HD13 1 1 4 766 1 1 5 ILE HG12 H -4.714 4.939 0.442 1.00 . A A . 5 ILE HG12 1 1 4 767 1 1 5 ILE HG13 H -4.564 5.858 1.939 1.00 . A A . 5 ILE HG13 1 1 4 768 1 1 5 ILE HG21 H -1.710 4.426 3.340 1.00 . A A . 5 ILE HG21 1 1 4 769 1 1 5 ILE HG22 H -2.162 5.987 2.656 1.00 . A A . 5 ILE HG22 1 1 4 770 1 1 5 ILE HG23 H -1.048 4.932 1.787 1.00 . A A . 5 ILE HG23 1 1 4 771 1 1 5 ILE N N -3.750 2.587 0.175 1.00 . A A . 5 ILE N 1 1 4 772 1 1 5 ILE O O -0.281 2.860 0.923 1.00 . A A . 5 ILE O 1 1 4 773 1 1 6 TRP C C -0.128 -0.331 0.958 1.00 . A A . 6 TRP C 1 1 4 774 1 1 6 TRP CA C -0.703 0.484 2.119 1.00 . A A . 6 TRP CA 1 1 4 775 1 1 6 TRP CB C -1.405 -0.430 3.126 1.00 . A A . 6 TRP CB 1 1 4 776 1 1 6 TRP CD1 C -0.937 -2.909 3.278 1.00 . A A . 6 TRP CD1 1 1 4 777 1 1 6 TRP CD2 C 0.841 -1.657 3.858 1.00 . A A . 6 TRP CD2 1 1 4 778 1 1 6 TRP CE2 C 1.237 -3.010 3.985 1.00 . A A . 6 TRP CE2 1 1 4 779 1 1 6 TRP CE3 C 1.782 -0.659 4.165 1.00 . A A . 6 TRP CE3 1 1 4 780 1 1 6 TRP CG C -0.545 -1.621 3.406 1.00 . A A . 6 TRP CG 1 1 4 781 1 1 6 TRP CH2 C 3.445 -2.354 4.705 1.00 . A A . 6 TRP CH2 1 1 4 782 1 1 6 TRP CZ2 C 2.522 -3.359 4.403 1.00 . A A . 6 TRP CZ2 1 1 4 783 1 1 6 TRP CZ3 C 3.076 -1.007 4.587 1.00 . A A . 6 TRP CZ3 1 1 4 784 1 1 6 TRP H H -2.711 1.156 1.721 1.00 . A A . 6 TRP H 1 1 4 785 1 1 6 TRP HA H 0.077 1.042 2.609 1.00 . A A . 6 TRP HA 1 1 4 786 1 1 6 TRP HB2 H -1.577 0.113 4.044 1.00 . A A . 6 TRP HB2 1 1 4 787 1 1 6 TRP HB3 H -2.350 -0.756 2.717 1.00 . A A . 6 TRP HB3 1 1 4 788 1 1 6 TRP HD1 H -1.914 -3.240 2.959 1.00 . A A . 6 TRP HD1 1 1 4 789 1 1 6 TRP HE1 H 0.098 -4.714 3.610 1.00 . A A . 6 TRP HE1 1 1 4 790 1 1 6 TRP HE3 H 1.508 0.383 4.078 1.00 . A A . 6 TRP HE3 1 1 4 791 1 1 6 TRP HH2 H 4.441 -2.616 5.029 1.00 . A A . 6 TRP HH2 1 1 4 792 1 1 6 TRP HZ2 H 2.801 -4.399 4.492 1.00 . A A . 6 TRP HZ2 1 1 4 793 1 1 6 TRP HZ3 H 3.791 -0.232 4.821 1.00 . A A . 6 TRP HZ3 1 1 4 794 1 1 6 TRP N N -1.767 1.402 1.624 1.00 . A A . 6 TRP N 1 1 4 795 1 1 6 TRP NE1 N 0.120 -3.734 3.619 1.00 . A A . 6 TRP NE1 1 1 4 796 1 1 6 TRP O O 1.042 -0.656 0.934 1.00 . A A . 6 TRP O 1 1 4 797 1 1 7 GLU C C 0.676 -0.684 -1.879 1.00 . A A . 7 GLU C 1 1 4 798 1 1 7 GLU CA C -0.440 -1.451 -1.165 1.00 . A A . 7 GLU CA 1 1 4 799 1 1 7 GLU CB C -1.649 -1.621 -2.085 1.00 . A A . 7 GLU CB 1 1 4 800 1 1 7 GLU CD C -3.126 -3.629 -2.250 1.00 . A A . 7 GLU CD 1 1 4 801 1 1 7 GLU CG C -1.732 -3.074 -2.554 1.00 . A A . 7 GLU CG 1 1 4 802 1 1 7 GLU H H -1.882 -0.385 0.031 1.00 . A A . 7 GLU H 1 1 4 803 1 1 7 GLU HA H -0.086 -2.415 -0.838 1.00 . A A . 7 GLU HA 1 1 4 804 1 1 7 GLU HB2 H -2.549 -1.361 -1.548 1.00 . A A . 7 GLU HB2 1 1 4 805 1 1 7 GLU HB3 H -1.541 -0.974 -2.944 1.00 . A A . 7 GLU HB3 1 1 4 806 1 1 7 GLU HG2 H -1.550 -3.120 -3.618 1.00 . A A . 7 GLU HG2 1 1 4 807 1 1 7 GLU HG3 H -0.991 -3.664 -2.035 1.00 . A A . 7 GLU HG3 1 1 4 808 1 1 7 GLU N N -0.942 -0.660 -0.006 1.00 . A A . 7 GLU N 1 1 4 809 1 1 7 GLU O O 1.547 -1.263 -2.494 1.00 . A A . 7 GLU O 1 1 4 810 1 1 7 GLU OE1 O -3.681 -3.256 -1.230 1.00 . A A . 7 GLU OE1 1 1 4 811 1 1 7 GLU OE2 O -3.613 -4.419 -3.042 1.00 . A A . 7 GLU OE2 1 1 4 812 1 1 8 GLY C C 2.940 1.509 -1.570 1.00 . A A . 8 GLY C 1 1 4 813 1 1 8 GLY CA C 1.709 1.425 -2.471 1.00 . A A . 8 GLY CA 1 1 4 814 1 1 8 GLY H H -0.062 1.065 -1.297 1.00 . A A . 8 GLY H 1 1 4 815 1 1 8 GLY HA2 H 1.977 0.958 -3.406 1.00 . A A . 8 GLY HA2 1 1 4 816 1 1 8 GLY HA3 H 1.337 2.422 -2.659 1.00 . A A . 8 GLY HA3 1 1 4 817 1 1 8 GLY N N 0.652 0.618 -1.800 1.00 . A A . 8 GLY N 1 1 4 818 1 1 8 GLY O O 4.062 1.536 -2.037 1.00 . A A . 8 GLY O 1 1 4 819 1 1 9 ILE C C 4.779 0.380 0.512 1.00 . A A . 9 ILE C 1 1 4 820 1 1 9 ILE CA C 3.906 1.631 0.649 1.00 . A A . 9 ILE CA 1 1 4 821 1 1 9 ILE CB C 3.294 1.707 2.048 1.00 . A A . 9 ILE CB 1 1 4 822 1 1 9 ILE CD1 C 2.251 3.267 3.703 1.00 . A A . 9 ILE CD1 1 1 4 823 1 1 9 ILE CG1 C 2.590 3.055 2.224 1.00 . A A . 9 ILE CG1 1 1 4 824 1 1 9 ILE CG2 C 4.400 1.568 3.096 1.00 . A A . 9 ILE CG2 1 1 4 825 1 1 9 ILE H H 1.830 1.527 0.074 1.00 . A A . 9 ILE H 1 1 4 826 1 1 9 ILE HA H 4.485 2.519 0.452 1.00 . A A . 9 ILE HA 1 1 4 827 1 1 9 ILE HB H 2.580 0.906 2.172 1.00 . A A . 9 ILE HB 1 1 4 828 1 1 9 ILE HD11 H 1.373 3.891 3.785 1.00 . A A . 9 ILE HD11 1 1 4 829 1 1 9 ILE HD12 H 3.083 3.749 4.196 1.00 . A A . 9 ILE HD12 1 1 4 830 1 1 9 ILE HD13 H 2.060 2.312 4.169 1.00 . A A . 9 ILE HD13 1 1 4 831 1 1 9 ILE HG12 H 3.241 3.848 1.886 1.00 . A A . 9 ILE HG12 1 1 4 832 1 1 9 ILE HG13 H 1.680 3.063 1.645 1.00 . A A . 9 ILE HG13 1 1 4 833 1 1 9 ILE HG21 H 4.912 0.627 2.958 1.00 . A A . 9 ILE HG21 1 1 4 834 1 1 9 ILE HG22 H 3.966 1.599 4.084 1.00 . A A . 9 ILE HG22 1 1 4 835 1 1 9 ILE HG23 H 5.105 2.380 2.986 1.00 . A A . 9 ILE HG23 1 1 4 836 1 1 9 ILE N N 2.742 1.550 -0.281 1.00 . A A . 9 ILE N 1 1 4 837 1 1 9 ILE O O 5.890 0.437 0.025 1.00 . A A . 9 ILE O 1 1 4 838 1 1 10 LYS C C 5.527 -2.227 -0.614 1.00 . A A . 10 LYS C 1 1 4 839 1 1 10 LYS CA C 5.083 -2.003 0.834 1.00 . A A . 10 LYS CA 1 1 4 840 1 1 10 LYS CB C 4.133 -3.115 1.281 1.00 . A A . 10 LYS CB 1 1 4 841 1 1 10 LYS CD C 1.946 -4.228 0.805 1.00 . A A . 10 LYS CD 1 1 4 842 1 1 10 LYS CE C 2.640 -5.515 1.259 1.00 . A A . 10 LYS CE 1 1 4 843 1 1 10 LYS CG C 2.990 -3.246 0.271 1.00 . A A . 10 LYS CG 1 1 4 844 1 1 10 LYS H H 3.383 -0.773 1.328 1.00 . A A . 10 LYS H 1 1 4 845 1 1 10 LYS HA H 5.937 -1.961 1.489 1.00 . A A . 10 LYS HA 1 1 4 846 1 1 10 LYS HB2 H 4.674 -4.048 1.337 1.00 . A A . 10 LYS HB2 1 1 4 847 1 1 10 LYS HB3 H 3.727 -2.874 2.252 1.00 . A A . 10 LYS HB3 1 1 4 848 1 1 10 LYS HD2 H 1.428 -3.782 1.643 1.00 . A A . 10 LYS HD2 1 1 4 849 1 1 10 LYS HD3 H 1.237 -4.459 0.025 1.00 . A A . 10 LYS HD3 1 1 4 850 1 1 10 LYS HE2 H 3.139 -5.987 0.423 1.00 . A A . 10 LYS HE2 1 1 4 851 1 1 10 LYS HE3 H 3.344 -5.305 2.049 1.00 . A A . 10 LYS HE3 1 1 4 852 1 1 10 LYS HG2 H 2.533 -2.279 0.119 1.00 . A A . 10 LYS HG2 1 1 4 853 1 1 10 LYS HG3 H 3.379 -3.613 -0.667 1.00 . A A . 10 LYS HG3 1 1 4 854 1 1 10 LYS HZ1 H 1.925 -7.053 2.466 1.00 . A A . 10 LYS HZ1 1 1 4 855 1 1 10 LYS HZ2 H 1.119 -6.908 0.977 1.00 . A A . 10 LYS HZ2 1 1 4 856 1 1 10 LYS HZ3 H 0.816 -5.794 2.223 1.00 . A A . 10 LYS HZ3 1 1 4 857 1 1 10 LYS N N 4.283 -0.748 0.938 1.00 . A A . 10 LYS N 1 1 4 858 1 1 10 LYS NZ N 1.542 -6.383 1.769 1.00 . A A . 10 LYS NZ 1 1 4 859 1 1 10 LYS O O 6.524 -2.871 -0.876 1.00 . A A . 10 LYS O 1 1 4 860 1 1 11 SER C C 6.312 -0.934 -3.362 1.00 . A A . 11 SER C 1 1 4 861 1 1 11 SER CA C 5.175 -1.888 -2.988 1.00 . A A . 11 SER CA 1 1 4 862 1 1 11 SER CB C 3.912 -1.551 -3.780 1.00 . A A . 11 SER CB 1 1 4 863 1 1 11 SER H H 3.993 -1.187 -1.326 1.00 . A A . 11 SER H 1 1 4 864 1 1 11 SER HA H 5.464 -2.908 -3.171 1.00 . A A . 11 SER HA 1 1 4 865 1 1 11 SER HB2 H 3.255 -2.404 -3.793 1.00 . A A . 11 SER HB2 1 1 4 866 1 1 11 SER HB3 H 3.407 -0.716 -3.313 1.00 . A A . 11 SER HB3 1 1 4 867 1 1 11 SER HG H 3.763 -0.446 -5.375 1.00 . A A . 11 SER HG 1 1 4 868 1 1 11 SER N N 4.794 -1.702 -1.558 1.00 . A A . 11 SER N 1 1 4 869 1 1 11 SER O O 7.118 -1.220 -4.225 1.00 . A A . 11 SER O 1 1 4 870 1 1 11 SER OG O 4.271 -1.218 -5.116 1.00 . A A . 11 SER OG 1 1 4 871 1 1 12 LEU C C 8.830 0.586 -2.650 1.00 . A A . 12 LEU C 1 1 4 872 1 1 12 LEU CA C 7.469 1.169 -3.037 1.00 . A A . 12 LEU CA 1 1 4 873 1 1 12 LEU CB C 7.155 2.405 -2.195 1.00 . A A . 12 LEU CB 1 1 4 874 1 1 12 LEU CD1 C 5.683 4.421 -2.098 1.00 . A A . 12 LEU CD1 1 1 4 875 1 1 12 LEU CD2 C 7.259 4.115 -4.012 1.00 . A A . 12 LEU CD2 1 1 4 876 1 1 12 LEU CG C 6.336 3.396 -3.025 1.00 . A A . 12 LEU CG 1 1 4 877 1 1 12 LEU H H 5.724 0.410 -2.026 1.00 . A A . 12 LEU H 1 1 4 878 1 1 12 LEU HA H 7.453 1.423 -4.085 1.00 . A A . 12 LEU HA 1 1 4 879 1 1 12 LEU HB2 H 6.589 2.111 -1.322 1.00 . A A . 12 LEU HB2 1 1 4 880 1 1 12 LEU HB3 H 8.078 2.874 -1.885 1.00 . A A . 12 LEU HB3 1 1 4 881 1 1 12 LEU HD11 H 4.686 4.093 -1.843 1.00 . A A . 12 LEU HD11 1 1 4 882 1 1 12 LEU HD12 H 5.629 5.376 -2.600 1.00 . A A . 12 LEU HD12 1 1 4 883 1 1 12 LEU HD13 H 6.271 4.520 -1.198 1.00 . A A . 12 LEU HD13 1 1 4 884 1 1 12 LEU HD21 H 6.841 4.054 -5.006 1.00 . A A . 12 LEU HD21 1 1 4 885 1 1 12 LEU HD22 H 8.232 3.648 -4.002 1.00 . A A . 12 LEU HD22 1 1 4 886 1 1 12 LEU HD23 H 7.354 5.152 -3.725 1.00 . A A . 12 LEU HD23 1 1 4 887 1 1 12 LEU HG H 5.570 2.861 -3.568 1.00 . A A . 12 LEU HG 1 1 4 888 1 1 12 LEU N N 6.384 0.198 -2.718 1.00 . A A . 12 LEU N 1 1 4 889 1 1 12 LEU O O 9.849 0.938 -3.208 1.00 . A A . 12 LEU O 1 1 4 890 1 1 13 PHE C C 10.547 -2.030 -2.234 1.00 . A A . 13 PHE C 1 1 4 891 1 1 13 PHE CA C 10.147 -0.909 -1.271 1.00 . A A . 13 PHE CA 1 1 4 892 1 1 13 PHE CB C 9.882 -1.470 0.125 1.00 . A A . 13 PHE CB 1 1 4 893 1 1 13 PHE CD1 C 11.112 0.547 0.985 1.00 . A A . 13 PHE CD1 1 1 4 894 1 1 13 PHE CD2 C 11.377 -1.560 2.153 1.00 . A A . 13 PHE CD2 1 1 4 895 1 1 13 PHE CE1 C 11.975 1.162 1.896 1.00 . A A . 13 PHE CE1 1 1 4 896 1 1 13 PHE CE2 C 12.242 -0.944 3.067 1.00 . A A . 13 PHE CE2 1 1 4 897 1 1 13 PHE CG C 10.812 -0.812 1.113 1.00 . A A . 13 PHE CG 1 1 4 898 1 1 13 PHE CZ C 12.540 0.418 2.937 1.00 . A A . 13 PHE CZ 1 1 4 899 1 1 13 PHE H H 8.018 -0.573 -1.257 1.00 . A A . 13 PHE H 1 1 4 900 1 1 13 PHE HA H 10.919 -0.156 -1.226 1.00 . A A . 13 PHE HA 1 1 4 901 1 1 13 PHE HB2 H 8.859 -1.268 0.407 1.00 . A A . 13 PHE HB2 1 1 4 902 1 1 13 PHE HB3 H 10.053 -2.537 0.126 1.00 . A A . 13 PHE HB3 1 1 4 903 1 1 13 PHE HD1 H 10.675 1.123 0.182 1.00 . A A . 13 PHE HD1 1 1 4 904 1 1 13 PHE HD2 H 11.146 -2.610 2.251 1.00 . A A . 13 PHE HD2 1 1 4 905 1 1 13 PHE HE1 H 12.203 2.211 1.794 1.00 . A A . 13 PHE HE1 1 1 4 906 1 1 13 PHE HE2 H 12.677 -1.519 3.870 1.00 . A A . 13 PHE HE2 1 1 4 907 1 1 13 PHE HZ H 13.207 0.893 3.641 1.00 . A A . 13 PHE HZ 1 1 4 908 1 1 13 PHE N N 8.853 -0.303 -1.695 1.00 . A A . 13 PHE N 1 1 4 909 1 1 13 PHE O O 9.714 -2.591 -2.919 1.00 . A A . 13 PHE O 1 1 4 910 1 1 14 NH2 HN1 H 12.474 -1.932 -1.767 1.00 . A A . 14 NH2 HN1 1 1 4 911 1 1 14 NH2 HN2 H 12.069 -3.098 -2.933 1.00 . A A . 14 NH2 HN2 1 1 4 912 1 1 14 NH2 N N 11.801 -2.383 -2.318 1.00 . A A . 14 NH2 N 1 1 5 913 1 1 1 ILE C C -9.488 -2.577 1.997 1.00 . A A . 1 ILE C 1 1 5 914 1 1 1 ILE CA C -10.150 -2.429 0.625 1.00 . A A . 1 ILE CA 1 1 5 915 1 1 1 ILE CB C -9.359 -1.455 -0.251 1.00 . A A . 1 ILE CB 1 1 5 916 1 1 1 ILE CD1 C -7.839 -1.790 -2.206 1.00 . A A . 1 ILE CD1 1 1 5 917 1 1 1 ILE CG1 C -8.076 -2.134 -0.734 1.00 . A A . 1 ILE CG1 1 1 5 918 1 1 1 ILE CG2 C -9.001 -0.210 0.563 1.00 . A A . 1 ILE CG2 1 1 5 919 1 1 1 ILE H1 H -12.124 -2.165 0.015 1.00 . A A . 1 ILE H1 1 1 5 920 1 1 1 ILE H2 H -11.416 -0.776 0.690 1.00 . A A . 1 ILE H2 1 1 5 921 1 1 1 ILE H3 H -11.900 -2.060 1.693 1.00 . A A . 1 ILE H3 1 1 5 922 1 1 1 ILE HA H -10.223 -3.387 0.136 1.00 . A A . 1 ILE HA 1 1 5 923 1 1 1 ILE HB H -9.960 -1.168 -1.101 1.00 . A A . 1 ILE HB 1 1 5 924 1 1 1 ILE HD11 H -8.173 -2.608 -2.825 1.00 . A A . 1 ILE HD11 1 1 5 925 1 1 1 ILE HD12 H -6.785 -1.620 -2.370 1.00 . A A . 1 ILE HD12 1 1 5 926 1 1 1 ILE HD13 H -8.392 -0.897 -2.460 1.00 . A A . 1 ILE HD13 1 1 5 927 1 1 1 ILE HG12 H -7.240 -1.787 -0.143 1.00 . A A . 1 ILE HG12 1 1 5 928 1 1 1 ILE HG13 H -8.172 -3.204 -0.628 1.00 . A A . 1 ILE HG13 1 1 5 929 1 1 1 ILE HG21 H -7.992 -0.303 0.937 1.00 . A A . 1 ILE HG21 1 1 5 930 1 1 1 ILE HG22 H -9.686 -0.113 1.393 1.00 . A A . 1 ILE HG22 1 1 5 931 1 1 1 ILE HG23 H -9.071 0.664 -0.067 1.00 . A A . 1 ILE HG23 1 1 5 932 1 1 1 ILE N N -11.499 -1.810 0.766 1.00 . A A . 1 ILE N 1 1 5 933 1 1 1 ILE O O -9.840 -1.899 2.943 1.00 . A A . 1 ILE O 1 1 5 934 1 1 2 LEU C C -6.717 -2.632 3.586 1.00 . A A . 2 LEU C 1 1 5 935 1 1 2 LEU CA C -7.851 -3.649 3.427 1.00 . A A . 2 LEU CA 1 1 5 936 1 1 2 LEU CB C -7.293 -5.072 3.380 1.00 . A A . 2 LEU CB 1 1 5 937 1 1 2 LEU CD1 C -7.539 -6.240 5.575 1.00 . A A . 2 LEU CD1 1 1 5 938 1 1 2 LEU CD2 C -5.317 -6.176 4.436 1.00 . A A . 2 LEU CD2 1 1 5 939 1 1 2 LEU CG C -6.605 -5.396 4.708 1.00 . A A . 2 LEU CG 1 1 5 940 1 1 2 LEU H H -8.265 -3.995 1.340 1.00 . A A . 2 LEU H 1 1 5 941 1 1 2 LEU HA H -8.557 -3.557 4.236 1.00 . A A . 2 LEU HA 1 1 5 942 1 1 2 LEU HB2 H -8.100 -5.770 3.212 1.00 . A A . 2 LEU HB2 1 1 5 943 1 1 2 LEU HB3 H -6.576 -5.151 2.577 1.00 . A A . 2 LEU HB3 1 1 5 944 1 1 2 LEU HD11 H -7.774 -7.160 5.061 1.00 . A A . 2 LEU HD11 1 1 5 945 1 1 2 LEU HD12 H -8.450 -5.690 5.765 1.00 . A A . 2 LEU HD12 1 1 5 946 1 1 2 LEU HD13 H -7.053 -6.466 6.512 1.00 . A A . 2 LEU HD13 1 1 5 947 1 1 2 LEU HD21 H -4.504 -5.485 4.270 1.00 . A A . 2 LEU HD21 1 1 5 948 1 1 2 LEU HD22 H -5.448 -6.795 3.560 1.00 . A A . 2 LEU HD22 1 1 5 949 1 1 2 LEU HD23 H -5.089 -6.802 5.286 1.00 . A A . 2 LEU HD23 1 1 5 950 1 1 2 LEU HG H -6.369 -4.477 5.224 1.00 . A A . 2 LEU HG 1 1 5 951 1 1 2 LEU N N -8.533 -3.459 2.115 1.00 . A A . 2 LEU N 1 1 5 952 1 1 2 LEU O O -6.164 -2.466 4.656 1.00 . A A . 2 LEU O 1 1 5 953 1 1 3 GLY C C -4.864 -0.494 1.224 1.00 . A A . 3 GLY C 1 1 5 954 1 1 3 GLY CA C -5.269 -0.945 2.626 1.00 . A A . 3 GLY CA 1 1 5 955 1 1 3 GLY H H -6.824 -2.096 1.678 1.00 . A A . 3 GLY H 1 1 5 956 1 1 3 GLY HA2 H -5.609 -0.092 3.195 1.00 . A A . 3 GLY HA2 1 1 5 957 1 1 3 GLY HA3 H -4.417 -1.389 3.116 1.00 . A A . 3 GLY HA3 1 1 5 958 1 1 3 GLY N N -6.366 -1.949 2.531 1.00 . A A . 3 GLY N 1 1 5 959 1 1 3 GLY O O -3.915 -0.992 0.650 1.00 . A A . 3 GLY O 1 1 5 960 1 1 4 LYS C C -3.925 1.741 -0.637 1.00 . A A . 4 LYS C 1 1 5 961 1 1 4 LYS CA C -5.222 0.935 -0.695 1.00 . A A . 4 LYS CA 1 1 5 962 1 1 4 LYS CB C -6.392 1.824 -1.115 1.00 . A A . 4 LYS CB 1 1 5 963 1 1 4 LYS CD C -5.957 3.064 -3.242 1.00 . A A . 4 LYS CD 1 1 5 964 1 1 4 LYS CE C -6.431 3.208 -4.689 1.00 . A A . 4 LYS CE 1 1 5 965 1 1 4 LYS CG C -6.542 1.786 -2.638 1.00 . A A . 4 LYS CG 1 1 5 966 1 1 4 LYS H H -6.329 0.840 1.151 1.00 . A A . 4 LYS H 1 1 5 967 1 1 4 LYS HA H -5.120 0.108 -1.375 1.00 . A A . 4 LYS HA 1 1 5 968 1 1 4 LYS HB2 H -7.301 1.465 -0.655 1.00 . A A . 4 LYS HB2 1 1 5 969 1 1 4 LYS HB3 H -6.206 2.839 -0.801 1.00 . A A . 4 LYS HB3 1 1 5 970 1 1 4 LYS HD2 H -6.287 3.917 -2.667 1.00 . A A . 4 LYS HD2 1 1 5 971 1 1 4 LYS HD3 H -4.879 3.011 -3.222 1.00 . A A . 4 LYS HD3 1 1 5 972 1 1 4 LYS HE2 H -7.498 3.042 -4.753 1.00 . A A . 4 LYS HE2 1 1 5 973 1 1 4 LYS HE3 H -6.177 4.184 -5.074 1.00 . A A . 4 LYS HE3 1 1 5 974 1 1 4 LYS HG2 H -6.015 0.927 -3.029 1.00 . A A . 4 LYS HG2 1 1 5 975 1 1 4 LYS HG3 H -7.588 1.714 -2.895 1.00 . A A . 4 LYS HG3 1 1 5 976 1 1 4 LYS HZ1 H -4.672 2.264 -5.280 1.00 . A A . 4 LYS HZ1 1 1 5 977 1 1 4 LYS HZ2 H -5.896 2.251 -6.458 1.00 . A A . 4 LYS HZ2 1 1 5 978 1 1 4 LYS HZ3 H -5.996 1.217 -5.114 1.00 . A A . 4 LYS HZ3 1 1 5 979 1 1 4 LYS N N -5.571 0.449 0.669 1.00 . A A . 4 LYS N 1 1 5 980 1 1 4 LYS NZ N -5.693 2.155 -5.442 1.00 . A A . 4 LYS NZ 1 1 5 981 1 1 4 LYS O O -3.044 1.582 -1.459 1.00 . A A . 4 LYS O 1 1 5 982 1 1 5 ILE C C -1.409 2.517 0.928 1.00 . A A . 5 ILE C 1 1 5 983 1 1 5 ILE CA C -2.561 3.408 0.461 1.00 . A A . 5 ILE CA 1 1 5 984 1 1 5 ILE CB C -2.887 4.467 1.513 1.00 . A A . 5 ILE CB 1 1 5 985 1 1 5 ILE CD1 C -3.117 6.357 -0.105 1.00 . A A . 5 ILE CD1 1 1 5 986 1 1 5 ILE CG1 C -3.855 5.492 0.919 1.00 . A A . 5 ILE CG1 1 1 5 987 1 1 5 ILE CG2 C -1.600 5.171 1.947 1.00 . A A . 5 ILE CG2 1 1 5 988 1 1 5 ILE H H -4.524 2.699 0.987 1.00 . A A . 5 ILE H 1 1 5 989 1 1 5 ILE HA H -2.320 3.880 -0.478 1.00 . A A . 5 ILE HA 1 1 5 990 1 1 5 ILE HB H -3.343 3.992 2.370 1.00 . A A . 5 ILE HB 1 1 5 991 1 1 5 ILE HD11 H -3.749 6.511 -0.968 1.00 . A A . 5 ILE HD11 1 1 5 992 1 1 5 ILE HD12 H -2.209 5.858 -0.409 1.00 . A A . 5 ILE HD12 1 1 5 993 1 1 5 ILE HD13 H -2.874 7.310 0.337 1.00 . A A . 5 ILE HD13 1 1 5 994 1 1 5 ILE HG12 H -4.672 4.977 0.436 1.00 . A A . 5 ILE HG12 1 1 5 995 1 1 5 ILE HG13 H -4.241 6.121 1.707 1.00 . A A . 5 ILE HG13 1 1 5 996 1 1 5 ILE HG21 H -0.922 4.450 2.377 1.00 . A A . 5 ILE HG21 1 1 5 997 1 1 5 ILE HG22 H -1.834 5.929 2.680 1.00 . A A . 5 ILE HG22 1 1 5 998 1 1 5 ILE HG23 H -1.136 5.633 1.087 1.00 . A A . 5 ILE HG23 1 1 5 999 1 1 5 ILE N N -3.802 2.597 0.335 1.00 . A A . 5 ILE N 1 1 5 1000 1 1 5 ILE O O -0.257 2.765 0.632 1.00 . A A . 5 ILE O 1 1 5 1001 1 1 6 TRP C C -0.173 -0.341 0.995 1.00 . A A . 6 TRP C 1 1 5 1002 1 1 6 TRP CA C -0.644 0.562 2.136 1.00 . A A . 6 TRP CA 1 1 5 1003 1 1 6 TRP CB C -1.297 -0.264 3.245 1.00 . A A . 6 TRP CB 1 1 5 1004 1 1 6 TRP CD1 C -0.721 -2.723 3.238 1.00 . A A . 6 TRP CD1 1 1 5 1005 1 1 6 TRP CD2 C 0.842 -1.473 4.264 1.00 . A A . 6 TRP CD2 1 1 5 1006 1 1 6 TRP CE2 C 1.286 -2.815 4.332 1.00 . A A . 6 TRP CE2 1 1 5 1007 1 1 6 TRP CE3 C 1.651 -0.478 4.842 1.00 . A A . 6 TRP CE3 1 1 5 1008 1 1 6 TRP CG C -0.436 -1.443 3.564 1.00 . A A . 6 TRP CG 1 1 5 1009 1 1 6 TRP CH2 C 3.282 -2.155 5.518 1.00 . A A . 6 TRP CH2 1 1 5 1010 1 1 6 TRP CZ2 C 2.490 -3.157 4.949 1.00 . A A . 6 TRP CZ2 1 1 5 1011 1 1 6 TRP CZ3 C 2.863 -0.818 5.464 1.00 . A A . 6 TRP CZ3 1 1 5 1012 1 1 6 TRP H H -2.653 1.294 1.876 1.00 . A A . 6 TRP H 1 1 5 1013 1 1 6 TRP HA H 0.183 1.128 2.536 1.00 . A A . 6 TRP HA 1 1 5 1014 1 1 6 TRP HB2 H -1.413 0.348 4.128 1.00 . A A . 6 TRP HB2 1 1 5 1015 1 1 6 TRP HB3 H -2.267 -0.605 2.915 1.00 . A A . 6 TRP HB3 1 1 5 1016 1 1 6 TRP HD1 H -1.603 -3.055 2.708 1.00 . A A . 6 TRP HD1 1 1 5 1017 1 1 6 TRP HE1 H 0.337 -4.512 3.583 1.00 . A A . 6 TRP HE1 1 1 5 1018 1 1 6 TRP HE3 H 1.338 0.556 4.805 1.00 . A A . 6 TRP HE3 1 1 5 1019 1 1 6 TRP HH2 H 4.215 -2.410 5.998 1.00 . A A . 6 TRP HH2 1 1 5 1020 1 1 6 TRP HZ2 H 2.808 -4.189 4.988 1.00 . A A . 6 TRP HZ2 1 1 5 1021 1 1 6 TRP HZ3 H 3.476 -0.045 5.903 1.00 . A A . 6 TRP HZ3 1 1 5 1022 1 1 6 TRP N N -1.715 1.477 1.653 1.00 . A A . 6 TRP N 1 1 5 1023 1 1 6 TRP NE1 N 0.300 -3.539 3.692 1.00 . A A . 6 TRP NE1 1 1 5 1024 1 1 6 TRP O O 0.950 -0.805 0.979 1.00 . A A . 6 TRP O 1 1 5 1025 1 1 7 GLU C C 0.525 -0.811 -1.881 1.00 . A A . 7 GLU C 1 1 5 1026 1 1 7 GLU CA C -0.620 -1.463 -1.105 1.00 . A A . 7 GLU CA 1 1 5 1027 1 1 7 GLU CB C -1.870 -1.573 -1.981 1.00 . A A . 7 GLU CB 1 1 5 1028 1 1 7 GLU CD C -3.204 -3.112 -3.429 1.00 . A A . 7 GLU CD 1 1 5 1029 1 1 7 GLU CG C -2.071 -3.030 -2.404 1.00 . A A . 7 GLU CG 1 1 5 1030 1 1 7 GLU H H -1.924 -0.207 0.065 1.00 . A A . 7 GLU H 1 1 5 1031 1 1 7 GLU HA H -0.330 -2.438 -0.751 1.00 . A A . 7 GLU HA 1 1 5 1032 1 1 7 GLU HB2 H -2.731 -1.236 -1.423 1.00 . A A . 7 GLU HB2 1 1 5 1033 1 1 7 GLU HB3 H -1.748 -0.959 -2.860 1.00 . A A . 7 GLU HB3 1 1 5 1034 1 1 7 GLU HG2 H -1.158 -3.407 -2.842 1.00 . A A . 7 GLU HG2 1 1 5 1035 1 1 7 GLU HG3 H -2.327 -3.623 -1.539 1.00 . A A . 7 GLU HG3 1 1 5 1036 1 1 7 GLU N N -1.024 -0.592 0.035 1.00 . A A . 7 GLU N 1 1 5 1037 1 1 7 GLU O O 1.382 -1.479 -2.425 1.00 . A A . 7 GLU O 1 1 5 1038 1 1 7 GLU OE1 O -2.958 -2.791 -4.580 1.00 . A A . 7 GLU OE1 1 1 5 1039 1 1 7 GLU OE2 O -4.296 -3.494 -3.046 1.00 . A A . 7 GLU OE2 1 1 5 1040 1 1 8 GLY C C 2.889 1.242 -1.795 1.00 . A A . 8 GLY C 1 1 5 1041 1 1 8 GLY CA C 1.636 1.192 -2.669 1.00 . A A . 8 GLY CA 1 1 5 1042 1 1 8 GLY H H -0.153 1.009 -1.484 1.00 . A A . 8 GLY H 1 1 5 1043 1 1 8 GLY HA2 H 1.854 0.658 -3.582 1.00 . A A . 8 GLY HA2 1 1 5 1044 1 1 8 GLY HA3 H 1.325 2.198 -2.904 1.00 . A A . 8 GLY HA3 1 1 5 1045 1 1 8 GLY N N 0.546 0.492 -1.933 1.00 . A A . 8 GLY N 1 1 5 1046 1 1 8 GLY O O 4.001 1.237 -2.285 1.00 . A A . 8 GLY O 1 1 5 1047 1 1 9 ILE C C 4.665 0.010 0.340 1.00 . A A . 9 ILE C 1 1 5 1048 1 1 9 ILE CA C 3.900 1.334 0.405 1.00 . A A . 9 ILE CA 1 1 5 1049 1 1 9 ILE CB C 3.320 1.550 1.802 1.00 . A A . 9 ILE CB 1 1 5 1050 1 1 9 ILE CD1 C 2.201 3.209 3.300 1.00 . A A . 9 ILE CD1 1 1 5 1051 1 1 9 ILE CG1 C 2.628 2.914 1.861 1.00 . A A . 9 ILE CG1 1 1 5 1052 1 1 9 ILE CG2 C 4.446 1.507 2.836 1.00 . A A . 9 ILE CG2 1 1 5 1053 1 1 9 ILE H H 1.813 1.288 -0.128 1.00 . A A . 9 ILE H 1 1 5 1054 1 1 9 ILE HA H 4.546 2.158 0.142 1.00 . A A . 9 ILE HA 1 1 5 1055 1 1 9 ILE HB H 2.603 0.771 2.018 1.00 . A A . 9 ILE HB 1 1 5 1056 1 1 9 ILE HD11 H 1.336 3.854 3.294 1.00 . A A . 9 ILE HD11 1 1 5 1057 1 1 9 ILE HD12 H 3.011 3.698 3.822 1.00 . A A . 9 ILE HD12 1 1 5 1058 1 1 9 ILE HD13 H 1.958 2.284 3.801 1.00 . A A . 9 ILE HD13 1 1 5 1059 1 1 9 ILE HG12 H 3.312 3.679 1.523 1.00 . A A . 9 ILE HG12 1 1 5 1060 1 1 9 ILE HG13 H 1.756 2.903 1.225 1.00 . A A . 9 ILE HG13 1 1 5 1061 1 1 9 ILE HG21 H 4.189 0.810 3.621 1.00 . A A . 9 ILE HG21 1 1 5 1062 1 1 9 ILE HG22 H 4.585 2.490 3.260 1.00 . A A . 9 ILE HG22 1 1 5 1063 1 1 9 ILE HG23 H 5.362 1.188 2.359 1.00 . A A . 9 ILE HG23 1 1 5 1064 1 1 9 ILE N N 2.719 1.287 -0.502 1.00 . A A . 9 ILE N 1 1 5 1065 1 1 9 ILE O O 5.856 -0.019 0.101 1.00 . A A . 9 ILE O 1 1 5 1066 1 1 10 LYS C C 5.327 -2.611 -0.874 1.00 . A A . 10 LYS C 1 1 5 1067 1 1 10 LYS CA C 4.677 -2.408 0.497 1.00 . A A . 10 LYS CA 1 1 5 1068 1 1 10 LYS CB C 3.570 -3.439 0.725 1.00 . A A . 10 LYS CB 1 1 5 1069 1 1 10 LYS CD C 2.990 -4.245 -1.569 1.00 . A A . 10 LYS CD 1 1 5 1070 1 1 10 LYS CE C 2.080 -5.472 -1.642 1.00 . A A . 10 LYS CE 1 1 5 1071 1 1 10 LYS CG C 2.548 -3.349 -0.410 1.00 . A A . 10 LYS CG 1 1 5 1072 1 1 10 LYS H H 3.029 -1.041 0.740 1.00 . A A . 10 LYS H 1 1 5 1073 1 1 10 LYS HA H 5.415 -2.480 1.279 1.00 . A A . 10 LYS HA 1 1 5 1074 1 1 10 LYS HB2 H 4.001 -4.429 0.746 1.00 . A A . 10 LYS HB2 1 1 5 1075 1 1 10 LYS HB3 H 3.080 -3.239 1.665 1.00 . A A . 10 LYS HB3 1 1 5 1076 1 1 10 LYS HD2 H 2.927 -3.693 -2.495 1.00 . A A . 10 LYS HD2 1 1 5 1077 1 1 10 LYS HD3 H 4.010 -4.564 -1.409 1.00 . A A . 10 LYS HD3 1 1 5 1078 1 1 10 LYS HE2 H 2.379 -6.205 -0.904 1.00 . A A . 10 LYS HE2 1 1 5 1079 1 1 10 LYS HE3 H 1.050 -5.187 -1.494 1.00 . A A . 10 LYS HE3 1 1 5 1080 1 1 10 LYS HG2 H 1.583 -3.675 -0.051 1.00 . A A . 10 LYS HG2 1 1 5 1081 1 1 10 LYS HG3 H 2.479 -2.328 -0.754 1.00 . A A . 10 LYS HG3 1 1 5 1082 1 1 10 LYS HZ1 H 3.030 -6.718 -3.012 1.00 . A A . 10 LYS HZ1 1 1 5 1083 1 1 10 LYS HZ2 H 2.522 -5.232 -3.661 1.00 . A A . 10 LYS HZ2 1 1 5 1084 1 1 10 LYS HZ3 H 1.387 -6.455 -3.341 1.00 . A A . 10 LYS HZ3 1 1 5 1085 1 1 10 LYS N N 3.989 -1.086 0.549 1.00 . A A . 10 LYS N 1 1 5 1086 1 1 10 LYS NZ N 2.269 -6.010 -3.018 1.00 . A A . 10 LYS NZ 1 1 5 1087 1 1 10 LYS O O 6.285 -3.344 -1.016 1.00 . A A . 10 LYS O 1 1 5 1088 1 1 11 SER C C 6.653 -1.254 -3.382 1.00 . A A . 11 SER C 1 1 5 1089 1 1 11 SER CA C 5.399 -2.121 -3.246 1.00 . A A . 11 SER CA 1 1 5 1090 1 1 11 SER CB C 4.308 -1.643 -4.204 1.00 . A A . 11 SER CB 1 1 5 1091 1 1 11 SER H H 4.038 -1.380 -1.749 1.00 . A A . 11 SER H 1 1 5 1092 1 1 11 SER HA H 5.632 -3.156 -3.440 1.00 . A A . 11 SER HA 1 1 5 1093 1 1 11 SER HB2 H 3.637 -0.979 -3.686 1.00 . A A . 11 SER HB2 1 1 5 1094 1 1 11 SER HB3 H 4.764 -1.117 -5.032 1.00 . A A . 11 SER HB3 1 1 5 1095 1 1 11 SER HG H 3.405 -2.630 -5.618 1.00 . A A . 11 SER HG 1 1 5 1096 1 1 11 SER N N 4.810 -1.966 -1.884 1.00 . A A . 11 SER N 1 1 5 1097 1 1 11 SER O O 7.526 -1.530 -4.182 1.00 . A A . 11 SER O 1 1 5 1098 1 1 11 SER OG O 3.580 -2.766 -4.683 1.00 . A A . 11 SER OG 1 1 5 1099 1 1 12 LEU C C 8.957 0.304 -1.605 1.00 . A A . 12 LEU C 1 1 5 1100 1 1 12 LEU CA C 7.948 0.674 -2.695 1.00 . A A . 12 LEU CA 1 1 5 1101 1 1 12 LEU CB C 7.414 2.090 -2.473 1.00 . A A . 12 LEU CB 1 1 5 1102 1 1 12 LEU CD1 C 5.521 2.494 -4.051 1.00 . A A . 12 LEU CD1 1 1 5 1103 1 1 12 LEU CD2 C 7.327 4.202 -3.805 1.00 . A A . 12 LEU CD2 1 1 5 1104 1 1 12 LEU CG C 7.018 2.703 -3.816 1.00 . A A . 12 LEU CG 1 1 5 1105 1 1 12 LEU H H 6.035 -0.003 -1.969 1.00 . A A . 12 LEU H 1 1 5 1106 1 1 12 LEU HA H 8.403 0.600 -3.669 1.00 . A A . 12 LEU HA 1 1 5 1107 1 1 12 LEU HB2 H 6.551 2.051 -1.825 1.00 . A A . 12 LEU HB2 1 1 5 1108 1 1 12 LEU HB3 H 8.182 2.696 -2.015 1.00 . A A . 12 LEU HB3 1 1 5 1109 1 1 12 LEU HD11 H 5.293 1.439 -4.011 1.00 . A A . 12 LEU HD11 1 1 5 1110 1 1 12 LEU HD12 H 5.251 2.884 -5.021 1.00 . A A . 12 LEU HD12 1 1 5 1111 1 1 12 LEU HD13 H 4.962 3.013 -3.287 1.00 . A A . 12 LEU HD13 1 1 5 1112 1 1 12 LEU HD21 H 7.302 4.582 -4.814 1.00 . A A . 12 LEU HD21 1 1 5 1113 1 1 12 LEU HD22 H 8.307 4.364 -3.381 1.00 . A A . 12 LEU HD22 1 1 5 1114 1 1 12 LEU HD23 H 6.588 4.716 -3.207 1.00 . A A . 12 LEU HD23 1 1 5 1115 1 1 12 LEU HG H 7.577 2.224 -4.609 1.00 . A A . 12 LEU HG 1 1 5 1116 1 1 12 LEU N N 6.750 -0.208 -2.608 1.00 . A A . 12 LEU N 1 1 5 1117 1 1 12 LEU O O 10.149 0.479 -1.761 1.00 . A A . 12 LEU O 1 1 5 1118 1 1 13 PHE C C 8.625 -1.093 1.811 1.00 . A A . 13 PHE C 1 1 5 1119 1 1 13 PHE CA C 9.417 -0.590 0.600 1.00 . A A . 13 PHE CA 1 1 5 1120 1 1 13 PHE CB C 10.170 0.694 0.948 1.00 . A A . 13 PHE CB 1 1 5 1121 1 1 13 PHE CD1 C 12.281 -0.497 0.266 1.00 . A A . 13 PHE CD1 1 1 5 1122 1 1 13 PHE CD2 C 12.336 0.945 2.214 1.00 . A A . 13 PHE CD2 1 1 5 1123 1 1 13 PHE CE1 C 13.633 -0.798 0.449 1.00 . A A . 13 PHE CE1 1 1 5 1124 1 1 13 PHE CE2 C 13.691 0.643 2.397 1.00 . A A . 13 PHE CE2 1 1 5 1125 1 1 13 PHE CG C 11.632 0.374 1.147 1.00 . A A . 13 PHE CG 1 1 5 1126 1 1 13 PHE CZ C 14.340 -0.228 1.515 1.00 . A A . 13 PHE CZ 1 1 5 1127 1 1 13 PHE H H 7.522 -0.340 -0.396 1.00 . A A . 13 PHE H 1 1 5 1128 1 1 13 PHE HA H 10.111 -1.345 0.264 1.00 . A A . 13 PHE HA 1 1 5 1129 1 1 13 PHE HB2 H 10.063 1.405 0.143 1.00 . A A . 13 PHE HB2 1 1 5 1130 1 1 13 PHE HB3 H 9.767 1.113 1.858 1.00 . A A . 13 PHE HB3 1 1 5 1131 1 1 13 PHE HD1 H 11.737 -0.936 -0.557 1.00 . A A . 13 PHE HD1 1 1 5 1132 1 1 13 PHE HD2 H 11.835 1.617 2.895 1.00 . A A . 13 PHE HD2 1 1 5 1133 1 1 13 PHE HE1 H 14.130 -1.471 -0.232 1.00 . A A . 13 PHE HE1 1 1 5 1134 1 1 13 PHE HE2 H 14.236 1.084 3.220 1.00 . A A . 13 PHE HE2 1 1 5 1135 1 1 13 PHE HZ H 15.385 -0.461 1.655 1.00 . A A . 13 PHE HZ 1 1 5 1136 1 1 13 PHE N N 8.486 -0.208 -0.501 1.00 . A A . 13 PHE N 1 1 5 1137 1 1 13 PHE O O 8.146 -0.313 2.610 1.00 . A A . 13 PHE O 1 1 5 1138 1 1 14 NH2 HN1 H 8.850 -3.007 1.336 1.00 . A A . 14 NH2 HN1 1 1 5 1139 1 1 14 NH2 HN2 H 7.960 -2.710 2.751 1.00 . A A . 14 NH2 HN2 1 1 5 1140 1 1 14 NH2 N N 8.466 -2.376 1.981 1.00 . A A . 14 NH2 N 1 1 6 1141 1 1 1 ILE C C -9.119 -2.100 0.597 1.00 . A A . 1 ILE C 1 1 6 1142 1 1 1 ILE CA C -9.140 -3.574 0.180 1.00 . A A . 1 ILE CA 1 1 6 1143 1 1 1 ILE CB C -7.865 -3.933 -0.583 1.00 . A A . 1 ILE CB 1 1 6 1144 1 1 1 ILE CD1 C -6.534 -3.401 -2.630 1.00 . A A . 1 ILE CD1 1 1 6 1145 1 1 1 ILE CG1 C -7.918 -3.319 -1.984 1.00 . A A . 1 ILE CG1 1 1 6 1146 1 1 1 ILE CG2 C -7.751 -5.454 -0.700 1.00 . A A . 1 ILE CG2 1 1 6 1147 1 1 1 ILE H1 H -10.006 -4.623 -1.398 1.00 . A A . 1 ILE H1 1 1 6 1148 1 1 1 ILE H2 H -10.398 -2.970 -1.366 1.00 . A A . 1 ILE H2 1 1 6 1149 1 1 1 ILE H3 H -11.122 -4.039 -0.262 1.00 . A A . 1 ILE H3 1 1 6 1150 1 1 1 ILE HA H -9.244 -4.209 1.045 1.00 . A A . 1 ILE HA 1 1 6 1151 1 1 1 ILE HB H -7.007 -3.548 -0.051 1.00 . A A . 1 ILE HB 1 1 6 1152 1 1 1 ILE HD11 H -5.877 -3.983 -2.000 1.00 . A A . 1 ILE HD11 1 1 6 1153 1 1 1 ILE HD12 H -6.132 -2.407 -2.748 1.00 . A A . 1 ILE HD12 1 1 6 1154 1 1 1 ILE HD13 H -6.616 -3.874 -3.597 1.00 . A A . 1 ILE HD13 1 1 6 1155 1 1 1 ILE HG12 H -8.632 -3.861 -2.588 1.00 . A A . 1 ILE HG12 1 1 6 1156 1 1 1 ILE HG13 H -8.219 -2.285 -1.913 1.00 . A A . 1 ILE HG13 1 1 6 1157 1 1 1 ILE HG21 H -8.628 -5.915 -0.269 1.00 . A A . 1 ILE HG21 1 1 6 1158 1 1 1 ILE HG22 H -6.871 -5.791 -0.172 1.00 . A A . 1 ILE HG22 1 1 6 1159 1 1 1 ILE HG23 H -7.674 -5.730 -1.741 1.00 . A A . 1 ILE HG23 1 1 6 1160 1 1 1 ILE N N -10.251 -3.820 -0.785 1.00 . A A . 1 ILE N 1 1 6 1161 1 1 1 ILE O O -8.779 -1.230 -0.180 1.00 . A A . 1 ILE O 1 1 6 1162 1 1 2 LEU C C -8.045 0.119 2.409 1.00 . A A . 2 LEU C 1 1 6 1163 1 1 2 LEU CA C -9.481 -0.396 2.281 1.00 . A A . 2 LEU CA 1 1 6 1164 1 1 2 LEU CB C -10.164 -0.425 3.648 1.00 . A A . 2 LEU CB 1 1 6 1165 1 1 2 LEU CD1 C -12.489 0.028 2.856 1.00 . A A . 2 LEU CD1 1 1 6 1166 1 1 2 LEU CD2 C -11.761 0.821 5.109 1.00 . A A . 2 LEU CD2 1 1 6 1167 1 1 2 LEU CG C -11.315 0.581 3.665 1.00 . A A . 2 LEU CG 1 1 6 1168 1 1 2 LEU H H -9.752 -2.530 2.430 1.00 . A A . 2 LEU H 1 1 6 1169 1 1 2 LEU HA H -10.045 0.222 1.601 1.00 . A A . 2 LEU HA 1 1 6 1170 1 1 2 LEU HB2 H -10.548 -1.417 3.838 1.00 . A A . 2 LEU HB2 1 1 6 1171 1 1 2 LEU HB3 H -9.448 -0.164 4.414 1.00 . A A . 2 LEU HB3 1 1 6 1172 1 1 2 LEU HD11 H -12.114 -0.510 1.999 1.00 . A A . 2 LEU HD11 1 1 6 1173 1 1 2 LEU HD12 H -13.115 0.844 2.524 1.00 . A A . 2 LEU HD12 1 1 6 1174 1 1 2 LEU HD13 H -13.070 -0.640 3.475 1.00 . A A . 2 LEU HD13 1 1 6 1175 1 1 2 LEU HD21 H -10.899 0.804 5.760 1.00 . A A . 2 LEU HD21 1 1 6 1176 1 1 2 LEU HD22 H -12.451 0.045 5.407 1.00 . A A . 2 LEU HD22 1 1 6 1177 1 1 2 LEU HD23 H -12.248 1.782 5.181 1.00 . A A . 2 LEU HD23 1 1 6 1178 1 1 2 LEU HG H -10.985 1.512 3.228 1.00 . A A . 2 LEU HG 1 1 6 1179 1 1 2 LEU N N -9.481 -1.814 1.818 1.00 . A A . 2 LEU N 1 1 6 1180 1 1 2 LEU O O -7.810 1.302 2.555 1.00 . A A . 2 LEU O 1 1 6 1181 1 1 3 GLY C C -5.107 -0.006 1.087 1.00 . A A . 3 GLY C 1 1 6 1182 1 1 3 GLY CA C -5.663 -0.318 2.473 1.00 . A A . 3 GLY CA 1 1 6 1183 1 1 3 GLY H H -7.290 -1.711 2.236 1.00 . A A . 3 GLY H 1 1 6 1184 1 1 3 GLY HA2 H -5.613 0.569 3.089 1.00 . A A . 3 GLY HA2 1 1 6 1185 1 1 3 GLY HA3 H -5.076 -1.099 2.922 1.00 . A A . 3 GLY HA3 1 1 6 1186 1 1 3 GLY N N -7.081 -0.760 2.355 1.00 . A A . 3 GLY N 1 1 6 1187 1 1 3 GLY O O -4.048 -0.469 0.712 1.00 . A A . 3 GLY O 1 1 6 1188 1 1 4 LYS C C -4.021 1.933 -0.917 1.00 . A A . 4 LYS C 1 1 6 1189 1 1 4 LYS CA C -5.315 1.130 -1.036 1.00 . A A . 4 LYS CA 1 1 6 1190 1 1 4 LYS CB C -6.425 1.978 -1.661 1.00 . A A . 4 LYS CB 1 1 6 1191 1 1 4 LYS CD C -8.081 1.260 -3.390 1.00 . A A . 4 LYS CD 1 1 6 1192 1 1 4 LYS CE C -8.300 1.051 -4.891 1.00 . A A . 4 LYS CE 1 1 6 1193 1 1 4 LYS CG C -6.608 1.581 -3.127 1.00 . A A . 4 LYS CG 1 1 6 1194 1 1 4 LYS H H -6.654 1.149 0.653 1.00 . A A . 4 LYS H 1 1 6 1195 1 1 4 LYS HA H -5.153 0.239 -1.619 1.00 . A A . 4 LYS HA 1 1 6 1196 1 1 4 LYS HB2 H -7.348 1.812 -1.124 1.00 . A A . 4 LYS HB2 1 1 6 1197 1 1 4 LYS HB3 H -6.157 3.022 -1.603 1.00 . A A . 4 LYS HB3 1 1 6 1198 1 1 4 LYS HD2 H -8.354 0.361 -2.857 1.00 . A A . 4 LYS HD2 1 1 6 1199 1 1 4 LYS HD3 H -8.694 2.081 -3.050 1.00 . A A . 4 LYS HD3 1 1 6 1200 1 1 4 LYS HE2 H -7.957 1.915 -5.444 1.00 . A A . 4 LYS HE2 1 1 6 1201 1 1 4 LYS HE3 H -7.789 0.161 -5.225 1.00 . A A . 4 LYS HE3 1 1 6 1202 1 1 4 LYS HG2 H -6.298 2.399 -3.763 1.00 . A A . 4 LYS HG2 1 1 6 1203 1 1 4 LYS HG3 H -6.008 0.710 -3.343 1.00 . A A . 4 LYS HG3 1 1 6 1204 1 1 4 LYS HZ1 H -10.007 -0.129 -5.056 1.00 . A A . 4 LYS HZ1 1 1 6 1205 1 1 4 LYS HZ2 H -10.080 1.322 -5.937 1.00 . A A . 4 LYS HZ2 1 1 6 1206 1 1 4 LYS HZ3 H -10.259 1.339 -4.248 1.00 . A A . 4 LYS HZ3 1 1 6 1207 1 1 4 LYS N N -5.809 0.782 0.325 1.00 . A A . 4 LYS N 1 1 6 1208 1 1 4 LYS NZ N -9.773 0.883 -5.045 1.00 . A A . 4 LYS NZ 1 1 6 1209 1 1 4 LYS O O -3.143 1.851 -1.751 1.00 . A A . 4 LYS O 1 1 6 1210 1 1 5 ILE C C -1.545 2.608 0.861 1.00 . A A . 5 ILE C 1 1 6 1211 1 1 5 ILE CA C -2.662 3.505 0.325 1.00 . A A . 5 ILE CA 1 1 6 1212 1 1 5 ILE CB C -3.050 4.562 1.356 1.00 . A A . 5 ILE CB 1 1 6 1213 1 1 5 ILE CD1 C -3.149 6.496 -0.230 1.00 . A A . 5 ILE CD1 1 1 6 1214 1 1 5 ILE CG1 C -3.967 5.597 0.700 1.00 . A A . 5 ILE CG1 1 1 6 1215 1 1 5 ILE CG2 C -1.790 5.252 1.884 1.00 . A A . 5 ILE CG2 1 1 6 1216 1 1 5 ILE H H -4.618 2.744 0.791 1.00 . A A . 5 ILE H 1 1 6 1217 1 1 5 ILE HA H -2.363 3.977 -0.598 1.00 . A A . 5 ILE HA 1 1 6 1218 1 1 5 ILE HB H -3.570 4.087 2.177 1.00 . A A . 5 ILE HB 1 1 6 1219 1 1 5 ILE HD11 H -3.817 7.070 -0.854 1.00 . A A . 5 ILE HD11 1 1 6 1220 1 1 5 ILE HD12 H -2.510 5.885 -0.850 1.00 . A A . 5 ILE HD12 1 1 6 1221 1 1 5 ILE HD13 H -2.542 7.167 0.361 1.00 . A A . 5 ILE HD13 1 1 6 1222 1 1 5 ILE HG12 H -4.731 5.088 0.129 1.00 . A A . 5 ILE HG12 1 1 6 1223 1 1 5 ILE HG13 H -4.433 6.200 1.464 1.00 . A A . 5 ILE HG13 1 1 6 1224 1 1 5 ILE HG21 H -1.319 5.803 1.082 1.00 . A A . 5 ILE HG21 1 1 6 1225 1 1 5 ILE HG22 H -1.103 4.509 2.261 1.00 . A A . 5 ILE HG22 1 1 6 1226 1 1 5 ILE HG23 H -2.058 5.932 2.679 1.00 . A A . 5 ILE HG23 1 1 6 1227 1 1 5 ILE N N -3.897 2.702 0.128 1.00 . A A . 5 ILE N 1 1 6 1228 1 1 5 ILE O O -0.373 2.881 0.685 1.00 . A A . 5 ILE O 1 1 6 1229 1 1 6 TRP C C -0.303 -0.263 0.937 1.00 . A A . 6 TRP C 1 1 6 1230 1 1 6 TRP CA C -0.866 0.613 2.060 1.00 . A A . 6 TRP CA 1 1 6 1231 1 1 6 TRP CB C -1.606 -0.236 3.097 1.00 . A A . 6 TRP CB 1 1 6 1232 1 1 6 TRP CD1 C -1.200 -2.730 3.161 1.00 . A A . 6 TRP CD1 1 1 6 1233 1 1 6 TRP CD2 C 0.510 -1.555 4.028 1.00 . A A . 6 TRP CD2 1 1 6 1234 1 1 6 TRP CE2 C 0.866 -2.921 4.126 1.00 . A A . 6 TRP CE2 1 1 6 1235 1 1 6 TRP CE3 C 1.423 -0.597 4.508 1.00 . A A . 6 TRP CE3 1 1 6 1236 1 1 6 TRP CG C -0.806 -1.461 3.411 1.00 . A A . 6 TRP CG 1 1 6 1237 1 1 6 TRP CH2 C 2.977 -2.358 5.152 1.00 . A A . 6 TRP CH2 1 1 6 1238 1 1 6 TRP CZ2 C 2.081 -3.323 4.679 1.00 . A A . 6 TRP CZ2 1 1 6 1239 1 1 6 TRP CZ3 C 2.648 -0.998 5.066 1.00 . A A . 6 TRP CZ3 1 1 6 1240 1 1 6 TRP H H -2.854 1.332 1.641 1.00 . A A . 6 TRP H 1 1 6 1241 1 1 6 TRP HA H -0.077 1.172 2.536 1.00 . A A . 6 TRP HA 1 1 6 1242 1 1 6 TRP HB2 H -1.748 0.341 3.998 1.00 . A A . 6 TRP HB2 1 1 6 1243 1 1 6 TRP HB3 H -2.568 -0.528 2.701 1.00 . A A . 6 TRP HB3 1 1 6 1244 1 1 6 TRP HD1 H -2.135 -3.018 2.704 1.00 . A A . 6 TRP HD1 1 1 6 1245 1 1 6 TRP HE1 H -0.246 -4.574 3.516 1.00 . A A . 6 TRP HE1 1 1 6 1246 1 1 6 TRP HE3 H 1.180 0.454 4.447 1.00 . A A . 6 TRP HE3 1 1 6 1247 1 1 6 TRP HH2 H 3.920 -2.661 5.581 1.00 . A A . 6 TRP HH2 1 1 6 1248 1 1 6 TRP HZ2 H 2.330 -4.372 4.742 1.00 . A A . 6 TRP HZ2 1 1 6 1249 1 1 6 TRP HZ3 H 3.341 -0.255 5.432 1.00 . A A . 6 TRP HZ3 1 1 6 1250 1 1 6 TRP N N -1.902 1.535 1.514 1.00 . A A . 6 TRP N 1 1 6 1251 1 1 6 TRP NE1 N -0.209 -3.598 3.584 1.00 . A A . 6 TRP NE1 1 1 6 1252 1 1 6 TRP O O 0.819 -0.725 1.001 1.00 . A A . 6 TRP O 1 1 6 1253 1 1 7 GLU C C 0.625 -0.667 -1.885 1.00 . A A . 7 GLU C 1 1 6 1254 1 1 7 GLU CA C -0.579 -1.334 -1.216 1.00 . A A . 7 GLU CA 1 1 6 1255 1 1 7 GLU CB C -1.754 -1.422 -2.191 1.00 . A A . 7 GLU CB 1 1 6 1256 1 1 7 GLU CD C -2.194 -3.193 -3.898 1.00 . A A . 7 GLU CD 1 1 6 1257 1 1 7 GLU CG C -2.137 -2.888 -2.400 1.00 . A A . 7 GLU CG 1 1 6 1258 1 1 7 GLU H H -1.975 -0.108 -0.125 1.00 . A A . 7 GLU H 1 1 6 1259 1 1 7 GLU HA H -0.318 -2.319 -0.864 1.00 . A A . 7 GLU HA 1 1 6 1260 1 1 7 GLU HB2 H -2.598 -0.882 -1.785 1.00 . A A . 7 GLU HB2 1 1 6 1261 1 1 7 GLU HB3 H -1.470 -0.988 -3.138 1.00 . A A . 7 GLU HB3 1 1 6 1262 1 1 7 GLU HG2 H -1.400 -3.523 -1.930 1.00 . A A . 7 GLU HG2 1 1 6 1263 1 1 7 GLU HG3 H -3.105 -3.074 -1.961 1.00 . A A . 7 GLU HG3 1 1 6 1264 1 1 7 GLU N N -1.073 -0.491 -0.091 1.00 . A A . 7 GLU N 1 1 6 1265 1 1 7 GLU O O 1.501 -1.324 -2.412 1.00 . A A . 7 GLU O 1 1 6 1266 1 1 7 GLU OE1 O -2.165 -2.252 -4.675 1.00 . A A . 7 GLU OE1 1 1 6 1267 1 1 7 GLU OE2 O -2.264 -4.361 -4.243 1.00 . A A . 7 GLU OE2 1 1 6 1268 1 1 8 GLY C C 2.991 1.411 -1.516 1.00 . A A . 8 GLY C 1 1 6 1269 1 1 8 GLY CA C 1.821 1.349 -2.498 1.00 . A A . 8 GLY CA 1 1 6 1270 1 1 8 GLY H H -0.041 1.146 -1.433 1.00 . A A . 8 GLY H 1 1 6 1271 1 1 8 GLY HA2 H 2.125 0.819 -3.389 1.00 . A A . 8 GLY HA2 1 1 6 1272 1 1 8 GLY HA3 H 1.521 2.352 -2.758 1.00 . A A . 8 GLY HA3 1 1 6 1273 1 1 8 GLY N N 0.675 0.636 -1.865 1.00 . A A . 8 GLY N 1 1 6 1274 1 1 8 GLY O O 4.141 1.400 -1.905 1.00 . A A . 8 GLY O 1 1 6 1275 1 1 9 ILE C C 4.633 0.246 0.717 1.00 . A A . 9 ILE C 1 1 6 1276 1 1 9 ILE CA C 3.807 1.534 0.762 1.00 . A A . 9 ILE CA 1 1 6 1277 1 1 9 ILE CB C 3.105 1.676 2.112 1.00 . A A . 9 ILE CB 1 1 6 1278 1 1 9 ILE CD1 C 1.762 3.211 3.555 1.00 . A A . 9 ILE CD1 1 1 6 1279 1 1 9 ILE CG1 C 2.373 3.018 2.166 1.00 . A A . 9 ILE CG1 1 1 6 1280 1 1 9 ILE CG2 C 4.142 1.615 3.236 1.00 . A A . 9 ILE CG2 1 1 6 1281 1 1 9 ILE H H 1.773 1.480 0.050 1.00 . A A . 9 ILE H 1 1 6 1282 1 1 9 ILE HA H 4.437 2.391 0.581 1.00 . A A . 9 ILE HA 1 1 6 1283 1 1 9 ILE HB H 2.396 0.870 2.234 1.00 . A A . 9 ILE HB 1 1 6 1284 1 1 9 ILE HD11 H 0.899 2.569 3.661 1.00 . A A . 9 ILE HD11 1 1 6 1285 1 1 9 ILE HD12 H 1.461 4.241 3.678 1.00 . A A . 9 ILE HD12 1 1 6 1286 1 1 9 ILE HD13 H 2.493 2.958 4.309 1.00 . A A . 9 ILE HD13 1 1 6 1287 1 1 9 ILE HG12 H 3.073 3.817 1.967 1.00 . A A . 9 ILE HG12 1 1 6 1288 1 1 9 ILE HG13 H 1.589 3.032 1.425 1.00 . A A . 9 ILE HG13 1 1 6 1289 1 1 9 ILE HG21 H 4.910 2.353 3.057 1.00 . A A . 9 ILE HG21 1 1 6 1290 1 1 9 ILE HG22 H 4.586 0.631 3.263 1.00 . A A . 9 ILE HG22 1 1 6 1291 1 1 9 ILE HG23 H 3.661 1.819 4.180 1.00 . A A . 9 ILE HG23 1 1 6 1292 1 1 9 ILE N N 2.708 1.473 -0.244 1.00 . A A . 9 ILE N 1 1 6 1293 1 1 9 ILE O O 5.798 0.255 0.372 1.00 . A A . 9 ILE O 1 1 6 1294 1 1 10 LYS C C 5.374 -2.392 -0.355 1.00 . A A . 10 LYS C 1 1 6 1295 1 1 10 LYS CA C 4.788 -2.151 1.038 1.00 . A A . 10 LYS CA 1 1 6 1296 1 1 10 LYS CB C 3.750 -3.221 1.376 1.00 . A A . 10 LYS CB 1 1 6 1297 1 1 10 LYS CD C 3.181 -4.550 -0.663 1.00 . A A . 10 LYS CD 1 1 6 1298 1 1 10 LYS CE C 1.981 -5.018 -1.491 1.00 . A A . 10 LYS CE 1 1 6 1299 1 1 10 LYS CG C 2.768 -3.365 0.212 1.00 . A A . 10 LYS CG 1 1 6 1300 1 1 10 LYS H H 3.097 -0.849 1.337 1.00 . A A . 10 LYS H 1 1 6 1301 1 1 10 LYS HA H 5.570 -2.146 1.782 1.00 . A A . 10 LYS HA 1 1 6 1302 1 1 10 LYS HB2 H 4.248 -4.164 1.546 1.00 . A A . 10 LYS HB2 1 1 6 1303 1 1 10 LYS HB3 H 3.212 -2.932 2.265 1.00 . A A . 10 LYS HB3 1 1 6 1304 1 1 10 LYS HD2 H 3.981 -4.249 -1.324 1.00 . A A . 10 LYS HD2 1 1 6 1305 1 1 10 LYS HD3 H 3.519 -5.360 -0.034 1.00 . A A . 10 LYS HD3 1 1 6 1306 1 1 10 LYS HE2 H 1.328 -4.183 -1.707 1.00 . A A . 10 LYS HE2 1 1 6 1307 1 1 10 LYS HE3 H 2.313 -5.485 -2.404 1.00 . A A . 10 LYS HE3 1 1 6 1308 1 1 10 LYS HG2 H 1.773 -3.531 0.600 1.00 . A A . 10 LYS HG2 1 1 6 1309 1 1 10 LYS HG3 H 2.777 -2.463 -0.381 1.00 . A A . 10 LYS HG3 1 1 6 1310 1 1 10 LYS HZ1 H 0.777 -5.523 0.130 1.00 . A A . 10 LYS HZ1 1 1 6 1311 1 1 10 LYS HZ2 H 1.987 -6.665 -0.218 1.00 . A A . 10 LYS HZ2 1 1 6 1312 1 1 10 LYS HZ3 H 0.608 -6.556 -1.204 1.00 . A A . 10 LYS HZ3 1 1 6 1313 1 1 10 LYS N N 4.038 -0.863 1.063 1.00 . A A . 10 LYS N 1 1 6 1314 1 1 10 LYS NZ N 1.286 -6.015 -0.631 1.00 . A A . 10 LYS NZ 1 1 6 1315 1 1 10 LYS O O 6.323 -3.133 -0.521 1.00 . A A . 10 LYS O 1 1 6 1316 1 1 11 SER C C 6.603 -1.124 -2.953 1.00 . A A . 11 SER C 1 1 6 1317 1 1 11 SER CA C 5.341 -1.966 -2.740 1.00 . A A . 11 SER CA 1 1 6 1318 1 1 11 SER CB C 4.218 -1.489 -3.659 1.00 . A A . 11 SER CB 1 1 6 1319 1 1 11 SER H H 4.052 -1.178 -1.203 1.00 . A A . 11 SER H 1 1 6 1320 1 1 11 SER HA H 5.548 -3.008 -2.921 1.00 . A A . 11 SER HA 1 1 6 1321 1 1 11 SER HB2 H 3.376 -2.156 -3.577 1.00 . A A . 11 SER HB2 1 1 6 1322 1 1 11 SER HB3 H 3.915 -0.492 -3.369 1.00 . A A . 11 SER HB3 1 1 6 1323 1 1 11 SER HG H 4.775 -0.571 -5.281 1.00 . A A . 11 SER HG 1 1 6 1324 1 1 11 SER N N 4.817 -1.771 -1.359 1.00 . A A . 11 SER N 1 1 6 1325 1 1 11 SER O O 7.401 -1.396 -3.829 1.00 . A A . 11 SER O 1 1 6 1326 1 1 11 SER OG O 4.681 -1.485 -5.003 1.00 . A A . 11 SER OG 1 1 6 1327 1 1 12 LEU C C 9.161 0.189 -1.503 1.00 . A A . 12 LEU C 1 1 6 1328 1 1 12 LEU CA C 8.002 0.752 -2.325 1.00 . A A . 12 LEU CA 1 1 6 1329 1 1 12 LEU CB C 7.591 2.128 -1.798 1.00 . A A . 12 LEU CB 1 1 6 1330 1 1 12 LEU CD1 C 6.050 3.974 -2.477 1.00 . A A . 12 LEU CD1 1 1 6 1331 1 1 12 LEU CD2 C 8.319 3.799 -3.507 1.00 . A A . 12 LEU CD2 1 1 6 1332 1 1 12 LEU CG C 7.129 3.005 -2.964 1.00 . A A . 12 LEU CG 1 1 6 1333 1 1 12 LEU H H 6.137 0.102 -1.461 1.00 . A A . 12 LEU H 1 1 6 1334 1 1 12 LEU HA H 8.276 0.822 -3.361 1.00 . A A . 12 LEU HA 1 1 6 1335 1 1 12 LEU HB2 H 6.784 2.015 -1.089 1.00 . A A . 12 LEU HB2 1 1 6 1336 1 1 12 LEU HB3 H 8.435 2.594 -1.313 1.00 . A A . 12 LEU HB3 1 1 6 1337 1 1 12 LEU HD11 H 6.452 4.593 -1.689 1.00 . A A . 12 LEU HD11 1 1 6 1338 1 1 12 LEU HD12 H 5.207 3.415 -2.100 1.00 . A A . 12 LEU HD12 1 1 6 1339 1 1 12 LEU HD13 H 5.730 4.598 -3.298 1.00 . A A . 12 LEU HD13 1 1 6 1340 1 1 12 LEU HD21 H 8.660 3.351 -4.428 1.00 . A A . 12 LEU HD21 1 1 6 1341 1 1 12 LEU HD22 H 9.120 3.788 -2.782 1.00 . A A . 12 LEU HD22 1 1 6 1342 1 1 12 LEU HD23 H 8.015 4.819 -3.694 1.00 . A A . 12 LEU HD23 1 1 6 1343 1 1 12 LEU HG H 6.723 2.378 -3.746 1.00 . A A . 12 LEU HG 1 1 6 1344 1 1 12 LEU N N 6.790 -0.103 -2.162 1.00 . A A . 12 LEU N 1 1 6 1345 1 1 12 LEU O O 10.157 -0.259 -2.036 1.00 . A A . 12 LEU O 1 1 6 1346 1 1 13 PHE C C 9.762 -0.159 2.134 1.00 . A A . 13 PHE C 1 1 6 1347 1 1 13 PHE CA C 10.130 -0.323 0.657 1.00 . A A . 13 PHE CA 1 1 6 1348 1 1 13 PHE CB C 11.355 0.525 0.313 1.00 . A A . 13 PHE CB 1 1 6 1349 1 1 13 PHE CD1 C 12.423 -1.587 -0.548 1.00 . A A . 13 PHE CD1 1 1 6 1350 1 1 13 PHE CD2 C 13.797 0.002 0.662 1.00 . A A . 13 PHE CD2 1 1 6 1351 1 1 13 PHE CE1 C 13.531 -2.424 -0.709 1.00 . A A . 13 PHE CE1 1 1 6 1352 1 1 13 PHE CE2 C 14.907 -0.835 0.501 1.00 . A A . 13 PHE CE2 1 1 6 1353 1 1 13 PHE CG C 12.555 -0.374 0.137 1.00 . A A . 13 PHE CG 1 1 6 1354 1 1 13 PHE CZ C 14.774 -2.049 -0.185 1.00 . A A . 13 PHE CZ 1 1 6 1355 1 1 13 PHE H H 8.225 0.575 0.197 1.00 . A A . 13 PHE H 1 1 6 1356 1 1 13 PHE HA H 10.323 -1.360 0.428 1.00 . A A . 13 PHE HA 1 1 6 1357 1 1 13 PHE HB2 H 11.173 1.065 -0.604 1.00 . A A . 13 PHE HB2 1 1 6 1358 1 1 13 PHE HB3 H 11.545 1.225 1.113 1.00 . A A . 13 PHE HB3 1 1 6 1359 1 1 13 PHE HD1 H 11.465 -1.877 -0.954 1.00 . A A . 13 PHE HD1 1 1 6 1360 1 1 13 PHE HD2 H 13.899 0.938 1.191 1.00 . A A . 13 PHE HD2 1 1 6 1361 1 1 13 PHE HE1 H 13.425 -3.358 -1.237 1.00 . A A . 13 PHE HE1 1 1 6 1362 1 1 13 PHE HE2 H 15.866 -0.545 0.905 1.00 . A A . 13 PHE HE2 1 1 6 1363 1 1 13 PHE HZ H 15.630 -2.696 -0.309 1.00 . A A . 13 PHE HZ 1 1 6 1364 1 1 13 PHE N N 9.038 0.209 -0.208 1.00 . A A . 13 PHE N 1 1 6 1365 1 1 13 PHE O O 9.961 0.889 2.714 1.00 . A A . 13 PHE O 1 1 6 1366 1 1 14 NH2 HN1 H 9.064 -2.011 2.308 1.00 . A A . 14 NH2 HN1 1 1 6 1367 1 1 14 NH2 HN2 H 8.985 -1.070 3.718 1.00 . A A . 14 NH2 HN2 1 1 6 1368 1 1 14 NH2 N N 9.226 -1.164 2.774 1.00 . A A . 14 NH2 N 1 1 7 1369 1 1 1 ILE C C -8.039 -3.451 3.900 1.00 . A A . 1 ILE C 1 1 7 1370 1 1 1 ILE CA C -9.477 -2.928 3.841 1.00 . A A . 1 ILE CA 1 1 7 1371 1 1 1 ILE CB C -9.494 -1.443 3.481 1.00 . A A . 1 ILE CB 1 1 7 1372 1 1 1 ILE CD1 C -10.339 -1.447 1.129 1.00 . A A . 1 ILE CD1 1 1 7 1373 1 1 1 ILE CG1 C -9.101 -1.271 2.012 1.00 . A A . 1 ILE CG1 1 1 7 1374 1 1 1 ILE CG2 C -8.496 -0.692 4.364 1.00 . A A . 1 ILE CG2 1 1 7 1375 1 1 1 ILE H1 H -10.436 -3.978 5.364 1.00 . A A . 1 ILE H1 1 1 7 1376 1 1 1 ILE H2 H -10.919 -2.354 5.230 1.00 . A A . 1 ILE H2 1 1 7 1377 1 1 1 ILE H3 H -9.414 -2.742 5.915 1.00 . A A . 1 ILE H3 1 1 7 1378 1 1 1 ILE HA H -10.053 -3.488 3.122 1.00 . A A . 1 ILE HA 1 1 7 1379 1 1 1 ILE HB H -10.486 -1.046 3.641 1.00 . A A . 1 ILE HB 1 1 7 1380 1 1 1 ILE HD11 H -10.270 -0.787 0.277 1.00 . A A . 1 ILE HD11 1 1 7 1381 1 1 1 ILE HD12 H -11.224 -1.207 1.699 1.00 . A A . 1 ILE HD12 1 1 7 1382 1 1 1 ILE HD13 H -10.395 -2.470 0.789 1.00 . A A . 1 ILE HD13 1 1 7 1383 1 1 1 ILE HG12 H -8.689 -0.283 1.863 1.00 . A A . 1 ILE HG12 1 1 7 1384 1 1 1 ILE HG13 H -8.364 -2.012 1.746 1.00 . A A . 1 ILE HG13 1 1 7 1385 1 1 1 ILE HG21 H -7.627 -0.426 3.781 1.00 . A A . 1 ILE HG21 1 1 7 1386 1 1 1 ILE HG22 H -8.197 -1.324 5.188 1.00 . A A . 1 ILE HG22 1 1 7 1387 1 1 1 ILE HG23 H -8.959 0.204 4.749 1.00 . A A . 1 ILE HG23 1 1 7 1388 1 1 1 ILE N N -10.109 -3.006 5.189 1.00 . A A . 1 ILE N 1 1 7 1389 1 1 1 ILE O O -7.328 -3.234 4.861 1.00 . A A . 1 ILE O 1 1 7 1390 1 1 2 LEU C C -5.204 -3.527 2.954 1.00 . A A . 2 LEU C 1 1 7 1391 1 1 2 LEU CA C -6.214 -4.675 2.878 1.00 . A A . 2 LEU CA 1 1 7 1392 1 1 2 LEU CB C -6.077 -5.421 1.550 1.00 . A A . 2 LEU CB 1 1 7 1393 1 1 2 LEU CD1 C -6.683 -7.614 0.518 1.00 . A A . 2 LEU CD1 1 1 7 1394 1 1 2 LEU CD2 C -4.832 -7.490 2.190 1.00 . A A . 2 LEU CD2 1 1 7 1395 1 1 2 LEU CG C -6.199 -6.926 1.795 1.00 . A A . 2 LEU CG 1 1 7 1396 1 1 2 LEU H H -8.194 -4.303 2.113 1.00 . A A . 2 LEU H 1 1 7 1397 1 1 2 LEU HA H -6.073 -5.358 3.701 1.00 . A A . 2 LEU HA 1 1 7 1398 1 1 2 LEU HB2 H -6.858 -5.100 0.876 1.00 . A A . 2 LEU HB2 1 1 7 1399 1 1 2 LEU HB3 H -5.113 -5.206 1.114 1.00 . A A . 2 LEU HB3 1 1 7 1400 1 1 2 LEU HD11 H -5.885 -8.212 0.106 1.00 . A A . 2 LEU HD11 1 1 7 1401 1 1 2 LEU HD12 H -6.981 -6.865 -0.203 1.00 . A A . 2 LEU HD12 1 1 7 1402 1 1 2 LEU HD13 H -7.527 -8.248 0.748 1.00 . A A . 2 LEU HD13 1 1 7 1403 1 1 2 LEU HD21 H -4.053 -6.896 1.734 1.00 . A A . 2 LEU HD21 1 1 7 1404 1 1 2 LEU HD22 H -4.753 -8.511 1.850 1.00 . A A . 2 LEU HD22 1 1 7 1405 1 1 2 LEU HD23 H -4.727 -7.458 3.264 1.00 . A A . 2 LEU HD23 1 1 7 1406 1 1 2 LEU HG H -6.908 -7.105 2.591 1.00 . A A . 2 LEU HG 1 1 7 1407 1 1 2 LEU N N -7.606 -4.139 2.879 1.00 . A A . 2 LEU N 1 1 7 1408 1 1 2 LEU O O -4.084 -3.702 3.391 1.00 . A A . 2 LEU O 1 1 7 1409 1 1 3 GLY C C -4.453 -0.639 1.173 1.00 . A A . 3 GLY C 1 1 7 1410 1 1 3 GLY CA C -4.650 -1.199 2.581 1.00 . A A . 3 GLY CA 1 1 7 1411 1 1 3 GLY H H -6.497 -2.234 2.182 1.00 . A A . 3 GLY H 1 1 7 1412 1 1 3 GLY HA2 H -5.056 -0.430 3.221 1.00 . A A . 3 GLY HA2 1 1 7 1413 1 1 3 GLY HA3 H -3.699 -1.526 2.969 1.00 . A A . 3 GLY HA3 1 1 7 1414 1 1 3 GLY N N -5.590 -2.355 2.532 1.00 . A A . 3 GLY N 1 1 7 1415 1 1 3 GLY O O -3.532 -1.008 0.470 1.00 . A A . 3 GLY O 1 1 7 1416 1 1 4 LYS C C -3.918 1.727 -0.648 1.00 . A A . 4 LYS C 1 1 7 1417 1 1 4 LYS CA C -5.160 0.841 -0.606 1.00 . A A . 4 LYS CA 1 1 7 1418 1 1 4 LYS CB C -6.425 1.673 -0.822 1.00 . A A . 4 LYS CB 1 1 7 1419 1 1 4 LYS CD C -6.571 0.874 -3.185 1.00 . A A . 4 LYS CD 1 1 7 1420 1 1 4 LYS CE C -7.579 0.823 -4.336 1.00 . A A . 4 LYS CE 1 1 7 1421 1 1 4 LYS CG C -7.319 0.983 -1.855 1.00 . A A . 4 LYS CG 1 1 7 1422 1 1 4 LYS H H -6.037 0.542 1.339 1.00 . A A . 4 LYS H 1 1 7 1423 1 1 4 LYS HA H -5.094 0.065 -1.347 1.00 . A A . 4 LYS HA 1 1 7 1424 1 1 4 LYS HB2 H -6.959 1.765 0.113 1.00 . A A . 4 LYS HB2 1 1 7 1425 1 1 4 LYS HB3 H -6.154 2.654 -1.181 1.00 . A A . 4 LYS HB3 1 1 7 1426 1 1 4 LYS HD2 H -5.927 1.734 -3.307 1.00 . A A . 4 LYS HD2 1 1 7 1427 1 1 4 LYS HD3 H -5.975 -0.026 -3.191 1.00 . A A . 4 LYS HD3 1 1 7 1428 1 1 4 LYS HE2 H -8.056 1.786 -4.459 1.00 . A A . 4 LYS HE2 1 1 7 1429 1 1 4 LYS HE3 H -7.092 0.522 -5.250 1.00 . A A . 4 LYS HE3 1 1 7 1430 1 1 4 LYS HG2 H -7.577 -0.006 -1.505 1.00 . A A . 4 LYS HG2 1 1 7 1431 1 1 4 LYS HG3 H -8.218 1.562 -1.997 1.00 . A A . 4 LYS HG3 1 1 7 1432 1 1 4 LYS HZ1 H -8.122 -0.900 -3.301 1.00 . A A . 4 LYS HZ1 1 1 7 1433 1 1 4 LYS HZ2 H -8.945 -0.686 -4.772 1.00 . A A . 4 LYS HZ2 1 1 7 1434 1 1 4 LYS HZ3 H -9.360 0.254 -3.420 1.00 . A A . 4 LYS HZ3 1 1 7 1435 1 1 4 LYS N N -5.306 0.254 0.755 1.00 . A A . 4 LYS N 1 1 7 1436 1 1 4 LYS NZ N -8.577 -0.205 -3.926 1.00 . A A . 4 LYS NZ 1 1 7 1437 1 1 4 LYS O O -3.060 1.578 -1.496 1.00 . A A . 4 LYS O 1 1 7 1438 1 1 5 ILE C C -1.379 2.710 0.654 1.00 . A A . 5 ILE C 1 1 7 1439 1 1 5 ILE CA C -2.621 3.531 0.306 1.00 . A A . 5 ILE CA 1 1 7 1440 1 1 5 ILE CB C -2.923 4.548 1.406 1.00 . A A . 5 ILE CB 1 1 7 1441 1 1 5 ILE CD1 C -3.283 6.491 -0.126 1.00 . A A . 5 ILE CD1 1 1 7 1442 1 1 5 ILE CG1 C -3.947 5.563 0.892 1.00 . A A . 5 ILE CG1 1 1 7 1443 1 1 5 ILE CG2 C -1.635 5.275 1.797 1.00 . A A . 5 ILE CG2 1 1 7 1444 1 1 5 ILE H H -4.512 2.731 0.950 1.00 . A A . 5 ILE H 1 1 7 1445 1 1 5 ILE HA H -2.494 4.031 -0.640 1.00 . A A . 5 ILE HA 1 1 7 1446 1 1 5 ILE HB H -3.323 4.035 2.269 1.00 . A A . 5 ILE HB 1 1 7 1447 1 1 5 ILE HD11 H -4.011 6.795 -0.864 1.00 . A A . 5 ILE HD11 1 1 7 1448 1 1 5 ILE HD12 H -2.471 5.971 -0.614 1.00 . A A . 5 ILE HD12 1 1 7 1449 1 1 5 ILE HD13 H -2.897 7.364 0.380 1.00 . A A . 5 ILE HD13 1 1 7 1450 1 1 5 ILE HG12 H -4.766 5.039 0.421 1.00 . A A . 5 ILE HG12 1 1 7 1451 1 1 5 ILE HG13 H -4.321 6.147 1.719 1.00 . A A . 5 ILE HG13 1 1 7 1452 1 1 5 ILE HG21 H -1.882 6.203 2.293 1.00 . A A . 5 ILE HG21 1 1 7 1453 1 1 5 ILE HG22 H -1.056 5.486 0.910 1.00 . A A . 5 ILE HG22 1 1 7 1454 1 1 5 ILE HG23 H -1.057 4.653 2.464 1.00 . A A . 5 ILE HG23 1 1 7 1455 1 1 5 ILE N N -3.812 2.639 0.273 1.00 . A A . 5 ILE N 1 1 7 1456 1 1 5 ILE O O -0.273 3.034 0.265 1.00 . A A . 5 ILE O 1 1 7 1457 1 1 6 TRP C C 0.059 -0.032 0.544 1.00 . A A . 6 TRP C 1 1 7 1458 1 1 6 TRP CA C -0.392 0.789 1.754 1.00 . A A . 6 TRP CA 1 1 7 1459 1 1 6 TRP CB C -0.912 -0.126 2.864 1.00 . A A . 6 TRP CB 1 1 7 1460 1 1 6 TRP CD1 C -0.026 -2.486 2.680 1.00 . A A . 6 TRP CD1 1 1 7 1461 1 1 6 TRP CD2 C 1.330 -1.145 3.873 1.00 . A A . 6 TRP CD2 1 1 7 1462 1 1 6 TRP CE2 C 1.940 -2.421 3.850 1.00 . A A . 6 TRP CE2 1 1 7 1463 1 1 6 TRP CE3 C 1.985 -0.110 4.564 1.00 . A A . 6 TRP CE3 1 1 7 1464 1 1 6 TRP CG C 0.083 -1.213 3.122 1.00 . A A . 6 TRP CG 1 1 7 1465 1 1 6 TRP CH2 C 3.794 -1.624 5.172 1.00 . A A . 6 TRP CH2 1 1 7 1466 1 1 6 TRP CZ2 C 3.156 -2.663 4.490 1.00 . A A . 6 TRP CZ2 1 1 7 1467 1 1 6 TRP CZ3 C 3.210 -0.350 5.210 1.00 . A A . 6 TRP CZ3 1 1 7 1468 1 1 6 TRP H H -2.458 1.396 1.681 1.00 . A A . 6 TRP H 1 1 7 1469 1 1 6 TRP HA H 0.418 1.396 2.124 1.00 . A A . 6 TRP HA 1 1 7 1470 1 1 6 TRP HB2 H -1.058 0.449 3.766 1.00 . A A . 6 TRP HB2 1 1 7 1471 1 1 6 TRP HB3 H -1.850 -0.564 2.559 1.00 . A A . 6 TRP HB3 1 1 7 1472 1 1 6 TRP HD1 H -0.840 -2.878 2.087 1.00 . A A . 6 TRP HD1 1 1 7 1473 1 1 6 TRP HE1 H 1.239 -4.152 2.924 1.00 . A A . 6 TRP HE1 1 1 7 1474 1 1 6 TRP HE3 H 1.544 0.875 4.599 1.00 . A A . 6 TRP HE3 1 1 7 1475 1 1 6 TRP HH2 H 4.735 -1.802 5.670 1.00 . A A . 6 TRP HH2 1 1 7 1476 1 1 6 TRP HZ2 H 3.601 -3.647 4.457 1.00 . A A . 6 TRP HZ2 1 1 7 1477 1 1 6 TRP HZ3 H 3.704 0.452 5.738 1.00 . A A . 6 TRP HZ3 1 1 7 1478 1 1 6 TRP N N -1.556 1.641 1.383 1.00 . A A . 6 TRP N 1 1 7 1479 1 1 6 TRP NE1 N 1.075 -3.205 3.110 1.00 . A A . 6 TRP NE1 1 1 7 1480 1 1 6 TRP O O 1.201 -0.433 0.444 1.00 . A A . 6 TRP O 1 1 7 1481 1 1 7 GLU C C 0.744 -0.430 -2.278 1.00 . A A . 7 GLU C 1 1 7 1482 1 1 7 GLU CA C -0.455 -1.075 -1.583 1.00 . A A . 7 GLU CA 1 1 7 1483 1 1 7 GLU CB C -1.688 -1.033 -2.485 1.00 . A A . 7 GLU CB 1 1 7 1484 1 1 7 GLU CD C -3.069 -2.921 -1.610 1.00 . A A . 7 GLU CD 1 1 7 1485 1 1 7 GLU CG C -2.170 -2.459 -2.758 1.00 . A A . 7 GLU CG 1 1 7 1486 1 1 7 GLU H H -1.748 0.050 -0.277 1.00 . A A . 7 GLU H 1 1 7 1487 1 1 7 GLU HA H -0.230 -2.092 -1.310 1.00 . A A . 7 GLU HA 1 1 7 1488 1 1 7 GLU HB2 H -2.472 -0.473 -1.998 1.00 . A A . 7 GLU HB2 1 1 7 1489 1 1 7 GLU HB3 H -1.433 -0.557 -3.421 1.00 . A A . 7 GLU HB3 1 1 7 1490 1 1 7 GLU HG2 H -2.728 -2.478 -3.683 1.00 . A A . 7 GLU HG2 1 1 7 1491 1 1 7 GLU HG3 H -1.320 -3.119 -2.835 1.00 . A A . 7 GLU HG3 1 1 7 1492 1 1 7 GLU N N -0.832 -0.284 -0.377 1.00 . A A . 7 GLU N 1 1 7 1493 1 1 7 GLU O O 1.661 -1.098 -2.711 1.00 . A A . 7 GLU O 1 1 7 1494 1 1 7 GLU OE1 O -2.537 -3.409 -0.626 1.00 . A A . 7 GLU OE1 1 1 7 1495 1 1 7 GLU OE2 O -4.275 -2.779 -1.733 1.00 . A A . 7 GLU OE2 1 1 7 1496 1 1 8 GLY C C 3.058 1.644 -2.079 1.00 . A A . 8 GLY C 1 1 7 1497 1 1 8 GLY CA C 1.877 1.567 -3.047 1.00 . A A . 8 GLY CA 1 1 7 1498 1 1 8 GLY H H -0.010 1.384 -2.024 1.00 . A A . 8 GLY H 1 1 7 1499 1 1 8 GLY HA2 H 2.168 1.020 -3.932 1.00 . A A . 8 GLY HA2 1 1 7 1500 1 1 8 GLY HA3 H 1.576 2.566 -3.323 1.00 . A A . 8 GLY HA3 1 1 7 1501 1 1 8 GLY N N 0.740 0.868 -2.384 1.00 . A A . 8 GLY N 1 1 7 1502 1 1 8 GLY O O 4.204 1.667 -2.483 1.00 . A A . 8 GLY O 1 1 7 1503 1 1 9 ILE C C 4.682 0.440 0.203 1.00 . A A . 9 ILE C 1 1 7 1504 1 1 9 ILE CA C 3.897 1.755 0.191 1.00 . A A . 9 ILE CA 1 1 7 1505 1 1 9 ILE CB C 3.209 1.981 1.538 1.00 . A A . 9 ILE CB 1 1 7 1506 1 1 9 ILE CD1 C 2.004 3.658 2.944 1.00 . A A . 9 ILE CD1 1 1 7 1507 1 1 9 ILE CG1 C 2.549 3.361 1.546 1.00 . A A . 9 ILE CG1 1 1 7 1508 1 1 9 ILE CG2 C 4.244 1.906 2.662 1.00 . A A . 9 ILE CG2 1 1 7 1509 1 1 9 ILE H H 1.858 1.660 -0.499 1.00 . A A . 9 ILE H 1 1 7 1510 1 1 9 ILE HA H 4.551 2.583 -0.033 1.00 . A A . 9 ILE HA 1 1 7 1511 1 1 9 ILE HB H 2.458 1.220 1.690 1.00 . A A . 9 ILE HB 1 1 7 1512 1 1 9 ILE HD11 H 0.960 3.926 2.874 1.00 . A A . 9 ILE HD11 1 1 7 1513 1 1 9 ILE HD12 H 2.557 4.476 3.381 1.00 . A A . 9 ILE HD12 1 1 7 1514 1 1 9 ILE HD13 H 2.109 2.781 3.566 1.00 . A A . 9 ILE HD13 1 1 7 1515 1 1 9 ILE HG12 H 3.280 4.111 1.277 1.00 . A A . 9 ILE HG12 1 1 7 1516 1 1 9 ILE HG13 H 1.737 3.378 0.834 1.00 . A A . 9 ILE HG13 1 1 7 1517 1 1 9 ILE HG21 H 3.779 1.514 3.555 1.00 . A A . 9 ILE HG21 1 1 7 1518 1 1 9 ILE HG22 H 4.630 2.895 2.862 1.00 . A A . 9 ILE HG22 1 1 7 1519 1 1 9 ILE HG23 H 5.055 1.257 2.362 1.00 . A A . 9 ILE HG23 1 1 7 1520 1 1 9 ILE N N 2.788 1.682 -0.803 1.00 . A A . 9 ILE N 1 1 7 1521 1 1 9 ILE O O 5.893 0.429 0.115 1.00 . A A . 9 ILE O 1 1 7 1522 1 1 10 LYS C C 5.401 -2.223 -1.020 1.00 . A A . 10 LYS C 1 1 7 1523 1 1 10 LYS CA C 4.708 -1.980 0.324 1.00 . A A . 10 LYS CA 1 1 7 1524 1 1 10 LYS CB C 3.612 -3.019 0.559 1.00 . A A . 10 LYS CB 1 1 7 1525 1 1 10 LYS CD C 2.888 -4.374 -1.412 1.00 . A A . 10 LYS CD 1 1 7 1526 1 1 10 LYS CE C 1.632 -4.700 -2.224 1.00 . A A . 10 LYS CE 1 1 7 1527 1 1 10 LYS CG C 2.679 -3.062 -0.653 1.00 . A A . 10 LYS CG 1 1 7 1528 1 1 10 LYS H H 3.023 -0.637 0.377 1.00 . A A . 10 LYS H 1 1 7 1529 1 1 10 LYS HA H 5.424 -2.012 1.130 1.00 . A A . 10 LYS HA 1 1 7 1530 1 1 10 LYS HB2 H 4.062 -3.991 0.703 1.00 . A A . 10 LYS HB2 1 1 7 1531 1 1 10 LYS HB3 H 3.044 -2.752 1.438 1.00 . A A . 10 LYS HB3 1 1 7 1532 1 1 10 LYS HD2 H 3.732 -4.274 -2.079 1.00 . A A . 10 LYS HD2 1 1 7 1533 1 1 10 LYS HD3 H 3.076 -5.171 -0.709 1.00 . A A . 10 LYS HD3 1 1 7 1534 1 1 10 LYS HE2 H 0.929 -3.879 -2.172 1.00 . A A . 10 LYS HE2 1 1 7 1535 1 1 10 LYS HE3 H 1.891 -4.911 -3.250 1.00 . A A . 10 LYS HE3 1 1 7 1536 1 1 10 LYS HG2 H 1.654 -2.996 -0.320 1.00 . A A . 10 LYS HG2 1 1 7 1537 1 1 10 LYS HG3 H 2.900 -2.232 -1.306 1.00 . A A . 10 LYS HG3 1 1 7 1538 1 1 10 LYS HZ1 H 0.046 -5.975 -1.786 1.00 . A A . 10 LYS HZ1 1 1 7 1539 1 1 10 LYS HZ2 H 1.207 -5.863 -0.551 1.00 . A A . 10 LYS HZ2 1 1 7 1540 1 1 10 LYS HZ3 H 1.539 -6.762 -1.954 1.00 . A A . 10 LYS HZ3 1 1 7 1541 1 1 10 LYS N N 4.001 -0.668 0.309 1.00 . A A . 10 LYS N 1 1 7 1542 1 1 10 LYS NZ N 1.063 -5.917 -1.580 1.00 . A A . 10 LYS NZ 1 1 7 1543 1 1 10 LYS O O 6.354 -2.971 -1.111 1.00 . A A . 10 LYS O 1 1 7 1544 1 1 11 SER C C 6.808 -0.910 -3.526 1.00 . A A . 11 SER C 1 1 7 1545 1 1 11 SER CA C 5.562 -1.791 -3.398 1.00 . A A . 11 SER CA 1 1 7 1546 1 1 11 SER CB C 4.498 -1.363 -4.407 1.00 . A A . 11 SER CB 1 1 7 1547 1 1 11 SER H H 4.160 -0.996 -1.968 1.00 . A A . 11 SER H 1 1 7 1548 1 1 11 SER HA H 5.816 -2.828 -3.548 1.00 . A A . 11 SER HA 1 1 7 1549 1 1 11 SER HB2 H 3.607 -1.953 -4.266 1.00 . A A . 11 SER HB2 1 1 7 1550 1 1 11 SER HB3 H 4.262 -0.318 -4.259 1.00 . A A . 11 SER HB3 1 1 7 1551 1 1 11 SER HG H 4.244 -1.542 -6.329 1.00 . A A . 11 SER HG 1 1 7 1552 1 1 11 SER N N 4.930 -1.595 -2.062 1.00 . A A . 11 SER N 1 1 7 1553 1 1 11 SER O O 7.675 -1.159 -4.341 1.00 . A A . 11 SER O 1 1 7 1554 1 1 11 SER OG O 4.991 -1.569 -5.725 1.00 . A A . 11 SER OG 1 1 7 1555 1 1 12 LEU C C 9.278 0.381 -2.065 1.00 . A A . 12 LEU C 1 1 7 1556 1 1 12 LEU CA C 8.095 1.012 -2.803 1.00 . A A . 12 LEU CA 1 1 7 1557 1 1 12 LEU CB C 7.661 2.306 -2.113 1.00 . A A . 12 LEU CB 1 1 7 1558 1 1 12 LEU CD1 C 6.127 4.229 -2.544 1.00 . A A . 12 LEU CD1 1 1 7 1559 1 1 12 LEU CD2 C 8.363 4.143 -3.653 1.00 . A A . 12 LEU CD2 1 1 7 1560 1 1 12 LEU CG C 7.178 3.308 -3.164 1.00 . A A . 12 LEU CG 1 1 7 1561 1 1 12 LEU H H 6.195 0.300 -2.077 1.00 . A A . 12 LEU H 1 1 7 1562 1 1 12 LEU HA H 8.353 1.210 -3.831 1.00 . A A . 12 LEU HA 1 1 7 1563 1 1 12 LEU HB2 H 6.860 2.094 -1.421 1.00 . A A . 12 LEU HB2 1 1 7 1564 1 1 12 LEU HB3 H 8.499 2.726 -1.577 1.00 . A A . 12 LEU HB3 1 1 7 1565 1 1 12 LEU HD11 H 5.176 4.069 -3.030 1.00 . A A . 12 LEU HD11 1 1 7 1566 1 1 12 LEU HD12 H 6.428 5.258 -2.674 1.00 . A A . 12 LEU HD12 1 1 7 1567 1 1 12 LEU HD13 H 6.033 4.012 -1.490 1.00 . A A . 12 LEU HD13 1 1 7 1568 1 1 12 LEU HD21 H 9.235 3.513 -3.742 1.00 . A A . 12 LEU HD21 1 1 7 1569 1 1 12 LEU HD22 H 8.563 4.934 -2.944 1.00 . A A . 12 LEU HD22 1 1 7 1570 1 1 12 LEU HD23 H 8.128 4.572 -4.615 1.00 . A A . 12 LEU HD23 1 1 7 1571 1 1 12 LEU HG H 6.743 2.773 -3.996 1.00 . A A . 12 LEU HG 1 1 7 1572 1 1 12 LEU N N 6.904 0.117 -2.727 1.00 . A A . 12 LEU N 1 1 7 1573 1 1 12 LEU O O 10.424 0.654 -2.361 1.00 . A A . 12 LEU O 1 1 7 1574 1 1 13 PHE C C 10.835 -2.133 -1.237 1.00 . A A . 13 PHE C 1 1 7 1575 1 1 13 PHE CA C 10.118 -1.111 -0.350 1.00 . A A . 13 PHE CA 1 1 7 1576 1 1 13 PHE CB C 9.437 -1.808 0.828 1.00 . A A . 13 PHE CB 1 1 7 1577 1 1 13 PHE CD1 C 10.526 -0.076 2.295 1.00 . A A . 13 PHE CD1 1 1 7 1578 1 1 13 PHE CD2 C 10.335 -2.347 3.121 1.00 . A A . 13 PHE CD2 1 1 7 1579 1 1 13 PHE CE1 C 11.155 0.304 3.483 1.00 . A A . 13 PHE CE1 1 1 7 1580 1 1 13 PHE CE2 C 10.965 -1.967 4.312 1.00 . A A . 13 PHE CE2 1 1 7 1581 1 1 13 PHE CG C 10.115 -1.402 2.113 1.00 . A A . 13 PHE CG 1 1 7 1582 1 1 13 PHE CZ C 11.376 -0.640 4.493 1.00 . A A . 13 PHE CZ 1 1 7 1583 1 1 13 PHE H H 8.077 -0.669 -0.884 1.00 . A A . 13 PHE H 1 1 7 1584 1 1 13 PHE HA H 10.814 -0.369 0.011 1.00 . A A . 13 PHE HA 1 1 7 1585 1 1 13 PHE HB2 H 8.397 -1.520 0.864 1.00 . A A . 13 PHE HB2 1 1 7 1586 1 1 13 PHE HB3 H 9.512 -2.878 0.707 1.00 . A A . 13 PHE HB3 1 1 7 1587 1 1 13 PHE HD1 H 10.356 0.652 1.517 1.00 . A A . 13 PHE HD1 1 1 7 1588 1 1 13 PHE HD2 H 10.018 -3.370 2.981 1.00 . A A . 13 PHE HD2 1 1 7 1589 1 1 13 PHE HE1 H 11.471 1.326 3.620 1.00 . A A . 13 PHE HE1 1 1 7 1590 1 1 13 PHE HE2 H 11.134 -2.696 5.091 1.00 . A A . 13 PHE HE2 1 1 7 1591 1 1 13 PHE HZ H 11.862 -0.346 5.411 1.00 . A A . 13 PHE HZ 1 1 7 1592 1 1 13 PHE N N 9.008 -0.463 -1.107 1.00 . A A . 13 PHE N 1 1 7 1593 1 1 13 PHE O O 10.362 -3.237 -1.423 1.00 . A A . 13 PHE O 1 1 7 1594 1 1 14 NH2 HN1 H 12.352 -0.920 -1.647 1.00 . A A . 14 NH2 HN1 1 1 7 1595 1 1 14 NH2 HN2 H 12.436 -2.455 -2.366 1.00 . A A . 14 NH2 HN2 1 1 7 1596 1 1 14 NH2 N N 11.968 -1.809 -1.797 1.00 . A A . 14 NH2 N 1 1 8 1597 1 1 1 ILE C C -9.068 -2.750 0.359 1.00 . A A . 1 ILE C 1 1 8 1598 1 1 1 ILE CA C -8.882 -4.225 -0.005 1.00 . A A . 1 ILE CA 1 1 8 1599 1 1 1 ILE CB C -7.397 -4.564 -0.132 1.00 . A A . 1 ILE CB 1 1 8 1600 1 1 1 ILE CD1 C -5.566 -2.880 -0.375 1.00 . A A . 1 ILE CD1 1 1 8 1601 1 1 1 ILE CG1 C -6.728 -3.574 -1.088 1.00 . A A . 1 ILE CG1 1 1 8 1602 1 1 1 ILE CG2 C -7.241 -5.984 -0.680 1.00 . A A . 1 ILE CG2 1 1 8 1603 1 1 1 ILE H1 H -10.229 -3.831 -1.545 1.00 . A A . 1 ILE H1 1 1 8 1604 1 1 1 ILE H2 H -9.826 -5.473 -1.380 1.00 . A A . 1 ILE H2 1 1 8 1605 1 1 1 ILE H3 H -8.717 -4.390 -2.074 1.00 . A A . 1 ILE H3 1 1 8 1606 1 1 1 ILE HA H -9.342 -4.858 0.737 1.00 . A A . 1 ILE HA 1 1 8 1607 1 1 1 ILE HB H -6.929 -4.501 0.840 1.00 . A A . 1 ILE HB 1 1 8 1608 1 1 1 ILE HD11 H -4.910 -3.624 0.052 1.00 . A A . 1 ILE HD11 1 1 8 1609 1 1 1 ILE HD12 H -5.953 -2.248 0.412 1.00 . A A . 1 ILE HD12 1 1 8 1610 1 1 1 ILE HD13 H -5.017 -2.277 -1.083 1.00 . A A . 1 ILE HD13 1 1 8 1611 1 1 1 ILE HG12 H -6.356 -4.104 -1.953 1.00 . A A . 1 ILE HG12 1 1 8 1612 1 1 1 ILE HG13 H -7.448 -2.834 -1.402 1.00 . A A . 1 ILE HG13 1 1 8 1613 1 1 1 ILE HG21 H -6.254 -6.353 -0.446 1.00 . A A . 1 ILE HG21 1 1 8 1614 1 1 1 ILE HG22 H -7.378 -5.973 -1.751 1.00 . A A . 1 ILE HG22 1 1 8 1615 1 1 1 ILE HG23 H -7.983 -6.627 -0.229 1.00 . A A . 1 ILE HG23 1 1 8 1616 1 1 1 ILE N N -9.457 -4.500 -1.353 1.00 . A A . 1 ILE N 1 1 8 1617 1 1 1 ILE O O -9.093 -1.888 -0.497 1.00 . A A . 1 ILE O 1 1 8 1618 1 1 2 LEU C C -8.025 -0.341 2.180 1.00 . A A . 2 LEU C 1 1 8 1619 1 1 2 LEU CA C -9.384 -1.032 2.039 1.00 . A A . 2 LEU CA 1 1 8 1620 1 1 2 LEU CB C -10.094 -1.103 3.391 1.00 . A A . 2 LEU CB 1 1 8 1621 1 1 2 LEU CD1 C -12.582 -1.197 3.604 1.00 . A A . 2 LEU CD1 1 1 8 1622 1 1 2 LEU CD2 C -11.335 0.818 4.394 1.00 . A A . 2 LEU CD2 1 1 8 1623 1 1 2 LEU CG C -11.384 -0.284 3.333 1.00 . A A . 2 LEU CG 1 1 8 1624 1 1 2 LEU H H -9.177 -3.161 2.298 1.00 . A A . 2 LEU H 1 1 8 1625 1 1 2 LEU HA H -10.001 -0.508 1.326 1.00 . A A . 2 LEU HA 1 1 8 1626 1 1 2 LEU HB2 H -10.329 -2.132 3.620 1.00 . A A . 2 LEU HB2 1 1 8 1627 1 1 2 LEU HB3 H -9.448 -0.701 4.158 1.00 . A A . 2 LEU HB3 1 1 8 1628 1 1 2 LEU HD11 H -12.237 -2.126 4.031 1.00 . A A . 2 LEU HD11 1 1 8 1629 1 1 2 LEU HD12 H -13.098 -1.396 2.677 1.00 . A A . 2 LEU HD12 1 1 8 1630 1 1 2 LEU HD13 H -13.255 -0.711 4.294 1.00 . A A . 2 LEU HD13 1 1 8 1631 1 1 2 LEU HD21 H -11.833 1.700 4.020 1.00 . A A . 2 LEU HD21 1 1 8 1632 1 1 2 LEU HD22 H -10.305 1.055 4.620 1.00 . A A . 2 LEU HD22 1 1 8 1633 1 1 2 LEU HD23 H -11.831 0.479 5.290 1.00 . A A . 2 LEU HD23 1 1 8 1634 1 1 2 LEU HG H -11.485 0.161 2.354 1.00 . A A . 2 LEU HG 1 1 8 1635 1 1 2 LEU N N -9.200 -2.453 1.623 1.00 . A A . 2 LEU N 1 1 8 1636 1 1 2 LEU O O -7.927 0.869 2.147 1.00 . A A . 2 LEU O 1 1 8 1637 1 1 3 GLY C C -5.072 -0.139 1.102 1.00 . A A . 3 GLY C 1 1 8 1638 1 1 3 GLY CA C -5.626 -0.486 2.482 1.00 . A A . 3 GLY CA 1 1 8 1639 1 1 3 GLY H H -7.075 -2.075 2.364 1.00 . A A . 3 GLY H 1 1 8 1640 1 1 3 GLY HA2 H -5.701 0.412 3.078 1.00 . A A . 3 GLY HA2 1 1 8 1641 1 1 3 GLY HA3 H -4.962 -1.182 2.964 1.00 . A A . 3 GLY HA3 1 1 8 1642 1 1 3 GLY N N -6.976 -1.101 2.339 1.00 . A A . 3 GLY N 1 1 8 1643 1 1 3 GLY O O -3.989 -0.547 0.736 1.00 . A A . 3 GLY O 1 1 8 1644 1 1 4 LYS C C -4.047 1.834 -0.889 1.00 . A A . 4 LYS C 1 1 8 1645 1 1 4 LYS CA C -5.316 0.995 -1.020 1.00 . A A . 4 LYS CA 1 1 8 1646 1 1 4 LYS CB C -6.448 1.816 -1.638 1.00 . A A . 4 LYS CB 1 1 8 1647 1 1 4 LYS CD C -8.300 1.754 -3.315 1.00 . A A . 4 LYS CD 1 1 8 1648 1 1 4 LYS CE C -8.908 0.962 -4.475 1.00 . A A . 4 LYS CE 1 1 8 1649 1 1 4 LYS CG C -7.008 1.077 -2.855 1.00 . A A . 4 LYS CG 1 1 8 1650 1 1 4 LYS H H -6.672 0.938 0.656 1.00 . A A . 4 LYS H 1 1 8 1651 1 1 4 LYS HA H -5.128 0.115 -1.612 1.00 . A A . 4 LYS HA 1 1 8 1652 1 1 4 LYS HB2 H -7.232 1.956 -0.908 1.00 . A A . 4 LYS HB2 1 1 8 1653 1 1 4 LYS HB3 H -6.067 2.778 -1.948 1.00 . A A . 4 LYS HB3 1 1 8 1654 1 1 4 LYS HD2 H -9.002 1.786 -2.494 1.00 . A A . 4 LYS HD2 1 1 8 1655 1 1 4 LYS HD3 H -8.083 2.759 -3.644 1.00 . A A . 4 LYS HD3 1 1 8 1656 1 1 4 LYS HE2 H -9.601 1.580 -5.029 1.00 . A A . 4 LYS HE2 1 1 8 1657 1 1 4 LYS HE3 H -8.131 0.590 -5.125 1.00 . A A . 4 LYS HE3 1 1 8 1658 1 1 4 LYS HG2 H -6.283 1.101 -3.656 1.00 . A A . 4 LYS HG2 1 1 8 1659 1 1 4 LYS HG3 H -7.216 0.052 -2.589 1.00 . A A . 4 LYS HG3 1 1 8 1660 1 1 4 LYS HZ1 H -10.080 -0.756 -4.562 1.00 . A A . 4 LYS HZ1 1 1 8 1661 1 1 4 LYS HZ2 H -10.342 0.193 -3.178 1.00 . A A . 4 LYS HZ2 1 1 8 1662 1 1 4 LYS HZ3 H -8.942 -0.760 -3.305 1.00 . A A . 4 LYS HZ3 1 1 8 1663 1 1 4 LYS N N -5.806 0.616 0.336 1.00 . A A . 4 LYS N 1 1 8 1664 1 1 4 LYS NZ N -9.621 -0.176 -3.832 1.00 . A A . 4 LYS NZ 1 1 8 1665 1 1 4 LYS O O -3.134 1.731 -1.683 1.00 . A A . 4 LYS O 1 1 8 1666 1 1 5 ILE C C -1.627 2.640 0.852 1.00 . A A . 5 ILE C 1 1 8 1667 1 1 5 ILE CA C -2.776 3.501 0.321 1.00 . A A . 5 ILE CA 1 1 8 1668 1 1 5 ILE CB C -3.197 4.537 1.359 1.00 . A A . 5 ILE CB 1 1 8 1669 1 1 5 ILE CD1 C -3.255 6.509 -0.183 1.00 . A A . 5 ILE CD1 1 1 8 1670 1 1 5 ILE CG1 C -4.098 5.582 0.695 1.00 . A A . 5 ILE CG1 1 1 8 1671 1 1 5 ILE CG2 C -1.956 5.221 1.937 1.00 . A A . 5 ILE CG2 1 1 8 1672 1 1 5 ILE H H -4.732 2.715 0.748 1.00 . A A . 5 ILE H 1 1 8 1673 1 1 5 ILE HA H -2.493 3.986 -0.598 1.00 . A A . 5 ILE HA 1 1 8 1674 1 1 5 ILE HB H -3.740 4.047 2.154 1.00 . A A . 5 ILE HB 1 1 8 1675 1 1 5 ILE HD11 H -2.705 5.920 -0.904 1.00 . A A . 5 ILE HD11 1 1 8 1676 1 1 5 ILE HD12 H -2.561 7.059 0.436 1.00 . A A . 5 ILE HD12 1 1 8 1677 1 1 5 ILE HD13 H -3.901 7.202 -0.702 1.00 . A A . 5 ILE HD13 1 1 8 1678 1 1 5 ILE HG12 H -4.837 5.083 0.085 1.00 . A A . 5 ILE HG12 1 1 8 1679 1 1 5 ILE HG13 H -4.595 6.163 1.456 1.00 . A A . 5 ILE HG13 1 1 8 1680 1 1 5 ILE HG21 H -1.574 4.637 2.761 1.00 . A A . 5 ILE HG21 1 1 8 1681 1 1 5 ILE HG22 H -2.218 6.208 2.288 1.00 . A A . 5 ILE HG22 1 1 8 1682 1 1 5 ILE HG23 H -1.199 5.301 1.171 1.00 . A A . 5 ILE HG23 1 1 8 1683 1 1 5 ILE N N -3.984 2.657 0.119 1.00 . A A . 5 ILE N 1 1 8 1684 1 1 5 ILE O O -0.468 2.909 0.606 1.00 . A A . 5 ILE O 1 1 8 1685 1 1 6 TRP C C -0.307 -0.163 1.008 1.00 . A A . 6 TRP C 1 1 8 1686 1 1 6 TRP CA C -0.878 0.717 2.123 1.00 . A A . 6 TRP CA 1 1 8 1687 1 1 6 TRP CB C -1.579 -0.136 3.182 1.00 . A A . 6 TRP CB 1 1 8 1688 1 1 6 TRP CD1 C -1.066 -2.606 3.323 1.00 . A A . 6 TRP CD1 1 1 8 1689 1 1 6 TRP CD2 C 0.601 -1.330 4.133 1.00 . A A . 6 TRP CD2 1 1 8 1690 1 1 6 TRP CE2 C 1.015 -2.676 4.270 1.00 . A A . 6 TRP CE2 1 1 8 1691 1 1 6 TRP CE3 C 1.474 -0.319 4.570 1.00 . A A . 6 TRP CE3 1 1 8 1692 1 1 6 TRP CG C -0.724 -1.313 3.527 1.00 . A A . 6 TRP CG 1 1 8 1693 1 1 6 TRP CH2 C 3.109 -1.990 5.253 1.00 . A A . 6 TRP CH2 1 1 8 1694 1 1 6 TRP CZ2 C 2.253 -3.007 4.823 1.00 . A A . 6 TRP CZ2 1 1 8 1695 1 1 6 TRP CZ3 C 2.721 -0.649 5.127 1.00 . A A . 6 TRP CZ3 1 1 8 1696 1 1 6 TRP H H -2.887 1.402 1.759 1.00 . A A . 6 TRP H 1 1 8 1697 1 1 6 TRP HA H -0.097 1.303 2.578 1.00 . A A . 6 TRP HA 1 1 8 1698 1 1 6 TRP HB2 H -1.747 0.459 4.068 1.00 . A A . 6 TRP HB2 1 1 8 1699 1 1 6 TRP HB3 H -2.527 -0.480 2.797 1.00 . A A . 6 TRP HB3 1 1 8 1700 1 1 6 TRP HD1 H -1.992 -2.949 2.886 1.00 . A A . 6 TRP HD1 1 1 8 1701 1 1 6 TRP HE1 H -0.030 -4.395 3.727 1.00 . A A . 6 TRP HE1 1 1 8 1702 1 1 6 TRP HE3 H 1.185 0.718 4.479 1.00 . A A . 6 TRP HE3 1 1 8 1703 1 1 6 TRP HH2 H 4.069 -2.237 5.683 1.00 . A A . 6 TRP HH2 1 1 8 1704 1 1 6 TRP HZ2 H 2.547 -4.042 4.918 1.00 . A A . 6 TRP HZ2 1 1 8 1705 1 1 6 TRP HZ3 H 3.384 0.136 5.461 1.00 . A A . 6 TRP HZ3 1 1 8 1706 1 1 6 TRP N N -1.945 1.602 1.577 1.00 . A A . 6 TRP N 1 1 8 1707 1 1 6 TRP NE1 N -0.034 -3.415 3.762 1.00 . A A . 6 TRP NE1 1 1 8 1708 1 1 6 TRP O O 0.836 -0.571 1.049 1.00 . A A . 6 TRP O 1 1 8 1709 1 1 7 GLU C C 0.520 -0.578 -1.861 1.00 . A A . 7 GLU C 1 1 8 1710 1 1 7 GLU CA C -0.598 -1.304 -1.108 1.00 . A A . 7 GLU CA 1 1 8 1711 1 1 7 GLU CB C -1.809 -1.514 -2.016 1.00 . A A . 7 GLU CB 1 1 8 1712 1 1 7 GLU CD C -1.776 -3.355 -3.704 1.00 . A A . 7 GLU CD 1 1 8 1713 1 1 7 GLU CG C -2.032 -3.011 -2.235 1.00 . A A . 7 GLU CG 1 1 8 1714 1 1 7 GLU H H -2.014 -0.113 -0.004 1.00 . A A . 7 GLU H 1 1 8 1715 1 1 7 GLU HA H -0.247 -2.253 -0.734 1.00 . A A . 7 GLU HA 1 1 8 1716 1 1 7 GLU HB2 H -2.686 -1.083 -1.551 1.00 . A A . 7 GLU HB2 1 1 8 1717 1 1 7 GLU HB3 H -1.634 -1.034 -2.967 1.00 . A A . 7 GLU HB3 1 1 8 1718 1 1 7 GLU HG2 H -1.352 -3.571 -1.609 1.00 . A A . 7 GLU HG2 1 1 8 1719 1 1 7 GLU HG3 H -3.049 -3.266 -1.980 1.00 . A A . 7 GLU HG3 1 1 8 1720 1 1 7 GLU N N -1.095 -0.454 0.011 1.00 . A A . 7 GLU N 1 1 8 1721 1 1 7 GLU O O 1.384 -1.192 -2.453 1.00 . A A . 7 GLU O 1 1 8 1722 1 1 7 GLU OE1 O -2.104 -2.539 -4.549 1.00 . A A . 7 GLU OE1 1 1 8 1723 1 1 7 GLU OE2 O -1.255 -4.429 -3.958 1.00 . A A . 7 GLU OE2 1 1 8 1724 1 1 8 GLY C C 2.820 1.566 -1.677 1.00 . A A . 8 GLY C 1 1 8 1725 1 1 8 GLY CA C 1.567 1.494 -2.550 1.00 . A A . 8 GLY CA 1 1 8 1726 1 1 8 GLY H H -0.199 1.201 -1.352 1.00 . A A . 8 GLY H 1 1 8 1727 1 1 8 GLY HA2 H 1.804 1.000 -3.481 1.00 . A A . 8 GLY HA2 1 1 8 1728 1 1 8 GLY HA3 H 1.215 2.494 -2.752 1.00 . A A . 8 GLY HA3 1 1 8 1729 1 1 8 GLY N N 0.508 0.727 -1.839 1.00 . A A . 8 GLY N 1 1 8 1730 1 1 8 GLY O O 3.932 1.568 -2.167 1.00 . A A . 8 GLY O 1 1 8 1731 1 1 9 ILE C C 4.614 0.380 0.470 1.00 . A A . 9 ILE C 1 1 8 1732 1 1 9 ILE CA C 3.834 1.696 0.519 1.00 . A A . 9 ILE CA 1 1 8 1733 1 1 9 ILE CB C 3.256 1.924 1.915 1.00 . A A . 9 ILE CB 1 1 8 1734 1 1 9 ILE CD1 C 1.910 3.487 3.328 1.00 . A A . 9 ILE CD1 1 1 8 1735 1 1 9 ILE CG1 C 2.380 3.179 1.905 1.00 . A A . 9 ILE CG1 1 1 8 1736 1 1 9 ILE CG2 C 4.397 2.109 2.916 1.00 . A A . 9 ILE CG2 1 1 8 1737 1 1 9 ILE H H 1.745 1.622 -0.011 1.00 . A A . 9 ILE H 1 1 8 1738 1 1 9 ILE HA H 4.471 2.522 0.243 1.00 . A A . 9 ILE HA 1 1 8 1739 1 1 9 ILE HB H 2.661 1.069 2.202 1.00 . A A . 9 ILE HB 1 1 8 1740 1 1 9 ILE HD11 H 0.875 3.198 3.435 1.00 . A A . 9 ILE HD11 1 1 8 1741 1 1 9 ILE HD12 H 2.010 4.545 3.520 1.00 . A A . 9 ILE HD12 1 1 8 1742 1 1 9 ILE HD13 H 2.513 2.935 4.034 1.00 . A A . 9 ILE HD13 1 1 8 1743 1 1 9 ILE HG12 H 2.952 4.014 1.525 1.00 . A A . 9 ILE HG12 1 1 8 1744 1 1 9 ILE HG13 H 1.522 3.014 1.272 1.00 . A A . 9 ILE HG13 1 1 8 1745 1 1 9 ILE HG21 H 4.029 1.941 3.918 1.00 . A A . 9 ILE HG21 1 1 8 1746 1 1 9 ILE HG22 H 4.785 3.114 2.839 1.00 . A A . 9 ILE HG22 1 1 8 1747 1 1 9 ILE HG23 H 5.185 1.402 2.699 1.00 . A A . 9 ILE HG23 1 1 8 1748 1 1 9 ILE N N 2.650 1.626 -0.386 1.00 . A A . 9 ILE N 1 1 8 1749 1 1 9 ILE O O 5.791 0.354 0.168 1.00 . A A . 9 ILE O 1 1 8 1750 1 1 10 LYS C C 5.303 -2.259 -0.639 1.00 . A A . 10 LYS C 1 1 8 1751 1 1 10 LYS CA C 4.671 -2.028 0.736 1.00 . A A . 10 LYS CA 1 1 8 1752 1 1 10 LYS CB C 3.582 -3.067 1.006 1.00 . A A . 10 LYS CB 1 1 8 1753 1 1 10 LYS CD C 2.136 -4.137 -0.729 1.00 . A A . 10 LYS CD 1 1 8 1754 1 1 10 LYS CE C 3.304 -4.427 -1.675 1.00 . A A . 10 LYS CE 1 1 8 1755 1 1 10 LYS CG C 2.413 -2.845 0.043 1.00 . A A . 10 LYS CG 1 1 8 1756 1 1 10 LYS H H 3.017 -0.672 1.006 1.00 . A A . 10 LYS H 1 1 8 1757 1 1 10 LYS HA H 5.422 -2.071 1.508 1.00 . A A . 10 LYS HA 1 1 8 1758 1 1 10 LYS HB2 H 3.987 -4.058 0.861 1.00 . A A . 10 LYS HB2 1 1 8 1759 1 1 10 LYS HB3 H 3.232 -2.966 2.023 1.00 . A A . 10 LYS HB3 1 1 8 1760 1 1 10 LYS HD2 H 2.024 -4.956 -0.033 1.00 . A A . 10 LYS HD2 1 1 8 1761 1 1 10 LYS HD3 H 1.230 -4.025 -1.304 1.00 . A A . 10 LYS HD3 1 1 8 1762 1 1 10 LYS HE2 H 3.425 -3.617 -2.381 1.00 . A A . 10 LYS HE2 1 1 8 1763 1 1 10 LYS HE3 H 4.214 -4.581 -1.115 1.00 . A A . 10 LYS HE3 1 1 8 1764 1 1 10 LYS HG2 H 1.534 -2.564 0.604 1.00 . A A . 10 LYS HG2 1 1 8 1765 1 1 10 LYS HG3 H 2.665 -2.059 -0.653 1.00 . A A . 10 LYS HG3 1 1 8 1766 1 1 10 LYS HZ1 H 2.547 -6.366 -1.697 1.00 . A A . 10 LYS HZ1 1 1 8 1767 1 1 10 LYS HZ2 H 3.760 -6.083 -2.853 1.00 . A A . 10 LYS HZ2 1 1 8 1768 1 1 10 LYS HZ3 H 2.193 -5.470 -3.092 1.00 . A A . 10 LYS HZ3 1 1 8 1769 1 1 10 LYS N N 3.967 -0.713 0.765 1.00 . A A . 10 LYS N 1 1 8 1770 1 1 10 LYS NZ N 2.922 -5.681 -2.382 1.00 . A A . 10 LYS NZ 1 1 8 1771 1 1 10 LYS O O 6.261 -2.992 -0.777 1.00 . A A . 10 LYS O 1 1 8 1772 1 1 11 SER C C 6.682 -1.091 -3.142 1.00 . A A . 11 SER C 1 1 8 1773 1 1 11 SER CA C 5.343 -1.824 -3.023 1.00 . A A . 11 SER CA 1 1 8 1774 1 1 11 SER CB C 4.312 -1.212 -3.970 1.00 . A A . 11 SER CB 1 1 8 1775 1 1 11 SER H H 3.998 -1.053 -1.526 1.00 . A A . 11 SER H 1 1 8 1776 1 1 11 SER HA H 5.466 -2.873 -3.241 1.00 . A A . 11 SER HA 1 1 8 1777 1 1 11 SER HB2 H 3.558 -1.945 -4.208 1.00 . A A . 11 SER HB2 1 1 8 1778 1 1 11 SER HB3 H 3.846 -0.361 -3.491 1.00 . A A . 11 SER HB3 1 1 8 1779 1 1 11 SER HG H 4.282 -0.587 -5.812 1.00 . A A . 11 SER HG 1 1 8 1780 1 1 11 SER N N 4.772 -1.639 -1.658 1.00 . A A . 11 SER N 1 1 8 1781 1 1 11 SER O O 7.518 -1.434 -3.955 1.00 . A A . 11 SER O 1 1 8 1782 1 1 11 SER OG O 4.959 -0.802 -5.167 1.00 . A A . 11 SER OG 1 1 8 1783 1 1 12 LEU C C 9.231 0.005 -1.516 1.00 . A A . 12 LEU C 1 1 8 1784 1 1 12 LEU CA C 8.179 0.667 -2.409 1.00 . A A . 12 LEU CA 1 1 8 1785 1 1 12 LEU CB C 7.846 2.069 -1.896 1.00 . A A . 12 LEU CB 1 1 8 1786 1 1 12 LEU CD1 C 6.461 3.768 -3.095 1.00 . A A . 12 LEU CD1 1 1 8 1787 1 1 12 LEU CD2 C 8.934 4.073 -2.916 1.00 . A A . 12 LEU CD2 1 1 8 1788 1 1 12 LEU CG C 7.809 3.046 -3.073 1.00 . A A . 12 LEU CG 1 1 8 1789 1 1 12 LEU H H 6.206 0.176 -1.690 1.00 . A A . 12 LEU H 1 1 8 1790 1 1 12 LEU HA H 8.528 0.721 -3.426 1.00 . A A . 12 LEU HA 1 1 8 1791 1 1 12 LEU HB2 H 6.882 2.054 -1.409 1.00 . A A . 12 LEU HB2 1 1 8 1792 1 1 12 LEU HB3 H 8.601 2.384 -1.192 1.00 . A A . 12 LEU HB3 1 1 8 1793 1 1 12 LEU HD11 H 6.469 4.523 -3.868 1.00 . A A . 12 LEU HD11 1 1 8 1794 1 1 12 LEU HD12 H 6.285 4.235 -2.138 1.00 . A A . 12 LEU HD12 1 1 8 1795 1 1 12 LEU HD13 H 5.675 3.056 -3.298 1.00 . A A . 12 LEU HD13 1 1 8 1796 1 1 12 LEU HD21 H 8.728 4.704 -2.063 1.00 . A A . 12 LEU HD21 1 1 8 1797 1 1 12 LEU HD22 H 8.993 4.679 -3.806 1.00 . A A . 12 LEU HD22 1 1 8 1798 1 1 12 LEU HD23 H 9.872 3.560 -2.765 1.00 . A A . 12 LEU HD23 1 1 8 1799 1 1 12 LEU HG H 7.942 2.502 -3.996 1.00 . A A . 12 LEU HG 1 1 8 1800 1 1 12 LEU N N 6.894 -0.085 -2.338 1.00 . A A . 12 LEU N 1 1 8 1801 1 1 12 LEU O O 10.412 0.040 -1.798 1.00 . A A . 12 LEU O 1 1 8 1802 1 1 13 PHE C C 9.065 -1.809 1.709 1.00 . A A . 13 PHE C 1 1 8 1803 1 1 13 PHE CA C 9.785 -1.269 0.471 1.00 . A A . 13 PHE CA 1 1 8 1804 1 1 13 PHE CB C 10.778 -0.174 0.864 1.00 . A A . 13 PHE CB 1 1 8 1805 1 1 13 PHE CD1 C 12.516 -1.475 -0.410 1.00 . A A . 13 PHE CD1 1 1 8 1806 1 1 13 PHE CD2 C 13.156 -0.402 1.667 1.00 . A A . 13 PHE CD2 1 1 8 1807 1 1 13 PHE CE1 C 13.817 -1.962 -0.560 1.00 . A A . 13 PHE CE1 1 1 8 1808 1 1 13 PHE CE2 C 14.460 -0.890 1.516 1.00 . A A . 13 PHE CE2 1 1 8 1809 1 1 13 PHE CG C 12.185 -0.695 0.703 1.00 . A A . 13 PHE CG 1 1 8 1810 1 1 13 PHE CZ C 14.790 -1.671 0.402 1.00 . A A . 13 PHE CZ 1 1 8 1811 1 1 13 PHE H H 7.853 -0.618 -0.233 1.00 . A A . 13 PHE H 1 1 8 1812 1 1 13 PHE HA H 10.298 -2.065 -0.045 1.00 . A A . 13 PHE HA 1 1 8 1813 1 1 13 PHE HB2 H 10.637 0.687 0.226 1.00 . A A . 13 PHE HB2 1 1 8 1814 1 1 13 PHE HB3 H 10.614 0.109 1.892 1.00 . A A . 13 PHE HB3 1 1 8 1815 1 1 13 PHE HD1 H 11.766 -1.701 -1.153 1.00 . A A . 13 PHE HD1 1 1 8 1816 1 1 13 PHE HD2 H 12.901 0.200 2.526 1.00 . A A . 13 PHE HD2 1 1 8 1817 1 1 13 PHE HE1 H 14.069 -2.564 -1.419 1.00 . A A . 13 PHE HE1 1 1 8 1818 1 1 13 PHE HE2 H 15.211 -0.664 2.259 1.00 . A A . 13 PHE HE2 1 1 8 1819 1 1 13 PHE HZ H 15.797 -2.047 0.285 1.00 . A A . 13 PHE HZ 1 1 8 1820 1 1 13 PHE N N 8.810 -0.601 -0.440 1.00 . A A . 13 PHE N 1 1 8 1821 1 1 13 PHE O O 8.493 -1.058 2.475 1.00 . A A . 13 PHE O 1 1 8 1822 1 1 14 NH2 HN1 H 9.529 -3.700 1.322 1.00 . A A . 14 NH2 HN1 1 1 8 1823 1 1 14 NH2 HN2 H 8.610 -3.451 2.728 1.00 . A A . 14 NH2 HN2 1 1 8 1824 1 1 14 NH2 N N 9.068 -3.093 1.939 1.00 . A A . 14 NH2 N 1 1 9 1825 1 1 1 ILE C C -9.333 -0.949 1.817 1.00 . A A . 1 ILE C 1 1 9 1826 1 1 1 ILE CA C -10.126 -0.517 0.580 1.00 . A A . 1 ILE CA 1 1 9 1827 1 1 1 ILE CB C -9.828 -1.436 -0.605 1.00 . A A . 1 ILE CB 1 1 9 1828 1 1 1 ILE CD1 C -7.781 -2.785 -1.099 1.00 . A A . 1 ILE CD1 1 1 9 1829 1 1 1 ILE CG1 C -8.336 -1.367 -0.940 1.00 . A A . 1 ILE CG1 1 1 9 1830 1 1 1 ILE CG2 C -10.643 -0.985 -1.819 1.00 . A A . 1 ILE CG2 1 1 9 1831 1 1 1 ILE H1 H -10.103 1.051 -0.792 1.00 . A A . 1 ILE H1 1 1 9 1832 1 1 1 ILE H2 H -8.651 0.862 0.068 1.00 . A A . 1 ILE H2 1 1 9 1833 1 1 1 ILE H3 H -10.008 1.549 0.826 1.00 . A A . 1 ILE H3 1 1 9 1834 1 1 1 ILE HA H -11.184 -0.520 0.792 1.00 . A A . 1 ILE HA 1 1 9 1835 1 1 1 ILE HB H -10.096 -2.451 -0.351 1.00 . A A . 1 ILE HB 1 1 9 1836 1 1 1 ILE HD11 H -8.599 -3.480 -1.221 1.00 . A A . 1 ILE HD11 1 1 9 1837 1 1 1 ILE HD12 H -7.212 -3.049 -0.220 1.00 . A A . 1 ILE HD12 1 1 9 1838 1 1 1 ILE HD13 H -7.141 -2.825 -1.968 1.00 . A A . 1 ILE HD13 1 1 9 1839 1 1 1 ILE HG12 H -8.200 -0.821 -1.862 1.00 . A A . 1 ILE HG12 1 1 9 1840 1 1 1 ILE HG13 H -7.811 -0.865 -0.142 1.00 . A A . 1 ILE HG13 1 1 9 1841 1 1 1 ILE HG21 H -10.953 -1.850 -2.386 1.00 . A A . 1 ILE HG21 1 1 9 1842 1 1 1 ILE HG22 H -10.036 -0.344 -2.442 1.00 . A A . 1 ILE HG22 1 1 9 1843 1 1 1 ILE HG23 H -11.515 -0.443 -1.485 1.00 . A A . 1 ILE HG23 1 1 9 1844 1 1 1 ILE N N -9.689 0.839 0.137 1.00 . A A . 1 ILE N 1 1 9 1845 1 1 1 ILE O O -8.898 -0.131 2.603 1.00 . A A . 1 ILE O 1 1 9 1846 1 1 2 LEU C C -7.117 -1.871 3.387 1.00 . A A . 2 LEU C 1 1 9 1847 1 1 2 LEU CA C -8.382 -2.708 3.187 1.00 . A A . 2 LEU CA 1 1 9 1848 1 1 2 LEU CB C -8.017 -4.157 2.864 1.00 . A A . 2 LEU CB 1 1 9 1849 1 1 2 LEU CD1 C -8.149 -5.097 5.175 1.00 . A A . 2 LEU CD1 1 1 9 1850 1 1 2 LEU CD2 C -6.494 -6.015 3.547 1.00 . A A . 2 LEU CD2 1 1 9 1851 1 1 2 LEU CG C -7.210 -4.747 4.021 1.00 . A A . 2 LEU CG 1 1 9 1852 1 1 2 LEU H H -9.504 -2.872 1.355 1.00 . A A . 2 LEU H 1 1 9 1853 1 1 2 LEU HA H -9.000 -2.672 4.067 1.00 . A A . 2 LEU HA 1 1 9 1854 1 1 2 LEU HB2 H -8.922 -4.733 2.724 1.00 . A A . 2 LEU HB2 1 1 9 1855 1 1 2 LEU HB3 H -7.427 -4.188 1.962 1.00 . A A . 2 LEU HB3 1 1 9 1856 1 1 2 LEU HD11 H -8.286 -4.229 5.803 1.00 . A A . 2 LEU HD11 1 1 9 1857 1 1 2 LEU HD12 H -7.721 -5.898 5.759 1.00 . A A . 2 LEU HD12 1 1 9 1858 1 1 2 LEU HD13 H -9.105 -5.409 4.781 1.00 . A A . 2 LEU HD13 1 1 9 1859 1 1 2 LEU HD21 H -5.484 -5.769 3.253 1.00 . A A . 2 LEU HD21 1 1 9 1860 1 1 2 LEU HD22 H -7.022 -6.434 2.704 1.00 . A A . 2 LEU HD22 1 1 9 1861 1 1 2 LEU HD23 H -6.468 -6.736 4.350 1.00 . A A . 2 LEU HD23 1 1 9 1862 1 1 2 LEU HG H -6.481 -4.024 4.356 1.00 . A A . 2 LEU HG 1 1 9 1863 1 1 2 LEU N N -9.144 -2.228 1.998 1.00 . A A . 2 LEU N 1 1 9 1864 1 1 2 LEU O O -6.631 -1.718 4.489 1.00 . A A . 2 LEU O 1 1 9 1865 1 1 3 GLY C C -4.827 -0.109 1.083 1.00 . A A . 3 GLY C 1 1 9 1866 1 1 3 GLY CA C -5.340 -0.507 2.466 1.00 . A A . 3 GLY CA 1 1 9 1867 1 1 3 GLY H H -6.981 -1.466 1.448 1.00 . A A . 3 GLY H 1 1 9 1868 1 1 3 GLY HA2 H -5.560 0.383 3.037 1.00 . A A . 3 GLY HA2 1 1 9 1869 1 1 3 GLY HA3 H -4.582 -1.081 2.973 1.00 . A A . 3 GLY HA3 1 1 9 1870 1 1 3 GLY N N -6.576 -1.330 2.329 1.00 . A A . 3 GLY N 1 1 9 1871 1 1 3 GLY O O -3.940 -0.733 0.537 1.00 . A A . 3 GLY O 1 1 9 1872 1 1 4 LYS C C -3.558 2.075 -0.699 1.00 . A A . 4 LYS C 1 1 9 1873 1 1 4 LYS CA C -4.908 1.370 -0.829 1.00 . A A . 4 LYS CA 1 1 9 1874 1 1 4 LYS CB C -5.980 2.341 -1.326 1.00 . A A . 4 LYS CB 1 1 9 1875 1 1 4 LYS CD C -6.563 1.872 -3.710 1.00 . A A . 4 LYS CD 1 1 9 1876 1 1 4 LYS CE C -7.714 2.588 -4.420 1.00 . A A . 4 LYS CE 1 1 9 1877 1 1 4 LYS CG C -6.947 1.604 -2.254 1.00 . A A . 4 LYS CG 1 1 9 1878 1 1 4 LYS H H -6.084 1.421 0.976 1.00 . A A . 4 LYS H 1 1 9 1879 1 1 4 LYS HA H -4.831 0.529 -1.496 1.00 . A A . 4 LYS HA 1 1 9 1880 1 1 4 LYS HB2 H -6.523 2.740 -0.481 1.00 . A A . 4 LYS HB2 1 1 9 1881 1 1 4 LYS HB3 H -5.511 3.150 -1.867 1.00 . A A . 4 LYS HB3 1 1 9 1882 1 1 4 LYS HD2 H -5.677 2.491 -3.741 1.00 . A A . 4 LYS HD2 1 1 9 1883 1 1 4 LYS HD3 H -6.363 0.934 -4.208 1.00 . A A . 4 LYS HD3 1 1 9 1884 1 1 4 LYS HE2 H -7.788 2.254 -5.446 1.00 . A A . 4 LYS HE2 1 1 9 1885 1 1 4 LYS HE3 H -8.642 2.418 -3.898 1.00 . A A . 4 LYS HE3 1 1 9 1886 1 1 4 LYS HG2 H -6.897 0.543 -2.056 1.00 . A A . 4 LYS HG2 1 1 9 1887 1 1 4 LYS HG3 H -7.952 1.955 -2.079 1.00 . A A . 4 LYS HG3 1 1 9 1888 1 1 4 LYS HZ1 H -7.825 4.536 -5.147 1.00 . A A . 4 LYS HZ1 1 1 9 1889 1 1 4 LYS HZ2 H -6.325 4.139 -4.454 1.00 . A A . 4 LYS HZ2 1 1 9 1890 1 1 4 LYS HZ3 H -7.672 4.436 -3.461 1.00 . A A . 4 LYS HZ3 1 1 9 1891 1 1 4 LYS N N -5.373 0.929 0.515 1.00 . A A . 4 LYS N 1 1 9 1892 1 1 4 LYS NZ N -7.356 4.034 -4.367 1.00 . A A . 4 LYS NZ 1 1 9 1893 1 1 4 LYS O O -2.689 1.940 -1.537 1.00 . A A . 4 LYS O 1 1 9 1894 1 1 5 ILE C C -1.018 2.533 1.019 1.00 . A A . 5 ILE C 1 1 9 1895 1 1 5 ILE CA C -2.084 3.528 0.558 1.00 . A A . 5 ILE CA 1 1 9 1896 1 1 5 ILE CB C -2.365 4.558 1.650 1.00 . A A . 5 ILE CB 1 1 9 1897 1 1 5 ILE CD1 C -2.741 6.384 -0.017 1.00 . A A . 5 ILE CD1 1 1 9 1898 1 1 5 ILE CG1 C -3.369 5.591 1.131 1.00 . A A . 5 ILE CG1 1 1 9 1899 1 1 5 ILE CG2 C -1.064 5.262 2.038 1.00 . A A . 5 ILE CG2 1 1 9 1900 1 1 5 ILE H H -4.092 2.906 1.019 1.00 . A A . 5 ILE H 1 1 9 1901 1 1 5 ILE HA H -1.776 4.022 -0.350 1.00 . A A . 5 ILE HA 1 1 9 1902 1 1 5 ILE HB H -2.775 4.059 2.516 1.00 . A A . 5 ILE HB 1 1 9 1903 1 1 5 ILE HD11 H -2.871 5.843 -0.942 1.00 . A A . 5 ILE HD11 1 1 9 1904 1 1 5 ILE HD12 H -1.687 6.522 0.173 1.00 . A A . 5 ILE HD12 1 1 9 1905 1 1 5 ILE HD13 H -3.222 7.347 -0.093 1.00 . A A . 5 ILE HD13 1 1 9 1906 1 1 5 ILE HG12 H -4.254 5.083 0.778 1.00 . A A . 5 ILE HG12 1 1 9 1907 1 1 5 ILE HG13 H -3.634 6.266 1.929 1.00 . A A . 5 ILE HG13 1 1 9 1908 1 1 5 ILE HG21 H -0.690 4.845 2.962 1.00 . A A . 5 ILE HG21 1 1 9 1909 1 1 5 ILE HG22 H -1.251 6.318 2.169 1.00 . A A . 5 ILE HG22 1 1 9 1910 1 1 5 ILE HG23 H -0.331 5.121 1.257 1.00 . A A . 5 ILE HG23 1 1 9 1911 1 1 5 ILE N N -3.378 2.820 0.355 1.00 . A A . 5 ILE N 1 1 9 1912 1 1 5 ILE O O 0.159 2.707 0.772 1.00 . A A . 5 ILE O 1 1 9 1913 1 1 6 TRP C C -0.041 -0.451 1.010 1.00 . A A . 6 TRP C 1 1 9 1914 1 1 6 TRP CA C -0.440 0.476 2.161 1.00 . A A . 6 TRP CA 1 1 9 1915 1 1 6 TRP CB C -1.174 -0.304 3.255 1.00 . A A . 6 TRP CB 1 1 9 1916 1 1 6 TRP CD1 C -0.938 -2.820 3.311 1.00 . A A . 6 TRP CD1 1 1 9 1917 1 1 6 TRP CD2 C 0.892 -1.764 4.081 1.00 . A A . 6 TRP CD2 1 1 9 1918 1 1 6 TRP CE2 C 1.158 -3.151 4.167 1.00 . A A . 6 TRP CE2 1 1 9 1919 1 1 6 TRP CE3 C 1.891 -0.870 4.507 1.00 . A A . 6 TRP CE3 1 1 9 1920 1 1 6 TRP CG C -0.445 -1.581 3.535 1.00 . A A . 6 TRP CG 1 1 9 1921 1 1 6 TRP CH2 C 3.354 -2.732 5.076 1.00 . A A . 6 TRP CH2 1 1 9 1922 1 1 6 TRP CZ2 C 2.372 -3.634 4.656 1.00 . A A . 6 TRP CZ2 1 1 9 1923 1 1 6 TRP CZ3 C 3.113 -1.353 5.001 1.00 . A A . 6 TRP CZ3 1 1 9 1924 1 1 6 TRP H H -2.381 1.367 1.870 1.00 . A A . 6 TRP H 1 1 9 1925 1 1 6 TRP HA H 0.430 0.961 2.575 1.00 . A A . 6 TRP HA 1 1 9 1926 1 1 6 TRP HB2 H -1.215 0.290 4.156 1.00 . A A . 6 TRP HB2 1 1 9 1927 1 1 6 TRP HB3 H -2.177 -0.528 2.926 1.00 . A A . 6 TRP HB3 1 1 9 1928 1 1 6 TRP HD1 H -1.914 -3.045 2.906 1.00 . A A . 6 TRP HD1 1 1 9 1929 1 1 6 TRP HE1 H -0.095 -4.726 3.624 1.00 . A A . 6 TRP HE1 1 1 9 1930 1 1 6 TRP HE3 H 1.716 0.195 4.453 1.00 . A A . 6 TRP HE3 1 1 9 1931 1 1 6 TRP HH2 H 4.296 -3.097 5.457 1.00 . A A . 6 TRP HH2 1 1 9 1932 1 1 6 TRP HZ2 H 2.552 -4.698 4.712 1.00 . A A . 6 TRP HZ2 1 1 9 1933 1 1 6 TRP HZ3 H 3.873 -0.657 5.326 1.00 . A A . 6 TRP HZ3 1 1 9 1934 1 1 6 TRP N N -1.425 1.488 1.685 1.00 . A A . 6 TRP N 1 1 9 1935 1 1 6 TRP NE1 N 0.012 -3.754 3.685 1.00 . A A . 6 TRP NE1 1 1 9 1936 1 1 6 TRP O O 0.996 -1.083 1.040 1.00 . A A . 6 TRP O 1 1 9 1937 1 1 7 GLU C C 0.693 -0.880 -1.906 1.00 . A A . 7 GLU C 1 1 9 1938 1 1 7 GLU CA C -0.522 -1.426 -1.154 1.00 . A A . 7 GLU CA 1 1 9 1939 1 1 7 GLU CB C -1.763 -1.401 -2.048 1.00 . A A . 7 GLU CB 1 1 9 1940 1 1 7 GLU CD C -3.237 -2.898 -3.399 1.00 . A A . 7 GLU CD 1 1 9 1941 1 1 7 GLU CG C -2.340 -2.812 -2.163 1.00 . A A . 7 GLU CG 1 1 9 1942 1 1 7 GLU H H -1.691 -0.022 -0.010 1.00 . A A . 7 GLU H 1 1 9 1943 1 1 7 GLU HA H -0.334 -2.431 -0.813 1.00 . A A . 7 GLU HA 1 1 9 1944 1 1 7 GLU HB2 H -2.502 -0.742 -1.617 1.00 . A A . 7 GLU HB2 1 1 9 1945 1 1 7 GLU HB3 H -1.492 -1.044 -3.030 1.00 . A A . 7 GLU HB3 1 1 9 1946 1 1 7 GLU HG2 H -1.533 -3.525 -2.252 1.00 . A A . 7 GLU HG2 1 1 9 1947 1 1 7 GLU HG3 H -2.923 -3.036 -1.283 1.00 . A A . 7 GLU HG3 1 1 9 1948 1 1 7 GLU N N -0.857 -0.538 -0.004 1.00 . A A . 7 GLU N 1 1 9 1949 1 1 7 GLU O O 1.469 -1.620 -2.477 1.00 . A A . 7 GLU O 1 1 9 1950 1 1 7 GLU OE1 O -2.703 -2.885 -4.497 1.00 . A A . 7 GLU OE1 1 1 9 1951 1 1 7 GLU OE2 O -4.442 -2.975 -3.229 1.00 . A A . 7 GLU OE2 1 1 9 1952 1 1 8 GLY C C 3.250 0.992 -1.708 1.00 . A A . 8 GLY C 1 1 9 1953 1 1 8 GLY CA C 2.028 1.008 -2.625 1.00 . A A . 8 GLY CA 1 1 9 1954 1 1 8 GLY H H 0.226 0.992 -1.444 1.00 . A A . 8 GLY H 1 1 9 1955 1 1 8 GLY HA2 H 2.236 0.431 -3.515 1.00 . A A . 8 GLY HA2 1 1 9 1956 1 1 8 GLY HA3 H 1.802 2.027 -2.900 1.00 . A A . 8 GLY HA3 1 1 9 1957 1 1 8 GLY N N 0.863 0.413 -1.910 1.00 . A A . 8 GLY N 1 1 9 1958 1 1 8 GLY O O 4.371 0.835 -2.153 1.00 . A A . 8 GLY O 1 1 9 1959 1 1 9 ILE C C 4.973 -0.171 0.386 1.00 . A A . 9 ILE C 1 1 9 1960 1 1 9 ILE CA C 4.197 1.143 0.517 1.00 . A A . 9 ILE CA 1 1 9 1961 1 1 9 ILE CB C 3.570 1.260 1.905 1.00 . A A . 9 ILE CB 1 1 9 1962 1 1 9 ILE CD1 C 2.593 2.864 3.554 1.00 . A A . 9 ILE CD1 1 1 9 1963 1 1 9 ILE CG1 C 3.014 2.674 2.096 1.00 . A A . 9 ILE CG1 1 1 9 1964 1 1 9 ILE CG2 C 4.632 0.984 2.971 1.00 . A A . 9 ILE CG2 1 1 9 1965 1 1 9 ILE H H 2.134 1.274 -0.093 1.00 . A A . 9 ILE H 1 1 9 1966 1 1 9 ILE HA H 4.845 1.985 0.330 1.00 . A A . 9 ILE HA 1 1 9 1967 1 1 9 ILE HB H 2.770 0.541 2.001 1.00 . A A . 9 ILE HB 1 1 9 1968 1 1 9 ILE HD11 H 1.652 3.395 3.591 1.00 . A A . 9 ILE HD11 1 1 9 1969 1 1 9 ILE HD12 H 3.348 3.434 4.076 1.00 . A A . 9 ILE HD12 1 1 9 1970 1 1 9 ILE HD13 H 2.480 1.899 4.026 1.00 . A A . 9 ILE HD13 1 1 9 1971 1 1 9 ILE HG12 H 3.776 3.397 1.842 1.00 . A A . 9 ILE HG12 1 1 9 1972 1 1 9 ILE HG13 H 2.157 2.813 1.455 1.00 . A A . 9 ILE HG13 1 1 9 1973 1 1 9 ILE HG21 H 4.792 1.876 3.560 1.00 . A A . 9 ILE HG21 1 1 9 1974 1 1 9 ILE HG22 H 5.557 0.699 2.491 1.00 . A A . 9 ILE HG22 1 1 9 1975 1 1 9 ILE HG23 H 4.298 0.184 3.614 1.00 . A A . 9 ILE HG23 1 1 9 1976 1 1 9 ILE N N 3.045 1.151 -0.430 1.00 . A A . 9 ILE N 1 1 9 1977 1 1 9 ILE O O 6.098 -0.197 -0.071 1.00 . A A . 9 ILE O 1 1 9 1978 1 1 10 LYS C C 5.485 -2.846 -0.770 1.00 . A A . 10 LYS C 1 1 9 1979 1 1 10 LYS CA C 5.079 -2.575 0.681 1.00 . A A . 10 LYS CA 1 1 9 1980 1 1 10 LYS CB C 4.055 -3.608 1.152 1.00 . A A . 10 LYS CB 1 1 9 1981 1 1 10 LYS CD C 3.016 -5.057 -0.600 1.00 . A A . 10 LYS CD 1 1 9 1982 1 1 10 LYS CE C 2.763 -4.848 -2.095 1.00 . A A . 10 LYS CE 1 1 9 1983 1 1 10 LYS CG C 2.925 -3.713 0.126 1.00 . A A . 10 LYS CG 1 1 9 1984 1 1 10 LYS H H 3.469 -1.221 1.148 1.00 . A A . 10 LYS H 1 1 9 1985 1 1 10 LYS HA H 5.944 -2.593 1.325 1.00 . A A . 10 LYS HA 1 1 9 1986 1 1 10 LYS HB2 H 4.536 -4.569 1.260 1.00 . A A . 10 LYS HB2 1 1 9 1987 1 1 10 LYS HB3 H 3.645 -3.302 2.103 1.00 . A A . 10 LYS HB3 1 1 9 1988 1 1 10 LYS HD2 H 4.001 -5.477 -0.455 1.00 . A A . 10 LYS HD2 1 1 9 1989 1 1 10 LYS HD3 H 2.274 -5.732 -0.202 1.00 . A A . 10 LYS HD3 1 1 9 1990 1 1 10 LYS HE2 H 1.865 -4.265 -2.245 1.00 . A A . 10 LYS HE2 1 1 9 1991 1 1 10 LYS HE3 H 3.610 -4.363 -2.557 1.00 . A A . 10 LYS HE3 1 1 9 1992 1 1 10 LYS HG2 H 1.973 -3.639 0.630 1.00 . A A . 10 LYS HG2 1 1 9 1993 1 1 10 LYS HG3 H 3.016 -2.911 -0.592 1.00 . A A . 10 LYS HG3 1 1 9 1994 1 1 10 LYS HZ1 H 2.328 -6.157 -3.654 1.00 . A A . 10 LYS HZ1 1 1 9 1995 1 1 10 LYS HZ2 H 1.848 -6.717 -2.123 1.00 . A A . 10 LYS HZ2 1 1 9 1996 1 1 10 LYS HZ3 H 3.489 -6.742 -2.564 1.00 . A A . 10 LYS HZ3 1 1 9 1997 1 1 10 LYS N N 4.377 -1.263 0.783 1.00 . A A . 10 LYS N 1 1 9 1998 1 1 10 LYS NZ N 2.594 -6.219 -2.651 1.00 . A A . 10 LYS NZ 1 1 9 1999 1 1 10 LYS O O 6.378 -3.624 -1.040 1.00 . A A . 10 LYS O 1 1 9 2000 1 1 11 SER C C 6.341 -1.525 -3.554 1.00 . A A . 11 SER C 1 1 9 2001 1 1 11 SER CA C 5.181 -2.436 -3.140 1.00 . A A . 11 SER CA 1 1 9 2002 1 1 11 SER CB C 3.915 -2.075 -3.914 1.00 . A A . 11 SER CB 1 1 9 2003 1 1 11 SER H H 4.115 -1.590 -1.467 1.00 . A A . 11 SER H 1 1 9 2004 1 1 11 SER HA H 5.434 -3.470 -3.308 1.00 . A A . 11 SER HA 1 1 9 2005 1 1 11 SER HB2 H 3.304 -2.954 -4.039 1.00 . A A . 11 SER HB2 1 1 9 2006 1 1 11 SER HB3 H 3.358 -1.328 -3.363 1.00 . A A . 11 SER HB3 1 1 9 2007 1 1 11 SER HG H 4.350 -2.314 -5.795 1.00 . A A . 11 SER HG 1 1 9 2008 1 1 11 SER N N 4.834 -2.212 -1.707 1.00 . A A . 11 SER N 1 1 9 2009 1 1 11 SER O O 6.987 -1.747 -4.558 1.00 . A A . 11 SER O 1 1 9 2010 1 1 11 SER OG O 4.275 -1.570 -5.193 1.00 . A A . 11 SER OG 1 1 9 2011 1 1 12 LEU C C 8.948 0.140 -2.269 1.00 . A A . 12 LEU C 1 1 9 2012 1 1 12 LEU CA C 7.725 0.420 -3.145 1.00 . A A . 12 LEU CA 1 1 9 2013 1 1 12 LEU CB C 7.183 1.825 -2.873 1.00 . A A . 12 LEU CB 1 1 9 2014 1 1 12 LEU CD1 C 5.518 2.065 -4.719 1.00 . A A . 12 LEU CD1 1 1 9 2015 1 1 12 LEU CD2 C 6.866 4.037 -3.986 1.00 . A A . 12 LEU CD2 1 1 9 2016 1 1 12 LEU CG C 6.883 2.522 -4.200 1.00 . A A . 12 LEU CG 1 1 9 2017 1 1 12 LEU H H 6.075 -0.338 -1.983 1.00 . A A . 12 LEU H 1 1 9 2018 1 1 12 LEU HA H 7.979 0.320 -4.186 1.00 . A A . 12 LEU HA 1 1 9 2019 1 1 12 LEU HB2 H 6.277 1.753 -2.288 1.00 . A A . 12 LEU HB2 1 1 9 2020 1 1 12 LEU HB3 H 7.920 2.395 -2.328 1.00 . A A . 12 LEU HB3 1 1 9 2021 1 1 12 LEU HD11 H 4.753 2.337 -4.007 1.00 . A A . 12 LEU HD11 1 1 9 2022 1 1 12 LEU HD12 H 5.524 0.993 -4.851 1.00 . A A . 12 LEU HD12 1 1 9 2023 1 1 12 LEU HD13 H 5.315 2.544 -5.666 1.00 . A A . 12 LEU HD13 1 1 9 2024 1 1 12 LEU HD21 H 6.067 4.295 -3.305 1.00 . A A . 12 LEU HD21 1 1 9 2025 1 1 12 LEU HD22 H 6.706 4.533 -4.932 1.00 . A A . 12 LEU HD22 1 1 9 2026 1 1 12 LEU HD23 H 7.810 4.353 -3.569 1.00 . A A . 12 LEU HD23 1 1 9 2027 1 1 12 LEU HG H 7.646 2.267 -4.921 1.00 . A A . 12 LEU HG 1 1 9 2028 1 1 12 LEU N N 6.608 -0.502 -2.789 1.00 . A A . 12 LEU N 1 1 9 2029 1 1 12 LEU O O 10.076 0.278 -2.698 1.00 . A A . 12 LEU O 1 1 9 2030 1 1 13 PHE C C 10.355 -1.985 -0.329 1.00 . A A . 13 PHE C 1 1 9 2031 1 1 13 PHE CA C 9.885 -0.541 -0.142 1.00 . A A . 13 PHE CA 1 1 9 2032 1 1 13 PHE CB C 9.341 -0.331 1.272 1.00 . A A . 13 PHE CB 1 1 9 2033 1 1 13 PHE CD1 C 10.690 1.792 1.312 1.00 . A A . 13 PHE CD1 1 1 9 2034 1 1 13 PHE CD2 C 10.518 0.487 3.347 1.00 . A A . 13 PHE CD2 1 1 9 2035 1 1 13 PHE CE1 C 11.491 2.725 1.976 1.00 . A A . 13 PHE CE1 1 1 9 2036 1 1 13 PHE CE2 C 11.321 1.422 4.013 1.00 . A A . 13 PHE CE2 1 1 9 2037 1 1 13 PHE CG C 10.203 0.673 1.995 1.00 . A A . 13 PHE CG 1 1 9 2038 1 1 13 PHE CZ C 11.808 2.541 3.327 1.00 . A A . 13 PHE CZ 1 1 9 2039 1 1 13 PHE H H 7.816 -0.357 -0.720 1.00 . A A . 13 PHE H 1 1 9 2040 1 1 13 PHE HA H 10.694 0.148 -0.332 1.00 . A A . 13 PHE HA 1 1 9 2041 1 1 13 PHE HB2 H 8.328 0.038 1.217 1.00 . A A . 13 PHE HB2 1 1 9 2042 1 1 13 PHE HB3 H 9.356 -1.269 1.807 1.00 . A A . 13 PHE HB3 1 1 9 2043 1 1 13 PHE HD1 H 10.447 1.935 0.269 1.00 . A A . 13 PHE HD1 1 1 9 2044 1 1 13 PHE HD2 H 10.142 -0.376 3.875 1.00 . A A . 13 PHE HD2 1 1 9 2045 1 1 13 PHE HE1 H 11.866 3.586 1.445 1.00 . A A . 13 PHE HE1 1 1 9 2046 1 1 13 PHE HE2 H 11.564 1.280 5.056 1.00 . A A . 13 PHE HE2 1 1 9 2047 1 1 13 PHE HZ H 12.426 3.262 3.840 1.00 . A A . 13 PHE HZ 1 1 9 2048 1 1 13 PHE N N 8.733 -0.253 -1.045 1.00 . A A . 13 PHE N 1 1 9 2049 1 1 13 PHE O O 11.537 -2.245 -0.450 1.00 . A A . 13 PHE O 1 1 9 2050 1 1 14 NH2 HN1 H 8.520 -2.737 -0.262 1.00 . A A . 14 NH2 HN1 1 1 9 2051 1 1 14 NH2 HN2 H 9.762 -3.873 -0.479 1.00 . A A . 14 NH2 HN2 1 1 9 2052 1 1 14 NH2 N N 9.472 -2.946 -0.359 1.00 . A A . 14 NH2 N 1 1 10 2053 1 1 1 ILE C C -8.878 -2.574 3.851 1.00 . A A . 1 ILE C 1 1 10 2054 1 1 1 ILE CA C -10.189 -2.044 3.265 1.00 . A A . 1 ILE CA 1 1 10 2055 1 1 1 ILE CB C -10.080 -1.902 1.747 1.00 . A A . 1 ILE CB 1 1 10 2056 1 1 1 ILE CD1 C -8.639 -0.882 -0.021 1.00 . A A . 1 ILE CD1 1 1 10 2057 1 1 1 ILE CG1 C -9.155 -0.730 1.412 1.00 . A A . 1 ILE CG1 1 1 10 2058 1 1 1 ILE CG2 C -11.467 -1.640 1.157 1.00 . A A . 1 ILE CG2 1 1 10 2059 1 1 1 ILE H1 H -11.225 -0.237 3.210 1.00 . A A . 1 ILE H1 1 1 10 2060 1 1 1 ILE H2 H -9.595 -0.089 3.667 1.00 . A A . 1 ILE H2 1 1 10 2061 1 1 1 ILE H3 H -10.735 -0.705 4.764 1.00 . A A . 1 ILE H3 1 1 10 2062 1 1 1 ILE HA H -11.007 -2.701 3.516 1.00 . A A . 1 ILE HA 1 1 10 2063 1 1 1 ILE HB H -9.677 -2.812 1.328 1.00 . A A . 1 ILE HB 1 1 10 2064 1 1 1 ILE HD11 H -8.755 -1.906 -0.340 1.00 . A A . 1 ILE HD11 1 1 10 2065 1 1 1 ILE HD12 H -7.594 -0.610 -0.057 1.00 . A A . 1 ILE HD12 1 1 10 2066 1 1 1 ILE HD13 H -9.201 -0.233 -0.677 1.00 . A A . 1 ILE HD13 1 1 10 2067 1 1 1 ILE HG12 H -9.702 0.197 1.502 1.00 . A A . 1 ILE HG12 1 1 10 2068 1 1 1 ILE HG13 H -8.319 -0.723 2.094 1.00 . A A . 1 ILE HG13 1 1 10 2069 1 1 1 ILE HG21 H -12.216 -1.780 1.922 1.00 . A A . 1 ILE HG21 1 1 10 2070 1 1 1 ILE HG22 H -11.649 -2.328 0.345 1.00 . A A . 1 ILE HG22 1 1 10 2071 1 1 1 ILE HG23 H -11.516 -0.626 0.787 1.00 . A A . 1 ILE HG23 1 1 10 2072 1 1 1 ILE N N -10.456 -0.665 3.764 1.00 . A A . 1 ILE N 1 1 10 2073 1 1 1 ILE O O -8.385 -2.075 4.844 1.00 . A A . 1 ILE O 1 1 10 2074 1 1 2 LEU C C -5.943 -3.067 3.779 1.00 . A A . 2 LEU C 1 1 10 2075 1 1 2 LEU CA C -7.032 -4.143 3.771 1.00 . A A . 2 LEU CA 1 1 10 2076 1 1 2 LEU CB C -6.667 -5.267 2.802 1.00 . A A . 2 LEU CB 1 1 10 2077 1 1 2 LEU CD1 C -7.378 -7.187 4.234 1.00 . A A . 2 LEU CD1 1 1 10 2078 1 1 2 LEU CD2 C -5.471 -7.454 2.644 1.00 . A A . 2 LEU CD2 1 1 10 2079 1 1 2 LEU CG C -6.182 -6.484 3.590 1.00 . A A . 2 LEU CG 1 1 10 2080 1 1 2 LEU H H -8.725 -3.970 2.448 1.00 . A A . 2 LEU H 1 1 10 2081 1 1 2 LEU HA H -7.175 -4.543 4.762 1.00 . A A . 2 LEU HA 1 1 10 2082 1 1 2 LEU HB2 H -7.537 -5.538 2.220 1.00 . A A . 2 LEU HB2 1 1 10 2083 1 1 2 LEU HB3 H -5.881 -4.933 2.140 1.00 . A A . 2 LEU HB3 1 1 10 2084 1 1 2 LEU HD11 H -8.274 -6.952 3.678 1.00 . A A . 2 LEU HD11 1 1 10 2085 1 1 2 LEU HD12 H -7.489 -6.850 5.253 1.00 . A A . 2 LEU HD12 1 1 10 2086 1 1 2 LEU HD13 H -7.218 -8.255 4.223 1.00 . A A . 2 LEU HD13 1 1 10 2087 1 1 2 LEU HD21 H -4.959 -6.895 1.874 1.00 . A A . 2 LEU HD21 1 1 10 2088 1 1 2 LEU HD22 H -6.197 -8.112 2.190 1.00 . A A . 2 LEU HD22 1 1 10 2089 1 1 2 LEU HD23 H -4.753 -8.039 3.200 1.00 . A A . 2 LEU HD23 1 1 10 2090 1 1 2 LEU HG H -5.496 -6.163 4.362 1.00 . A A . 2 LEU HG 1 1 10 2091 1 1 2 LEU N N -8.310 -3.582 3.246 1.00 . A A . 2 LEU N 1 1 10 2092 1 1 2 LEU O O -5.000 -3.131 4.542 1.00 . A A . 2 LEU O 1 1 10 2093 1 1 3 GLY C C -4.769 -0.596 1.449 1.00 . A A . 3 GLY C 1 1 10 2094 1 1 3 GLY CA C -5.035 -1.002 2.897 1.00 . A A . 3 GLY CA 1 1 10 2095 1 1 3 GLY H H -6.833 -2.045 2.327 1.00 . A A . 3 GLY H 1 1 10 2096 1 1 3 GLY HA2 H -5.388 -0.145 3.453 1.00 . A A . 3 GLY HA2 1 1 10 2097 1 1 3 GLY HA3 H -4.120 -1.364 3.338 1.00 . A A . 3 GLY HA3 1 1 10 2098 1 1 3 GLY N N -6.065 -2.079 2.935 1.00 . A A . 3 GLY N 1 1 10 2099 1 1 3 GLY O O -3.840 -1.065 0.822 1.00 . A A . 3 GLY O 1 1 10 2100 1 1 4 LYS C C -4.111 1.599 -0.571 1.00 . A A . 4 LYS C 1 1 10 2101 1 1 4 LYS CA C -5.359 0.721 -0.494 1.00 . A A . 4 LYS CA 1 1 10 2102 1 1 4 LYS CB C -6.608 1.524 -0.857 1.00 . A A . 4 LYS CB 1 1 10 2103 1 1 4 LYS CD C -5.976 1.685 -3.270 1.00 . A A . 4 LYS CD 1 1 10 2104 1 1 4 LYS CE C -6.230 3.160 -3.589 1.00 . A A . 4 LYS CE 1 1 10 2105 1 1 4 LYS CG C -7.036 1.185 -2.286 1.00 . A A . 4 LYS CG 1 1 10 2106 1 1 4 LYS H H -6.312 0.650 1.438 1.00 . A A . 4 LYS H 1 1 10 2107 1 1 4 LYS HA H -5.260 -0.129 -1.145 1.00 . A A . 4 LYS HA 1 1 10 2108 1 1 4 LYS HB2 H -7.406 1.276 -0.172 1.00 . A A . 4 LYS HB2 1 1 10 2109 1 1 4 LYS HB3 H -6.390 2.579 -0.790 1.00 . A A . 4 LYS HB3 1 1 10 2110 1 1 4 LYS HD2 H -4.996 1.575 -2.829 1.00 . A A . 4 LYS HD2 1 1 10 2111 1 1 4 LYS HD3 H -6.029 1.107 -4.180 1.00 . A A . 4 LYS HD3 1 1 10 2112 1 1 4 LYS HE2 H -6.491 3.699 -2.689 1.00 . A A . 4 LYS HE2 1 1 10 2113 1 1 4 LYS HE3 H -5.361 3.600 -4.054 1.00 . A A . 4 LYS HE3 1 1 10 2114 1 1 4 LYS HG2 H -7.143 0.114 -2.385 1.00 . A A . 4 LYS HG2 1 1 10 2115 1 1 4 LYS HG3 H -7.979 1.663 -2.503 1.00 . A A . 4 LYS HG3 1 1 10 2116 1 1 4 LYS HZ1 H -7.011 3.182 -5.519 1.00 . A A . 4 LYS HZ1 1 1 10 2117 1 1 4 LYS HZ2 H -7.972 3.989 -4.373 1.00 . A A . 4 LYS HZ2 1 1 10 2118 1 1 4 LYS HZ3 H -7.934 2.291 -4.410 1.00 . A A . 4 LYS HZ3 1 1 10 2119 1 1 4 LYS N N -5.573 0.280 0.913 1.00 . A A . 4 LYS N 1 1 10 2120 1 1 4 LYS NZ N -7.372 3.154 -4.544 1.00 . A A . 4 LYS NZ 1 1 10 2121 1 1 4 LYS O O -3.304 1.476 -1.471 1.00 . A A . 4 LYS O 1 1 10 2122 1 1 5 ILE C C -1.510 2.536 0.758 1.00 . A A . 5 ILE C 1 1 10 2123 1 1 5 ILE CA C -2.744 3.355 0.375 1.00 . A A . 5 ILE CA 1 1 10 2124 1 1 5 ILE CB C -3.034 4.420 1.431 1.00 . A A . 5 ILE CB 1 1 10 2125 1 1 5 ILE CD1 C -3.573 6.230 -0.206 1.00 . A A . 5 ILE CD1 1 1 10 2126 1 1 5 ILE CG1 C -4.130 5.357 0.921 1.00 . A A . 5 ILE CG1 1 1 10 2127 1 1 5 ILE CG2 C -1.763 5.225 1.710 1.00 . A A . 5 ILE CG2 1 1 10 2128 1 1 5 ILE H H -4.604 2.546 1.096 1.00 . A A . 5 ILE H 1 1 10 2129 1 1 5 ILE HA H -2.611 3.815 -0.591 1.00 . A A . 5 ILE HA 1 1 10 2130 1 1 5 ILE HB H -3.363 3.941 2.343 1.00 . A A . 5 ILE HB 1 1 10 2131 1 1 5 ILE HD11 H -4.382 6.766 -0.679 1.00 . A A . 5 ILE HD11 1 1 10 2132 1 1 5 ILE HD12 H -3.081 5.603 -0.936 1.00 . A A . 5 ILE HD12 1 1 10 2133 1 1 5 ILE HD13 H -2.863 6.934 0.201 1.00 . A A . 5 ILE HD13 1 1 10 2134 1 1 5 ILE HG12 H -4.959 4.773 0.549 1.00 . A A . 5 ILE HG12 1 1 10 2135 1 1 5 ILE HG13 H -4.468 5.989 1.728 1.00 . A A . 5 ILE HG13 1 1 10 2136 1 1 5 ILE HG21 H -2.012 6.102 2.290 1.00 . A A . 5 ILE HG21 1 1 10 2137 1 1 5 ILE HG22 H -1.317 5.528 0.775 1.00 . A A . 5 ILE HG22 1 1 10 2138 1 1 5 ILE HG23 H -1.064 4.615 2.262 1.00 . A A . 5 ILE HG23 1 1 10 2139 1 1 5 ILE N N -3.944 2.474 0.377 1.00 . A A . 5 ILE N 1 1 10 2140 1 1 5 ILE O O -0.397 2.859 0.392 1.00 . A A . 5 ILE O 1 1 10 2141 1 1 6 TRP C C -0.085 -0.229 0.712 1.00 . A A . 6 TRP C 1 1 10 2142 1 1 6 TRP CA C -0.548 0.624 1.896 1.00 . A A . 6 TRP CA 1 1 10 2143 1 1 6 TRP CB C -1.087 -0.257 3.025 1.00 . A A . 6 TRP CB 1 1 10 2144 1 1 6 TRP CD1 C -0.474 -2.708 2.984 1.00 . A A . 6 TRP CD1 1 1 10 2145 1 1 6 TRP CD2 C 1.196 -1.415 3.758 1.00 . A A . 6 TRP CD2 1 1 10 2146 1 1 6 TRP CE2 C 1.668 -2.749 3.787 1.00 . A A . 6 TRP CE2 1 1 10 2147 1 1 6 TRP CE3 C 2.059 -0.396 4.196 1.00 . A A . 6 TRP CE3 1 1 10 2148 1 1 6 TRP CG C -0.168 -1.417 3.243 1.00 . A A . 6 TRP CG 1 1 10 2149 1 1 6 TRP CH2 C 3.798 -2.035 4.670 1.00 . A A . 6 TRP CH2 1 1 10 2150 1 1 6 TRP CZ2 C 2.952 -3.060 4.237 1.00 . A A . 6 TRP CZ2 1 1 10 2151 1 1 6 TRP CZ3 C 3.352 -0.706 4.650 1.00 . A A . 6 TRP CZ3 1 1 10 2152 1 1 6 TRP H H -2.612 1.229 1.770 1.00 . A A . 6 TRP H 1 1 10 2153 1 1 6 TRP HA H 0.261 1.238 2.259 1.00 . A A . 6 TRP HA 1 1 10 2154 1 1 6 TRP HB2 H -1.152 0.323 3.933 1.00 . A A . 6 TRP HB2 1 1 10 2155 1 1 6 TRP HB3 H -2.068 -0.622 2.760 1.00 . A A . 6 TRP HB3 1 1 10 2156 1 1 6 TRP HD1 H -1.415 -3.064 2.590 1.00 . A A . 6 TRP HD1 1 1 10 2157 1 1 6 TRP HE1 H 0.652 -4.475 3.212 1.00 . A A . 6 TRP HE1 1 1 10 2158 1 1 6 TRP HE3 H 1.726 0.631 4.186 1.00 . A A . 6 TRP HE3 1 1 10 2159 1 1 6 TRP HH2 H 4.793 -2.267 5.020 1.00 . A A . 6 TRP HH2 1 1 10 2160 1 1 6 TRP HZ2 H 3.290 -4.086 4.250 1.00 . A A . 6 TRP HZ2 1 1 10 2161 1 1 6 TRP HZ3 H 4.007 0.085 4.985 1.00 . A A . 6 TRP HZ3 1 1 10 2162 1 1 6 TRP N N -1.703 1.472 1.490 1.00 . A A . 6 TRP N 1 1 10 2163 1 1 6 TRP NE1 N 0.614 -3.500 3.306 1.00 . A A . 6 TRP NE1 1 1 10 2164 1 1 6 TRP O O 1.062 -0.620 0.628 1.00 . A A . 6 TRP O 1 1 10 2165 1 1 7 GLU C C 0.566 -0.663 -2.143 1.00 . A A . 7 GLU C 1 1 10 2166 1 1 7 GLU CA C -0.573 -1.345 -1.382 1.00 . A A . 7 GLU CA 1 1 10 2167 1 1 7 GLU CB C -1.829 -1.423 -2.252 1.00 . A A . 7 GLU CB 1 1 10 2168 1 1 7 GLU CD C -3.429 -2.972 -3.385 1.00 . A A . 7 GLU CD 1 1 10 2169 1 1 7 GLU CG C -2.244 -2.885 -2.422 1.00 . A A . 7 GLU CG 1 1 10 2170 1 1 7 GLU H H -1.889 -0.193 -0.120 1.00 . A A . 7 GLU H 1 1 10 2171 1 1 7 GLU HA H -0.279 -2.332 -1.069 1.00 . A A . 7 GLU HA 1 1 10 2172 1 1 7 GLU HB2 H -2.629 -0.874 -1.777 1.00 . A A . 7 GLU HB2 1 1 10 2173 1 1 7 GLU HB3 H -1.623 -0.994 -3.221 1.00 . A A . 7 GLU HB3 1 1 10 2174 1 1 7 GLU HG2 H -1.414 -3.451 -2.821 1.00 . A A . 7 GLU HG2 1 1 10 2175 1 1 7 GLU HG3 H -2.530 -3.293 -1.464 1.00 . A A . 7 GLU HG3 1 1 10 2176 1 1 7 GLU N N -0.967 -0.519 -0.205 1.00 . A A . 7 GLU N 1 1 10 2177 1 1 7 GLU O O 1.442 -1.310 -2.684 1.00 . A A . 7 GLU O 1 1 10 2178 1 1 7 GLU OE1 O -3.325 -2.428 -4.472 1.00 . A A . 7 GLU OE1 1 1 10 2179 1 1 7 GLU OE2 O -4.422 -3.580 -3.018 1.00 . A A . 7 GLU OE2 1 1 10 2180 1 1 8 GLY C C 2.867 1.487 -2.000 1.00 . A A . 8 GLY C 1 1 10 2181 1 1 8 GLY CA C 1.642 1.369 -2.905 1.00 . A A . 8 GLY CA 1 1 10 2182 1 1 8 GLY H H -0.154 1.139 -1.739 1.00 . A A . 8 GLY H 1 1 10 2183 1 1 8 GLY HA2 H 1.905 0.825 -3.801 1.00 . A A . 8 GLY HA2 1 1 10 2184 1 1 8 GLY HA3 H 1.297 2.356 -3.170 1.00 . A A . 8 GLY HA3 1 1 10 2185 1 1 8 GLY N N 0.560 0.639 -2.184 1.00 . A A . 8 GLY N 1 1 10 2186 1 1 8 GLY O O 3.990 1.533 -2.459 1.00 . A A . 8 GLY O 1 1 10 2187 1 1 9 ILE C C 4.646 0.364 0.198 1.00 . A A . 9 ILE C 1 1 10 2188 1 1 9 ILE CA C 3.815 1.649 0.225 1.00 . A A . 9 ILE CA 1 1 10 2189 1 1 9 ILE CB C 3.187 1.852 1.604 1.00 . A A . 9 ILE CB 1 1 10 2190 1 1 9 ILE CD1 C 2.150 3.546 3.118 1.00 . A A . 9 ILE CD1 1 1 10 2191 1 1 9 ILE CG1 C 2.548 3.240 1.674 1.00 . A A . 9 ILE CG1 1 1 10 2192 1 1 9 ILE CG2 C 4.269 1.734 2.679 1.00 . A A . 9 ILE CG2 1 1 10 2193 1 1 9 ILE H H 1.746 1.496 -0.361 1.00 . A A . 9 ILE H 1 1 10 2194 1 1 9 ILE HA H 4.427 2.499 -0.031 1.00 . A A . 9 ILE HA 1 1 10 2195 1 1 9 ILE HB H 2.432 1.097 1.769 1.00 . A A . 9 ILE HB 1 1 10 2196 1 1 9 ILE HD11 H 1.303 4.216 3.124 1.00 . A A . 9 ILE HD11 1 1 10 2197 1 1 9 ILE HD12 H 2.979 4.011 3.631 1.00 . A A . 9 ILE HD12 1 1 10 2198 1 1 9 ILE HD13 H 1.885 2.627 3.621 1.00 . A A . 9 ILE HD13 1 1 10 2199 1 1 9 ILE HG12 H 3.258 3.981 1.331 1.00 . A A . 9 ILE HG12 1 1 10 2200 1 1 9 ILE HG13 H 1.670 3.266 1.047 1.00 . A A . 9 ILE HG13 1 1 10 2201 1 1 9 ILE HG21 H 3.805 1.705 3.654 1.00 . A A . 9 ILE HG21 1 1 10 2202 1 1 9 ILE HG22 H 4.929 2.587 2.620 1.00 . A A . 9 ILE HG22 1 1 10 2203 1 1 9 ILE HG23 H 4.835 0.829 2.523 1.00 . A A . 9 ILE HG23 1 1 10 2204 1 1 9 ILE N N 2.660 1.535 -0.712 1.00 . A A . 9 ILE N 1 1 10 2205 1 1 9 ILE O O 5.799 0.367 -0.185 1.00 . A A . 9 ILE O 1 1 10 2206 1 1 10 LYS C C 5.404 -2.285 -0.797 1.00 . A A . 10 LYS C 1 1 10 2207 1 1 10 LYS CA C 4.825 -2.020 0.595 1.00 . A A . 10 LYS CA 1 1 10 2208 1 1 10 LYS CB C 3.794 -3.088 0.959 1.00 . A A . 10 LYS CB 1 1 10 2209 1 1 10 LYS CD C 2.927 -4.282 -1.057 1.00 . A A . 10 LYS CD 1 1 10 2210 1 1 10 LYS CE C 1.945 -5.412 -0.739 1.00 . A A . 10 LYS CE 1 1 10 2211 1 1 10 LYS CG C 2.690 -3.114 -0.099 1.00 . A A . 10 LYS CG 1 1 10 2212 1 1 10 LYS H H 3.136 -0.716 0.903 1.00 . A A . 10 LYS H 1 1 10 2213 1 1 10 LYS HA H 5.611 -1.998 1.333 1.00 . A A . 10 LYS HA 1 1 10 2214 1 1 10 LYS HB2 H 4.277 -4.054 1.001 1.00 . A A . 10 LYS HB2 1 1 10 2215 1 1 10 LYS HB3 H 3.362 -2.858 1.922 1.00 . A A . 10 LYS HB3 1 1 10 2216 1 1 10 LYS HD2 H 2.778 -3.949 -2.074 1.00 . A A . 10 LYS HD2 1 1 10 2217 1 1 10 LYS HD3 H 3.938 -4.643 -0.942 1.00 . A A . 10 LYS HD3 1 1 10 2218 1 1 10 LYS HE2 H 1.723 -5.429 0.319 1.00 . A A . 10 LYS HE2 1 1 10 2219 1 1 10 LYS HE3 H 1.040 -5.297 -1.314 1.00 . A A . 10 LYS HE3 1 1 10 2220 1 1 10 LYS HG2 H 1.731 -3.234 0.385 1.00 . A A . 10 LYS HG2 1 1 10 2221 1 1 10 LYS HG3 H 2.700 -2.188 -0.654 1.00 . A A . 10 LYS HG3 1 1 10 2222 1 1 10 LYS HZ1 H 3.136 -7.066 -0.321 1.00 . A A . 10 LYS HZ1 1 1 10 2223 1 1 10 LYS HZ2 H 3.348 -6.438 -1.885 1.00 . A A . 10 LYS HZ2 1 1 10 2224 1 1 10 LYS HZ3 H 1.961 -7.345 -1.511 1.00 . A A . 10 LYS HZ3 1 1 10 2225 1 1 10 LYS N N 4.068 -0.735 0.599 1.00 . A A . 10 LYS N 1 1 10 2226 1 1 10 LYS NZ N 2.650 -6.660 -1.144 1.00 . A A . 10 LYS NZ 1 1 10 2227 1 1 10 LYS O O 6.375 -3.000 -0.950 1.00 . A A . 10 LYS O 1 1 10 2228 1 1 11 SER C C 6.643 -1.162 -3.394 1.00 . A A . 11 SER C 1 1 10 2229 1 1 11 SER CA C 5.336 -1.933 -3.193 1.00 . A A . 11 SER CA 1 1 10 2230 1 1 11 SER CB C 4.245 -1.391 -4.116 1.00 . A A . 11 SER CB 1 1 10 2231 1 1 11 SER H H 4.035 -1.141 -1.668 1.00 . A A . 11 SER H 1 1 10 2232 1 1 11 SER HA H 5.486 -2.985 -3.377 1.00 . A A . 11 SER HA 1 1 10 2233 1 1 11 SER HB2 H 3.457 -0.953 -3.528 1.00 . A A . 11 SER HB2 1 1 10 2234 1 1 11 SER HB3 H 4.668 -0.636 -4.766 1.00 . A A . 11 SER HB3 1 1 10 2235 1 1 11 SER HG H 3.080 -2.088 -5.510 1.00 . A A . 11 SER HG 1 1 10 2236 1 1 11 SER N N 4.817 -1.713 -1.812 1.00 . A A . 11 SER N 1 1 10 2237 1 1 11 SER O O 7.473 -1.529 -4.202 1.00 . A A . 11 SER O 1 1 10 2238 1 1 11 SER OG O 3.714 -2.458 -4.891 1.00 . A A . 11 SER OG 1 1 10 2239 1 1 12 LEU C C 9.224 0.040 -2.027 1.00 . A A . 12 LEU C 1 1 10 2240 1 1 12 LEU CA C 8.086 0.695 -2.814 1.00 . A A . 12 LEU CA 1 1 10 2241 1 1 12 LEU CB C 7.757 2.070 -2.233 1.00 . A A . 12 LEU CB 1 1 10 2242 1 1 12 LEU CD1 C 6.353 4.079 -2.719 1.00 . A A . 12 LEU CD1 1 1 10 2243 1 1 12 LEU CD2 C 8.378 3.606 -4.102 1.00 . A A . 12 LEU CD2 1 1 10 2244 1 1 12 LEU CG C 7.212 2.975 -3.339 1.00 . A A . 12 LEU CG 1 1 10 2245 1 1 12 LEU H H 6.151 0.181 -2.018 1.00 . A A . 12 LEU H 1 1 10 2246 1 1 12 LEU HA H 8.352 0.789 -3.853 1.00 . A A . 12 LEU HA 1 1 10 2247 1 1 12 LEU HB2 H 7.015 1.964 -1.455 1.00 . A A . 12 LEU HB2 1 1 10 2248 1 1 12 LEU HB3 H 8.652 2.511 -1.819 1.00 . A A . 12 LEU HB3 1 1 10 2249 1 1 12 LEU HD11 H 6.603 5.027 -3.173 1.00 . A A . 12 LEU HD11 1 1 10 2250 1 1 12 LEU HD12 H 6.542 4.128 -1.657 1.00 . A A . 12 LEU HD12 1 1 10 2251 1 1 12 LEU HD13 H 5.309 3.862 -2.890 1.00 . A A . 12 LEU HD13 1 1 10 2252 1 1 12 LEU HD21 H 8.274 4.681 -4.096 1.00 . A A . 12 LEU HD21 1 1 10 2253 1 1 12 LEU HD22 H 8.376 3.249 -5.122 1.00 . A A . 12 LEU HD22 1 1 10 2254 1 1 12 LEU HD23 H 9.309 3.332 -3.627 1.00 . A A . 12 LEU HD23 1 1 10 2255 1 1 12 LEU HG H 6.610 2.389 -4.018 1.00 . A A . 12 LEU HG 1 1 10 2256 1 1 12 LEU N N 6.832 -0.097 -2.665 1.00 . A A . 12 LEU N 1 1 10 2257 1 1 12 LEU O O 10.382 0.162 -2.372 1.00 . A A . 12 LEU O 1 1 10 2258 1 1 13 PHE C C 9.985 -2.823 -0.449 1.00 . A A . 13 PHE C 1 1 10 2259 1 1 13 PHE CA C 9.963 -1.319 -0.163 1.00 . A A . 13 PHE CA 1 1 10 2260 1 1 13 PHE CB C 9.574 -1.056 1.293 1.00 . A A . 13 PHE CB 1 1 10 2261 1 1 13 PHE CD1 C 11.412 0.661 1.300 1.00 . A A . 13 PHE CD1 1 1 10 2262 1 1 13 PHE CD2 C 11.024 -0.632 3.313 1.00 . A A . 13 PHE CD2 1 1 10 2263 1 1 13 PHE CE1 C 12.455 1.340 1.938 1.00 . A A . 13 PHE CE1 1 1 10 2264 1 1 13 PHE CE2 C 12.067 0.047 3.952 1.00 . A A . 13 PHE CE2 1 1 10 2265 1 1 13 PHE CG C 10.697 -0.325 1.986 1.00 . A A . 13 PHE CG 1 1 10 2266 1 1 13 PHE CZ C 12.783 1.035 3.264 1.00 . A A . 13 PHE CZ 1 1 10 2267 1 1 13 PHE H H 7.961 -0.740 -0.710 1.00 . A A . 13 PHE H 1 1 10 2268 1 1 13 PHE HA H 10.927 -0.881 -0.372 1.00 . A A . 13 PHE HA 1 1 10 2269 1 1 13 PHE HB2 H 8.680 -0.451 1.323 1.00 . A A . 13 PHE HB2 1 1 10 2270 1 1 13 PHE HB3 H 9.393 -1.995 1.795 1.00 . A A . 13 PHE HB3 1 1 10 2271 1 1 13 PHE HD1 H 11.160 0.898 0.278 1.00 . A A . 13 PHE HD1 1 1 10 2272 1 1 13 PHE HD2 H 10.470 -1.394 3.843 1.00 . A A . 13 PHE HD2 1 1 10 2273 1 1 13 PHE HE1 H 13.005 2.099 1.405 1.00 . A A . 13 PHE HE1 1 1 10 2274 1 1 13 PHE HE2 H 12.319 -0.190 4.975 1.00 . A A . 13 PHE HE2 1 1 10 2275 1 1 13 PHE HZ H 13.588 1.559 3.756 1.00 . A A . 13 PHE HZ 1 1 10 2276 1 1 13 PHE N N 8.901 -0.656 -0.971 1.00 . A A . 13 PHE N 1 1 10 2277 1 1 13 PHE O O 10.915 -3.515 -0.084 1.00 . A A . 13 PHE O 1 1 10 2278 1 1 14 NH2 HN1 H 8.235 -2.808 -1.388 1.00 . A A . 14 NH2 HN1 1 1 10 2279 1 1 14 NH2 HN2 H 8.990 -4.325 -1.283 1.00 . A A . 14 NH2 HN2 1 1 10 2280 1 1 14 NH2 N N 8.987 -3.364 -1.094 1.00 . A A . 14 NH2 N 1 1 11 2281 1 1 1 ILE C C -8.320 -3.524 1.812 1.00 . A A . 1 ILE C 1 1 11 2282 1 1 1 ILE CA C -8.690 -3.949 0.388 1.00 . A A . 1 ILE CA 1 1 11 2283 1 1 1 ILE CB C -9.751 -3.015 -0.192 1.00 . A A . 1 ILE CB 1 1 11 2284 1 1 1 ILE CD1 C -8.995 -1.386 -1.931 1.00 . A A . 1 ILE CD1 1 1 11 2285 1 1 1 ILE CG1 C -9.138 -1.632 -0.428 1.00 . A A . 1 ILE CG1 1 1 11 2286 1 1 1 ILE CG2 C -10.918 -2.894 0.790 1.00 . A A . 1 ILE CG2 1 1 11 2287 1 1 1 ILE H1 H -10.011 -5.367 -0.378 1.00 . A A . 1 ILE H1 1 1 11 2288 1 1 1 ILE H2 H -9.819 -5.438 1.309 1.00 . A A . 1 ILE H2 1 1 11 2289 1 1 1 ILE H3 H -8.598 -6.028 0.286 1.00 . A A . 1 ILE H3 1 1 11 2290 1 1 1 ILE HA H -7.816 -3.953 -0.244 1.00 . A A . 1 ILE HA 1 1 11 2291 1 1 1 ILE HB H -10.110 -3.416 -1.129 1.00 . A A . 1 ILE HB 1 1 11 2292 1 1 1 ILE HD11 H -8.131 -1.915 -2.303 1.00 . A A . 1 ILE HD11 1 1 11 2293 1 1 1 ILE HD12 H -8.875 -0.327 -2.112 1.00 . A A . 1 ILE HD12 1 1 11 2294 1 1 1 ILE HD13 H -9.881 -1.739 -2.439 1.00 . A A . 1 ILE HD13 1 1 11 2295 1 1 1 ILE HG12 H -9.778 -0.876 0.004 1.00 . A A . 1 ILE HG12 1 1 11 2296 1 1 1 ILE HG13 H -8.164 -1.587 0.036 1.00 . A A . 1 ILE HG13 1 1 11 2297 1 1 1 ILE HG21 H -10.741 -2.063 1.457 1.00 . A A . 1 ILE HG21 1 1 11 2298 1 1 1 ILE HG22 H -11.002 -3.804 1.363 1.00 . A A . 1 ILE HG22 1 1 11 2299 1 1 1 ILE HG23 H -11.833 -2.726 0.242 1.00 . A A . 1 ILE HG23 1 1 11 2300 1 1 1 ILE N N -9.328 -5.297 0.403 1.00 . A A . 1 ILE N 1 1 11 2301 1 1 1 ILE O O -8.669 -2.451 2.261 1.00 . A A . 1 ILE O 1 1 11 2302 1 1 2 LEU C C -6.268 -2.806 3.910 1.00 . A A . 2 LEU C 1 1 11 2303 1 1 2 LEU CA C -7.223 -4.002 3.919 1.00 . A A . 2 LEU CA 1 1 11 2304 1 1 2 LEU CB C -6.518 -5.246 4.463 1.00 . A A . 2 LEU CB 1 1 11 2305 1 1 2 LEU CD1 C -6.517 -6.442 6.656 1.00 . A A . 2 LEU CD1 1 1 11 2306 1 1 2 LEU CD2 C -4.872 -4.612 6.230 1.00 . A A . 2 LEU CD2 1 1 11 2307 1 1 2 LEU CG C -6.301 -5.093 5.969 1.00 . A A . 2 LEU CG 1 1 11 2308 1 1 2 LEU H H -7.342 -5.220 2.145 1.00 . A A . 2 LEU H 1 1 11 2309 1 1 2 LEU HA H -8.096 -3.784 4.513 1.00 . A A . 2 LEU HA 1 1 11 2310 1 1 2 LEU HB2 H -7.128 -6.117 4.273 1.00 . A A . 2 LEU HB2 1 1 11 2311 1 1 2 LEU HB3 H -5.563 -5.361 3.974 1.00 . A A . 2 LEU HB3 1 1 11 2312 1 1 2 LEU HD11 H -7.435 -6.415 7.225 1.00 . A A . 2 LEU HD11 1 1 11 2313 1 1 2 LEU HD12 H -5.689 -6.645 7.320 1.00 . A A . 2 LEU HD12 1 1 11 2314 1 1 2 LEU HD13 H -6.579 -7.221 5.910 1.00 . A A . 2 LEU HD13 1 1 11 2315 1 1 2 LEU HD21 H -4.252 -4.848 5.378 1.00 . A A . 2 LEU HD21 1 1 11 2316 1 1 2 LEU HD22 H -4.481 -5.105 7.108 1.00 . A A . 2 LEU HD22 1 1 11 2317 1 1 2 LEU HD23 H -4.875 -3.544 6.389 1.00 . A A . 2 LEU HD23 1 1 11 2318 1 1 2 LEU HG H -7.004 -4.373 6.363 1.00 . A A . 2 LEU HG 1 1 11 2319 1 1 2 LEU N N -7.614 -4.359 2.525 1.00 . A A . 2 LEU N 1 1 11 2320 1 1 2 LEU O O -6.068 -2.152 4.914 1.00 . A A . 2 LEU O 1 1 11 2321 1 1 3 GLY C C -4.544 -0.949 1.253 1.00 . A A . 3 GLY C 1 1 11 2322 1 1 3 GLY CA C -4.737 -1.361 2.711 1.00 . A A . 3 GLY CA 1 1 11 2323 1 1 3 GLY H H -5.853 -3.056 1.985 1.00 . A A . 3 GLY H 1 1 11 2324 1 1 3 GLY HA2 H -5.141 -0.530 3.270 1.00 . A A . 3 GLY HA2 1 1 11 2325 1 1 3 GLY HA3 H -3.785 -1.647 3.128 1.00 . A A . 3 GLY HA3 1 1 11 2326 1 1 3 GLY N N -5.677 -2.515 2.784 1.00 . A A . 3 GLY N 1 1 11 2327 1 1 3 GLY O O -3.593 -1.343 0.606 1.00 . A A . 3 GLY O 1 1 11 2328 1 1 4 LYS C C -4.127 1.268 -0.803 1.00 . A A . 4 LYS C 1 1 11 2329 1 1 4 LYS CA C -5.294 0.292 -0.684 1.00 . A A . 4 LYS CA 1 1 11 2330 1 1 4 LYS CB C -6.615 0.986 -1.017 1.00 . A A . 4 LYS CB 1 1 11 2331 1 1 4 LYS CD C -7.593 2.337 -2.878 1.00 . A A . 4 LYS CD 1 1 11 2332 1 1 4 LYS CE C -9.031 2.146 -2.387 1.00 . A A . 4 LYS CE 1 1 11 2333 1 1 4 LYS CG C -6.767 1.095 -2.536 1.00 . A A . 4 LYS CG 1 1 11 2334 1 1 4 LYS H H -6.187 0.160 1.273 1.00 . A A . 4 LYS H 1 1 11 2335 1 1 4 LYS HA H -5.146 -0.553 -1.332 1.00 . A A . 4 LYS HA 1 1 11 2336 1 1 4 LYS HB2 H -7.436 0.411 -0.612 1.00 . A A . 4 LYS HB2 1 1 11 2337 1 1 4 LYS HB3 H -6.622 1.976 -0.585 1.00 . A A . 4 LYS HB3 1 1 11 2338 1 1 4 LYS HD2 H -7.159 3.202 -2.397 1.00 . A A . 4 LYS HD2 1 1 11 2339 1 1 4 LYS HD3 H -7.597 2.483 -3.948 1.00 . A A . 4 LYS HD3 1 1 11 2340 1 1 4 LYS HE2 H -9.054 1.455 -1.557 1.00 . A A . 4 LYS HE2 1 1 11 2341 1 1 4 LYS HE3 H -9.460 3.095 -2.102 1.00 . A A . 4 LYS HE3 1 1 11 2342 1 1 4 LYS HG2 H -5.790 1.175 -2.990 1.00 . A A . 4 LYS HG2 1 1 11 2343 1 1 4 LYS HG3 H -7.269 0.217 -2.912 1.00 . A A . 4 LYS HG3 1 1 11 2344 1 1 4 LYS HZ1 H -9.390 1.999 -4.432 1.00 . A A . 4 LYS HZ1 1 1 11 2345 1 1 4 LYS HZ2 H -10.777 1.812 -3.470 1.00 . A A . 4 LYS HZ2 1 1 11 2346 1 1 4 LYS HZ3 H -9.640 0.554 -3.581 1.00 . A A . 4 LYS HZ3 1 1 11 2347 1 1 4 LYS N N -5.433 -0.152 0.731 1.00 . A A . 4 LYS N 1 1 11 2348 1 1 4 LYS NZ N -9.765 1.585 -3.556 1.00 . A A . 4 LYS NZ 1 1 11 2349 1 1 4 LYS O O -3.245 1.107 -1.622 1.00 . A A . 4 LYS O 1 1 11 2350 1 1 5 ILE C C -1.697 2.588 0.405 1.00 . A A . 5 ILE C 1 1 11 2351 1 1 5 ILE CA C -3.001 3.262 -0.026 1.00 . A A . 5 ILE CA 1 1 11 2352 1 1 5 ILE CB C -3.399 4.351 0.970 1.00 . A A . 5 ILE CB 1 1 11 2353 1 1 5 ILE CD1 C -4.028 6.001 -0.799 1.00 . A A . 5 ILE CD1 1 1 11 2354 1 1 5 ILE CG1 C -4.545 5.181 0.385 1.00 . A A . 5 ILE CG1 1 1 11 2355 1 1 5 ILE CG2 C -2.199 5.259 1.242 1.00 . A A . 5 ILE CG2 1 1 11 2356 1 1 5 ILE H H -4.833 2.376 0.676 1.00 . A A . 5 ILE H 1 1 11 2357 1 1 5 ILE HA H -2.905 3.680 -1.014 1.00 . A A . 5 ILE HA 1 1 11 2358 1 1 5 ILE HB H -3.721 3.891 1.894 1.00 . A A . 5 ILE HB 1 1 11 2359 1 1 5 ILE HD11 H -3.162 6.569 -0.494 1.00 . A A . 5 ILE HD11 1 1 11 2360 1 1 5 ILE HD12 H -4.802 6.675 -1.134 1.00 . A A . 5 ILE HD12 1 1 11 2361 1 1 5 ILE HD13 H -3.756 5.336 -1.606 1.00 . A A . 5 ILE HD13 1 1 11 2362 1 1 5 ILE HG12 H -5.333 4.521 0.051 1.00 . A A . 5 ILE HG12 1 1 11 2363 1 1 5 ILE HG13 H -4.929 5.847 1.141 1.00 . A A . 5 ILE HG13 1 1 11 2364 1 1 5 ILE HG21 H -1.778 5.019 2.208 1.00 . A A . 5 ILE HG21 1 1 11 2365 1 1 5 ILE HG22 H -2.519 6.291 1.235 1.00 . A A . 5 ILE HG22 1 1 11 2366 1 1 5 ILE HG23 H -1.452 5.108 0.477 1.00 . A A . 5 ILE HG23 1 1 11 2367 1 1 5 ILE N N -4.114 2.275 0.021 1.00 . A A . 5 ILE N 1 1 11 2368 1 1 5 ILE O O -0.618 2.984 0.009 1.00 . A A . 5 ILE O 1 1 11 2369 1 1 6 TRP C C -0.008 -0.010 0.536 1.00 . A A . 6 TRP C 1 1 11 2370 1 1 6 TRP CA C -0.564 0.859 1.669 1.00 . A A . 6 TRP CA 1 1 11 2371 1 1 6 TRP CB C -1.020 -0.011 2.840 1.00 . A A . 6 TRP CB 1 1 11 2372 1 1 6 TRP CD1 C 0.002 -2.321 2.831 1.00 . A A . 6 TRP CD1 1 1 11 2373 1 1 6 TRP CD2 C 1.295 -0.808 3.881 1.00 . A A . 6 TRP CD2 1 1 11 2374 1 1 6 TRP CE2 C 1.979 -2.044 3.949 1.00 . A A . 6 TRP CE2 1 1 11 2375 1 1 6 TRP CE3 C 1.897 0.318 4.471 1.00 . A A . 6 TRP CE3 1 1 11 2376 1 1 6 TRP CG C 0.041 -1.010 3.165 1.00 . A A . 6 TRP CG 1 1 11 2377 1 1 6 TRP CH2 C 3.803 -1.031 5.162 1.00 . A A . 6 TRP CH2 1 1 11 2378 1 1 6 TRP CZ2 C 3.218 -2.159 4.581 1.00 . A A . 6 TRP CZ2 1 1 11 2379 1 1 6 TRP CZ3 C 3.144 0.205 5.107 1.00 . A A . 6 TRP CZ3 1 1 11 2380 1 1 6 TRP H H -2.674 1.262 1.515 1.00 . A A . 6 TRP H 1 1 11 2381 1 1 6 TRP HA H 0.178 1.566 2.001 1.00 . A A . 6 TRP HA 1 1 11 2382 1 1 6 TRP HB2 H -1.202 0.614 3.701 1.00 . A A . 6 TRP HB2 1 1 11 2383 1 1 6 TRP HB3 H -1.930 -0.526 2.571 1.00 . A A . 6 TRP HB3 1 1 11 2384 1 1 6 TRP HD1 H -0.795 -2.808 2.291 1.00 . A A . 6 TRP HD1 1 1 11 2385 1 1 6 TRP HE1 H 1.370 -3.884 3.185 1.00 . A A . 6 TRP HE1 1 1 11 2386 1 1 6 TRP HE3 H 1.398 1.275 4.433 1.00 . A A . 6 TRP HE3 1 1 11 2387 1 1 6 TRP HH2 H 4.762 -1.111 5.653 1.00 . A A . 6 TRP HH2 1 1 11 2388 1 1 6 TRP HZ2 H 3.721 -3.114 4.621 1.00 . A A . 6 TRP HZ2 1 1 11 2389 1 1 6 TRP HZ3 H 3.598 1.076 5.556 1.00 . A A . 6 TRP HZ3 1 1 11 2390 1 1 6 TRP N N -1.793 1.567 1.212 1.00 . A A . 6 TRP N 1 1 11 2391 1 1 6 TRP NE1 N 1.151 -2.935 3.296 1.00 . A A . 6 TRP NE1 1 1 11 2392 1 1 6 TRP O O 1.175 -0.277 0.470 1.00 . A A . 6 TRP O 1 1 11 2393 1 1 7 GLU C C 0.764 -0.585 -2.221 1.00 . A A . 7 GLU C 1 1 11 2394 1 1 7 GLU CA C -0.372 -1.295 -1.485 1.00 . A A . 7 GLU CA 1 1 11 2395 1 1 7 GLU CB C -1.584 -1.463 -2.400 1.00 . A A . 7 GLU CB 1 1 11 2396 1 1 7 GLU CD C -1.797 -3.941 -2.153 1.00 . A A . 7 GLU CD 1 1 11 2397 1 1 7 GLU CG C -1.491 -2.805 -3.131 1.00 . A A . 7 GLU CG 1 1 11 2398 1 1 7 GLU H H -1.804 -0.219 -0.286 1.00 . A A . 7 GLU H 1 1 11 2399 1 1 7 GLU HA H -0.045 -2.255 -1.123 1.00 . A A . 7 GLU HA 1 1 11 2400 1 1 7 GLU HB2 H -2.488 -1.437 -1.809 1.00 . A A . 7 GLU HB2 1 1 11 2401 1 1 7 GLU HB3 H -1.603 -0.663 -3.125 1.00 . A A . 7 GLU HB3 1 1 11 2402 1 1 7 GLU HG2 H -2.206 -2.824 -3.942 1.00 . A A . 7 GLU HG2 1 1 11 2403 1 1 7 GLU HG3 H -0.494 -2.931 -3.526 1.00 . A A . 7 GLU HG3 1 1 11 2404 1 1 7 GLU N N -0.853 -0.448 -0.355 1.00 . A A . 7 GLU N 1 1 11 2405 1 1 7 GLU O O 1.741 -1.192 -2.615 1.00 . A A . 7 GLU O 1 1 11 2406 1 1 7 GLU OE1 O -1.646 -3.728 -0.962 1.00 . A A . 7 GLU OE1 1 1 11 2407 1 1 7 GLU OE2 O -2.177 -5.006 -2.613 1.00 . A A . 7 GLU OE2 1 1 11 2408 1 1 8 GLY C C 2.857 1.745 -2.141 1.00 . A A . 8 GLY C 1 1 11 2409 1 1 8 GLY CA C 1.712 1.456 -3.113 1.00 . A A . 8 GLY CA 1 1 11 2410 1 1 8 GLY H H -0.154 1.164 -2.078 1.00 . A A . 8 GLY H 1 1 11 2411 1 1 8 GLY HA2 H 2.080 0.870 -3.944 1.00 . A A . 8 GLY HA2 1 1 11 2412 1 1 8 GLY HA3 H 1.312 2.389 -3.479 1.00 . A A . 8 GLY HA3 1 1 11 2413 1 1 8 GLY N N 0.643 0.698 -2.407 1.00 . A A . 8 GLY N 1 1 11 2414 1 1 8 GLY O O 3.993 1.913 -2.538 1.00 . A A . 8 GLY O 1 1 11 2415 1 1 9 ILE C C 4.526 0.840 0.305 1.00 . A A . 9 ILE C 1 1 11 2416 1 1 9 ILE CA C 3.642 2.077 0.127 1.00 . A A . 9 ILE CA 1 1 11 2417 1 1 9 ILE CB C 2.903 2.401 1.426 1.00 . A A . 9 ILE CB 1 1 11 2418 1 1 9 ILE CD1 C 1.568 4.146 2.614 1.00 . A A . 9 ILE CD1 1 1 11 2419 1 1 9 ILE CG1 C 2.136 3.714 1.261 1.00 . A A . 9 ILE CG1 1 1 11 2420 1 1 9 ILE CG2 C 3.914 2.542 2.566 1.00 . A A . 9 ILE CG2 1 1 11 2421 1 1 9 ILE H H 1.645 1.662 -0.571 1.00 . A A . 9 ILE H 1 1 11 2422 1 1 9 ILE HA H 4.234 2.924 -0.181 1.00 . A A . 9 ILE HA 1 1 11 2423 1 1 9 ILE HB H 2.213 1.602 1.655 1.00 . A A . 9 ILE HB 1 1 11 2424 1 1 9 ILE HD11 H 0.488 4.114 2.578 1.00 . A A . 9 ILE HD11 1 1 11 2425 1 1 9 ILE HD12 H 1.890 5.152 2.834 1.00 . A A . 9 ILE HD12 1 1 11 2426 1 1 9 ILE HD13 H 1.922 3.477 3.384 1.00 . A A . 9 ILE HD13 1 1 11 2427 1 1 9 ILE HG12 H 2.804 4.477 0.890 1.00 . A A . 9 ILE HG12 1 1 11 2428 1 1 9 ILE HG13 H 1.327 3.573 0.561 1.00 . A A . 9 ILE HG13 1 1 11 2429 1 1 9 ILE HG21 H 4.903 2.304 2.202 1.00 . A A . 9 ILE HG21 1 1 11 2430 1 1 9 ILE HG22 H 3.653 1.865 3.365 1.00 . A A . 9 ILE HG22 1 1 11 2431 1 1 9 ILE HG23 H 3.901 3.557 2.934 1.00 . A A . 9 ILE HG23 1 1 11 2432 1 1 9 ILE N N 2.568 1.801 -0.870 1.00 . A A . 9 ILE N 1 1 11 2433 1 1 9 ILE O O 5.734 0.909 0.198 1.00 . A A . 9 ILE O 1 1 11 2434 1 1 10 LYS C C 5.504 -1.858 -0.529 1.00 . A A . 10 LYS C 1 1 11 2435 1 1 10 LYS CA C 4.741 -1.531 0.757 1.00 . A A . 10 LYS CA 1 1 11 2436 1 1 10 LYS CB C 3.720 -2.627 1.068 1.00 . A A . 10 LYS CB 1 1 11 2437 1 1 10 LYS CD C 2.426 -4.279 -0.288 1.00 . A A . 10 LYS CD 1 1 11 2438 1 1 10 LYS CE C 1.675 -4.483 -1.605 1.00 . A A . 10 LYS CE 1 1 11 2439 1 1 10 LYS CG C 2.775 -2.798 -0.121 1.00 . A A . 10 LYS CG 1 1 11 2440 1 1 10 LYS H H 2.957 -0.326 0.655 1.00 . A A . 10 LYS H 1 1 11 2441 1 1 10 LYS HA H 5.423 -1.417 1.584 1.00 . A A . 10 LYS HA 1 1 11 2442 1 1 10 LYS HB2 H 4.237 -3.556 1.256 1.00 . A A . 10 LYS HB2 1 1 11 2443 1 1 10 LYS HB3 H 3.149 -2.350 1.942 1.00 . A A . 10 LYS HB3 1 1 11 2444 1 1 10 LYS HD2 H 3.335 -4.864 -0.295 1.00 . A A . 10 LYS HD2 1 1 11 2445 1 1 10 LYS HD3 H 1.802 -4.596 0.533 1.00 . A A . 10 LYS HD3 1 1 11 2446 1 1 10 LYS HE2 H 1.098 -5.397 -1.570 1.00 . A A . 10 LYS HE2 1 1 11 2447 1 1 10 LYS HE3 H 1.034 -3.639 -1.808 1.00 . A A . 10 LYS HE3 1 1 11 2448 1 1 10 LYS HG2 H 1.871 -2.232 0.052 1.00 . A A . 10 LYS HG2 1 1 11 2449 1 1 10 LYS HG3 H 3.256 -2.442 -1.019 1.00 . A A . 10 LYS HG3 1 1 11 2450 1 1 10 LYS HZ1 H 3.205 -5.505 -2.580 1.00 . A A . 10 LYS HZ1 1 1 11 2451 1 1 10 LYS HZ2 H 3.440 -3.825 -2.490 1.00 . A A . 10 LYS HZ2 1 1 11 2452 1 1 10 LYS HZ3 H 2.314 -4.470 -3.586 1.00 . A A . 10 LYS HZ3 1 1 11 2453 1 1 10 LYS N N 3.933 -0.291 0.574 1.00 . A A . 10 LYS N 1 1 11 2454 1 1 10 LYS NZ N 2.738 -4.578 -2.643 1.00 . A A . 10 LYS NZ 1 1 11 2455 1 1 10 LYS O O 6.448 -2.621 -0.524 1.00 . A A . 10 LYS O 1 1 11 2456 1 1 11 SER C C 7.042 -0.668 -3.044 1.00 . A A . 11 SER C 1 1 11 2457 1 1 11 SER CA C 5.806 -1.561 -2.915 1.00 . A A . 11 SER CA 1 1 11 2458 1 1 11 SER CB C 4.788 -1.228 -4.003 1.00 . A A . 11 SER CB 1 1 11 2459 1 1 11 SER H H 4.338 -0.671 -1.612 1.00 . A A . 11 SER H 1 1 11 2460 1 1 11 SER HA H 6.083 -2.602 -2.976 1.00 . A A . 11 SER HA 1 1 11 2461 1 1 11 SER HB2 H 3.933 -0.742 -3.564 1.00 . A A . 11 SER HB2 1 1 11 2462 1 1 11 SER HB3 H 5.242 -0.565 -4.729 1.00 . A A . 11 SER HB3 1 1 11 2463 1 1 11 SER HG H 3.635 -2.790 -4.135 1.00 . A A . 11 SER HG 1 1 11 2464 1 1 11 SER N N 5.102 -1.284 -1.630 1.00 . A A . 11 SER N 1 1 11 2465 1 1 11 SER O O 7.963 -0.966 -3.779 1.00 . A A . 11 SER O 1 1 11 2466 1 1 11 SER OG O 4.368 -2.428 -4.637 1.00 . A A . 11 SER OG 1 1 11 2467 1 1 12 LEU C C 9.354 0.858 -1.467 1.00 . A A . 12 LEU C 1 1 11 2468 1 1 12 LEU CA C 8.251 1.337 -2.413 1.00 . A A . 12 LEU CA 1 1 11 2469 1 1 12 LEU CB C 7.725 2.705 -1.977 1.00 . A A . 12 LEU CB 1 1 11 2470 1 1 12 LEU CD1 C 7.100 3.870 -4.097 1.00 . A A . 12 LEU CD1 1 1 11 2471 1 1 12 LEU CD2 C 8.291 5.117 -2.291 1.00 . A A . 12 LEU CD2 1 1 11 2472 1 1 12 LEU CG C 8.154 3.765 -2.993 1.00 . A A . 12 LEU CG 1 1 11 2473 1 1 12 LEU H H 6.320 0.649 -1.744 1.00 . A A . 12 LEU H 1 1 11 2474 1 1 12 LEU HA H 8.618 1.389 -3.426 1.00 . A A . 12 LEU HA 1 1 11 2475 1 1 12 LEU HB2 H 6.647 2.675 -1.919 1.00 . A A . 12 LEU HB2 1 1 11 2476 1 1 12 LEU HB3 H 8.132 2.954 -1.008 1.00 . A A . 12 LEU HB3 1 1 11 2477 1 1 12 LEU HD11 H 6.633 2.907 -4.242 1.00 . A A . 12 LEU HD11 1 1 11 2478 1 1 12 LEU HD12 H 7.572 4.182 -5.017 1.00 . A A . 12 LEU HD12 1 1 11 2479 1 1 12 LEU HD13 H 6.350 4.594 -3.812 1.00 . A A . 12 LEU HD13 1 1 11 2480 1 1 12 LEU HD21 H 8.496 4.960 -1.242 1.00 . A A . 12 LEU HD21 1 1 11 2481 1 1 12 LEU HD22 H 7.373 5.674 -2.399 1.00 . A A . 12 LEU HD22 1 1 11 2482 1 1 12 LEU HD23 H 9.104 5.673 -2.736 1.00 . A A . 12 LEU HD23 1 1 11 2483 1 1 12 LEU HG H 9.102 3.484 -3.427 1.00 . A A . 12 LEU HG 1 1 11 2484 1 1 12 LEU N N 7.072 0.426 -2.332 1.00 . A A . 12 LEU N 1 1 11 2485 1 1 12 LEU O O 10.524 1.098 -1.689 1.00 . A A . 12 LEU O 1 1 11 2486 1 1 13 PHE C C 11.068 0.767 0.804 1.00 . A A . 13 PHE C 1 1 11 2487 1 1 13 PHE CA C 10.015 -0.315 0.550 1.00 . A A . 13 PHE CA 1 1 11 2488 1 1 13 PHE CB C 10.646 -1.527 -0.135 1.00 . A A . 13 PHE CB 1 1 11 2489 1 1 13 PHE CD1 C 9.420 -2.933 1.553 1.00 . A A . 13 PHE CD1 1 1 11 2490 1 1 13 PHE CD2 C 11.648 -3.608 0.878 1.00 . A A . 13 PHE CD2 1 1 11 2491 1 1 13 PHE CE1 C 9.345 -4.034 2.411 1.00 . A A . 13 PHE CE1 1 1 11 2492 1 1 13 PHE CE2 C 11.573 -4.711 1.736 1.00 . A A . 13 PHE CE2 1 1 11 2493 1 1 13 PHE CG C 10.569 -2.719 0.787 1.00 . A A . 13 PHE CG 1 1 11 2494 1 1 13 PHE CZ C 10.421 -4.925 2.503 1.00 . A A . 13 PHE CZ 1 1 11 2495 1 1 13 PHE H H 8.039 -0.002 -0.254 1.00 . A A . 13 PHE H 1 1 11 2496 1 1 13 PHE HA H 9.550 -0.614 1.476 1.00 . A A . 13 PHE HA 1 1 11 2497 1 1 13 PHE HB2 H 10.110 -1.744 -1.048 1.00 . A A . 13 PHE HB2 1 1 11 2498 1 1 13 PHE HB3 H 11.680 -1.316 -0.365 1.00 . A A . 13 PHE HB3 1 1 11 2499 1 1 13 PHE HD1 H 8.589 -2.247 1.484 1.00 . A A . 13 PHE HD1 1 1 11 2500 1 1 13 PHE HD2 H 12.536 -3.443 0.286 1.00 . A A . 13 PHE HD2 1 1 11 2501 1 1 13 PHE HE1 H 8.458 -4.196 3.001 1.00 . A A . 13 PHE HE1 1 1 11 2502 1 1 13 PHE HE2 H 12.404 -5.399 1.805 1.00 . A A . 13 PHE HE2 1 1 11 2503 1 1 13 PHE HZ H 10.364 -5.776 3.165 1.00 . A A . 13 PHE HZ 1 1 11 2504 1 1 13 PHE N N 8.988 0.181 -0.413 1.00 . A A . 13 PHE N 1 1 11 2505 1 1 13 PHE O O 12.251 0.529 0.668 1.00 . A A . 13 PHE O 1 1 11 2506 1 1 14 NH2 HN1 H 9.729 2.153 1.282 1.00 . A A . 14 NH2 HN1 1 1 11 2507 1 1 14 NH2 HN2 H 11.348 2.659 1.337 1.00 . A A . 14 NH2 HN2 1 1 11 2508 1 1 14 NH2 N N 10.684 1.959 1.171 1.00 . A A . 14 NH2 N 1 1 12 2509 1 1 1 ILE C C -9.312 -1.284 2.741 1.00 . A A . 1 ILE C 1 1 12 2510 1 1 1 ILE CA C -10.418 -0.224 2.738 1.00 . A A . 1 ILE CA 1 1 12 2511 1 1 1 ILE CB C -9.817 1.181 2.732 1.00 . A A . 1 ILE CB 1 1 12 2512 1 1 1 ILE CD1 C -10.384 1.746 0.366 1.00 . A A . 1 ILE CD1 1 1 12 2513 1 1 1 ILE CG1 C -9.241 1.483 1.347 1.00 . A A . 1 ILE CG1 1 1 12 2514 1 1 1 ILE CG2 C -8.701 1.263 3.776 1.00 . A A . 1 ILE CG2 1 1 12 2515 1 1 1 ILE H1 H -10.605 -0.656 4.767 1.00 . A A . 1 ILE H1 1 1 12 2516 1 1 1 ILE H2 H -12.014 -0.947 3.864 1.00 . A A . 1 ILE H2 1 1 12 2517 1 1 1 ILE H3 H -11.560 0.645 4.247 1.00 . A A . 1 ILE H3 1 1 12 2518 1 1 1 ILE HA H -11.060 -0.353 1.881 1.00 . A A . 1 ILE HA 1 1 12 2519 1 1 1 ILE HB H -10.586 1.901 2.971 1.00 . A A . 1 ILE HB 1 1 12 2520 1 1 1 ILE HD11 H -10.208 2.680 -0.150 1.00 . A A . 1 ILE HD11 1 1 12 2521 1 1 1 ILE HD12 H -11.317 1.804 0.907 1.00 . A A . 1 ILE HD12 1 1 12 2522 1 1 1 ILE HD13 H -10.433 0.942 -0.353 1.00 . A A . 1 ILE HD13 1 1 12 2523 1 1 1 ILE HG12 H -8.606 2.355 1.404 1.00 . A A . 1 ILE HG12 1 1 12 2524 1 1 1 ILE HG13 H -8.662 0.638 1.005 1.00 . A A . 1 ILE HG13 1 1 12 2525 1 1 1 ILE HG21 H -8.986 0.700 4.652 1.00 . A A . 1 ILE HG21 1 1 12 2526 1 1 1 ILE HG22 H -8.538 2.295 4.047 1.00 . A A . 1 ILE HG22 1 1 12 2527 1 1 1 ILE HG23 H -7.792 0.851 3.363 1.00 . A A . 1 ILE HG23 1 1 12 2528 1 1 1 ILE N N -11.210 -0.302 4.000 1.00 . A A . 1 ILE N 1 1 12 2529 1 1 1 ILE O O -8.451 -1.293 3.599 1.00 . A A . 1 ILE O 1 1 12 2530 1 1 2 LEU C C -6.898 -2.621 2.000 1.00 . A A . 2 LEU C 1 1 12 2531 1 1 2 LEU CA C -8.278 -3.233 1.738 1.00 . A A . 2 LEU CA 1 1 12 2532 1 1 2 LEU CB C -8.354 -3.800 0.321 1.00 . A A . 2 LEU CB 1 1 12 2533 1 1 2 LEU CD1 C -7.963 -6.200 0.895 1.00 . A A . 2 LEU CD1 1 1 12 2534 1 1 2 LEU CD2 C -7.175 -5.295 -1.295 1.00 . A A . 2 LEU CD2 1 1 12 2535 1 1 2 LEU CG C -7.383 -4.974 0.187 1.00 . A A . 2 LEU CG 1 1 12 2536 1 1 2 LEU H H -10.031 -2.151 1.107 1.00 . A A . 2 LEU H 1 1 12 2537 1 1 2 LEU HA H -8.488 -4.008 2.457 1.00 . A A . 2 LEU HA 1 1 12 2538 1 1 2 LEU HB2 H -9.360 -4.139 0.122 1.00 . A A . 2 LEU HB2 1 1 12 2539 1 1 2 LEU HB3 H -8.086 -3.031 -0.389 1.00 . A A . 2 LEU HB3 1 1 12 2540 1 1 2 LEU HD11 H -7.767 -6.128 1.956 1.00 . A A . 2 LEU HD11 1 1 12 2541 1 1 2 LEU HD12 H -7.502 -7.094 0.504 1.00 . A A . 2 LEU HD12 1 1 12 2542 1 1 2 LEU HD13 H -9.029 -6.241 0.728 1.00 . A A . 2 LEU HD13 1 1 12 2543 1 1 2 LEU HD21 H -6.614 -4.498 -1.761 1.00 . A A . 2 LEU HD21 1 1 12 2544 1 1 2 LEU HD22 H -8.134 -5.391 -1.781 1.00 . A A . 2 LEU HD22 1 1 12 2545 1 1 2 LEU HD23 H -6.629 -6.223 -1.389 1.00 . A A . 2 LEU HD23 1 1 12 2546 1 1 2 LEU HG H -6.436 -4.712 0.637 1.00 . A A . 2 LEU HG 1 1 12 2547 1 1 2 LEU N N -9.328 -2.176 1.789 1.00 . A A . 2 LEU N 1 1 12 2548 1 1 2 LEU O O -5.992 -3.284 2.466 1.00 . A A . 2 LEU O 1 1 12 2549 1 1 3 GLY C C -4.818 -0.265 0.603 1.00 . A A . 3 GLY C 1 1 12 2550 1 1 3 GLY CA C -5.413 -0.708 1.938 1.00 . A A . 3 GLY CA 1 1 12 2551 1 1 3 GLY H H -7.477 -0.845 1.331 1.00 . A A . 3 GLY H 1 1 12 2552 1 1 3 GLY HA2 H -5.546 0.152 2.577 1.00 . A A . 3 GLY HA2 1 1 12 2553 1 1 3 GLY HA3 H -4.744 -1.407 2.409 1.00 . A A . 3 GLY HA3 1 1 12 2554 1 1 3 GLY N N -6.733 -1.362 1.705 1.00 . A A . 3 GLY N 1 1 12 2555 1 1 3 GLY O O -3.714 -0.631 0.252 1.00 . A A . 3 GLY O 1 1 12 2556 1 1 4 LYS C C -3.785 1.879 -1.221 1.00 . A A . 4 LYS C 1 1 12 2557 1 1 4 LYS CA C -5.010 0.997 -1.452 1.00 . A A . 4 LYS CA 1 1 12 2558 1 1 4 LYS CB C -6.150 1.803 -2.075 1.00 . A A . 4 LYS CB 1 1 12 2559 1 1 4 LYS CD C -7.136 0.023 -3.525 1.00 . A A . 4 LYS CD 1 1 12 2560 1 1 4 LYS CE C -8.640 0.303 -3.506 1.00 . A A . 4 LYS CE 1 1 12 2561 1 1 4 LYS CG C -6.369 1.346 -3.519 1.00 . A A . 4 LYS CG 1 1 12 2562 1 1 4 LYS H H -6.422 0.809 0.166 1.00 . A A . 4 LYS H 1 1 12 2563 1 1 4 LYS HA H -4.759 0.159 -2.081 1.00 . A A . 4 LYS HA 1 1 12 2564 1 1 4 LYS HB2 H -7.055 1.646 -1.505 1.00 . A A . 4 LYS HB2 1 1 12 2565 1 1 4 LYS HB3 H -5.895 2.852 -2.066 1.00 . A A . 4 LYS HB3 1 1 12 2566 1 1 4 LYS HD2 H -6.884 -0.535 -4.416 1.00 . A A . 4 LYS HD2 1 1 12 2567 1 1 4 LYS HD3 H -6.868 -0.553 -2.652 1.00 . A A . 4 LYS HD3 1 1 12 2568 1 1 4 LYS HE2 H -8.908 0.850 -2.612 1.00 . A A . 4 LYS HE2 1 1 12 2569 1 1 4 LYS HE3 H -8.931 0.854 -4.387 1.00 . A A . 4 LYS HE3 1 1 12 2570 1 1 4 LYS HG2 H -6.938 2.096 -4.050 1.00 . A A . 4 LYS HG2 1 1 12 2571 1 1 4 LYS HG3 H -5.413 1.209 -4.002 1.00 . A A . 4 LYS HG3 1 1 12 2572 1 1 4 LYS HZ1 H -8.626 -1.738 -3.104 1.00 . A A . 4 LYS HZ1 1 1 12 2573 1 1 4 LYS HZ2 H -9.518 -1.309 -4.485 1.00 . A A . 4 LYS HZ2 1 1 12 2574 1 1 4 LYS HZ3 H -10.150 -1.012 -2.937 1.00 . A A . 4 LYS HZ3 1 1 12 2575 1 1 4 LYS N N -5.539 0.524 -0.140 1.00 . A A . 4 LYS N 1 1 12 2576 1 1 4 LYS NZ N -9.282 -1.040 -3.508 1.00 . A A . 4 LYS NZ 1 1 12 2577 1 1 4 LYS O O -2.854 1.890 -2.001 1.00 . A A . 4 LYS O 1 1 12 2578 1 1 5 ILE C C -1.461 2.655 0.706 1.00 . A A . 5 ILE C 1 1 12 2579 1 1 5 ILE CA C -2.617 3.493 0.156 1.00 . A A . 5 ILE CA 1 1 12 2580 1 1 5 ILE CB C -3.132 4.463 1.218 1.00 . A A . 5 ILE CB 1 1 12 2581 1 1 5 ILE CD1 C -3.248 6.498 -0.236 1.00 . A A . 5 ILE CD1 1 1 12 2582 1 1 5 ILE CG1 C -4.067 5.483 0.562 1.00 . A A . 5 ILE CG1 1 1 12 2583 1 1 5 ILE CG2 C -1.951 5.188 1.869 1.00 . A A . 5 ILE CG2 1 1 12 2584 1 1 5 ILE H H -4.540 2.581 0.472 1.00 . A A . 5 ILE H 1 1 12 2585 1 1 5 ILE HA H -2.312 4.033 -0.724 1.00 . A A . 5 ILE HA 1 1 12 2586 1 1 5 ILE HB H -3.673 3.910 1.973 1.00 . A A . 5 ILE HB 1 1 12 2587 1 1 5 ILE HD11 H -2.693 5.986 -1.008 1.00 . A A . 5 ILE HD11 1 1 12 2588 1 1 5 ILE HD12 H -2.561 7.006 0.425 1.00 . A A . 5 ILE HD12 1 1 12 2589 1 1 5 ILE HD13 H -3.911 7.220 -0.689 1.00 . A A . 5 ILE HD13 1 1 12 2590 1 1 5 ILE HG12 H -4.749 4.969 -0.101 1.00 . A A . 5 ILE HG12 1 1 12 2591 1 1 5 ILE HG13 H -4.630 5.996 1.326 1.00 . A A . 5 ILE HG13 1 1 12 2592 1 1 5 ILE HG21 H -1.043 4.945 1.337 1.00 . A A . 5 ILE HG21 1 1 12 2593 1 1 5 ILE HG22 H -1.860 4.876 2.898 1.00 . A A . 5 ILE HG22 1 1 12 2594 1 1 5 ILE HG23 H -2.118 6.254 1.829 1.00 . A A . 5 ILE HG23 1 1 12 2595 1 1 5 ILE N N -3.779 2.614 -0.144 1.00 . A A . 5 ILE N 1 1 12 2596 1 1 5 ILE O O -0.304 2.991 0.544 1.00 . A A . 5 ILE O 1 1 12 2597 1 1 6 TRP C C -0.096 -0.182 0.815 1.00 . A A . 6 TRP C 1 1 12 2598 1 1 6 TRP CA C -0.690 0.700 1.915 1.00 . A A . 6 TRP CA 1 1 12 2599 1 1 6 TRP CB C -1.385 -0.153 2.978 1.00 . A A . 6 TRP CB 1 1 12 2600 1 1 6 TRP CD1 C -0.765 -2.602 3.051 1.00 . A A . 6 TRP CD1 1 1 12 2601 1 1 6 TRP CD2 C 0.752 -1.296 4.076 1.00 . A A . 6 TRP CD2 1 1 12 2602 1 1 6 TRP CE2 C 1.218 -2.627 4.191 1.00 . A A . 6 TRP CE2 1 1 12 2603 1 1 6 TRP CE3 C 1.531 -0.270 4.644 1.00 . A A . 6 TRP CE3 1 1 12 2604 1 1 6 TRP CG C -0.509 -1.308 3.348 1.00 . A A . 6 TRP CG 1 1 12 2605 1 1 6 TRP CH2 C 3.174 -1.899 5.402 1.00 . A A . 6 TRP CH2 1 1 12 2606 1 1 6 TRP CZ2 C 2.414 -2.930 4.844 1.00 . A A . 6 TRP CZ2 1 1 12 2607 1 1 6 TRP CZ3 C 2.733 -0.572 5.302 1.00 . A A . 6 TRP CZ3 1 1 12 2608 1 1 6 TRP H H -2.708 1.313 1.471 1.00 . A A . 6 TRP H 1 1 12 2609 1 1 6 TRP HA H 0.078 1.303 2.371 1.00 . A A . 6 TRP HA 1 1 12 2610 1 1 6 TRP HB2 H -1.575 0.450 3.853 1.00 . A A . 6 TRP HB2 1 1 12 2611 1 1 6 TRP HB3 H -2.321 -0.523 2.587 1.00 . A A . 6 TRP HB3 1 1 12 2612 1 1 6 TRP HD1 H -1.629 -2.964 2.512 1.00 . A A . 6 TRP HD1 1 1 12 2613 1 1 6 TRP HE1 H 0.315 -4.361 3.470 1.00 . A A . 6 TRP HE1 1 1 12 2614 1 1 6 TRP HE3 H 1.200 0.756 4.572 1.00 . A A . 6 TRP HE3 1 1 12 2615 1 1 6 TRP HH2 H 4.101 -2.125 5.910 1.00 . A A . 6 TRP HH2 1 1 12 2616 1 1 6 TRP HZ2 H 2.748 -3.954 4.919 1.00 . A A . 6 TRP HZ2 1 1 12 2617 1 1 6 TRP HZ3 H 3.324 0.224 5.734 1.00 . A A . 6 TRP HZ3 1 1 12 2618 1 1 6 TRP N N -1.767 1.565 1.353 1.00 . A A . 6 TRP N 1 1 12 2619 1 1 6 TRP NE1 N 0.259 -3.386 3.550 1.00 . A A . 6 TRP NE1 1 1 12 2620 1 1 6 TRP O O 1.047 -0.590 0.883 1.00 . A A . 6 TRP O 1 1 12 2621 1 1 7 GLU C C 0.847 -0.636 -1.986 1.00 . A A . 7 GLU C 1 1 12 2622 1 1 7 GLU CA C -0.332 -1.333 -1.303 1.00 . A A . 7 GLU CA 1 1 12 2623 1 1 7 GLU CB C -1.500 -1.494 -2.277 1.00 . A A . 7 GLU CB 1 1 12 2624 1 1 7 GLU CD C -3.170 -3.260 -2.857 1.00 . A A . 7 GLU CD 1 1 12 2625 1 1 7 GLU CG C -1.688 -2.976 -2.607 1.00 . A A . 7 GLU CG 1 1 12 2626 1 1 7 GLU H H -1.779 -0.139 -0.240 1.00 . A A . 7 GLU H 1 1 12 2627 1 1 7 GLU HA H -0.032 -2.296 -0.923 1.00 . A A . 7 GLU HA 1 1 12 2628 1 1 7 GLU HB2 H -2.401 -1.108 -1.823 1.00 . A A . 7 GLU HB2 1 1 12 2629 1 1 7 GLU HB3 H -1.290 -0.949 -3.185 1.00 . A A . 7 GLU HB3 1 1 12 2630 1 1 7 GLU HG2 H -1.118 -3.222 -3.491 1.00 . A A . 7 GLU HG2 1 1 12 2631 1 1 7 GLU HG3 H -1.344 -3.576 -1.778 1.00 . A A . 7 GLU HG3 1 1 12 2632 1 1 7 GLU N N -0.859 -0.478 -0.201 1.00 . A A . 7 GLU N 1 1 12 2633 1 1 7 GLU O O 1.755 -1.272 -2.485 1.00 . A A . 7 GLU O 1 1 12 2634 1 1 7 GLU OE1 O -3.646 -2.913 -3.927 1.00 . A A . 7 GLU OE1 1 1 12 2635 1 1 7 GLU OE2 O -3.804 -3.817 -1.977 1.00 . A A . 7 GLU OE2 1 1 12 2636 1 1 8 GLY C C 3.110 1.565 -1.663 1.00 . A A . 8 GLY C 1 1 12 2637 1 1 8 GLY CA C 1.958 1.409 -2.656 1.00 . A A . 8 GLY CA 1 1 12 2638 1 1 8 GLY H H 0.099 1.160 -1.597 1.00 . A A . 8 GLY H 1 1 12 2639 1 1 8 GLY HA2 H 2.299 0.861 -3.522 1.00 . A A . 8 GLY HA2 1 1 12 2640 1 1 8 GLY HA3 H 1.614 2.387 -2.959 1.00 . A A . 8 GLY HA3 1 1 12 2641 1 1 8 GLY N N 0.840 0.668 -2.009 1.00 . A A . 8 GLY N 1 1 12 2642 1 1 8 GLY O O 4.265 1.608 -2.039 1.00 . A A . 8 GLY O 1 1 12 2643 1 1 9 ILE C C 4.801 0.573 0.606 1.00 . A A . 9 ILE C 1 1 12 2644 1 1 9 ILE CA C 3.888 1.802 0.620 1.00 . A A . 9 ILE CA 1 1 12 2645 1 1 9 ILE CB C 3.161 1.915 1.960 1.00 . A A . 9 ILE CB 1 1 12 2646 1 1 9 ILE CD1 C 1.765 3.406 3.399 1.00 . A A . 9 ILE CD1 1 1 12 2647 1 1 9 ILE CG1 C 2.415 3.248 2.023 1.00 . A A . 9 ILE CG1 1 1 12 2648 1 1 9 ILE CG2 C 4.180 1.849 3.099 1.00 . A A . 9 ILE CG2 1 1 12 2649 1 1 9 ILE H H 1.869 1.612 -0.114 1.00 . A A . 9 ILE H 1 1 12 2650 1 1 9 ILE HA H 4.458 2.698 0.432 1.00 . A A . 9 ILE HA 1 1 12 2651 1 1 9 ILE HB H 2.458 1.100 2.058 1.00 . A A . 9 ILE HB 1 1 12 2652 1 1 9 ILE HD11 H 0.771 3.811 3.283 1.00 . A A . 9 ILE HD11 1 1 12 2653 1 1 9 ILE HD12 H 2.358 4.077 4.003 1.00 . A A . 9 ILE HD12 1 1 12 2654 1 1 9 ILE HD13 H 1.707 2.442 3.882 1.00 . A A . 9 ILE HD13 1 1 12 2655 1 1 9 ILE HG12 H 3.111 4.059 1.857 1.00 . A A . 9 ILE HG12 1 1 12 2656 1 1 9 ILE HG13 H 1.649 3.269 1.262 1.00 . A A . 9 ILE HG13 1 1 12 2657 1 1 9 ILE HG21 H 4.717 0.913 3.048 1.00 . A A . 9 ILE HG21 1 1 12 2658 1 1 9 ILE HG22 H 3.666 1.918 4.046 1.00 . A A . 9 ILE HG22 1 1 12 2659 1 1 9 ILE HG23 H 4.877 2.668 3.007 1.00 . A A . 9 ILE HG23 1 1 12 2660 1 1 9 ILE N N 2.807 1.650 -0.397 1.00 . A A . 9 ILE N 1 1 12 2661 1 1 9 ILE O O 5.986 0.672 0.362 1.00 . A A . 9 ILE O 1 1 12 2662 1 1 10 LYS C C 5.735 -2.021 -0.509 1.00 . A A . 10 LYS C 1 1 12 2663 1 1 10 LYS CA C 5.096 -1.818 0.868 1.00 . A A . 10 LYS CA 1 1 12 2664 1 1 10 LYS CB C 4.127 -2.957 1.186 1.00 . A A . 10 LYS CB 1 1 12 2665 1 1 10 LYS CD C 2.470 -4.428 0.032 1.00 . A A . 10 LYS CD 1 1 12 2666 1 1 10 LYS CE C 1.231 -4.546 0.923 1.00 . A A . 10 LYS CE 1 1 12 2667 1 1 10 LYS CG C 3.028 -3.006 0.123 1.00 . A A . 10 LYS CG 1 1 12 2668 1 1 10 LYS H H 3.299 -0.644 1.061 1.00 . A A . 10 LYS H 1 1 12 2669 1 1 10 LYS HA H 5.855 -1.755 1.630 1.00 . A A . 10 LYS HA 1 1 12 2670 1 1 10 LYS HB2 H 4.664 -3.894 1.193 1.00 . A A . 10 LYS HB2 1 1 12 2671 1 1 10 LYS HB3 H 3.681 -2.790 2.154 1.00 . A A . 10 LYS HB3 1 1 12 2672 1 1 10 LYS HD2 H 2.200 -4.644 -0.991 1.00 . A A . 10 LYS HD2 1 1 12 2673 1 1 10 LYS HD3 H 3.218 -5.131 0.365 1.00 . A A . 10 LYS HD3 1 1 12 2674 1 1 10 LYS HE2 H 1.504 -4.932 1.895 1.00 . A A . 10 LYS HE2 1 1 12 2675 1 1 10 LYS HE3 H 0.744 -3.589 1.020 1.00 . A A . 10 LYS HE3 1 1 12 2676 1 1 10 LYS HG2 H 2.236 -2.322 0.392 1.00 . A A . 10 LYS HG2 1 1 12 2677 1 1 10 LYS HG3 H 3.439 -2.723 -0.834 1.00 . A A . 10 LYS HG3 1 1 12 2678 1 1 10 LYS HZ1 H 0.734 -6.463 0.280 1.00 . A A . 10 LYS HZ1 1 1 12 2679 1 1 10 LYS HZ2 H 0.261 -5.229 -0.787 1.00 . A A . 10 LYS HZ2 1 1 12 2680 1 1 10 LYS HZ3 H -0.605 -5.490 0.651 1.00 . A A . 10 LYS HZ3 1 1 12 2681 1 1 10 LYS N N 4.258 -0.584 0.866 1.00 . A A . 10 LYS N 1 1 12 2682 1 1 10 LYS NZ N 0.338 -5.504 0.213 1.00 . A A . 10 LYS NZ 1 1 12 2683 1 1 10 LYS O O 6.770 -2.644 -0.637 1.00 . A A . 10 LYS O 1 1 12 2684 1 1 11 SER C C 6.797 -0.617 -3.141 1.00 . A A . 11 SER C 1 1 12 2685 1 1 11 SER CA C 5.701 -1.660 -2.904 1.00 . A A . 11 SER CA 1 1 12 2686 1 1 11 SER CB C 4.529 -1.432 -3.856 1.00 . A A . 11 SER CB 1 1 12 2687 1 1 11 SER H H 4.293 -0.998 -1.413 1.00 . A A . 11 SER H 1 1 12 2688 1 1 11 SER HA H 6.093 -2.657 -3.033 1.00 . A A . 11 SER HA 1 1 12 2689 1 1 11 SER HB2 H 3.798 -2.214 -3.725 1.00 . A A . 11 SER HB2 1 1 12 2690 1 1 11 SER HB3 H 4.072 -0.475 -3.641 1.00 . A A . 11 SER HB3 1 1 12 2691 1 1 11 SER HG H 4.242 -1.547 -5.777 1.00 . A A . 11 SER HG 1 1 12 2692 1 1 11 SER N N 5.127 -1.498 -1.538 1.00 . A A . 11 SER N 1 1 12 2693 1 1 11 SER O O 7.575 -0.720 -4.069 1.00 . A A . 11 SER O 1 1 12 2694 1 1 11 SER OG O 5.001 -1.454 -5.197 1.00 . A A . 11 SER OG 1 1 12 2695 1 1 12 LEU C C 9.179 1.049 -1.735 1.00 . A A . 12 LEU C 1 1 12 2696 1 1 12 LEU CA C 7.905 1.436 -2.488 1.00 . A A . 12 LEU CA 1 1 12 2697 1 1 12 LEU CB C 7.294 2.705 -1.893 1.00 . A A . 12 LEU CB 1 1 12 2698 1 1 12 LEU CD1 C 6.204 4.139 -3.626 1.00 . A A . 12 LEU CD1 1 1 12 2699 1 1 12 LEU CD2 C 7.887 5.125 -2.065 1.00 . A A . 12 LEU CD2 1 1 12 2700 1 1 12 LEU CG C 7.501 3.874 -2.857 1.00 . A A . 12 LEU CG 1 1 12 2701 1 1 12 LEU H H 6.224 0.451 -1.570 1.00 . A A . 12 LEU H 1 1 12 2702 1 1 12 LEU HA H 8.116 1.585 -3.533 1.00 . A A . 12 LEU HA 1 1 12 2703 1 1 12 LEU HB2 H 6.237 2.553 -1.731 1.00 . A A . 12 LEU HB2 1 1 12 2704 1 1 12 LEU HB3 H 7.774 2.929 -0.952 1.00 . A A . 12 LEU HB3 1 1 12 2705 1 1 12 LEU HD11 H 5.674 4.959 -3.166 1.00 . A A . 12 LEU HD11 1 1 12 2706 1 1 12 LEU HD12 H 5.586 3.252 -3.605 1.00 . A A . 12 LEU HD12 1 1 12 2707 1 1 12 LEU HD13 H 6.438 4.390 -4.650 1.00 . A A . 12 LEU HD13 1 1 12 2708 1 1 12 LEU HD21 H 7.007 5.725 -1.891 1.00 . A A . 12 LEU HD21 1 1 12 2709 1 1 12 LEU HD22 H 8.608 5.699 -2.628 1.00 . A A . 12 LEU HD22 1 1 12 2710 1 1 12 LEU HD23 H 8.317 4.833 -1.119 1.00 . A A . 12 LEU HD23 1 1 12 2711 1 1 12 LEU HG H 8.288 3.629 -3.555 1.00 . A A . 12 LEU HG 1 1 12 2712 1 1 12 LEU N N 6.862 0.386 -2.310 1.00 . A A . 12 LEU N 1 1 12 2713 1 1 12 LEU O O 10.280 1.324 -2.172 1.00 . A A . 12 LEU O 1 1 12 2714 1 1 13 PHE C C 11.144 1.218 0.429 1.00 . A A . 13 PHE C 1 1 12 2715 1 1 13 PHE CA C 10.241 0.007 0.178 1.00 . A A . 13 PHE CA 1 1 12 2716 1 1 13 PHE CB C 10.956 -1.022 -0.698 1.00 . A A . 13 PHE CB 1 1 12 2717 1 1 13 PHE CD1 C 10.668 -2.663 1.188 1.00 . A A . 13 PHE CD1 1 1 12 2718 1 1 13 PHE CD2 C 12.763 -2.647 -0.029 1.00 . A A . 13 PHE CD2 1 1 12 2719 1 1 13 PHE CE1 C 11.146 -3.694 2.000 1.00 . A A . 13 PHE CE1 1 1 12 2720 1 1 13 PHE CE2 C 13.243 -3.680 0.783 1.00 . A A . 13 PHE CE2 1 1 12 2721 1 1 13 PHE CG C 11.474 -2.140 0.173 1.00 . A A . 13 PHE CG 1 1 12 2722 1 1 13 PHE CZ C 12.434 -4.205 1.799 1.00 . A A . 13 PHE CZ 1 1 12 2723 1 1 13 PHE H H 8.142 0.203 -0.274 1.00 . A A . 13 PHE H 1 1 12 2724 1 1 13 PHE HA H 9.947 -0.445 1.113 1.00 . A A . 13 PHE HA 1 1 12 2725 1 1 13 PHE HB2 H 10.263 -1.422 -1.423 1.00 . A A . 13 PHE HB2 1 1 12 2726 1 1 13 PHE HB3 H 11.781 -0.551 -1.208 1.00 . A A . 13 PHE HB3 1 1 12 2727 1 1 13 PHE HD1 H 9.673 -2.272 1.343 1.00 . A A . 13 PHE HD1 1 1 12 2728 1 1 13 PHE HD2 H 13.387 -2.242 -0.813 1.00 . A A . 13 PHE HD2 1 1 12 2729 1 1 13 PHE HE1 H 10.522 -4.096 2.783 1.00 . A A . 13 PHE HE1 1 1 12 2730 1 1 13 PHE HE2 H 14.237 -4.074 0.627 1.00 . A A . 13 PHE HE2 1 1 12 2731 1 1 13 PHE HZ H 12.804 -5.002 2.427 1.00 . A A . 13 PHE HZ 1 1 12 2732 1 1 13 PHE N N 9.038 0.413 -0.606 1.00 . A A . 13 PHE N 1 1 12 2733 1 1 13 PHE O O 11.829 1.680 -0.462 1.00 . A A . 13 PHE O 1 1 12 2734 1 1 14 NH2 HN1 H 10.622 1.387 2.337 1.00 . A A . 14 NH2 HN1 1 1 12 2735 1 1 14 NH2 HN2 H 11.749 2.531 1.789 1.00 . A A . 14 NH2 HN2 1 1 12 2736 1 1 14 NH2 N N 11.174 1.757 1.617 1.00 . A A . 14 NH2 N 1 1 13 2737 1 1 1 ILE C C -9.911 0.318 2.013 1.00 . A A . 1 ILE C 1 1 13 2738 1 1 1 ILE CA C -10.794 1.182 1.110 1.00 . A A . 1 ILE CA 1 1 13 2739 1 1 1 ILE CB C -10.442 0.954 -0.360 1.00 . A A . 1 ILE CB 1 1 13 2740 1 1 1 ILE CD1 C -8.364 -0.196 -1.139 1.00 . A A . 1 ILE CD1 1 1 13 2741 1 1 1 ILE CG1 C -8.929 1.097 -0.549 1.00 . A A . 1 ILE CG1 1 1 13 2742 1 1 1 ILE CG2 C -11.162 1.990 -1.225 1.00 . A A . 1 ILE CG2 1 1 13 2743 1 1 1 ILE H1 H -11.297 3.199 0.961 1.00 . A A . 1 ILE H1 1 1 13 2744 1 1 1 ILE H2 H -9.627 2.894 0.891 1.00 . A A . 1 ILE H2 1 1 13 2745 1 1 1 ILE H3 H -10.448 2.801 2.375 1.00 . A A . 1 ILE H3 1 1 13 2746 1 1 1 ILE HA H -11.836 0.962 1.277 1.00 . A A . 1 ILE HA 1 1 13 2747 1 1 1 ILE HB H -10.751 -0.038 -0.654 1.00 . A A . 1 ILE HB 1 1 13 2748 1 1 1 ILE HD11 H -8.871 -0.421 -2.066 1.00 . A A . 1 ILE HD11 1 1 13 2749 1 1 1 ILE HD12 H -8.514 -1.007 -0.441 1.00 . A A . 1 ILE HD12 1 1 13 2750 1 1 1 ILE HD13 H -7.308 -0.075 -1.327 1.00 . A A . 1 ILE HD13 1 1 13 2751 1 1 1 ILE HG12 H -8.727 1.919 -1.220 1.00 . A A . 1 ILE HG12 1 1 13 2752 1 1 1 ILE HG13 H -8.464 1.288 0.406 1.00 . A A . 1 ILE HG13 1 1 13 2753 1 1 1 ILE HG21 H -11.578 1.505 -2.096 1.00 . A A . 1 ILE HG21 1 1 13 2754 1 1 1 ILE HG22 H -10.461 2.750 -1.536 1.00 . A A . 1 ILE HG22 1 1 13 2755 1 1 1 ILE HG23 H -11.958 2.445 -0.653 1.00 . A A . 1 ILE HG23 1 1 13 2756 1 1 1 ILE N N -10.521 2.628 1.353 1.00 . A A . 1 ILE N 1 1 13 2757 1 1 1 ILE O O -9.395 0.775 3.014 1.00 . A A . 1 ILE O 1 1 13 2758 1 1 2 LEU C C -7.565 -1.118 2.851 1.00 . A A . 2 LEU C 1 1 13 2759 1 1 2 LEU CA C -8.881 -1.819 2.508 1.00 . A A . 2 LEU CA 1 1 13 2760 1 1 2 LEU CB C -8.624 -3.052 1.642 1.00 . A A . 2 LEU CB 1 1 13 2761 1 1 2 LEU CD1 C -8.374 -5.084 3.075 1.00 . A A . 2 LEU CD1 1 1 13 2762 1 1 2 LEU CD2 C -6.682 -4.587 1.307 1.00 . A A . 2 LEU CD2 1 1 13 2763 1 1 2 LEU CG C -7.622 -3.970 2.345 1.00 . A A . 2 LEU CG 1 1 13 2764 1 1 2 LEU H H -10.156 -1.278 0.857 1.00 . A A . 2 LEU H 1 1 13 2765 1 1 2 LEU HA H -9.404 -2.102 3.407 1.00 . A A . 2 LEU HA 1 1 13 2766 1 1 2 LEU HB2 H -9.552 -3.583 1.487 1.00 . A A . 2 LEU HB2 1 1 13 2767 1 1 2 LEU HB3 H -8.220 -2.746 0.689 1.00 . A A . 2 LEU HB3 1 1 13 2768 1 1 2 LEU HD11 H -7.746 -5.493 3.852 1.00 . A A . 2 LEU HD11 1 1 13 2769 1 1 2 LEU HD12 H -8.632 -5.863 2.373 1.00 . A A . 2 LEU HD12 1 1 13 2770 1 1 2 LEU HD13 H -9.275 -4.682 3.514 1.00 . A A . 2 LEU HD13 1 1 13 2771 1 1 2 LEU HD21 H -7.193 -5.384 0.787 1.00 . A A . 2 LEU HD21 1 1 13 2772 1 1 2 LEU HD22 H -5.809 -4.983 1.803 1.00 . A A . 2 LEU HD22 1 1 13 2773 1 1 2 LEU HD23 H -6.381 -3.830 0.598 1.00 . A A . 2 LEU HD23 1 1 13 2774 1 1 2 LEU HG H -7.048 -3.396 3.058 1.00 . A A . 2 LEU HG 1 1 13 2775 1 1 2 LEU N N -9.732 -0.928 1.668 1.00 . A A . 2 LEU N 1 1 13 2776 1 1 2 LEU O O -7.444 -0.465 3.868 1.00 . A A . 2 LEU O 1 1 13 2777 1 1 3 GLY C C -4.641 -0.127 0.973 1.00 . A A . 3 GLY C 1 1 13 2778 1 1 3 GLY CA C -5.272 -0.587 2.285 1.00 . A A . 3 GLY CA 1 1 13 2779 1 1 3 GLY H H -6.698 -1.777 1.192 1.00 . A A . 3 GLY H 1 1 13 2780 1 1 3 GLY HA2 H -5.430 0.267 2.928 1.00 . A A . 3 GLY HA2 1 1 13 2781 1 1 3 GLY HA3 H -4.612 -1.284 2.769 1.00 . A A . 3 GLY HA3 1 1 13 2782 1 1 3 GLY N N -6.579 -1.247 2.008 1.00 . A A . 3 GLY N 1 1 13 2783 1 1 3 GLY O O -3.542 -0.516 0.630 1.00 . A A . 3 GLY O 1 1 13 2784 1 1 4 LYS C C -3.492 2.006 -0.774 1.00 . A A . 4 LYS C 1 1 13 2785 1 1 4 LYS CA C -4.757 1.194 -1.050 1.00 . A A . 4 LYS CA 1 1 13 2786 1 1 4 LYS CB C -5.846 2.078 -1.659 1.00 . A A . 4 LYS CB 1 1 13 2787 1 1 4 LYS CD C -7.117 2.587 -3.751 1.00 . A A . 4 LYS CD 1 1 13 2788 1 1 4 LYS CE C -8.115 1.605 -4.368 1.00 . A A . 4 LYS CE 1 1 13 2789 1 1 4 LYS CG C -5.935 1.813 -3.164 1.00 . A A . 4 LYS CG 1 1 13 2790 1 1 4 LYS H H -6.204 1.008 0.537 1.00 . A A . 4 LYS H 1 1 13 2791 1 1 4 LYS HA H -4.540 0.367 -1.706 1.00 . A A . 4 LYS HA 1 1 13 2792 1 1 4 LYS HB2 H -6.795 1.852 -1.195 1.00 . A A . 4 LYS HB2 1 1 13 2793 1 1 4 LYS HB3 H -5.602 3.117 -1.493 1.00 . A A . 4 LYS HB3 1 1 13 2794 1 1 4 LYS HD2 H -7.602 3.151 -2.967 1.00 . A A . 4 LYS HD2 1 1 13 2795 1 1 4 LYS HD3 H -6.761 3.263 -4.514 1.00 . A A . 4 LYS HD3 1 1 13 2796 1 1 4 LYS HE2 H -8.381 0.841 -3.651 1.00 . A A . 4 LYS HE2 1 1 13 2797 1 1 4 LYS HE3 H -8.997 2.127 -4.707 1.00 . A A . 4 LYS HE3 1 1 13 2798 1 1 4 LYS HG2 H -5.020 2.134 -3.640 1.00 . A A . 4 LYS HG2 1 1 13 2799 1 1 4 LYS HG3 H -6.079 0.757 -3.335 1.00 . A A . 4 LYS HG3 1 1 13 2800 1 1 4 LYS HZ1 H -6.402 0.852 -5.279 1.00 . A A . 4 LYS HZ1 1 1 13 2801 1 1 4 LYS HZ2 H -7.457 1.653 -6.343 1.00 . A A . 4 LYS HZ2 1 1 13 2802 1 1 4 LYS HZ3 H -7.836 0.097 -5.775 1.00 . A A . 4 LYS HZ3 1 1 13 2803 1 1 4 LYS N N -5.324 0.703 0.238 1.00 . A A . 4 LYS N 1 1 13 2804 1 1 4 LYS NZ N -7.399 1.007 -5.529 1.00 . A A . 4 LYS NZ 1 1 13 2805 1 1 4 LYS O O -2.559 2.011 -1.553 1.00 . A A . 4 LYS O 1 1 13 2806 1 1 5 ILE C C -1.114 2.569 1.117 1.00 . A A . 5 ILE C 1 1 13 2807 1 1 5 ILE CA C -2.252 3.493 0.682 1.00 . A A . 5 ILE CA 1 1 13 2808 1 1 5 ILE CB C -2.701 4.381 1.841 1.00 . A A . 5 ILE CB 1 1 13 2809 1 1 5 ILE CD1 C -2.744 6.537 0.569 1.00 . A A . 5 ILE CD1 1 1 13 2810 1 1 5 ILE CG1 C -3.597 5.501 1.304 1.00 . A A . 5 ILE CG1 1 1 13 2811 1 1 5 ILE CG2 C -1.476 4.987 2.528 1.00 . A A . 5 ILE CG2 1 1 13 2812 1 1 5 ILE H H -4.218 2.660 0.951 1.00 . A A . 5 ILE H 1 1 13 2813 1 1 5 ILE HA H -1.950 4.099 -0.155 1.00 . A A . 5 ILE HA 1 1 13 2814 1 1 5 ILE HB H -3.256 3.785 2.552 1.00 . A A . 5 ILE HB 1 1 13 2815 1 1 5 ILE HD11 H -2.535 7.365 1.230 1.00 . A A . 5 ILE HD11 1 1 13 2816 1 1 5 ILE HD12 H -3.279 6.894 -0.298 1.00 . A A . 5 ILE HD12 1 1 13 2817 1 1 5 ILE HD13 H -1.815 6.082 0.257 1.00 . A A . 5 ILE HD13 1 1 13 2818 1 1 5 ILE HG12 H -4.323 5.083 0.621 1.00 . A A . 5 ILE HG12 1 1 13 2819 1 1 5 ILE HG13 H -4.110 5.976 2.126 1.00 . A A . 5 ILE HG13 1 1 13 2820 1 1 5 ILE HG21 H -1.024 4.250 3.175 1.00 . A A . 5 ILE HG21 1 1 13 2821 1 1 5 ILE HG22 H -1.780 5.842 3.115 1.00 . A A . 5 ILE HG22 1 1 13 2822 1 1 5 ILE HG23 H -0.761 5.299 1.781 1.00 . A A . 5 ILE HG23 1 1 13 2823 1 1 5 ILE N N -3.454 2.686 0.337 1.00 . A A . 5 ILE N 1 1 13 2824 1 1 5 ILE O O 0.042 2.812 0.832 1.00 . A A . 5 ILE O 1 1 13 2825 1 1 6 TRP C C 0.073 -0.312 1.074 1.00 . A A . 6 TRP C 1 1 13 2826 1 1 6 TRP CA C -0.379 0.557 2.250 1.00 . A A . 6 TRP CA 1 1 13 2827 1 1 6 TRP CB C -1.049 -0.294 3.331 1.00 . A A . 6 TRP CB 1 1 13 2828 1 1 6 TRP CD1 C -0.701 -2.796 3.393 1.00 . A A . 6 TRP CD1 1 1 13 2829 1 1 6 TRP CD2 C 1.132 -1.655 4.026 1.00 . A A . 6 TRP CD2 1 1 13 2830 1 1 6 TRP CE2 C 1.460 -3.029 4.105 1.00 . A A . 6 TRP CE2 1 1 13 2831 1 1 6 TRP CE3 C 2.120 -0.716 4.374 1.00 . A A . 6 TRP CE3 1 1 13 2832 1 1 6 TRP CG C -0.247 -1.534 3.570 1.00 . A A . 6 TRP CG 1 1 13 2833 1 1 6 TRP CH2 C 3.694 -2.510 4.858 1.00 . A A . 6 TRP CH2 1 1 13 2834 1 1 6 TRP CZ2 C 2.724 -3.457 4.516 1.00 . A A . 6 TRP CZ2 1 1 13 2835 1 1 6 TRP CZ3 C 3.393 -1.143 4.787 1.00 . A A . 6 TRP CZ3 1 1 13 2836 1 1 6 TRP H H -2.377 1.329 2.011 1.00 . A A . 6 TRP H 1 1 13 2837 1 1 6 TRP HA H 0.458 1.094 2.666 1.00 . A A . 6 TRP HA 1 1 13 2838 1 1 6 TRP HB2 H -1.112 0.275 4.247 1.00 . A A . 6 TRP HB2 1 1 13 2839 1 1 6 TRP HB3 H -2.043 -0.565 3.009 1.00 . A A . 6 TRP HB3 1 1 13 2840 1 1 6 TRP HD1 H -1.692 -3.065 3.058 1.00 . A A . 6 TRP HD1 1 1 13 2841 1 1 6 TRP HE1 H 0.240 -4.660 3.666 1.00 . A A . 6 TRP HE1 1 1 13 2842 1 1 6 TRP HE3 H 1.898 0.340 4.323 1.00 . A A . 6 TRP HE3 1 1 13 2843 1 1 6 TRP HH2 H 4.674 -2.832 5.176 1.00 . A A . 6 TRP HH2 1 1 13 2844 1 1 6 TRP HZ2 H 2.951 -4.511 4.569 1.00 . A A . 6 TRP HZ2 1 1 13 2845 1 1 6 TRP HZ3 H 4.144 -0.413 5.052 1.00 . A A . 6 TRP HZ3 1 1 13 2846 1 1 6 TRP N N -1.436 1.506 1.799 1.00 . A A . 6 TRP N 1 1 13 2847 1 1 6 TRP NE1 N 0.311 -3.684 3.710 1.00 . A A . 6 TRP NE1 1 1 13 2848 1 1 6 TRP O O 1.200 -0.763 1.017 1.00 . A A . 6 TRP O 1 1 13 2849 1 1 7 GLU C C 0.671 -0.675 -1.853 1.00 . A A . 7 GLU C 1 1 13 2850 1 1 7 GLU CA C -0.421 -1.379 -1.044 1.00 . A A . 7 GLU CA 1 1 13 2851 1 1 7 GLU CB C -1.702 -1.506 -1.868 1.00 . A A . 7 GLU CB 1 1 13 2852 1 1 7 GLU CD C -3.362 -3.233 -2.578 1.00 . A A . 7 GLU CD 1 1 13 2853 1 1 7 GLU CG C -2.467 -2.758 -1.432 1.00 . A A . 7 GLU CG 1 1 13 2854 1 1 7 GLU H H -1.700 -0.168 0.196 1.00 . A A . 7 GLU H 1 1 13 2855 1 1 7 GLU HA H -0.087 -2.353 -0.725 1.00 . A A . 7 GLU HA 1 1 13 2856 1 1 7 GLU HB2 H -2.319 -0.633 -1.710 1.00 . A A . 7 GLU HB2 1 1 13 2857 1 1 7 GLU HB3 H -1.451 -1.586 -2.914 1.00 . A A . 7 GLU HB3 1 1 13 2858 1 1 7 GLU HG2 H -1.765 -3.537 -1.175 1.00 . A A . 7 GLU HG2 1 1 13 2859 1 1 7 GLU HG3 H -3.079 -2.526 -0.573 1.00 . A A . 7 GLU HG3 1 1 13 2860 1 1 7 GLU N N -0.798 -0.545 0.132 1.00 . A A . 7 GLU N 1 1 13 2861 1 1 7 GLU O O 1.473 -1.304 -2.514 1.00 . A A . 7 GLU O 1 1 13 2862 1 1 7 GLU OE1 O -3.399 -2.559 -3.594 1.00 . A A . 7 GLU OE1 1 1 13 2863 1 1 7 GLU OE2 O -3.995 -4.264 -2.421 1.00 . A A . 7 GLU OE2 1 1 13 2864 1 1 8 GLY C C 3.053 1.375 -1.770 1.00 . A A . 8 GLY C 1 1 13 2865 1 1 8 GLY CA C 1.747 1.376 -2.563 1.00 . A A . 8 GLY CA 1 1 13 2866 1 1 8 GLY H H 0.051 1.115 -1.261 1.00 . A A . 8 GLY H 1 1 13 2867 1 1 8 GLY HA2 H 1.904 0.900 -3.520 1.00 . A A . 8 GLY HA2 1 1 13 2868 1 1 8 GLY HA3 H 1.422 2.394 -2.715 1.00 . A A . 8 GLY HA3 1 1 13 2869 1 1 8 GLY N N 0.707 0.628 -1.802 1.00 . A A . 8 GLY N 1 1 13 2870 1 1 8 GLY O O 4.132 1.375 -2.330 1.00 . A A . 8 GLY O 1 1 13 2871 1 1 9 ILE C C 4.915 0.015 0.232 1.00 . A A . 9 ILE C 1 1 13 2872 1 1 9 ILE CA C 4.203 1.364 0.362 1.00 . A A . 9 ILE CA 1 1 13 2873 1 1 9 ILE CB C 3.721 1.582 1.796 1.00 . A A . 9 ILE CB 1 1 13 2874 1 1 9 ILE CD1 C 2.784 3.287 3.366 1.00 . A A . 9 ILE CD1 1 1 13 2875 1 1 9 ILE CG1 C 3.013 2.936 1.895 1.00 . A A . 9 ILE CG1 1 1 13 2876 1 1 9 ILE CG2 C 4.918 1.564 2.747 1.00 . A A . 9 ILE CG2 1 1 13 2877 1 1 9 ILE H H 2.085 1.366 -0.038 1.00 . A A . 9 ILE H 1 1 13 2878 1 1 9 ILE HA H 4.860 2.168 0.067 1.00 . A A . 9 ILE HA 1 1 13 2879 1 1 9 ILE HB H 3.034 0.794 2.068 1.00 . A A . 9 ILE HB 1 1 13 2880 1 1 9 ILE HD11 H 1.743 3.528 3.520 1.00 . A A . 9 ILE HD11 1 1 13 2881 1 1 9 ILE HD12 H 3.394 4.138 3.631 1.00 . A A . 9 ILE HD12 1 1 13 2882 1 1 9 ILE HD13 H 3.054 2.444 3.984 1.00 . A A . 9 ILE HD13 1 1 13 2883 1 1 9 ILE HG12 H 3.626 3.696 1.433 1.00 . A A . 9 ILE HG12 1 1 13 2884 1 1 9 ILE HG13 H 2.062 2.882 1.387 1.00 . A A . 9 ILE HG13 1 1 13 2885 1 1 9 ILE HG21 H 5.460 0.638 2.627 1.00 . A A . 9 ILE HG21 1 1 13 2886 1 1 9 ILE HG22 H 4.570 1.648 3.766 1.00 . A A . 9 ILE HG22 1 1 13 2887 1 1 9 ILE HG23 H 5.570 2.395 2.520 1.00 . A A . 9 ILE HG23 1 1 13 2888 1 1 9 ILE N N 2.965 1.370 -0.469 1.00 . A A . 9 ILE N 1 1 13 2889 1 1 9 ILE O O 6.086 -0.052 -0.082 1.00 . A A . 9 ILE O 1 1 13 2890 1 1 10 LYS C C 5.398 -2.605 -1.062 1.00 . A A . 10 LYS C 1 1 13 2891 1 1 10 LYS CA C 4.850 -2.403 0.353 1.00 . A A . 10 LYS CA 1 1 13 2892 1 1 10 LYS CB C 3.728 -3.402 0.642 1.00 . A A . 10 LYS CB 1 1 13 2893 1 1 10 LYS CD C 2.701 -4.067 -1.537 1.00 . A A . 10 LYS CD 1 1 13 2894 1 1 10 LYS CE C 2.634 -5.530 -1.092 1.00 . A A . 10 LYS CE 1 1 13 2895 1 1 10 LYS CG C 2.562 -3.154 -0.317 1.00 . A A . 10 LYS CG 1 1 13 2896 1 1 10 LYS H H 3.269 -0.985 0.717 1.00 . A A . 10 LYS H 1 1 13 2897 1 1 10 LYS HA H 5.637 -2.511 1.082 1.00 . A A . 10 LYS HA 1 1 13 2898 1 1 10 LYS HB2 H 4.099 -4.408 0.508 1.00 . A A . 10 LYS HB2 1 1 13 2899 1 1 10 LYS HB3 H 3.388 -3.276 1.659 1.00 . A A . 10 LYS HB3 1 1 13 2900 1 1 10 LYS HD2 H 1.899 -3.863 -2.232 1.00 . A A . 10 LYS HD2 1 1 13 2901 1 1 10 LYS HD3 H 3.650 -3.883 -2.018 1.00 . A A . 10 LYS HD3 1 1 13 2902 1 1 10 LYS HE2 H 3.575 -5.832 -0.655 1.00 . A A . 10 LYS HE2 1 1 13 2903 1 1 10 LYS HE3 H 1.827 -5.673 -0.390 1.00 . A A . 10 LYS HE3 1 1 13 2904 1 1 10 LYS HG2 H 1.630 -3.367 0.188 1.00 . A A . 10 LYS HG2 1 1 13 2905 1 1 10 LYS HG3 H 2.571 -2.124 -0.637 1.00 . A A . 10 LYS HG3 1 1 13 2906 1 1 10 LYS HZ1 H 3.214 -6.287 -2.942 1.00 . A A . 10 LYS HZ1 1 1 13 2907 1 1 10 LYS HZ2 H 1.571 -5.863 -2.851 1.00 . A A . 10 LYS HZ2 1 1 13 2908 1 1 10 LYS HZ3 H 2.129 -7.281 -2.098 1.00 . A A . 10 LYS HZ3 1 1 13 2909 1 1 10 LYS N N 4.214 -1.060 0.468 1.00 . A A . 10 LYS N 1 1 13 2910 1 1 10 LYS NZ N 2.367 -6.298 -2.340 1.00 . A A . 10 LYS NZ 1 1 13 2911 1 1 10 LYS O O 6.330 -3.354 -1.277 1.00 . A A . 10 LYS O 1 1 13 2912 1 1 11 SER C C 6.519 -1.171 -3.666 1.00 . A A . 11 SER C 1 1 13 2913 1 1 11 SER CA C 5.316 -2.088 -3.429 1.00 . A A . 11 SER CA 1 1 13 2914 1 1 11 SER CB C 4.139 -1.668 -4.308 1.00 . A A . 11 SER CB 1 1 13 2915 1 1 11 SER H H 4.078 -1.338 -1.833 1.00 . A A . 11 SER H 1 1 13 2916 1 1 11 SER HA H 5.579 -3.115 -3.629 1.00 . A A . 11 SER HA 1 1 13 2917 1 1 11 SER HB2 H 3.309 -1.377 -3.686 1.00 . A A . 11 SER HB2 1 1 13 2918 1 1 11 SER HB3 H 4.434 -0.831 -4.926 1.00 . A A . 11 SER HB3 1 1 13 2919 1 1 11 SER HG H 3.573 -2.428 -6.007 1.00 . A A . 11 SER HG 1 1 13 2920 1 1 11 SER N N 4.827 -1.939 -2.028 1.00 . A A . 11 SER N 1 1 13 2921 1 1 11 SER O O 7.359 -1.435 -4.503 1.00 . A A . 11 SER O 1 1 13 2922 1 1 11 SER OG O 3.749 -2.764 -5.125 1.00 . A A . 11 SER OG 1 1 13 2923 1 1 12 LEU C C 8.903 0.445 -2.175 1.00 . A A . 12 LEU C 1 1 13 2924 1 1 12 LEU CA C 7.756 0.838 -3.109 1.00 . A A . 12 LEU CA 1 1 13 2925 1 1 12 LEU CB C 7.207 2.215 -2.734 1.00 . A A . 12 LEU CB 1 1 13 2926 1 1 12 LEU CD1 C 5.601 3.477 -4.173 1.00 . A A . 12 LEU CD1 1 1 13 2927 1 1 12 LEU CD2 C 7.929 4.326 -3.857 1.00 . A A . 12 LEU CD2 1 1 13 2928 1 1 12 LEU CG C 7.065 3.070 -3.994 1.00 . A A . 12 LEU CG 1 1 13 2929 1 1 12 LEU H H 5.920 0.095 -2.260 1.00 . A A . 12 LEU H 1 1 13 2930 1 1 12 LEU HA H 8.087 0.839 -4.136 1.00 . A A . 12 LEU HA 1 1 13 2931 1 1 12 LEU HB2 H 6.241 2.102 -2.265 1.00 . A A . 12 LEU HB2 1 1 13 2932 1 1 12 LEU HB3 H 7.887 2.699 -2.049 1.00 . A A . 12 LEU HB3 1 1 13 2933 1 1 12 LEU HD11 H 5.112 2.779 -4.836 1.00 . A A . 12 LEU HD11 1 1 13 2934 1 1 12 LEU HD12 H 5.553 4.470 -4.595 1.00 . A A . 12 LEU HD12 1 1 13 2935 1 1 12 LEU HD13 H 5.106 3.469 -3.213 1.00 . A A . 12 LEU HD13 1 1 13 2936 1 1 12 LEU HD21 H 8.670 4.341 -4.642 1.00 . A A . 12 LEU HD21 1 1 13 2937 1 1 12 LEU HD22 H 8.423 4.320 -2.896 1.00 . A A . 12 LEU HD22 1 1 13 2938 1 1 12 LEU HD23 H 7.304 5.203 -3.935 1.00 . A A . 12 LEU HD23 1 1 13 2939 1 1 12 LEU HG H 7.388 2.501 -4.854 1.00 . A A . 12 LEU HG 1 1 13 2940 1 1 12 LEU N N 6.608 -0.097 -2.931 1.00 . A A . 12 LEU N 1 1 13 2941 1 1 12 LEU O O 10.035 0.844 -2.363 1.00 . A A . 12 LEU O 1 1 13 2942 1 1 13 PHE C C 9.967 -2.250 -0.362 1.00 . A A . 13 PHE C 1 1 13 2943 1 1 13 PHE CA C 9.688 -0.751 -0.218 1.00 . A A . 13 PHE CA 1 1 13 2944 1 1 13 PHE CB C 9.129 -0.440 1.170 1.00 . A A . 13 PHE CB 1 1 13 2945 1 1 13 PHE CD1 C 11.133 1.040 1.526 1.00 . A A . 13 PHE CD1 1 1 13 2946 1 1 13 PHE CD2 C 10.364 -0.341 3.364 1.00 . A A . 13 PHE CD2 1 1 13 2947 1 1 13 PHE CE1 C 12.161 1.539 2.330 1.00 . A A . 13 PHE CE1 1 1 13 2948 1 1 13 PHE CE2 C 11.394 0.160 4.170 1.00 . A A . 13 PHE CE2 1 1 13 2949 1 1 13 PHE CG C 10.234 0.100 2.042 1.00 . A A . 13 PHE CG 1 1 13 2950 1 1 13 PHE CZ C 12.293 1.100 3.653 1.00 . A A . 13 PHE CZ 1 1 13 2951 1 1 13 PHE H H 7.696 -0.642 -1.034 1.00 . A A . 13 PHE H 1 1 13 2952 1 1 13 PHE HA H 10.588 -0.181 -0.389 1.00 . A A . 13 PHE HA 1 1 13 2953 1 1 13 PHE HB2 H 8.342 0.296 1.085 1.00 . A A . 13 PHE HB2 1 1 13 2954 1 1 13 PHE HB3 H 8.732 -1.343 1.610 1.00 . A A . 13 PHE HB3 1 1 13 2955 1 1 13 PHE HD1 H 11.031 1.382 0.507 1.00 . A A . 13 PHE HD1 1 1 13 2956 1 1 13 PHE HD2 H 9.670 -1.067 3.763 1.00 . A A . 13 PHE HD2 1 1 13 2957 1 1 13 PHE HE1 H 12.853 2.263 1.928 1.00 . A A . 13 PHE HE1 1 1 13 2958 1 1 13 PHE HE2 H 11.495 -0.180 5.191 1.00 . A A . 13 PHE HE2 1 1 13 2959 1 1 13 PHE HZ H 13.088 1.486 4.274 1.00 . A A . 13 PHE HZ 1 1 13 2960 1 1 13 PHE N N 8.616 -0.333 -1.167 1.00 . A A . 13 PHE N 1 1 13 2961 1 1 13 PHE O O 9.075 -3.065 -0.231 1.00 . A A . 13 PHE O 1 1 13 2962 1 1 14 NH2 HN1 H 11.900 -1.994 -0.733 1.00 . A A . 14 NH2 HN1 1 1 13 2963 1 1 14 NH2 HN2 H 11.371 -3.607 -0.721 1.00 . A A . 14 NH2 HN2 1 1 13 2964 1 1 14 NH2 N N 11.180 -2.650 -0.627 1.00 . A A . 14 NH2 N 1 1 14 2965 1 1 1 ILE C C -9.552 -0.286 1.769 1.00 . A A . 1 ILE C 1 1 14 2966 1 1 1 ILE CA C -10.215 0.371 0.555 1.00 . A A . 1 ILE CA 1 1 14 2967 1 1 1 ILE CB C -10.503 1.846 0.834 1.00 . A A . 1 ILE CB 1 1 14 2968 1 1 1 ILE CD1 C -9.160 3.626 -0.296 1.00 . A A . 1 ILE CD1 1 1 14 2969 1 1 1 ILE CG1 C -9.185 2.625 0.862 1.00 . A A . 1 ILE CG1 1 1 14 2970 1 1 1 ILE CG2 C -11.203 1.984 2.186 1.00 . A A . 1 ILE CG2 1 1 14 2971 1 1 1 ILE H1 H -11.736 -0.264 -0.719 1.00 . A A . 1 ILE H1 1 1 14 2972 1 1 1 ILE H2 H -12.286 0.323 0.777 1.00 . A A . 1 ILE H2 1 1 14 2973 1 1 1 ILE H3 H -11.564 -1.211 0.678 1.00 . A A . 1 ILE H3 1 1 14 2974 1 1 1 ILE HA H -9.587 0.277 -0.316 1.00 . A A . 1 ILE HA 1 1 14 2975 1 1 1 ILE HB H -11.141 2.242 0.057 1.00 . A A . 1 ILE HB 1 1 14 2976 1 1 1 ILE HD11 H -8.732 3.156 -1.168 1.00 . A A . 1 ILE HD11 1 1 14 2977 1 1 1 ILE HD12 H -8.564 4.483 -0.018 1.00 . A A . 1 ILE HD12 1 1 14 2978 1 1 1 ILE HD13 H -10.169 3.945 -0.517 1.00 . A A . 1 ILE HD13 1 1 14 2979 1 1 1 ILE HG12 H -9.101 3.156 1.799 1.00 . A A . 1 ILE HG12 1 1 14 2980 1 1 1 ILE HG13 H -8.359 1.939 0.759 1.00 . A A . 1 ILE HG13 1 1 14 2981 1 1 1 ILE HG21 H -12.125 2.531 2.061 1.00 . A A . 1 ILE HG21 1 1 14 2982 1 1 1 ILE HG22 H -10.559 2.516 2.873 1.00 . A A . 1 ILE HG22 1 1 14 2983 1 1 1 ILE HG23 H -11.418 1.002 2.582 1.00 . A A . 1 ILE HG23 1 1 14 2984 1 1 1 ILE N N -11.551 -0.242 0.304 1.00 . A A . 1 ILE N 1 1 14 2985 1 1 1 ILE O O -9.121 0.381 2.689 1.00 . A A . 1 ILE O 1 1 14 2986 1 1 2 LEU C C -7.426 -1.732 3.175 1.00 . A A . 2 LEU C 1 1 14 2987 1 1 2 LEU CA C -8.833 -2.285 2.933 1.00 . A A . 2 LEU CA 1 1 14 2988 1 1 2 LEU CB C -8.767 -3.756 2.522 1.00 . A A . 2 LEU CB 1 1 14 2989 1 1 2 LEU CD1 C -10.424 -5.329 3.532 1.00 . A A . 2 LEU CD1 1 1 14 2990 1 1 2 LEU CD2 C -7.979 -5.695 3.885 1.00 . A A . 2 LEU CD2 1 1 14 2991 1 1 2 LEU CG C -9.075 -4.638 3.734 1.00 . A A . 2 LEU CG 1 1 14 2992 1 1 2 LEU H H -9.822 -2.107 1.026 1.00 . A A . 2 LEU H 1 1 14 2993 1 1 2 LEU HA H -9.437 -2.175 3.818 1.00 . A A . 2 LEU HA 1 1 14 2994 1 1 2 LEU HB2 H -9.494 -3.944 1.745 1.00 . A A . 2 LEU HB2 1 1 14 2995 1 1 2 LEU HB3 H -7.779 -3.984 2.155 1.00 . A A . 2 LEU HB3 1 1 14 2996 1 1 2 LEU HD11 H -10.491 -6.186 4.186 1.00 . A A . 2 LEU HD11 1 1 14 2997 1 1 2 LEU HD12 H -10.514 -5.652 2.506 1.00 . A A . 2 LEU HD12 1 1 14 2998 1 1 2 LEU HD13 H -11.221 -4.638 3.763 1.00 . A A . 2 LEU HD13 1 1 14 2999 1 1 2 LEU HD21 H -7.313 -5.410 4.686 1.00 . A A . 2 LEU HD21 1 1 14 3000 1 1 2 LEU HD22 H -7.422 -5.770 2.963 1.00 . A A . 2 LEU HD22 1 1 14 3001 1 1 2 LEU HD23 H -8.429 -6.650 4.112 1.00 . A A . 2 LEU HD23 1 1 14 3002 1 1 2 LEU HG H -9.114 -4.026 4.623 1.00 . A A . 2 LEU HG 1 1 14 3003 1 1 2 LEU N N -9.467 -1.588 1.778 1.00 . A A . 2 LEU N 1 1 14 3004 1 1 2 LEU O O -6.933 -1.725 4.285 1.00 . A A . 2 LEU O 1 1 14 3005 1 1 3 GLY C C -4.879 -0.234 0.962 1.00 . A A . 3 GLY C 1 1 14 3006 1 1 3 GLY CA C -5.404 -0.714 2.312 1.00 . A A . 3 GLY CA 1 1 14 3007 1 1 3 GLY H H -7.195 -1.282 1.258 1.00 . A A . 3 GLY H 1 1 14 3008 1 1 3 GLY HA2 H -5.433 0.114 3.005 1.00 . A A . 3 GLY HA2 1 1 14 3009 1 1 3 GLY HA3 H -4.751 -1.479 2.694 1.00 . A A . 3 GLY HA3 1 1 14 3010 1 1 3 GLY N N -6.778 -1.267 2.144 1.00 . A A . 3 GLY N 1 1 14 3011 1 1 3 GLY O O -3.790 -0.580 0.549 1.00 . A A . 3 GLY O 1 1 14 3012 1 1 4 LYS C C -3.930 1.936 -0.849 1.00 . A A . 4 LYS C 1 1 14 3013 1 1 4 LYS CA C -5.178 1.079 -1.045 1.00 . A A . 4 LYS CA 1 1 14 3014 1 1 4 LYS CB C -6.339 1.923 -1.575 1.00 . A A . 4 LYS CB 1 1 14 3015 1 1 4 LYS CD C -5.192 1.723 -3.786 1.00 . A A . 4 LYS CD 1 1 14 3016 1 1 4 LYS CE C -5.425 1.777 -5.297 1.00 . A A . 4 LYS CE 1 1 14 3017 1 1 4 LYS CG C -6.538 1.637 -3.065 1.00 . A A . 4 LYS CG 1 1 14 3018 1 1 4 LYS H H -6.508 0.841 0.633 1.00 . A A . 4 LYS H 1 1 14 3019 1 1 4 LYS HA H -4.974 0.261 -1.717 1.00 . A A . 4 LYS HA 1 1 14 3020 1 1 4 LYS HB2 H -7.240 1.673 -1.035 1.00 . A A . 4 LYS HB2 1 1 14 3021 1 1 4 LYS HB3 H -6.114 2.970 -1.438 1.00 . A A . 4 LYS HB3 1 1 14 3022 1 1 4 LYS HD2 H -4.671 2.616 -3.469 1.00 . A A . 4 LYS HD2 1 1 14 3023 1 1 4 LYS HD3 H -4.598 0.855 -3.545 1.00 . A A . 4 LYS HD3 1 1 14 3024 1 1 4 LYS HE2 H -4.846 1.009 -5.792 1.00 . A A . 4 LYS HE2 1 1 14 3025 1 1 4 LYS HE3 H -6.474 1.663 -5.521 1.00 . A A . 4 LYS HE3 1 1 14 3026 1 1 4 LYS HG2 H -6.951 0.646 -3.189 1.00 . A A . 4 LYS HG2 1 1 14 3027 1 1 4 LYS HG3 H -7.216 2.365 -3.483 1.00 . A A . 4 LYS HG3 1 1 14 3028 1 1 4 LYS HZ1 H -4.008 3.302 -5.329 1.00 . A A . 4 LYS HZ1 1 1 14 3029 1 1 4 LYS HZ2 H -5.616 3.849 -5.344 1.00 . A A . 4 LYS HZ2 1 1 14 3030 1 1 4 LYS HZ3 H -4.928 3.184 -6.748 1.00 . A A . 4 LYS HZ3 1 1 14 3031 1 1 4 LYS N N -5.640 0.569 0.276 1.00 . A A . 4 LYS N 1 1 14 3032 1 1 4 LYS NZ N -4.960 3.130 -5.711 1.00 . A A . 4 LYS NZ 1 1 14 3033 1 1 4 LYS O O -3.036 1.956 -1.671 1.00 . A A . 4 LYS O 1 1 14 3034 1 1 5 ILE C C -1.514 2.612 0.997 1.00 . A A . 5 ILE C 1 1 14 3035 1 1 5 ILE CA C -2.676 3.487 0.524 1.00 . A A . 5 ILE CA 1 1 14 3036 1 1 5 ILE CB C -3.128 4.431 1.636 1.00 . A A . 5 ILE CB 1 1 14 3037 1 1 5 ILE CD1 C -3.338 6.483 0.217 1.00 . A A . 5 ILE CD1 1 1 14 3038 1 1 5 ILE CG1 C -4.104 5.462 1.061 1.00 . A A . 5 ILE CG1 1 1 14 3039 1 1 5 ILE CG2 C -1.913 5.147 2.229 1.00 . A A . 5 ILE CG2 1 1 14 3040 1 1 5 ILE H H -4.596 2.593 0.897 1.00 . A A . 5 ILE H 1 1 14 3041 1 1 5 ILE HA H -2.399 4.050 -0.352 1.00 . A A . 5 ILE HA 1 1 14 3042 1 1 5 ILE HB H -3.622 3.858 2.409 1.00 . A A . 5 ILE HB 1 1 14 3043 1 1 5 ILE HD11 H -3.220 7.397 0.778 1.00 . A A . 5 ILE HD11 1 1 14 3044 1 1 5 ILE HD12 H -3.890 6.685 -0.689 1.00 . A A . 5 ILE HD12 1 1 14 3045 1 1 5 ILE HD13 H -2.366 6.085 -0.034 1.00 . A A . 5 ILE HD13 1 1 14 3046 1 1 5 ILE HG12 H -4.835 4.960 0.445 1.00 . A A . 5 ILE HG12 1 1 14 3047 1 1 5 ILE HG13 H -4.607 5.970 1.871 1.00 . A A . 5 ILE HG13 1 1 14 3048 1 1 5 ILE HG21 H -1.036 4.906 1.647 1.00 . A A . 5 ILE HG21 1 1 14 3049 1 1 5 ILE HG22 H -1.768 4.826 3.250 1.00 . A A . 5 ILE HG22 1 1 14 3050 1 1 5 ILE HG23 H -2.078 6.215 2.205 1.00 . A A . 5 ILE HG23 1 1 14 3051 1 1 5 ILE N N -3.864 2.636 0.248 1.00 . A A . 5 ILE N 1 1 14 3052 1 1 5 ILE O O -0.359 2.914 0.769 1.00 . A A . 5 ILE O 1 1 14 3053 1 1 6 TRP C C -0.213 -0.235 0.981 1.00 . A A . 6 TRP C 1 1 14 3054 1 1 6 TRP CA C -0.733 0.621 2.138 1.00 . A A . 6 TRP CA 1 1 14 3055 1 1 6 TRP CB C -1.398 -0.254 3.201 1.00 . A A . 6 TRP CB 1 1 14 3056 1 1 6 TRP CD1 C -0.718 -2.688 3.218 1.00 . A A . 6 TRP CD1 1 1 14 3057 1 1 6 TRP CD2 C 0.764 -1.370 4.280 1.00 . A A . 6 TRP CD2 1 1 14 3058 1 1 6 TRP CE2 C 1.262 -2.692 4.364 1.00 . A A . 6 TRP CE2 1 1 14 3059 1 1 6 TRP CE3 C 1.515 -0.339 4.873 1.00 . A A . 6 TRP CE3 1 1 14 3060 1 1 6 TRP CG C -0.494 -1.395 3.547 1.00 . A A . 6 TRP CG 1 1 14 3061 1 1 6 TRP CH2 C 3.197 -1.945 5.599 1.00 . A A . 6 TRP CH2 1 1 14 3062 1 1 6 TRP CZ2 C 2.464 -2.980 5.014 1.00 . A A . 6 TRP CZ2 1 1 14 3063 1 1 6 TRP CZ3 C 2.724 -0.627 5.528 1.00 . A A . 6 TRP CZ3 1 1 14 3064 1 1 6 TRP H H -2.754 1.299 1.821 1.00 . A A . 6 TRP H 1 1 14 3065 1 1 6 TRP HA H 0.068 1.193 2.576 1.00 . A A . 6 TRP HA 1 1 14 3066 1 1 6 TRP HB2 H -1.585 0.336 4.086 1.00 . A A . 6 TRP HB2 1 1 14 3067 1 1 6 TRP HB3 H -2.332 -0.638 2.819 1.00 . A A . 6 TRP HB3 1 1 14 3068 1 1 6 TRP HD1 H -1.571 -3.058 2.668 1.00 . A A . 6 TRP HD1 1 1 14 3069 1 1 6 TRP HE1 H 0.404 -4.429 3.599 1.00 . A A . 6 TRP HE1 1 1 14 3070 1 1 6 TRP HE3 H 1.160 0.680 4.824 1.00 . A A . 6 TRP HE3 1 1 14 3071 1 1 6 TRP HH2 H 4.127 -2.159 6.104 1.00 . A A . 6 TRP HH2 1 1 14 3072 1 1 6 TRP HZ2 H 2.823 -3.998 5.065 1.00 . A A . 6 TRP HZ2 1 1 14 3073 1 1 6 TRP HZ3 H 3.293 0.172 5.981 1.00 . A A . 6 TRP HZ3 1 1 14 3074 1 1 6 TRP N N -1.815 1.524 1.653 1.00 . A A . 6 TRP N 1 1 14 3075 1 1 6 TRP NE1 N 0.324 -3.458 3.702 1.00 . A A . 6 TRP NE1 1 1 14 3076 1 1 6 TRP O O 0.924 -0.663 0.974 1.00 . A A . 6 TRP O 1 1 14 3077 1 1 7 GLU C C 0.544 -0.587 -1.898 1.00 . A A . 7 GLU C 1 1 14 3078 1 1 7 GLU CA C -0.588 -1.303 -1.160 1.00 . A A . 7 GLU CA 1 1 14 3079 1 1 7 GLU CB C -1.819 -1.430 -2.059 1.00 . A A . 7 GLU CB 1 1 14 3080 1 1 7 GLU CD C -1.983 -3.922 -2.142 1.00 . A A . 7 GLU CD 1 1 14 3081 1 1 7 GLU CG C -2.645 -2.643 -1.626 1.00 . A A . 7 GLU CG 1 1 14 3082 1 1 7 GLU H H -1.949 -0.122 0.022 1.00 . A A . 7 GLU H 1 1 14 3083 1 1 7 GLU HA H -0.268 -2.278 -0.831 1.00 . A A . 7 GLU HA 1 1 14 3084 1 1 7 GLU HB2 H -2.420 -0.535 -1.973 1.00 . A A . 7 GLU HB2 1 1 14 3085 1 1 7 GLU HB3 H -1.505 -1.557 -3.084 1.00 . A A . 7 GLU HB3 1 1 14 3086 1 1 7 GLU HG2 H -2.701 -2.675 -0.547 1.00 . A A . 7 GLU HG2 1 1 14 3087 1 1 7 GLU HG3 H -3.640 -2.565 -2.036 1.00 . A A . 7 GLU HG3 1 1 14 3088 1 1 7 GLU N N -1.037 -0.481 0.000 1.00 . A A . 7 GLU N 1 1 14 3089 1 1 7 GLU O O 1.418 -1.207 -2.470 1.00 . A A . 7 GLU O 1 1 14 3090 1 1 7 GLU OE1 O -0.809 -3.867 -2.469 1.00 . A A . 7 GLU OE1 1 1 14 3091 1 1 7 GLU OE2 O -2.661 -4.935 -2.201 1.00 . A A . 7 GLU OE2 1 1 14 3092 1 1 8 GLY C C 2.846 1.542 -1.677 1.00 . A A . 8 GLY C 1 1 14 3093 1 1 8 GLY CA C 1.612 1.479 -2.577 1.00 . A A . 8 GLY CA 1 1 14 3094 1 1 8 GLY H H -0.178 1.195 -1.412 1.00 . A A . 8 GLY H 1 1 14 3095 1 1 8 GLY HA2 H 1.863 0.983 -3.503 1.00 . A A . 8 GLY HA2 1 1 14 3096 1 1 8 GLY HA3 H 1.269 2.480 -2.784 1.00 . A A . 8 GLY HA3 1 1 14 3097 1 1 8 GLY N N 0.535 0.718 -1.882 1.00 . A A . 8 GLY N 1 1 14 3098 1 1 8 GLY O O 3.964 1.614 -2.145 1.00 . A A . 8 GLY O 1 1 14 3099 1 1 9 ILE C C 4.642 0.284 0.421 1.00 . A A . 9 ILE C 1 1 14 3100 1 1 9 ILE CA C 3.815 1.565 0.544 1.00 . A A . 9 ILE CA 1 1 14 3101 1 1 9 ILE CB C 3.203 1.674 1.940 1.00 . A A . 9 ILE CB 1 1 14 3102 1 1 9 ILE CD1 C 2.220 3.279 3.585 1.00 . A A . 9 ILE CD1 1 1 14 3103 1 1 9 ILE CG1 C 2.572 3.058 2.112 1.00 . A A . 9 ILE CG1 1 1 14 3104 1 1 9 ILE CG2 C 4.296 1.478 2.992 1.00 . A A . 9 ILE CG2 1 1 14 3105 1 1 9 ILE H H 1.740 1.449 -0.030 1.00 . A A . 9 ILE H 1 1 14 3106 1 1 9 ILE HA H 4.423 2.430 0.338 1.00 . A A . 9 ILE HA 1 1 14 3107 1 1 9 ILE HB H 2.446 0.913 2.061 1.00 . A A . 9 ILE HB 1 1 14 3108 1 1 9 ILE HD11 H 1.341 3.901 3.656 1.00 . A A . 9 ILE HD11 1 1 14 3109 1 1 9 ILE HD12 H 3.046 3.764 4.084 1.00 . A A . 9 ILE HD12 1 1 14 3110 1 1 9 ILE HD13 H 2.026 2.326 4.056 1.00 . A A . 9 ILE HD13 1 1 14 3111 1 1 9 ILE HG12 H 3.272 3.815 1.792 1.00 . A A . 9 ILE HG12 1 1 14 3112 1 1 9 ILE HG13 H 1.675 3.121 1.517 1.00 . A A . 9 ILE HG13 1 1 14 3113 1 1 9 ILE HG21 H 5.232 1.253 2.502 1.00 . A A . 9 ILE HG21 1 1 14 3114 1 1 9 ILE HG22 H 4.026 0.661 3.644 1.00 . A A . 9 ILE HG22 1 1 14 3115 1 1 9 ILE HG23 H 4.402 2.382 3.573 1.00 . A A . 9 ILE HG23 1 1 14 3116 1 1 9 ILE N N 2.650 1.510 -0.387 1.00 . A A . 9 ILE N 1 1 14 3117 1 1 9 ILE O O 5.811 0.317 0.089 1.00 . A A . 9 ILE O 1 1 14 3118 1 1 10 LYS C C 5.270 -2.344 -0.861 1.00 . A A . 10 LYS C 1 1 14 3119 1 1 10 LYS CA C 4.798 -2.129 0.579 1.00 . A A . 10 LYS CA 1 1 14 3120 1 1 10 LYS CB C 3.796 -3.212 0.983 1.00 . A A . 10 LYS CB 1 1 14 3121 1 1 10 LYS CD C 3.113 -4.379 -1.119 1.00 . A A . 10 LYS CD 1 1 14 3122 1 1 10 LYS CE C 2.607 -5.752 -0.674 1.00 . A A . 10 LYS CE 1 1 14 3123 1 1 10 LYS CG C 2.708 -3.325 -0.088 1.00 . A A . 10 LYS CG 1 1 14 3124 1 1 10 LYS H H 3.102 -0.852 0.949 1.00 . A A . 10 LYS H 1 1 14 3125 1 1 10 LYS HA H 5.637 -2.132 1.257 1.00 . A A . 10 LYS HA 1 1 14 3126 1 1 10 LYS HB2 H 4.309 -4.158 1.078 1.00 . A A . 10 LYS HB2 1 1 14 3127 1 1 10 LYS HB3 H 3.344 -2.951 1.928 1.00 . A A . 10 LYS HB3 1 1 14 3128 1 1 10 LYS HD2 H 2.682 -4.128 -2.077 1.00 . A A . 10 LYS HD2 1 1 14 3129 1 1 10 LYS HD3 H 4.190 -4.404 -1.205 1.00 . A A . 10 LYS HD3 1 1 14 3130 1 1 10 LYS HE2 H 2.339 -5.731 0.373 1.00 . A A . 10 LYS HE2 1 1 14 3131 1 1 10 LYS HE3 H 1.765 -6.056 -1.275 1.00 . A A . 10 LYS HE3 1 1 14 3132 1 1 10 LYS HG2 H 1.776 -3.615 0.377 1.00 . A A . 10 LYS HG2 1 1 14 3133 1 1 10 LYS HG3 H 2.585 -2.371 -0.578 1.00 . A A . 10 LYS HG3 1 1 14 3134 1 1 10 LYS HZ1 H 3.687 -7.479 -0.244 1.00 . A A . 10 LYS HZ1 1 1 14 3135 1 1 10 LYS HZ2 H 4.647 -6.165 -0.736 1.00 . A A . 10 LYS HZ2 1 1 14 3136 1 1 10 LYS HZ3 H 3.730 -7.027 -1.878 1.00 . A A . 10 LYS HZ3 1 1 14 3137 1 1 10 LYS N N 4.045 -0.847 0.685 1.00 . A A . 10 LYS N 1 1 14 3138 1 1 10 LYS NZ N 3.754 -6.675 -0.900 1.00 . A A . 10 LYS NZ 1 1 14 3139 1 1 10 LYS O O 6.232 -3.043 -1.112 1.00 . A A . 10 LYS O 1 1 14 3140 1 1 11 SER C C 6.185 -0.983 -3.555 1.00 . A A . 11 SER C 1 1 14 3141 1 1 11 SER CA C 5.013 -1.912 -3.232 1.00 . A A . 11 SER CA 1 1 14 3142 1 1 11 SER CB C 3.781 -1.523 -4.048 1.00 . A A . 11 SER CB 1 1 14 3143 1 1 11 SER H H 3.830 -1.185 -1.584 1.00 . A A . 11 SER H 1 1 14 3144 1 1 11 SER HA H 5.277 -2.938 -3.430 1.00 . A A . 11 SER HA 1 1 14 3145 1 1 11 SER HB2 H 3.137 -2.379 -4.164 1.00 . A A . 11 SER HB2 1 1 14 3146 1 1 11 SER HB3 H 3.242 -0.737 -3.534 1.00 . A A . 11 SER HB3 1 1 14 3147 1 1 11 SER HG H 4.336 -0.122 -5.281 1.00 . A A . 11 SER HG 1 1 14 3148 1 1 11 SER N N 4.602 -1.745 -1.809 1.00 . A A . 11 SER N 1 1 14 3149 1 1 11 SER O O 6.958 -1.233 -4.459 1.00 . A A . 11 SER O 1 1 14 3150 1 1 11 SER OG O 4.192 -1.071 -5.332 1.00 . A A . 11 SER OG 1 1 14 3151 1 1 12 LEU C C 8.757 0.461 -2.535 1.00 . A A . 12 LEU C 1 1 14 3152 1 1 12 LEU CA C 7.448 1.032 -3.084 1.00 . A A . 12 LEU CA 1 1 14 3153 1 1 12 LEU CB C 7.070 2.316 -2.345 1.00 . A A . 12 LEU CB 1 1 14 3154 1 1 12 LEU CD1 C 5.238 4.001 -2.555 1.00 . A A . 12 LEU CD1 1 1 14 3155 1 1 12 LEU CD2 C 7.350 4.285 -3.856 1.00 . A A . 12 LEU CD2 1 1 14 3156 1 1 12 LEU CG C 6.350 3.265 -3.304 1.00 . A A . 12 LEU CG 1 1 14 3157 1 1 12 LEU H H 5.691 0.271 -2.096 1.00 . A A . 12 LEU H 1 1 14 3158 1 1 12 LEU HA H 7.536 1.227 -4.141 1.00 . A A . 12 LEU HA 1 1 14 3159 1 1 12 LEU HB2 H 6.418 2.074 -1.517 1.00 . A A . 12 LEU HB2 1 1 14 3160 1 1 12 LEU HB3 H 7.964 2.792 -1.972 1.00 . A A . 12 LEU HB3 1 1 14 3161 1 1 12 LEU HD11 H 5.330 3.811 -1.496 1.00 . A A . 12 LEU HD11 1 1 14 3162 1 1 12 LEU HD12 H 4.278 3.648 -2.901 1.00 . A A . 12 LEU HD12 1 1 14 3163 1 1 12 LEU HD13 H 5.319 5.062 -2.739 1.00 . A A . 12 LEU HD13 1 1 14 3164 1 1 12 LEU HD21 H 8.049 4.561 -3.080 1.00 . A A . 12 LEU HD21 1 1 14 3165 1 1 12 LEU HD22 H 6.819 5.163 -4.191 1.00 . A A . 12 LEU HD22 1 1 14 3166 1 1 12 LEU HD23 H 7.887 3.850 -4.686 1.00 . A A . 12 LEU HD23 1 1 14 3167 1 1 12 LEU HG H 5.923 2.699 -4.118 1.00 . A A . 12 LEU HG 1 1 14 3168 1 1 12 LEU N N 6.325 0.088 -2.821 1.00 . A A . 12 LEU N 1 1 14 3169 1 1 12 LEU O O 9.830 0.759 -3.023 1.00 . A A . 12 LEU O 1 1 14 3170 1 1 13 PHE C C 10.299 -2.226 -1.698 1.00 . A A . 13 PHE C 1 1 14 3171 1 1 13 PHE CA C 9.919 -0.951 -0.942 1.00 . A A . 13 PHE CA 1 1 14 3172 1 1 13 PHE CB C 9.562 -1.273 0.509 1.00 . A A . 13 PHE CB 1 1 14 3173 1 1 13 PHE CD1 C 11.401 0.304 1.192 1.00 . A A . 13 PHE CD1 1 1 14 3174 1 1 13 PHE CD2 C 11.116 -1.758 2.434 1.00 . A A . 13 PHE CD2 1 1 14 3175 1 1 13 PHE CE1 C 12.477 0.652 2.013 1.00 . A A . 13 PHE CE1 1 1 14 3176 1 1 13 PHE CE2 C 12.192 -1.410 3.258 1.00 . A A . 13 PHE CE2 1 1 14 3177 1 1 13 PHE CG C 10.720 -0.900 1.401 1.00 . A A . 13 PHE CG 1 1 14 3178 1 1 13 PHE CZ C 12.874 -0.205 3.047 1.00 . A A . 13 PHE CZ 1 1 14 3179 1 1 13 PHE H H 7.804 -0.587 -1.146 1.00 . A A . 13 PHE H 1 1 14 3180 1 1 13 PHE HA H 10.728 -0.237 -0.974 1.00 . A A . 13 PHE HA 1 1 14 3181 1 1 13 PHE HB2 H 8.687 -0.710 0.799 1.00 . A A . 13 PHE HB2 1 1 14 3182 1 1 13 PHE HB3 H 9.360 -2.329 0.605 1.00 . A A . 13 PHE HB3 1 1 14 3183 1 1 13 PHE HD1 H 11.096 0.966 0.396 1.00 . A A . 13 PHE HD1 1 1 14 3184 1 1 13 PHE HD2 H 10.590 -2.687 2.596 1.00 . A A . 13 PHE HD2 1 1 14 3185 1 1 13 PHE HE1 H 13.001 1.580 1.848 1.00 . A A . 13 PHE HE1 1 1 14 3186 1 1 13 PHE HE2 H 12.498 -2.071 4.056 1.00 . A A . 13 PHE HE2 1 1 14 3187 1 1 13 PHE HZ H 13.705 0.064 3.682 1.00 . A A . 13 PHE HZ 1 1 14 3188 1 1 13 PHE N N 8.679 -0.359 -1.524 1.00 . A A . 13 PHE N 1 1 14 3189 1 1 13 PHE O O 11.457 -2.461 -1.982 1.00 . A A . 13 PHE O 1 1 14 3190 1 1 14 NH2 HN1 H 8.429 -2.882 -1.811 1.00 . A A . 14 NH2 HN1 1 1 14 3191 1 1 14 NH2 HN2 H 9.595 -3.889 -2.523 1.00 . A A . 14 NH2 HN2 1 1 14 3192 1 1 14 NH2 N N 9.363 -3.069 -2.039 1.00 . A A . 14 NH2 N 1 1 15 3193 1 1 1 ILE C C -8.904 -2.237 1.934 1.00 . A A . 1 ILE C 1 1 15 3194 1 1 1 ILE CA C -9.582 -2.305 0.562 1.00 . A A . 1 ILE CA 1 1 15 3195 1 1 1 ILE CB C -8.600 -2.811 -0.495 1.00 . A A . 1 ILE CB 1 1 15 3196 1 1 1 ILE CD1 C -8.277 -3.215 -2.939 1.00 . A A . 1 ILE CD1 1 1 15 3197 1 1 1 ILE CG1 C -9.204 -2.606 -1.887 1.00 . A A . 1 ILE CG1 1 1 15 3198 1 1 1 ILE CG2 C -8.330 -4.300 -0.272 1.00 . A A . 1 ILE CG2 1 1 15 3199 1 1 1 ILE H1 H -10.714 -1.010 -0.612 1.00 . A A . 1 ILE H1 1 1 15 3200 1 1 1 ILE H2 H -9.137 -0.462 -0.299 1.00 . A A . 1 ILE H2 1 1 15 3201 1 1 1 ILE H3 H -10.322 -0.391 0.917 1.00 . A A . 1 ILE H3 1 1 15 3202 1 1 1 ILE HA H -10.446 -2.949 0.601 1.00 . A A . 1 ILE HA 1 1 15 3203 1 1 1 ILE HB H -7.673 -2.262 -0.417 1.00 . A A . 1 ILE HB 1 1 15 3204 1 1 1 ILE HD11 H -8.019 -2.463 -3.670 1.00 . A A . 1 ILE HD11 1 1 15 3205 1 1 1 ILE HD12 H -8.778 -4.037 -3.430 1.00 . A A . 1 ILE HD12 1 1 15 3206 1 1 1 ILE HD13 H -7.377 -3.576 -2.462 1.00 . A A . 1 ILE HD13 1 1 15 3207 1 1 1 ILE HG12 H -10.170 -3.089 -1.934 1.00 . A A . 1 ILE HG12 1 1 15 3208 1 1 1 ILE HG13 H -9.318 -1.550 -2.077 1.00 . A A . 1 ILE HG13 1 1 15 3209 1 1 1 ILE HG21 H -9.241 -4.789 0.042 1.00 . A A . 1 ILE HG21 1 1 15 3210 1 1 1 ILE HG22 H -7.577 -4.419 0.494 1.00 . A A . 1 ILE HG22 1 1 15 3211 1 1 1 ILE HG23 H -7.982 -4.746 -1.191 1.00 . A A . 1 ILE HG23 1 1 15 3212 1 1 1 ILE N N -9.967 -0.939 0.108 1.00 . A A . 1 ILE N 1 1 15 3213 1 1 1 ILE O O -8.697 -1.172 2.482 1.00 . A A . 1 ILE O 1 1 15 3214 1 1 2 LEU C C -6.773 -2.324 3.863 1.00 . A A . 2 LEU C 1 1 15 3215 1 1 2 LEU CA C -7.897 -3.364 3.829 1.00 . A A . 2 LEU CA 1 1 15 3216 1 1 2 LEU CB C -7.329 -4.775 3.987 1.00 . A A . 2 LEU CB 1 1 15 3217 1 1 2 LEU CD1 C -6.732 -6.280 5.889 1.00 . A A . 2 LEU CD1 1 1 15 3218 1 1 2 LEU CD2 C -5.083 -4.597 5.062 1.00 . A A . 2 LEU CD2 1 1 15 3219 1 1 2 LEU CG C -6.567 -4.875 5.309 1.00 . A A . 2 LEU CG 1 1 15 3220 1 1 2 LEU H H -8.736 -4.212 2.034 1.00 . A A . 2 LEU H 1 1 15 3221 1 1 2 LEU HA H -8.617 -3.167 4.607 1.00 . A A . 2 LEU HA 1 1 15 3222 1 1 2 LEU HB2 H -8.139 -5.491 3.982 1.00 . A A . 2 LEU HB2 1 1 15 3223 1 1 2 LEU HB3 H -6.656 -4.986 3.170 1.00 . A A . 2 LEU HB3 1 1 15 3224 1 1 2 LEU HD11 H -6.034 -6.419 6.701 1.00 . A A . 2 LEU HD11 1 1 15 3225 1 1 2 LEU HD12 H -6.541 -7.013 5.120 1.00 . A A . 2 LEU HD12 1 1 15 3226 1 1 2 LEU HD13 H -7.740 -6.401 6.259 1.00 . A A . 2 LEU HD13 1 1 15 3227 1 1 2 LEU HD21 H -4.975 -3.959 4.197 1.00 . A A . 2 LEU HD21 1 1 15 3228 1 1 2 LEU HD22 H -4.567 -5.530 4.886 1.00 . A A . 2 LEU HD22 1 1 15 3229 1 1 2 LEU HD23 H -4.659 -4.109 5.926 1.00 . A A . 2 LEU HD23 1 1 15 3230 1 1 2 LEU HG H -6.960 -4.148 6.007 1.00 . A A . 2 LEU HG 1 1 15 3231 1 1 2 LEU N N -8.559 -3.364 2.492 1.00 . A A . 2 LEU N 1 1 15 3232 1 1 2 LEU O O -6.388 -1.847 4.912 1.00 . A A . 2 LEU O 1 1 15 3233 1 1 3 GLY C C -4.897 -0.515 1.254 1.00 . A A . 3 GLY C 1 1 15 3234 1 1 3 GLY CA C -5.147 -0.960 2.694 1.00 . A A . 3 GLY CA 1 1 15 3235 1 1 3 GLY H H -6.569 -2.365 1.889 1.00 . A A . 3 GLY H 1 1 15 3236 1 1 3 GLY HA2 H -5.427 -0.104 3.292 1.00 . A A . 3 GLY HA2 1 1 15 3237 1 1 3 GLY HA3 H -4.246 -1.397 3.092 1.00 . A A . 3 GLY HA3 1 1 15 3238 1 1 3 GLY N N -6.244 -1.969 2.724 1.00 . A A . 3 GLY N 1 1 15 3239 1 1 3 GLY O O -4.033 -1.033 0.574 1.00 . A A . 3 GLY O 1 1 15 3240 1 1 4 LYS C C -4.148 1.734 -0.696 1.00 . A A . 4 LYS C 1 1 15 3241 1 1 4 LYS CA C -5.442 0.928 -0.611 1.00 . A A . 4 LYS CA 1 1 15 3242 1 1 4 LYS CB C -6.651 1.816 -0.905 1.00 . A A . 4 LYS CB 1 1 15 3243 1 1 4 LYS CD C -8.437 2.322 -2.578 1.00 . A A . 4 LYS CD 1 1 15 3244 1 1 4 LYS CE C -8.460 2.915 -3.989 1.00 . A A . 4 LYS CE 1 1 15 3245 1 1 4 LYS CG C -7.107 1.600 -2.349 1.00 . A A . 4 LYS CG 1 1 15 3246 1 1 4 LYS H H -6.330 0.853 1.351 1.00 . A A . 4 LYS H 1 1 15 3247 1 1 4 LYS HA H -5.414 0.100 -1.296 1.00 . A A . 4 LYS HA 1 1 15 3248 1 1 4 LYS HB2 H -7.457 1.562 -0.230 1.00 . A A . 4 LYS HB2 1 1 15 3249 1 1 4 LYS HB3 H -6.380 2.852 -0.767 1.00 . A A . 4 LYS HB3 1 1 15 3250 1 1 4 LYS HD2 H -9.251 1.619 -2.468 1.00 . A A . 4 LYS HD2 1 1 15 3251 1 1 4 LYS HD3 H -8.546 3.115 -1.854 1.00 . A A . 4 LYS HD3 1 1 15 3252 1 1 4 LYS HE2 H -7.829 2.337 -4.649 1.00 . A A . 4 LYS HE2 1 1 15 3253 1 1 4 LYS HE3 H -9.470 2.949 -4.366 1.00 . A A . 4 LYS HE3 1 1 15 3254 1 1 4 LYS HG2 H -6.361 1.994 -3.025 1.00 . A A . 4 LYS HG2 1 1 15 3255 1 1 4 LYS HG3 H -7.238 0.544 -2.532 1.00 . A A . 4 LYS HG3 1 1 15 3256 1 1 4 LYS HZ1 H -7.594 4.646 -4.755 1.00 . A A . 4 LYS HZ1 1 1 15 3257 1 1 4 LYS HZ2 H -7.135 4.289 -3.158 1.00 . A A . 4 LYS HZ2 1 1 15 3258 1 1 4 LYS HZ3 H -8.679 4.922 -3.479 1.00 . A A . 4 LYS HZ3 1 1 15 3259 1 1 4 LYS N N -5.642 0.446 0.785 1.00 . A A . 4 LYS N 1 1 15 3260 1 1 4 LYS NZ N -7.927 4.297 -3.834 1.00 . A A . 4 LYS NZ 1 1 15 3261 1 1 4 LYS O O -3.311 1.503 -1.544 1.00 . A A . 4 LYS O 1 1 15 3262 1 1 5 ILE C C -1.543 2.623 0.580 1.00 . A A . 5 ILE C 1 1 15 3263 1 1 5 ILE CA C -2.736 3.493 0.177 1.00 . A A . 5 ILE CA 1 1 15 3264 1 1 5 ILE CB C -2.976 4.590 1.213 1.00 . A A . 5 ILE CB 1 1 15 3265 1 1 5 ILE CD1 C -3.417 6.361 -0.495 1.00 . A A . 5 ILE CD1 1 1 15 3266 1 1 5 ILE CG1 C -4.013 5.580 0.676 1.00 . A A . 5 ILE CG1 1 1 15 3267 1 1 5 ILE CG2 C -1.665 5.326 1.492 1.00 . A A . 5 ILE CG2 1 1 15 3268 1 1 5 ILE H H -4.666 2.834 0.866 1.00 . A A . 5 ILE H 1 1 15 3269 1 1 5 ILE HA H -2.577 3.929 -0.798 1.00 . A A . 5 ILE HA 1 1 15 3270 1 1 5 ILE HB H -3.341 4.145 2.128 1.00 . A A . 5 ILE HB 1 1 15 3271 1 1 5 ILE HD11 H -4.007 6.186 -1.383 1.00 . A A . 5 ILE HD11 1 1 15 3272 1 1 5 ILE HD12 H -2.402 6.035 -0.667 1.00 . A A . 5 ILE HD12 1 1 15 3273 1 1 5 ILE HD13 H -3.422 7.416 -0.263 1.00 . A A . 5 ILE HD13 1 1 15 3274 1 1 5 ILE HG12 H -4.886 5.038 0.342 1.00 . A A . 5 ILE HG12 1 1 15 3275 1 1 5 ILE HG13 H -4.294 6.267 1.459 1.00 . A A . 5 ILE HG13 1 1 15 3276 1 1 5 ILE HG21 H -1.775 5.936 2.376 1.00 . A A . 5 ILE HG21 1 1 15 3277 1 1 5 ILE HG22 H -1.417 5.955 0.649 1.00 . A A . 5 ILE HG22 1 1 15 3278 1 1 5 ILE HG23 H -0.875 4.606 1.648 1.00 . A A . 5 ILE HG23 1 1 15 3279 1 1 5 ILE N N -3.979 2.673 0.189 1.00 . A A . 5 ILE N 1 1 15 3280 1 1 5 ILE O O -0.412 2.900 0.232 1.00 . A A . 5 ILE O 1 1 15 3281 1 1 6 TRP C C -0.251 -0.223 0.574 1.00 . A A . 6 TRP C 1 1 15 3282 1 1 6 TRP CA C -0.678 0.677 1.737 1.00 . A A . 6 TRP CA 1 1 15 3283 1 1 6 TRP CB C -1.256 -0.157 2.881 1.00 . A A . 6 TRP CB 1 1 15 3284 1 1 6 TRP CD1 C -0.641 -2.608 2.867 1.00 . A A . 6 TRP CD1 1 1 15 3285 1 1 6 TRP CD2 C 0.965 -1.320 3.773 1.00 . A A . 6 TRP CD2 1 1 15 3286 1 1 6 TRP CE2 C 1.435 -2.653 3.828 1.00 . A A . 6 TRP CE2 1 1 15 3287 1 1 6 TRP CE3 C 1.792 -0.303 4.283 1.00 . A A . 6 TRP CE3 1 1 15 3288 1 1 6 TRP CG C -0.356 -1.319 3.157 1.00 . A A . 6 TRP CG 1 1 15 3289 1 1 6 TRP CH2 C 3.491 -1.945 4.873 1.00 . A A . 6 TRP CH2 1 1 15 3290 1 1 6 TRP CZ2 C 2.681 -2.967 4.371 1.00 . A A . 6 TRP CZ2 1 1 15 3291 1 1 6 TRP CZ3 C 3.048 -0.615 4.830 1.00 . A A . 6 TRP CZ3 1 1 15 3292 1 1 6 TRP H H -2.714 1.365 1.579 1.00 . A A . 6 TRP H 1 1 15 3293 1 1 6 TRP HA H 0.158 1.259 2.090 1.00 . A A . 6 TRP HA 1 1 15 3294 1 1 6 TRP HB2 H -1.336 0.456 3.767 1.00 . A A . 6 TRP HB2 1 1 15 3295 1 1 6 TRP HB3 H -2.235 -0.518 2.604 1.00 . A A . 6 TRP HB3 1 1 15 3296 1 1 6 TRP HD1 H -1.549 -2.961 2.400 1.00 . A A . 6 TRP HD1 1 1 15 3297 1 1 6 TRP HE1 H 0.467 -4.376 3.165 1.00 . A A . 6 TRP HE1 1 1 15 3298 1 1 6 TRP HE3 H 1.460 0.724 4.254 1.00 . A A . 6 TRP HE3 1 1 15 3299 1 1 6 TRP HH2 H 4.458 -2.179 5.295 1.00 . A A . 6 TRP HH2 1 1 15 3300 1 1 6 TRP HZ2 H 3.019 -3.993 4.402 1.00 . A A . 6 TRP HZ2 1 1 15 3301 1 1 6 TRP HZ3 H 3.675 0.172 5.219 1.00 . A A . 6 TRP HZ3 1 1 15 3302 1 1 6 TRP N N -1.793 1.570 1.310 1.00 . A A . 6 TRP N 1 1 15 3303 1 1 6 TRP NE1 N 0.420 -3.402 3.264 1.00 . A A . 6 TRP NE1 1 1 15 3304 1 1 6 TRP O O 0.880 -0.661 0.500 1.00 . A A . 6 TRP O 1 1 15 3305 1 1 7 GLU C C 0.463 -0.829 -2.187 1.00 . A A . 7 GLU C 1 1 15 3306 1 1 7 GLU CA C -0.786 -1.371 -1.491 1.00 . A A . 7 GLU CA 1 1 15 3307 1 1 7 GLU CB C -1.994 -1.310 -2.426 1.00 . A A . 7 GLU CB 1 1 15 3308 1 1 7 GLU CD C -2.077 -3.746 -2.979 1.00 . A A . 7 GLU CD 1 1 15 3309 1 1 7 GLU CG C -2.812 -2.595 -2.289 1.00 . A A . 7 GLU CG 1 1 15 3310 1 1 7 GLU H H -2.053 -0.136 -0.258 1.00 . A A . 7 GLU H 1 1 15 3311 1 1 7 GLU HA H -0.624 -2.383 -1.163 1.00 . A A . 7 GLU HA 1 1 15 3312 1 1 7 GLU HB2 H -2.608 -0.461 -2.164 1.00 . A A . 7 GLU HB2 1 1 15 3313 1 1 7 GLU HB3 H -1.654 -1.208 -3.446 1.00 . A A . 7 GLU HB3 1 1 15 3314 1 1 7 GLU HG2 H -2.945 -2.828 -1.242 1.00 . A A . 7 GLU HG2 1 1 15 3315 1 1 7 GLU HG3 H -3.777 -2.458 -2.753 1.00 . A A . 7 GLU HG3 1 1 15 3316 1 1 7 GLU N N -1.145 -0.500 -0.335 1.00 . A A . 7 GLU N 1 1 15 3317 1 1 7 GLU O O 1.342 -1.571 -2.579 1.00 . A A . 7 GLU O 1 1 15 3318 1 1 7 GLU OE1 O -0.867 -3.820 -2.836 1.00 . A A . 7 GLU OE1 1 1 15 3319 1 1 7 GLU OE2 O -2.735 -4.534 -3.637 1.00 . A A . 7 GLU OE2 1 1 15 3320 1 1 8 GLY C C 2.882 1.175 -2.003 1.00 . A A . 8 GLY C 1 1 15 3321 1 1 8 GLY CA C 1.737 1.059 -3.010 1.00 . A A . 8 GLY CA 1 1 15 3322 1 1 8 GLY H H -0.173 1.038 -2.015 1.00 . A A . 8 GLY H 1 1 15 3323 1 1 8 GLY HA2 H 2.042 0.428 -3.833 1.00 . A A . 8 GLY HA2 1 1 15 3324 1 1 8 GLY HA3 H 1.488 2.041 -3.381 1.00 . A A . 8 GLY HA3 1 1 15 3325 1 1 8 GLY N N 0.548 0.461 -2.342 1.00 . A A . 8 GLY N 1 1 15 3326 1 1 8 GLY O O 4.043 1.129 -2.360 1.00 . A A . 8 GLY O 1 1 15 3327 1 1 9 ILE C C 4.424 0.135 0.376 1.00 . A A . 9 ILE C 1 1 15 3328 1 1 9 ILE CA C 3.636 1.443 0.284 1.00 . A A . 9 ILE CA 1 1 15 3329 1 1 9 ILE CB C 2.897 1.717 1.594 1.00 . A A . 9 ILE CB 1 1 15 3330 1 1 9 ILE CD1 C 1.868 3.511 2.999 1.00 . A A . 9 ILE CD1 1 1 15 3331 1 1 9 ILE CG1 C 2.403 3.166 1.608 1.00 . A A . 9 ILE CG1 1 1 15 3332 1 1 9 ILE CG2 C 3.845 1.491 2.773 1.00 . A A . 9 ILE CG2 1 1 15 3333 1 1 9 ILE H H 1.622 1.359 -0.481 1.00 . A A . 9 ILE H 1 1 15 3334 1 1 9 ILE HA H 4.294 2.266 0.052 1.00 . A A . 9 ILE HA 1 1 15 3335 1 1 9 ILE HB H 2.053 1.046 1.678 1.00 . A A . 9 ILE HB 1 1 15 3336 1 1 9 ILE HD11 H 0.887 3.954 2.907 1.00 . A A . 9 ILE HD11 1 1 15 3337 1 1 9 ILE HD12 H 2.536 4.210 3.478 1.00 . A A . 9 ILE HD12 1 1 15 3338 1 1 9 ILE HD13 H 1.802 2.610 3.592 1.00 . A A . 9 ILE HD13 1 1 15 3339 1 1 9 ILE HG12 H 3.223 3.827 1.362 1.00 . A A . 9 ILE HG12 1 1 15 3340 1 1 9 ILE HG13 H 1.614 3.284 0.881 1.00 . A A . 9 ILE HG13 1 1 15 3341 1 1 9 ILE HG21 H 4.618 2.246 2.764 1.00 . A A . 9 ILE HG21 1 1 15 3342 1 1 9 ILE HG22 H 4.295 0.513 2.691 1.00 . A A . 9 ILE HG22 1 1 15 3343 1 1 9 ILE HG23 H 3.292 1.556 3.698 1.00 . A A . 9 ILE HG23 1 1 15 3344 1 1 9 ILE N N 2.564 1.325 -0.747 1.00 . A A . 9 ILE N 1 1 15 3345 1 1 9 ILE O O 5.634 0.118 0.257 1.00 . A A . 9 ILE O 1 1 15 3346 1 1 10 LYS C C 5.178 -2.582 -0.631 1.00 . A A . 10 LYS C 1 1 15 3347 1 1 10 LYS CA C 4.462 -2.268 0.685 1.00 . A A . 10 LYS CA 1 1 15 3348 1 1 10 LYS CB C 3.364 -3.299 0.958 1.00 . A A . 10 LYS CB 1 1 15 3349 1 1 10 LYS CD C 2.530 -4.285 -1.181 1.00 . A A . 10 LYS CD 1 1 15 3350 1 1 10 LYS CE C 1.632 -5.489 -0.889 1.00 . A A . 10 LYS CE 1 1 15 3351 1 1 10 LYS CG C 2.292 -3.201 -0.129 1.00 . A A . 10 LYS CG 1 1 15 3352 1 1 10 LYS H H 2.775 -0.927 0.679 1.00 . A A . 10 LYS H 1 1 15 3353 1 1 10 LYS HA H 5.164 -2.255 1.503 1.00 . A A . 10 LYS HA 1 1 15 3354 1 1 10 LYS HB2 H 3.793 -4.290 0.953 1.00 . A A . 10 LYS HB2 1 1 15 3355 1 1 10 LYS HB3 H 2.918 -3.103 1.920 1.00 . A A . 10 LYS HB3 1 1 15 3356 1 1 10 LYS HD2 H 2.298 -3.891 -2.161 1.00 . A A . 10 LYS HD2 1 1 15 3357 1 1 10 LYS HD3 H 3.564 -4.593 -1.153 1.00 . A A . 10 LYS HD3 1 1 15 3358 1 1 10 LYS HE2 H 1.791 -5.837 0.123 1.00 . A A . 10 LYS HE2 1 1 15 3359 1 1 10 LYS HE3 H 0.596 -5.233 -1.042 1.00 . A A . 10 LYS HE3 1 1 15 3360 1 1 10 LYS HG2 H 1.316 -3.338 0.317 1.00 . A A . 10 LYS HG2 1 1 15 3361 1 1 10 LYS HG3 H 2.340 -2.229 -0.597 1.00 . A A . 10 LYS HG3 1 1 15 3362 1 1 10 LYS HZ1 H 1.281 -7.213 -2.002 1.00 . A A . 10 LYS HZ1 1 1 15 3363 1 1 10 LYS HZ2 H 2.896 -7.021 -1.511 1.00 . A A . 10 LYS HZ2 1 1 15 3364 1 1 10 LYS HZ3 H 2.272 -6.078 -2.779 1.00 . A A . 10 LYS HZ3 1 1 15 3365 1 1 10 LYS N N 3.750 -0.962 0.586 1.00 . A A . 10 LYS N 1 1 15 3366 1 1 10 LYS NZ N 2.052 -6.529 -1.870 1.00 . A A . 10 LYS NZ 1 1 15 3367 1 1 10 LYS O O 6.146 -3.315 -0.663 1.00 . A A . 10 LYS O 1 1 15 3368 1 1 11 SER C C 6.550 -1.345 -3.232 1.00 . A A . 11 SER C 1 1 15 3369 1 1 11 SER CA C 5.368 -2.297 -3.030 1.00 . A A . 11 SER CA 1 1 15 3370 1 1 11 SER CB C 4.285 -2.038 -4.076 1.00 . A A . 11 SER CB 1 1 15 3371 1 1 11 SER H H 3.929 -1.441 -1.672 1.00 . A A . 11 SER H 1 1 15 3372 1 1 11 SER HA H 5.696 -3.323 -3.086 1.00 . A A . 11 SER HA 1 1 15 3373 1 1 11 SER HB2 H 3.754 -2.951 -4.282 1.00 . A A . 11 SER HB2 1 1 15 3374 1 1 11 SER HB3 H 3.592 -1.298 -3.698 1.00 . A A . 11 SER HB3 1 1 15 3375 1 1 11 SER HG H 4.263 -0.998 -5.722 1.00 . A A . 11 SER HG 1 1 15 3376 1 1 11 SER N N 4.711 -2.030 -1.718 1.00 . A A . 11 SER N 1 1 15 3377 1 1 11 SER O O 7.334 -1.499 -4.147 1.00 . A A . 11 SER O 1 1 15 3378 1 1 11 SER OG O 4.892 -1.569 -5.273 1.00 . A A . 11 SER OG 1 1 15 3379 1 1 12 LEU C C 9.053 0.071 -1.801 1.00 . A A . 12 LEU C 1 1 15 3380 1 1 12 LEU CA C 7.815 0.599 -2.529 1.00 . A A . 12 LEU CA 1 1 15 3381 1 1 12 LEU CB C 7.322 1.893 -1.881 1.00 . A A . 12 LEU CB 1 1 15 3382 1 1 12 LEU CD1 C 7.945 4.307 -2.044 1.00 . A A . 12 LEU CD1 1 1 15 3383 1 1 12 LEU CD2 C 9.106 2.824 -0.404 1.00 . A A . 12 LEU CD2 1 1 15 3384 1 1 12 LEU CG C 8.475 2.894 -1.796 1.00 . A A . 12 LEU CG 1 1 15 3385 1 1 12 LEU H H 6.039 -0.253 -1.653 1.00 . A A . 12 LEU H 1 1 15 3386 1 1 12 LEU HA H 8.033 0.768 -3.570 1.00 . A A . 12 LEU HA 1 1 15 3387 1 1 12 LEU HB2 H 6.523 2.313 -2.477 1.00 . A A . 12 LEU HB2 1 1 15 3388 1 1 12 LEU HB3 H 6.956 1.683 -0.887 1.00 . A A . 12 LEU HB3 1 1 15 3389 1 1 12 LEU HD11 H 7.236 4.566 -1.272 1.00 . A A . 12 LEU HD11 1 1 15 3390 1 1 12 LEU HD12 H 7.459 4.345 -3.007 1.00 . A A . 12 LEU HD12 1 1 15 3391 1 1 12 LEU HD13 H 8.767 5.007 -2.027 1.00 . A A . 12 LEU HD13 1 1 15 3392 1 1 12 LEU HD21 H 8.952 1.840 0.012 1.00 . A A . 12 LEU HD21 1 1 15 3393 1 1 12 LEU HD22 H 8.647 3.561 0.237 1.00 . A A . 12 LEU HD22 1 1 15 3394 1 1 12 LEU HD23 H 10.166 3.022 -0.478 1.00 . A A . 12 LEU HD23 1 1 15 3395 1 1 12 LEU HG H 9.218 2.652 -2.543 1.00 . A A . 12 LEU HG 1 1 15 3396 1 1 12 LEU N N 6.683 -0.361 -2.384 1.00 . A A . 12 LEU N 1 1 15 3397 1 1 12 LEU O O 10.173 0.321 -2.198 1.00 . A A . 12 LEU O 1 1 15 3398 1 1 13 PHE C C 9.758 -2.665 0.406 1.00 . A A . 13 PHE C 1 1 15 3399 1 1 13 PHE CA C 10.021 -1.208 0.015 1.00 . A A . 13 PHE CA 1 1 15 3400 1 1 13 PHE CB C 10.132 -0.330 1.264 1.00 . A A . 13 PHE CB 1 1 15 3401 1 1 13 PHE CD1 C 12.178 0.670 0.193 1.00 . A A . 13 PHE CD1 1 1 15 3402 1 1 13 PHE CD2 C 12.164 0.345 2.594 1.00 . A A . 13 PHE CD2 1 1 15 3403 1 1 13 PHE CE1 C 13.468 1.200 0.270 1.00 . A A . 13 PHE CE1 1 1 15 3404 1 1 13 PHE CE2 C 13.457 0.875 2.673 1.00 . A A . 13 PHE CE2 1 1 15 3405 1 1 13 PHE CG C 11.524 0.242 1.353 1.00 . A A . 13 PHE CG 1 1 15 3406 1 1 13 PHE CZ C 14.109 1.303 1.511 1.00 . A A . 13 PHE CZ 1 1 15 3407 1 1 13 PHE H H 7.945 -0.851 -0.439 1.00 . A A . 13 PHE H 1 1 15 3408 1 1 13 PHE HA H 10.923 -1.130 -0.572 1.00 . A A . 13 PHE HA 1 1 15 3409 1 1 13 PHE HB2 H 9.415 0.475 1.202 1.00 . A A . 13 PHE HB2 1 1 15 3410 1 1 13 PHE HB3 H 9.931 -0.925 2.142 1.00 . A A . 13 PHE HB3 1 1 15 3411 1 1 13 PHE HD1 H 11.685 0.590 -0.764 1.00 . A A . 13 PHE HD1 1 1 15 3412 1 1 13 PHE HD2 H 11.660 0.014 3.491 1.00 . A A . 13 PHE HD2 1 1 15 3413 1 1 13 PHE HE1 H 13.968 1.528 -0.626 1.00 . A A . 13 PHE HE1 1 1 15 3414 1 1 13 PHE HE2 H 13.950 0.956 3.630 1.00 . A A . 13 PHE HE2 1 1 15 3415 1 1 13 PHE HZ H 15.107 1.713 1.571 1.00 . A A . 13 PHE HZ 1 1 15 3416 1 1 13 PHE N N 8.858 -0.661 -0.739 1.00 . A A . 13 PHE N 1 1 15 3417 1 1 13 PHE O O 10.319 -3.576 -0.170 1.00 . A A . 13 PHE O 1 1 15 3418 1 1 14 NH2 HN1 H 8.466 -2.192 1.838 1.00 . A A . 14 NH2 HN1 1 1 15 3419 1 1 14 NH2 HN2 H 8.743 -3.854 1.631 1.00 . A A . 14 NH2 HN2 1 1 15 3420 1 1 14 NH2 N N 8.920 -2.925 1.371 1.00 . A A . 14 NH2 N 1 1 16 3421 1 1 1 ILE C C -9.186 -1.286 3.217 1.00 . A A . 1 ILE C 1 1 16 3422 1 1 1 ILE CA C -10.254 -0.746 2.262 1.00 . A A . 1 ILE CA 1 1 16 3423 1 1 1 ILE CB C -10.066 -1.330 0.862 1.00 . A A . 1 ILE CB 1 1 16 3424 1 1 1 ILE CD1 C -8.253 -1.756 -0.803 1.00 . A A . 1 ILE CD1 1 1 16 3425 1 1 1 ILE CG1 C -8.776 -0.779 0.250 1.00 . A A . 1 ILE CG1 1 1 16 3426 1 1 1 ILE CG2 C -11.255 -0.940 -0.018 1.00 . A A . 1 ILE CG2 1 1 16 3427 1 1 1 ILE H1 H -9.087 0.976 2.136 1.00 . A A . 1 ILE H1 1 1 16 3428 1 1 1 ILE H2 H -10.610 1.221 2.849 1.00 . A A . 1 ILE H2 1 1 16 3429 1 1 1 ILE H3 H -10.479 1.013 1.168 1.00 . A A . 1 ILE H3 1 1 16 3430 1 1 1 ILE HA H -11.241 -0.979 2.629 1.00 . A A . 1 ILE HA 1 1 16 3431 1 1 1 ILE HB H -10.004 -2.407 0.927 1.00 . A A . 1 ILE HB 1 1 16 3432 1 1 1 ILE HD11 H -9.005 -2.505 -1.004 1.00 . A A . 1 ILE HD11 1 1 16 3433 1 1 1 ILE HD12 H -7.357 -2.234 -0.437 1.00 . A A . 1 ILE HD12 1 1 16 3434 1 1 1 ILE HD13 H -8.029 -1.220 -1.713 1.00 . A A . 1 ILE HD13 1 1 16 3435 1 1 1 ILE HG12 H -8.977 0.178 -0.213 1.00 . A A . 1 ILE HG12 1 1 16 3436 1 1 1 ILE HG13 H -8.033 -0.655 1.024 1.00 . A A . 1 ILE HG13 1 1 16 3437 1 1 1 ILE HG21 H -11.784 -0.117 0.437 1.00 . A A . 1 ILE HG21 1 1 16 3438 1 1 1 ILE HG22 H -11.921 -1.785 -0.118 1.00 . A A . 1 ILE HG22 1 1 16 3439 1 1 1 ILE HG23 H -10.899 -0.645 -0.993 1.00 . A A . 1 ILE HG23 1 1 16 3440 1 1 1 ILE N N -10.095 0.728 2.091 1.00 . A A . 1 ILE N 1 1 16 3441 1 1 1 ILE O O -8.598 -0.551 3.986 1.00 . A A . 1 ILE O 1 1 16 3442 1 1 2 LEU C C -6.653 -2.262 4.109 1.00 . A A . 2 LEU C 1 1 16 3443 1 1 2 LEU CA C -7.899 -3.150 4.077 1.00 . A A . 2 LEU CA 1 1 16 3444 1 1 2 LEU CB C -7.571 -4.515 3.473 1.00 . A A . 2 LEU CB 1 1 16 3445 1 1 2 LEU CD1 C -9.214 -6.281 4.121 1.00 . A A . 2 LEU CD1 1 1 16 3446 1 1 2 LEU CD2 C -6.771 -6.658 4.476 1.00 . A A . 2 LEU CD2 1 1 16 3447 1 1 2 LEU CG C -7.889 -5.612 4.489 1.00 . A A . 2 LEU CG 1 1 16 3448 1 1 2 LEU H H -9.413 -3.141 2.545 1.00 . A A . 2 LEU H 1 1 16 3449 1 1 2 LEU HA H -8.298 -3.274 5.070 1.00 . A A . 2 LEU HA 1 1 16 3450 1 1 2 LEU HB2 H -8.162 -4.666 2.581 1.00 . A A . 2 LEU HB2 1 1 16 3451 1 1 2 LEU HB3 H -6.522 -4.555 3.220 1.00 . A A . 2 LEU HB3 1 1 16 3452 1 1 2 LEU HD11 H -10.033 -5.642 4.417 1.00 . A A . 2 LEU HD11 1 1 16 3453 1 1 2 LEU HD12 H -9.294 -7.229 4.633 1.00 . A A . 2 LEU HD12 1 1 16 3454 1 1 2 LEU HD13 H -9.251 -6.444 3.055 1.00 . A A . 2 LEU HD13 1 1 16 3455 1 1 2 LEU HD21 H -5.813 -6.160 4.450 1.00 . A A . 2 LEU HD21 1 1 16 3456 1 1 2 LEU HD22 H -6.875 -7.285 3.603 1.00 . A A . 2 LEU HD22 1 1 16 3457 1 1 2 LEU HD23 H -6.836 -7.266 5.367 1.00 . A A . 2 LEU HD23 1 1 16 3458 1 1 2 LEU HG H -7.966 -5.177 5.475 1.00 . A A . 2 LEU HG 1 1 16 3459 1 1 2 LEU N N -8.928 -2.565 3.172 1.00 . A A . 2 LEU N 1 1 16 3460 1 1 2 LEU O O -5.935 -2.217 5.088 1.00 . A A . 2 LEU O 1 1 16 3461 1 1 3 GLY C C -4.852 -0.303 1.574 1.00 . A A . 3 GLY C 1 1 16 3462 1 1 3 GLY CA C -5.195 -0.665 3.018 1.00 . A A . 3 GLY CA 1 1 16 3463 1 1 3 GLY H H -6.986 -1.601 2.267 1.00 . A A . 3 GLY H 1 1 16 3464 1 1 3 GLY HA2 H -5.402 0.237 3.575 1.00 . A A . 3 GLY HA2 1 1 16 3465 1 1 3 GLY HA3 H -4.358 -1.177 3.463 1.00 . A A . 3 GLY HA3 1 1 16 3466 1 1 3 GLY N N -6.393 -1.552 3.046 1.00 . A A . 3 GLY N 1 1 16 3467 1 1 3 GLY O O -3.970 -0.882 0.972 1.00 . A A . 3 GLY O 1 1 16 3468 1 1 4 LYS C C -3.895 1.791 -0.424 1.00 . A A . 4 LYS C 1 1 16 3469 1 1 4 LYS CA C -5.235 1.064 -0.384 1.00 . A A . 4 LYS CA 1 1 16 3470 1 1 4 LYS CB C -6.371 2.007 -0.779 1.00 . A A . 4 LYS CB 1 1 16 3471 1 1 4 LYS CD C -7.539 1.374 -2.897 1.00 . A A . 4 LYS CD 1 1 16 3472 1 1 4 LYS CE C -7.441 1.395 -4.424 1.00 . A A . 4 LYS CE 1 1 16 3473 1 1 4 LYS CG C -6.385 2.181 -2.300 1.00 . A A . 4 LYS CG 1 1 16 3474 1 1 4 LYS H H -6.235 1.117 1.525 1.00 . A A . 4 LYS H 1 1 16 3475 1 1 4 LYS HA H -5.219 0.206 -1.032 1.00 . A A . 4 LYS HA 1 1 16 3476 1 1 4 LYS HB2 H -7.314 1.592 -0.454 1.00 . A A . 4 LYS HB2 1 1 16 3477 1 1 4 LYS HB3 H -6.220 2.969 -0.311 1.00 . A A . 4 LYS HB3 1 1 16 3478 1 1 4 LYS HD2 H -7.483 0.354 -2.546 1.00 . A A . 4 LYS HD2 1 1 16 3479 1 1 4 LYS HD3 H -8.479 1.810 -2.591 1.00 . A A . 4 LYS HD3 1 1 16 3480 1 1 4 LYS HE2 H -6.933 2.291 -4.754 1.00 . A A . 4 LYS HE2 1 1 16 3481 1 1 4 LYS HE3 H -6.928 0.516 -4.781 1.00 . A A . 4 LYS HE3 1 1 16 3482 1 1 4 LYS HG2 H -6.512 3.226 -2.541 1.00 . A A . 4 LYS HG2 1 1 16 3483 1 1 4 LYS HG3 H -5.451 1.827 -2.711 1.00 . A A . 4 LYS HG3 1 1 16 3484 1 1 4 LYS HZ1 H -8.912 1.872 -5.818 1.00 . A A . 4 LYS HZ1 1 1 16 3485 1 1 4 LYS HZ2 H -9.453 1.885 -4.208 1.00 . A A . 4 LYS HZ2 1 1 16 3486 1 1 4 LYS HZ3 H -9.181 0.409 -5.003 1.00 . A A . 4 LYS HZ3 1 1 16 3487 1 1 4 LYS N N -5.535 0.658 1.018 1.00 . A A . 4 LYS N 1 1 16 3488 1 1 4 LYS NZ N -8.853 1.390 -4.898 1.00 . A A . 4 LYS NZ 1 1 16 3489 1 1 4 LYS O O -3.019 1.468 -1.201 1.00 . A A . 4 LYS O 1 1 16 3490 1 1 5 ILE C C -1.310 2.571 0.857 1.00 . A A . 5 ILE C 1 1 16 3491 1 1 5 ILE CA C -2.445 3.514 0.456 1.00 . A A . 5 ILE CA 1 1 16 3492 1 1 5 ILE CB C -2.647 4.594 1.520 1.00 . A A . 5 ILE CB 1 1 16 3493 1 1 5 ILE CD1 C -3.160 6.276 -0.256 1.00 . A A . 5 ILE CD1 1 1 16 3494 1 1 5 ILE CG1 C -3.674 5.612 1.023 1.00 . A A . 5 ILE CG1 1 1 16 3495 1 1 5 ILE CG2 C -1.317 5.301 1.789 1.00 . A A . 5 ILE CG2 1 1 16 3496 1 1 5 ILE H H -4.451 2.996 1.043 1.00 . A A . 5 ILE H 1 1 16 3497 1 1 5 ILE HA H -2.244 3.968 -0.501 1.00 . A A . 5 ILE HA 1 1 16 3498 1 1 5 ILE HB H -3.002 4.136 2.432 1.00 . A A . 5 ILE HB 1 1 16 3499 1 1 5 ILE HD11 H -3.530 7.289 -0.309 1.00 . A A . 5 ILE HD11 1 1 16 3500 1 1 5 ILE HD12 H -3.509 5.721 -1.114 1.00 . A A . 5 ILE HD12 1 1 16 3501 1 1 5 ILE HD13 H -2.081 6.285 -0.248 1.00 . A A . 5 ILE HD13 1 1 16 3502 1 1 5 ILE HG12 H -4.609 5.110 0.819 1.00 . A A . 5 ILE HG12 1 1 16 3503 1 1 5 ILE HG13 H -3.829 6.366 1.780 1.00 . A A . 5 ILE HG13 1 1 16 3504 1 1 5 ILE HG21 H -1.503 6.232 2.304 1.00 . A A . 5 ILE HG21 1 1 16 3505 1 1 5 ILE HG22 H -0.819 5.501 0.852 1.00 . A A . 5 ILE HG22 1 1 16 3506 1 1 5 ILE HG23 H -0.691 4.669 2.401 1.00 . A A . 5 ILE HG23 1 1 16 3507 1 1 5 ILE N N -3.730 2.765 0.422 1.00 . A A . 5 ILE N 1 1 16 3508 1 1 5 ILE O O -0.166 2.769 0.498 1.00 . A A . 5 ILE O 1 1 16 3509 1 1 6 TRP C C -0.075 -0.225 0.809 1.00 . A A . 6 TRP C 1 1 16 3510 1 1 6 TRP CA C -0.565 0.577 2.016 1.00 . A A . 6 TRP CA 1 1 16 3511 1 1 6 TRP CB C -1.248 -0.340 3.032 1.00 . A A . 6 TRP CB 1 1 16 3512 1 1 6 TRP CD1 C -0.821 -2.830 3.059 1.00 . A A . 6 TRP CD1 1 1 16 3513 1 1 6 TRP CD2 C 0.973 -1.637 3.708 1.00 . A A . 6 TRP CD2 1 1 16 3514 1 1 6 TRP CE2 C 1.348 -3.000 3.769 1.00 . A A . 6 TRP CE2 1 1 16 3515 1 1 6 TRP CE3 C 1.928 -0.670 4.070 1.00 . A A . 6 TRP CE3 1 1 16 3516 1 1 6 TRP CG C -0.408 -1.557 3.254 1.00 . A A . 6 TRP CG 1 1 16 3517 1 1 6 TRP CH2 C 3.561 -2.416 4.530 1.00 . A A . 6 TRP CH2 1 1 16 3518 1 1 6 TRP CZ2 C 2.625 -3.390 4.174 1.00 . A A . 6 TRP CZ2 1 1 16 3519 1 1 6 TRP CZ3 C 3.214 -1.059 4.478 1.00 . A A . 6 TRP CZ3 1 1 16 3520 1 1 6 TRP H H -2.553 1.396 1.869 1.00 . A A . 6 TRP H 1 1 16 3521 1 1 6 TRP HA H 0.255 1.097 2.481 1.00 . A A . 6 TRP HA 1 1 16 3522 1 1 6 TRP HB2 H -1.372 0.187 3.967 1.00 . A A . 6 TRP HB2 1 1 16 3523 1 1 6 TRP HB3 H -2.217 -0.636 2.655 1.00 . A A . 6 TRP HB3 1 1 16 3524 1 1 6 TRP HD1 H -1.802 -3.128 2.719 1.00 . A A . 6 TRP HD1 1 1 16 3525 1 1 6 TRP HE1 H 0.184 -4.665 3.305 1.00 . A A . 6 TRP HE1 1 1 16 3526 1 1 6 TRP HE3 H 1.671 0.378 4.033 1.00 . A A . 6 TRP HE3 1 1 16 3527 1 1 6 TRP HH2 H 4.553 -2.709 4.845 1.00 . A A . 6 TRP HH2 1 1 16 3528 1 1 6 TRP HZ2 H 2.887 -4.437 4.212 1.00 . A A . 6 TRP HZ2 1 1 16 3529 1 1 6 TRP HZ3 H 3.940 -0.308 4.754 1.00 . A A . 6 TRP HZ3 1 1 16 3530 1 1 6 TRP N N -1.622 1.539 1.594 1.00 . A A . 6 TRP N 1 1 16 3531 1 1 6 TRP NE1 N 0.221 -3.688 3.363 1.00 . A A . 6 TRP NE1 1 1 16 3532 1 1 6 TRP O O 1.077 -0.600 0.726 1.00 . A A . 6 TRP O 1 1 16 3533 1 1 7 GLU C C 0.604 -0.540 -2.063 1.00 . A A . 7 GLU C 1 1 16 3534 1 1 7 GLU CA C -0.531 -1.263 -1.334 1.00 . A A . 7 GLU CA 1 1 16 3535 1 1 7 GLU CB C -1.781 -1.322 -2.212 1.00 . A A . 7 GLU CB 1 1 16 3536 1 1 7 GLU CD C -3.339 -2.942 -3.304 1.00 . A A . 7 GLU CD 1 1 16 3537 1 1 7 GLU CG C -1.900 -2.713 -2.839 1.00 . A A . 7 GLU CG 1 1 16 3538 1 1 7 GLU H H -1.867 -0.172 -0.041 1.00 . A A . 7 GLU H 1 1 16 3539 1 1 7 GLU HA H -0.227 -2.258 -1.055 1.00 . A A . 7 GLU HA 1 1 16 3540 1 1 7 GLU HB2 H -2.654 -1.123 -1.606 1.00 . A A . 7 GLU HB2 1 1 16 3541 1 1 7 GLU HB3 H -1.708 -0.582 -2.993 1.00 . A A . 7 GLU HB3 1 1 16 3542 1 1 7 GLU HG2 H -1.232 -2.783 -3.685 1.00 . A A . 7 GLU HG2 1 1 16 3543 1 1 7 GLU HG3 H -1.637 -3.462 -2.108 1.00 . A A . 7 GLU HG3 1 1 16 3544 1 1 7 GLU N N -0.943 -0.487 -0.128 1.00 . A A . 7 GLU N 1 1 16 3545 1 1 7 GLU O O 1.444 -1.154 -2.691 1.00 . A A . 7 GLU O 1 1 16 3546 1 1 7 GLU OE1 O -3.708 -2.379 -4.321 1.00 . A A . 7 GLU OE1 1 1 16 3547 1 1 7 GLU OE2 O -4.048 -3.675 -2.634 1.00 . A A . 7 GLU OE2 1 1 16 3548 1 1 8 GLY C C 2.990 1.475 -1.842 1.00 . A A . 8 GLY C 1 1 16 3549 1 1 8 GLY CA C 1.708 1.527 -2.674 1.00 . A A . 8 GLY CA 1 1 16 3550 1 1 8 GLY H H -0.057 1.235 -1.474 1.00 . A A . 8 GLY H 1 1 16 3551 1 1 8 GLY HA2 H 1.891 1.093 -3.647 1.00 . A A . 8 GLY HA2 1 1 16 3552 1 1 8 GLY HA3 H 1.400 2.555 -2.790 1.00 . A A . 8 GLY HA3 1 1 16 3553 1 1 8 GLY N N 0.632 0.761 -1.985 1.00 . A A . 8 GLY N 1 1 16 3554 1 1 8 GLY O O 4.084 1.545 -2.366 1.00 . A A . 8 GLY O 1 1 16 3555 1 1 9 ILE C C 4.715 -0.095 0.246 1.00 . A A . 9 ILE C 1 1 16 3556 1 1 9 ILE CA C 4.080 1.297 0.314 1.00 . A A . 9 ILE CA 1 1 16 3557 1 1 9 ILE CB C 3.577 1.590 1.727 1.00 . A A . 9 ILE CB 1 1 16 3558 1 1 9 ILE CD1 C 2.447 3.301 3.154 1.00 . A A . 9 ILE CD1 1 1 16 3559 1 1 9 ILE CG1 C 2.747 2.876 1.716 1.00 . A A . 9 ILE CG1 1 1 16 3560 1 1 9 ILE CG2 C 4.770 1.763 2.667 1.00 . A A . 9 ILE CG2 1 1 16 3561 1 1 9 ILE H H 1.974 1.299 -0.146 1.00 . A A . 9 ILE H 1 1 16 3562 1 1 9 ILE HA H 4.791 2.051 0.013 1.00 . A A . 9 ILE HA 1 1 16 3563 1 1 9 ILE HB H 2.966 0.766 2.069 1.00 . A A . 9 ILE HB 1 1 16 3564 1 1 9 ILE HD11 H 1.590 3.959 3.163 1.00 . A A . 9 ILE HD11 1 1 16 3565 1 1 9 ILE HD12 H 3.302 3.820 3.562 1.00 . A A . 9 ILE HD12 1 1 16 3566 1 1 9 ILE HD13 H 2.237 2.428 3.752 1.00 . A A . 9 ILE HD13 1 1 16 3567 1 1 9 ILE HG12 H 3.301 3.657 1.216 1.00 . A A . 9 ILE HG12 1 1 16 3568 1 1 9 ILE HG13 H 1.818 2.701 1.194 1.00 . A A . 9 ILE HG13 1 1 16 3569 1 1 9 ILE HG21 H 4.747 0.995 3.425 1.00 . A A . 9 ILE HG21 1 1 16 3570 1 1 9 ILE HG22 H 4.719 2.734 3.138 1.00 . A A . 9 ILE HG22 1 1 16 3571 1 1 9 ILE HG23 H 5.688 1.685 2.104 1.00 . A A . 9 ILE HG23 1 1 16 3572 1 1 9 ILE N N 2.865 1.353 -0.549 1.00 . A A . 9 ILE N 1 1 16 3573 1 1 9 ILE O O 5.897 -0.237 0.010 1.00 . A A . 9 ILE O 1 1 16 3574 1 1 10 LYS C C 5.169 -2.750 -0.955 1.00 . A A . 10 LYS C 1 1 16 3575 1 1 10 LYS CA C 4.500 -2.504 0.400 1.00 . A A . 10 LYS CA 1 1 16 3576 1 1 10 LYS CB C 3.297 -3.429 0.582 1.00 . A A . 10 LYS CB 1 1 16 3577 1 1 10 LYS CD C 1.581 -4.458 -0.915 1.00 . A A . 10 LYS CD 1 1 16 3578 1 1 10 LYS CE C 2.605 -5.394 -1.563 1.00 . A A . 10 LYS CE 1 1 16 3579 1 1 10 LYS CG C 2.266 -3.151 -0.515 1.00 . A A . 10 LYS CG 1 1 16 3580 1 1 10 LYS H H 2.986 -0.988 0.643 1.00 . A A . 10 LYS H 1 1 16 3581 1 1 10 LYS HA H 5.205 -2.654 1.203 1.00 . A A . 10 LYS HA 1 1 16 3582 1 1 10 LYS HB2 H 3.622 -4.458 0.518 1.00 . A A . 10 LYS HB2 1 1 16 3583 1 1 10 LYS HB3 H 2.848 -3.253 1.548 1.00 . A A . 10 LYS HB3 1 1 16 3584 1 1 10 LYS HD2 H 1.165 -4.930 -0.038 1.00 . A A . 10 LYS HD2 1 1 16 3585 1 1 10 LYS HD3 H 0.791 -4.249 -1.621 1.00 . A A . 10 LYS HD3 1 1 16 3586 1 1 10 LYS HE2 H 3.594 -4.962 -1.508 1.00 . A A . 10 LYS HE2 1 1 16 3587 1 1 10 LYS HE3 H 2.587 -6.361 -1.084 1.00 . A A . 10 LYS HE3 1 1 16 3588 1 1 10 LYS HG2 H 1.528 -2.455 -0.144 1.00 . A A . 10 LYS HG2 1 1 16 3589 1 1 10 LYS HG3 H 2.762 -2.728 -1.375 1.00 . A A . 10 LYS HG3 1 1 16 3590 1 1 10 LYS HZ1 H 2.553 -6.393 -3.388 1.00 . A A . 10 LYS HZ1 1 1 16 3591 1 1 10 LYS HZ2 H 2.514 -4.700 -3.523 1.00 . A A . 10 LYS HZ2 1 1 16 3592 1 1 10 LYS HZ3 H 1.129 -5.547 -3.024 1.00 . A A . 10 LYS HZ3 1 1 16 3593 1 1 10 LYS N N 3.938 -1.123 0.453 1.00 . A A . 10 LYS N 1 1 16 3594 1 1 10 LYS NZ N 2.167 -5.518 -2.981 1.00 . A A . 10 LYS NZ 1 1 16 3595 1 1 10 LYS O O 6.043 -3.582 -1.084 1.00 . A A . 10 LYS O 1 1 16 3596 1 1 11 SER C C 6.676 -1.422 -3.420 1.00 . A A . 11 SER C 1 1 16 3597 1 1 11 SER CA C 5.378 -2.224 -3.311 1.00 . A A . 11 SER CA 1 1 16 3598 1 1 11 SER CB C 4.339 -1.698 -4.299 1.00 . A A . 11 SER CB 1 1 16 3599 1 1 11 SER H H 4.057 -1.364 -1.841 1.00 . A A . 11 SER H 1 1 16 3600 1 1 11 SER HA H 5.563 -3.271 -3.494 1.00 . A A . 11 SER HA 1 1 16 3601 1 1 11 SER HB2 H 3.396 -2.193 -4.133 1.00 . A A . 11 SER HB2 1 1 16 3602 1 1 11 SER HB3 H 4.213 -0.632 -4.155 1.00 . A A . 11 SER HB3 1 1 16 3603 1 1 11 SER HG H 5.725 -1.816 -5.659 1.00 . A A . 11 SER HG 1 1 16 3604 1 1 11 SER N N 4.764 -2.031 -1.966 1.00 . A A . 11 SER N 1 1 16 3605 1 1 11 SER O O 7.506 -1.679 -4.269 1.00 . A A . 11 SER O 1 1 16 3606 1 1 11 SER OG O 4.777 -1.959 -5.626 1.00 . A A . 11 SER OG 1 1 16 3607 1 1 12 LEU C C 9.101 -0.115 -1.570 1.00 . A A . 12 LEU C 1 1 16 3608 1 1 12 LEU CA C 8.104 0.367 -2.624 1.00 . A A . 12 LEU CA 1 1 16 3609 1 1 12 LEU CB C 7.653 1.796 -2.322 1.00 . A A . 12 LEU CB 1 1 16 3610 1 1 12 LEU CD1 C 7.419 3.059 -4.466 1.00 . A A . 12 LEU CD1 1 1 16 3611 1 1 12 LEU CD2 C 8.664 4.068 -2.550 1.00 . A A . 12 LEU CD2 1 1 16 3612 1 1 12 LEU CG C 8.345 2.764 -3.284 1.00 . A A . 12 LEU CG 1 1 16 3613 1 1 12 LEU H H 6.177 -0.259 -1.890 1.00 . A A . 12 LEU H 1 1 16 3614 1 1 12 LEU HA H 8.542 0.318 -3.606 1.00 . A A . 12 LEU HA 1 1 16 3615 1 1 12 LEU HB2 H 6.582 1.870 -2.445 1.00 . A A . 12 LEU HB2 1 1 16 3616 1 1 12 LEU HB3 H 7.917 2.051 -1.307 1.00 . A A . 12 LEU HB3 1 1 16 3617 1 1 12 LEU HD11 H 6.431 3.292 -4.100 1.00 . A A . 12 LEU HD11 1 1 16 3618 1 1 12 LEU HD12 H 7.371 2.193 -5.110 1.00 . A A . 12 LEU HD12 1 1 16 3619 1 1 12 LEU HD13 H 7.805 3.900 -5.022 1.00 . A A . 12 LEU HD13 1 1 16 3620 1 1 12 LEU HD21 H 8.675 4.885 -3.256 1.00 . A A . 12 LEU HD21 1 1 16 3621 1 1 12 LEU HD22 H 9.633 3.988 -2.078 1.00 . A A . 12 LEU HD22 1 1 16 3622 1 1 12 LEU HD23 H 7.912 4.251 -1.797 1.00 . A A . 12 LEU HD23 1 1 16 3623 1 1 12 LEU HG H 9.260 2.318 -3.646 1.00 . A A . 12 LEU HG 1 1 16 3624 1 1 12 LEU N N 6.858 -0.451 -2.567 1.00 . A A . 12 LEU N 1 1 16 3625 1 1 12 LEU O O 10.287 -0.201 -1.815 1.00 . A A . 12 LEU O 1 1 16 3626 1 1 13 PHE C C 8.925 -2.099 1.409 1.00 . A A . 13 PHE C 1 1 16 3627 1 1 13 PHE CA C 9.545 -0.905 0.676 1.00 . A A . 13 PHE CA 1 1 16 3628 1 1 13 PHE CB C 9.698 0.286 1.622 1.00 . A A . 13 PHE CB 1 1 16 3629 1 1 13 PHE CD1 C 12.025 0.530 0.697 1.00 . A A . 13 PHE CD1 1 1 16 3630 1 1 13 PHE CD2 C 11.661 0.960 3.054 1.00 . A A . 13 PHE CD2 1 1 16 3631 1 1 13 PHE CE1 C 13.383 0.819 0.852 1.00 . A A . 13 PHE CE1 1 1 16 3632 1 1 13 PHE CE2 C 13.021 1.251 3.210 1.00 . A A . 13 PHE CE2 1 1 16 3633 1 1 13 PHE CG C 11.163 0.600 1.796 1.00 . A A . 13 PHE CG 1 1 16 3634 1 1 13 PHE CZ C 13.883 1.179 2.109 1.00 . A A . 13 PHE CZ 1 1 16 3635 1 1 13 PHE H H 7.667 -0.351 -0.226 1.00 . A A . 13 PHE H 1 1 16 3636 1 1 13 PHE HA H 10.504 -1.173 0.261 1.00 . A A . 13 PHE HA 1 1 16 3637 1 1 13 PHE HB2 H 9.192 1.144 1.206 1.00 . A A . 13 PHE HB2 1 1 16 3638 1 1 13 PHE HB3 H 9.267 0.042 2.582 1.00 . A A . 13 PHE HB3 1 1 16 3639 1 1 13 PHE HD1 H 11.640 0.252 -0.273 1.00 . A A . 13 PHE HD1 1 1 16 3640 1 1 13 PHE HD2 H 10.996 1.016 3.904 1.00 . A A . 13 PHE HD2 1 1 16 3641 1 1 13 PHE HE1 H 14.045 0.762 0.003 1.00 . A A . 13 PHE HE1 1 1 16 3642 1 1 13 PHE HE2 H 13.407 1.529 4.181 1.00 . A A . 13 PHE HE2 1 1 16 3643 1 1 13 PHE HZ H 14.933 1.402 2.229 1.00 . A A . 13 PHE HZ 1 1 16 3644 1 1 13 PHE N N 8.627 -0.429 -0.398 1.00 . A A . 13 PHE N 1 1 16 3645 1 1 13 PHE O O 7.765 -2.075 1.768 1.00 . A A . 13 PHE O 1 1 16 3646 1 1 14 NH2 HN1 H 10.595 -3.171 1.358 1.00 . A A . 14 NH2 HN1 1 1 16 3647 1 1 14 NH2 HN2 H 9.273 -3.920 2.116 1.00 . A A . 14 NH2 HN2 1 1 16 3648 1 1 14 NH2 N N 9.659 -3.151 1.647 1.00 . A A . 14 NH2 N 1 1 17 3649 1 1 1 ILE C C -7.867 -4.006 1.136 1.00 . A A . 1 ILE C 1 1 17 3650 1 1 1 ILE CA C -7.381 -5.188 0.292 1.00 . A A . 1 ILE CA 1 1 17 3651 1 1 1 ILE CB C -8.034 -5.165 -1.090 1.00 . A A . 1 ILE CB 1 1 17 3652 1 1 1 ILE CD1 C -7.811 -4.203 -3.386 1.00 . A A . 1 ILE CD1 1 1 17 3653 1 1 1 ILE CG1 C -7.439 -4.020 -1.913 1.00 . A A . 1 ILE CG1 1 1 17 3654 1 1 1 ILE CG2 C -9.542 -4.954 -0.940 1.00 . A A . 1 ILE CG2 1 1 17 3655 1 1 1 ILE H1 H -7.102 -6.799 1.582 1.00 . A A . 1 ILE H1 1 1 17 3656 1 1 1 ILE H2 H -7.944 -7.189 0.159 1.00 . A A . 1 ILE H2 1 1 17 3657 1 1 1 ILE H3 H -8.723 -6.332 1.402 1.00 . A A . 1 ILE H3 1 1 17 3658 1 1 1 ILE HA H -6.307 -5.164 0.193 1.00 . A A . 1 ILE HA 1 1 17 3659 1 1 1 ILE HB H -7.851 -6.104 -1.591 1.00 . A A . 1 ILE HB 1 1 17 3660 1 1 1 ILE HD11 H -8.524 -5.009 -3.480 1.00 . A A . 1 ILE HD11 1 1 17 3661 1 1 1 ILE HD12 H -6.924 -4.439 -3.956 1.00 . A A . 1 ILE HD12 1 1 17 3662 1 1 1 ILE HD13 H -8.249 -3.291 -3.763 1.00 . A A . 1 ILE HD13 1 1 17 3663 1 1 1 ILE HG12 H -7.831 -3.079 -1.557 1.00 . A A . 1 ILE HG12 1 1 17 3664 1 1 1 ILE HG13 H -6.364 -4.025 -1.814 1.00 . A A . 1 ILE HG13 1 1 17 3665 1 1 1 ILE HG21 H -9.868 -5.355 0.009 1.00 . A A . 1 ILE HG21 1 1 17 3666 1 1 1 ILE HG22 H -10.057 -5.461 -1.742 1.00 . A A . 1 ILE HG22 1 1 17 3667 1 1 1 ILE HG23 H -9.763 -3.897 -0.980 1.00 . A A . 1 ILE HG23 1 1 17 3668 1 1 1 ILE N N -7.820 -6.474 0.905 1.00 . A A . 1 ILE N 1 1 17 3669 1 1 1 ILE O O -8.156 -2.943 0.625 1.00 . A A . 1 ILE O 1 1 17 3670 1 1 2 LEU C C -7.381 -1.955 3.340 1.00 . A A . 2 LEU C 1 1 17 3671 1 1 2 LEU CA C -8.426 -3.073 3.303 1.00 . A A . 2 LEU CA 1 1 17 3672 1 1 2 LEU CB C -8.585 -3.703 4.687 1.00 . A A . 2 LEU CB 1 1 17 3673 1 1 2 LEU CD1 C -10.034 -1.815 5.449 1.00 . A A . 2 LEU CD1 1 1 17 3674 1 1 2 LEU CD2 C -11.052 -3.787 4.301 1.00 . A A . 2 LEU CD2 1 1 17 3675 1 1 2 LEU CG C -9.952 -3.331 5.264 1.00 . A A . 2 LEU CG 1 1 17 3676 1 1 2 LEU H H -7.721 -5.052 2.818 1.00 . A A . 2 LEU H 1 1 17 3677 1 1 2 LEU HA H -9.375 -2.694 2.959 1.00 . A A . 2 LEU HA 1 1 17 3678 1 1 2 LEU HB2 H -8.509 -4.778 4.603 1.00 . A A . 2 LEU HB2 1 1 17 3679 1 1 2 LEU HB3 H -7.808 -3.336 5.340 1.00 . A A . 2 LEU HB3 1 1 17 3680 1 1 2 LEU HD11 H -10.684 -1.395 4.694 1.00 . A A . 2 LEU HD11 1 1 17 3681 1 1 2 LEU HD12 H -9.047 -1.386 5.354 1.00 . A A . 2 LEU HD12 1 1 17 3682 1 1 2 LEU HD13 H -10.431 -1.593 6.429 1.00 . A A . 2 LEU HD13 1 1 17 3683 1 1 2 LEU HD21 H -11.453 -2.930 3.782 1.00 . A A . 2 LEU HD21 1 1 17 3684 1 1 2 LEU HD22 H -11.840 -4.271 4.859 1.00 . A A . 2 LEU HD22 1 1 17 3685 1 1 2 LEU HD23 H -10.638 -4.481 3.585 1.00 . A A . 2 LEU HD23 1 1 17 3686 1 1 2 LEU HG H -10.083 -3.818 6.219 1.00 . A A . 2 LEU HG 1 1 17 3687 1 1 2 LEU N N -7.959 -4.186 2.425 1.00 . A A . 2 LEU N 1 1 17 3688 1 1 2 LEU O O -7.605 -0.902 3.902 1.00 . A A . 2 LEU O 1 1 17 3689 1 1 3 GLY C C -4.809 -0.777 1.311 1.00 . A A . 3 GLY C 1 1 17 3690 1 1 3 GLY CA C -5.183 -1.128 2.749 1.00 . A A . 3 GLY CA 1 1 17 3691 1 1 3 GLY H H -6.080 -3.033 2.300 1.00 . A A . 3 GLY H 1 1 17 3692 1 1 3 GLY HA2 H -5.552 -0.246 3.252 1.00 . A A . 3 GLY HA2 1 1 17 3693 1 1 3 GLY HA3 H -4.311 -1.496 3.264 1.00 . A A . 3 GLY HA3 1 1 17 3694 1 1 3 GLY N N -6.240 -2.177 2.748 1.00 . A A . 3 GLY N 1 1 17 3695 1 1 3 GLY O O -3.762 -1.151 0.821 1.00 . A A . 3 GLY O 1 1 17 3696 1 1 4 LYS C C -4.193 1.318 -0.806 1.00 . A A . 4 LYS C 1 1 17 3697 1 1 4 LYS CA C -5.351 0.323 -0.776 1.00 . A A . 4 LYS CA 1 1 17 3698 1 1 4 LYS CB C -6.634 0.970 -1.299 1.00 . A A . 4 LYS CB 1 1 17 3699 1 1 4 LYS CD C -7.226 1.341 -3.698 1.00 . A A . 4 LYS CD 1 1 17 3700 1 1 4 LYS CE C -8.257 0.853 -4.720 1.00 . A A . 4 LYS CE 1 1 17 3701 1 1 4 LYS CG C -7.059 0.287 -2.601 1.00 . A A . 4 LYS CG 1 1 17 3702 1 1 4 LYS H H -6.491 0.232 1.051 1.00 . A A . 4 LYS H 1 1 17 3703 1 1 4 LYS HA H -5.111 -0.550 -1.359 1.00 . A A . 4 LYS HA 1 1 17 3704 1 1 4 LYS HB2 H -7.418 0.862 -0.563 1.00 . A A . 4 LYS HB2 1 1 17 3705 1 1 4 LYS HB3 H -6.458 2.019 -1.487 1.00 . A A . 4 LYS HB3 1 1 17 3706 1 1 4 LYS HD2 H -7.565 2.268 -3.258 1.00 . A A . 4 LYS HD2 1 1 17 3707 1 1 4 LYS HD3 H -6.280 1.500 -4.192 1.00 . A A . 4 LYS HD3 1 1 17 3708 1 1 4 LYS HE2 H -8.224 -0.225 -4.800 1.00 . A A . 4 LYS HE2 1 1 17 3709 1 1 4 LYS HE3 H -9.246 1.183 -4.443 1.00 . A A . 4 LYS HE3 1 1 17 3710 1 1 4 LYS HG2 H -6.302 -0.425 -2.897 1.00 . A A . 4 LYS HG2 1 1 17 3711 1 1 4 LYS HG3 H -7.997 -0.224 -2.449 1.00 . A A . 4 LYS HG3 1 1 17 3712 1 1 4 LYS HZ1 H -6.812 1.504 -6.070 1.00 . A A . 4 LYS HZ1 1 1 17 3713 1 1 4 LYS HZ2 H -8.218 2.457 -6.047 1.00 . A A . 4 LYS HZ2 1 1 17 3714 1 1 4 LYS HZ3 H -8.233 0.934 -6.800 1.00 . A A . 4 LYS HZ3 1 1 17 3715 1 1 4 LYS N N -5.655 -0.059 0.632 1.00 . A A . 4 LYS N 1 1 17 3716 1 1 4 LYS NZ N -7.849 1.485 -6.006 1.00 . A A . 4 LYS NZ 1 1 17 3717 1 1 4 LYS O O -3.309 1.239 -1.636 1.00 . A A . 4 LYS O 1 1 17 3718 1 1 5 ILE C C -1.801 2.586 0.630 1.00 . A A . 5 ILE C 1 1 17 3719 1 1 5 ILE CA C -3.088 3.253 0.140 1.00 . A A . 5 ILE CA 1 1 17 3720 1 1 5 ILE CB C -3.557 4.315 1.133 1.00 . A A . 5 ILE CB 1 1 17 3721 1 1 5 ILE CD1 C -4.056 6.081 -0.568 1.00 . A A . 5 ILE CD1 1 1 17 3722 1 1 5 ILE CG1 C -4.663 5.158 0.491 1.00 . A A . 5 ILE CG1 1 1 17 3723 1 1 5 ILE CG2 C -2.382 5.219 1.513 1.00 . A A . 5 ILE CG2 1 1 17 3724 1 1 5 ILE H H -4.911 2.291 0.762 1.00 . A A . 5 ILE H 1 1 17 3725 1 1 5 ILE HA H -2.941 3.693 -0.834 1.00 . A A . 5 ILE HA 1 1 17 3726 1 1 5 ILE HB H -3.940 3.832 2.020 1.00 . A A . 5 ILE HB 1 1 17 3727 1 1 5 ILE HD11 H -3.085 5.707 -0.857 1.00 . A A . 5 ILE HD11 1 1 17 3728 1 1 5 ILE HD12 H -3.953 7.076 -0.161 1.00 . A A . 5 ILE HD12 1 1 17 3729 1 1 5 ILE HD13 H -4.703 6.110 -1.433 1.00 . A A . 5 ILE HD13 1 1 17 3730 1 1 5 ILE HG12 H -5.388 4.506 0.027 1.00 . A A . 5 ILE HG12 1 1 17 3731 1 1 5 ILE HG13 H -5.148 5.754 1.250 1.00 . A A . 5 ILE HG13 1 1 17 3732 1 1 5 ILE HG21 H -2.753 6.193 1.793 1.00 . A A . 5 ILE HG21 1 1 17 3733 1 1 5 ILE HG22 H -1.716 5.316 0.668 1.00 . A A . 5 ILE HG22 1 1 17 3734 1 1 5 ILE HG23 H -1.847 4.783 2.344 1.00 . A A . 5 ILE HG23 1 1 17 3735 1 1 5 ILE N N -4.190 2.252 0.101 1.00 . A A . 5 ILE N 1 1 17 3736 1 1 5 ILE O O -0.707 2.984 0.282 1.00 . A A . 5 ILE O 1 1 17 3737 1 1 6 TRP C C -0.104 0.006 0.836 1.00 . A A . 6 TRP C 1 1 17 3738 1 1 6 TRP CA C -0.722 0.861 1.948 1.00 . A A . 6 TRP CA 1 1 17 3739 1 1 6 TRP CB C -1.237 -0.018 3.090 1.00 . A A . 6 TRP CB 1 1 17 3740 1 1 6 TRP CD1 C -0.416 -2.405 3.226 1.00 . A A . 6 TRP CD1 1 1 17 3741 1 1 6 TRP CD2 C 1.107 -0.924 3.968 1.00 . A A . 6 TRP CD2 1 1 17 3742 1 1 6 TRP CE2 C 1.690 -2.207 4.098 1.00 . A A . 6 TRP CE2 1 1 17 3743 1 1 6 TRP CE3 C 1.864 0.192 4.369 1.00 . A A . 6 TRP CE3 1 1 17 3744 1 1 6 TRP CG C -0.231 -1.077 3.411 1.00 . A A . 6 TRP CG 1 1 17 3745 1 1 6 TRP CH2 C 3.716 -1.257 5.001 1.00 . A A . 6 TRP CH2 1 1 17 3746 1 1 6 TRP CZ2 C 2.978 -2.376 4.608 1.00 . A A . 6 TRP CZ2 1 1 17 3747 1 1 6 TRP CZ3 C 3.161 0.024 4.882 1.00 . A A . 6 TRP CZ3 1 1 17 3748 1 1 6 TRP H H -2.823 1.260 1.697 1.00 . A A . 6 TRP H 1 1 17 3749 1 1 6 TRP HA H -0.001 1.570 2.323 1.00 . A A . 6 TRP HA 1 1 17 3750 1 1 6 TRP HB2 H -1.406 0.593 3.964 1.00 . A A . 6 TRP HB2 1 1 17 3751 1 1 6 TRP HB3 H -2.166 -0.484 2.793 1.00 . A A . 6 TRP HB3 1 1 17 3752 1 1 6 TRP HD1 H -1.307 -2.865 2.825 1.00 . A A . 6 TRP HD1 1 1 17 3753 1 1 6 TRP HE1 H 0.848 -4.047 3.602 1.00 . A A . 6 TRP HE1 1 1 17 3754 1 1 6 TRP HE3 H 1.446 1.184 4.281 1.00 . A A . 6 TRP HE3 1 1 17 3755 1 1 6 TRP HH2 H 4.714 -1.380 5.396 1.00 . A A . 6 TRP HH2 1 1 17 3756 1 1 6 TRP HZ2 H 3.401 -3.366 4.697 1.00 . A A . 6 TRP HZ2 1 1 17 3757 1 1 6 TRP HZ3 H 3.733 0.888 5.187 1.00 . A A . 6 TRP HZ3 1 1 17 3758 1 1 6 TRP N N -1.929 1.565 1.433 1.00 . A A . 6 TRP N 1 1 17 3759 1 1 6 TRP NE1 N 0.723 -3.076 3.633 1.00 . A A . 6 TRP NE1 1 1 17 3760 1 1 6 TRP O O 1.075 -0.285 0.846 1.00 . A A . 6 TRP O 1 1 17 3761 1 1 7 GLU C C 0.739 -0.448 -1.980 1.00 . A A . 7 GLU C 1 1 17 3762 1 1 7 GLU CA C -0.347 -1.225 -1.236 1.00 . A A . 7 GLU CA 1 1 17 3763 1 1 7 GLU CB C -1.540 -1.494 -2.153 1.00 . A A . 7 GLU CB 1 1 17 3764 1 1 7 GLU CD C -2.827 -3.345 -3.230 1.00 . A A . 7 GLU CD 1 1 17 3765 1 1 7 GLU CG C -1.461 -2.927 -2.686 1.00 . A A . 7 GLU CG 1 1 17 3766 1 1 7 GLU H H -1.842 -0.147 -0.117 1.00 . A A . 7 GLU H 1 1 17 3767 1 1 7 GLU HA H 0.045 -2.153 -0.856 1.00 . A A . 7 GLU HA 1 1 17 3768 1 1 7 GLU HB2 H -2.457 -1.366 -1.597 1.00 . A A . 7 GLU HB2 1 1 17 3769 1 1 7 GLU HB3 H -1.520 -0.803 -2.982 1.00 . A A . 7 GLU HB3 1 1 17 3770 1 1 7 GLU HG2 H -0.726 -2.975 -3.478 1.00 . A A . 7 GLU HG2 1 1 17 3771 1 1 7 GLU HG3 H -1.174 -3.593 -1.887 1.00 . A A . 7 GLU HG3 1 1 17 3772 1 1 7 GLU N N -0.894 -0.394 -0.124 1.00 . A A . 7 GLU N 1 1 17 3773 1 1 7 GLU O O 1.684 -1.015 -2.492 1.00 . A A . 7 GLU O 1 1 17 3774 1 1 7 GLU OE1 O -3.782 -2.622 -3.001 1.00 . A A . 7 GLU OE1 1 1 17 3775 1 1 7 GLU OE2 O -2.897 -4.384 -3.867 1.00 . A A . 7 GLU OE2 1 1 17 3776 1 1 8 GLY C C 2.814 1.925 -1.807 1.00 . A A . 8 GLY C 1 1 17 3777 1 1 8 GLY CA C 1.636 1.667 -2.747 1.00 . A A . 8 GLY CA 1 1 17 3778 1 1 8 GLY H H -0.158 1.283 -1.617 1.00 . A A . 8 GLY H 1 1 17 3779 1 1 8 GLY HA2 H 1.980 1.136 -3.623 1.00 . A A . 8 GLY HA2 1 1 17 3780 1 1 8 GLY HA3 H 1.203 2.610 -3.043 1.00 . A A . 8 GLY HA3 1 1 17 3781 1 1 8 GLY N N 0.612 0.848 -2.040 1.00 . A A . 8 GLY N 1 1 17 3782 1 1 8 GLY O O 3.941 2.079 -2.234 1.00 . A A . 8 GLY O 1 1 17 3783 1 1 9 ILE C C 4.584 0.990 0.518 1.00 . A A . 9 ILE C 1 1 17 3784 1 1 9 ILE CA C 3.669 2.215 0.443 1.00 . A A . 9 ILE CA 1 1 17 3785 1 1 9 ILE CB C 2.975 2.449 1.785 1.00 . A A . 9 ILE CB 1 1 17 3786 1 1 9 ILE CD1 C 1.460 3.979 3.055 1.00 . A A . 9 ILE CD1 1 1 17 3787 1 1 9 ILE CG1 C 2.091 3.695 1.689 1.00 . A A . 9 ILE CG1 1 1 17 3788 1 1 9 ILE CG2 C 4.028 2.656 2.875 1.00 . A A . 9 ILE CG2 1 1 17 3789 1 1 9 ILE H H 1.647 1.841 -0.203 1.00 . A A . 9 ILE H 1 1 17 3790 1 1 9 ILE HA H 4.232 3.091 0.160 1.00 . A A . 9 ILE HA 1 1 17 3791 1 1 9 ILE HB H 2.366 1.591 2.030 1.00 . A A . 9 ILE HB 1 1 17 3792 1 1 9 ILE HD11 H 0.600 3.342 3.193 1.00 . A A . 9 ILE HD11 1 1 17 3793 1 1 9 ILE HD12 H 1.153 5.014 3.101 1.00 . A A . 9 ILE HD12 1 1 17 3794 1 1 9 ILE HD13 H 2.183 3.783 3.833 1.00 . A A . 9 ILE HD13 1 1 17 3795 1 1 9 ILE HG12 H 2.691 4.541 1.387 1.00 . A A . 9 ILE HG12 1 1 17 3796 1 1 9 ILE HG13 H 1.310 3.529 0.963 1.00 . A A . 9 ILE HG13 1 1 17 3797 1 1 9 ILE HG21 H 5.007 2.712 2.424 1.00 . A A . 9 ILE HG21 1 1 17 3798 1 1 9 ILE HG22 H 3.997 1.826 3.566 1.00 . A A . 9 ILE HG22 1 1 17 3799 1 1 9 ILE HG23 H 3.822 3.573 3.405 1.00 . A A . 9 ILE HG23 1 1 17 3800 1 1 9 ILE N N 2.563 1.970 -0.527 1.00 . A A . 9 ILE N 1 1 17 3801 1 1 9 ILE O O 5.750 1.052 0.181 1.00 . A A . 9 ILE O 1 1 17 3802 1 1 10 LYS C C 5.579 -1.633 -0.296 1.00 . A A . 10 LYS C 1 1 17 3803 1 1 10 LYS CA C 4.905 -1.353 1.049 1.00 . A A . 10 LYS CA 1 1 17 3804 1 1 10 LYS CB C 3.930 -2.476 1.406 1.00 . A A . 10 LYS CB 1 1 17 3805 1 1 10 LYS CD C 3.745 -3.947 -0.606 1.00 . A A . 10 LYS CD 1 1 17 3806 1 1 10 LYS CE C 2.907 -5.222 -0.489 1.00 . A A . 10 LYS CE 1 1 17 3807 1 1 10 LYS CG C 3.076 -2.821 0.184 1.00 . A A . 10 LYS CG 1 1 17 3808 1 1 10 LYS H H 3.122 -0.156 1.219 1.00 . A A . 10 LYS H 1 1 17 3809 1 1 10 LYS HA H 5.645 -1.245 1.826 1.00 . A A . 10 LYS HA 1 1 17 3810 1 1 10 LYS HB2 H 4.486 -3.349 1.716 1.00 . A A . 10 LYS HB2 1 1 17 3811 1 1 10 LYS HB3 H 3.288 -2.152 2.212 1.00 . A A . 10 LYS HB3 1 1 17 3812 1 1 10 LYS HD2 H 3.824 -3.661 -1.645 1.00 . A A . 10 LYS HD2 1 1 17 3813 1 1 10 LYS HD3 H 4.732 -4.130 -0.207 1.00 . A A . 10 LYS HD3 1 1 17 3814 1 1 10 LYS HE2 H 1.861 -4.971 -0.375 1.00 . A A . 10 LYS HE2 1 1 17 3815 1 1 10 LYS HE3 H 3.053 -5.850 -1.354 1.00 . A A . 10 LYS HE3 1 1 17 3816 1 1 10 LYS HG2 H 2.097 -3.139 0.509 1.00 . A A . 10 LYS HG2 1 1 17 3817 1 1 10 LYS HG3 H 2.981 -1.949 -0.446 1.00 . A A . 10 LYS HG3 1 1 17 3818 1 1 10 LYS HZ1 H 4.415 -5.659 0.877 1.00 . A A . 10 LYS HZ1 1 1 17 3819 1 1 10 LYS HZ2 H 3.327 -6.936 0.613 1.00 . A A . 10 LYS HZ2 1 1 17 3820 1 1 10 LYS HZ3 H 2.863 -5.602 1.557 1.00 . A A . 10 LYS HZ3 1 1 17 3821 1 1 10 LYS N N 4.064 -0.125 0.955 1.00 . A A . 10 LYS N 1 1 17 3822 1 1 10 LYS NZ N 3.417 -5.906 0.731 1.00 . A A . 10 LYS NZ 1 1 17 3823 1 1 10 LYS O O 6.628 -2.245 -0.362 1.00 . A A . 10 LYS O 1 1 17 3824 1 1 11 SER C C 6.863 -0.589 -2.871 1.00 . A A . 11 SER C 1 1 17 3825 1 1 11 SER CA C 5.593 -1.428 -2.711 1.00 . A A . 11 SER CA 1 1 17 3826 1 1 11 SER CB C 4.529 -0.986 -3.713 1.00 . A A . 11 SER CB 1 1 17 3827 1 1 11 SER H H 4.143 -0.697 -1.296 1.00 . A A . 11 SER H 1 1 17 3828 1 1 11 SER HA H 5.814 -2.475 -2.845 1.00 . A A . 11 SER HA 1 1 17 3829 1 1 11 SER HB2 H 3.967 -0.163 -3.304 1.00 . A A . 11 SER HB2 1 1 17 3830 1 1 11 SER HB3 H 5.007 -0.671 -4.630 1.00 . A A . 11 SER HB3 1 1 17 3831 1 1 11 SER HG H 2.847 -1.717 -4.364 1.00 . A A . 11 SER HG 1 1 17 3832 1 1 11 SER N N 4.987 -1.190 -1.371 1.00 . A A . 11 SER N 1 1 17 3833 1 1 11 SER O O 7.787 -0.965 -3.564 1.00 . A A . 11 SER O 1 1 17 3834 1 1 11 SER OG O 3.648 -2.071 -3.971 1.00 . A A . 11 SER OG 1 1 17 3835 1 1 12 LEU C C 9.289 0.792 -1.574 1.00 . A A . 12 LEU C 1 1 17 3836 1 1 12 LEU CA C 8.120 1.414 -2.343 1.00 . A A . 12 LEU CA 1 1 17 3837 1 1 12 LEU CB C 7.710 2.744 -1.711 1.00 . A A . 12 LEU CB 1 1 17 3838 1 1 12 LEU CD1 C 6.700 4.715 -2.869 1.00 . A A . 12 LEU CD1 1 1 17 3839 1 1 12 LEU CD2 C 9.094 4.773 -2.162 1.00 . A A . 12 LEU CD2 1 1 17 3840 1 1 12 LEU CG C 7.972 3.882 -2.699 1.00 . A A . 12 LEU CG 1 1 17 3841 1 1 12 LEU H H 6.155 0.830 -1.680 1.00 . A A . 12 LEU H 1 1 17 3842 1 1 12 LEU HA H 8.384 1.563 -3.378 1.00 . A A . 12 LEU HA 1 1 17 3843 1 1 12 LEU HB2 H 6.658 2.716 -1.464 1.00 . A A . 12 LEU HB2 1 1 17 3844 1 1 12 LEU HB3 H 8.286 2.911 -0.814 1.00 . A A . 12 LEU HB3 1 1 17 3845 1 1 12 LEU HD11 H 5.848 4.057 -2.963 1.00 . A A . 12 LEU HD11 1 1 17 3846 1 1 12 LEU HD12 H 6.784 5.324 -3.757 1.00 . A A . 12 LEU HD12 1 1 17 3847 1 1 12 LEU HD13 H 6.568 5.352 -2.007 1.00 . A A . 12 LEU HD13 1 1 17 3848 1 1 12 LEU HD21 H 8.732 5.341 -1.318 1.00 . A A . 12 LEU HD21 1 1 17 3849 1 1 12 LEU HD22 H 9.420 5.450 -2.938 1.00 . A A . 12 LEU HD22 1 1 17 3850 1 1 12 LEU HD23 H 9.925 4.157 -1.851 1.00 . A A . 12 LEU HD23 1 1 17 3851 1 1 12 LEU HG H 8.262 3.470 -3.655 1.00 . A A . 12 LEU HG 1 1 17 3852 1 1 12 LEU N N 6.913 0.547 -2.232 1.00 . A A . 12 LEU N 1 1 17 3853 1 1 12 LEU O O 10.441 1.036 -1.874 1.00 . A A . 12 LEU O 1 1 17 3854 1 1 13 PHE C C 11.034 0.422 0.766 1.00 . A A . 13 PHE C 1 1 17 3855 1 1 13 PHE CA C 10.096 -0.648 0.200 1.00 . A A . 13 PHE CA 1 1 17 3856 1 1 13 PHE CB C 10.837 -1.536 -0.801 1.00 . A A . 13 PHE CB 1 1 17 3857 1 1 13 PHE CD1 C 10.167 -3.501 0.624 1.00 . A A . 13 PHE CD1 1 1 17 3858 1 1 13 PHE CD2 C 12.389 -3.470 -0.345 1.00 . A A . 13 PHE CD2 1 1 17 3859 1 1 13 PHE CE1 C 10.443 -4.732 1.223 1.00 . A A . 13 PHE CE1 1 1 17 3860 1 1 13 PHE CE2 C 12.667 -4.705 0.253 1.00 . A A . 13 PHE CE2 1 1 17 3861 1 1 13 PHE CG C 11.139 -2.868 -0.159 1.00 . A A . 13 PHE CG 1 1 17 3862 1 1 13 PHE CZ C 11.693 -5.336 1.038 1.00 . A A . 13 PHE CZ 1 1 17 3863 1 1 13 PHE H H 8.065 -0.194 -0.362 1.00 . A A . 13 PHE H 1 1 17 3864 1 1 13 PHE HA H 9.688 -1.251 0.997 1.00 . A A . 13 PHE HA 1 1 17 3865 1 1 13 PHE HB2 H 10.220 -1.687 -1.674 1.00 . A A . 13 PHE HB2 1 1 17 3866 1 1 13 PHE HB3 H 11.762 -1.059 -1.090 1.00 . A A . 13 PHE HB3 1 1 17 3867 1 1 13 PHE HD1 H 9.202 -3.036 0.767 1.00 . A A . 13 PHE HD1 1 1 17 3868 1 1 13 PHE HD2 H 13.139 -2.982 -0.951 1.00 . A A . 13 PHE HD2 1 1 17 3869 1 1 13 PHE HE1 H 9.693 -5.217 1.827 1.00 . A A . 13 PHE HE1 1 1 17 3870 1 1 13 PHE HE2 H 13.631 -5.169 0.110 1.00 . A A . 13 PHE HE2 1 1 17 3871 1 1 13 PHE HZ H 11.907 -6.289 1.500 1.00 . A A . 13 PHE HZ 1 1 17 3872 1 1 13 PHE N N 9.001 -0.010 -0.586 1.00 . A A . 13 PHE N 1 1 17 3873 1 1 13 PHE O O 10.661 1.570 0.902 1.00 . A A . 13 PHE O 1 1 17 3874 1 1 14 NH2 HN1 H 12.553 -0.836 0.998 1.00 . A A . 14 NH2 HN1 1 1 17 3875 1 1 14 NH2 HN2 H 12.859 0.765 1.469 1.00 . A A . 14 NH2 HN2 1 1 17 3876 1 1 14 NH2 N N 12.250 0.089 1.106 1.00 . A A . 14 NH2 N 1 1 18 3877 1 1 1 ILE C C -7.958 -3.320 0.621 1.00 . A A . 1 ILE C 1 1 18 3878 1 1 1 ILE CA C -7.751 -4.834 0.717 1.00 . A A . 1 ILE CA 1 1 18 3879 1 1 1 ILE CB C -6.608 -5.278 -0.197 1.00 . A A . 1 ILE CB 1 1 18 3880 1 1 1 ILE CD1 C -5.993 -5.809 -2.561 1.00 . A A . 1 ILE CD1 1 1 18 3881 1 1 1 ILE CG1 C -7.058 -5.184 -1.658 1.00 . A A . 1 ILE CG1 1 1 18 3882 1 1 1 ILE CG2 C -6.229 -6.725 0.126 1.00 . A A . 1 ILE CG2 1 1 18 3883 1 1 1 ILE H1 H -8.668 -6.463 -0.204 1.00 . A A . 1 ILE H1 1 1 18 3884 1 1 1 ILE H2 H -9.422 -4.973 -0.519 1.00 . A A . 1 ILE H2 1 1 18 3885 1 1 1 ILE H3 H -9.614 -5.722 0.993 1.00 . A A . 1 ILE H3 1 1 18 3886 1 1 1 ILE HA H -7.541 -5.122 1.734 1.00 . A A . 1 ILE HA 1 1 18 3887 1 1 1 ILE HB H -5.752 -4.638 -0.039 1.00 . A A . 1 ILE HB 1 1 18 3888 1 1 1 ILE HD11 H -5.754 -5.126 -3.362 1.00 . A A . 1 ILE HD11 1 1 18 3889 1 1 1 ILE HD12 H -6.369 -6.733 -2.974 1.00 . A A . 1 ILE HD12 1 1 18 3890 1 1 1 ILE HD13 H -5.103 -6.010 -1.982 1.00 . A A . 1 ILE HD13 1 1 18 3891 1 1 1 ILE HG12 H -7.992 -5.713 -1.781 1.00 . A A . 1 ILE HG12 1 1 18 3892 1 1 1 ILE HG13 H -7.192 -4.147 -1.928 1.00 . A A . 1 ILE HG13 1 1 18 3893 1 1 1 ILE HG21 H -6.220 -6.865 1.196 1.00 . A A . 1 ILE HG21 1 1 18 3894 1 1 1 ILE HG22 H -5.248 -6.937 -0.273 1.00 . A A . 1 ILE HG22 1 1 18 3895 1 1 1 ILE HG23 H -6.950 -7.394 -0.319 1.00 . A A . 1 ILE HG23 1 1 18 3896 1 1 1 ILE N N -8.955 -5.552 0.208 1.00 . A A . 1 ILE N 1 1 18 3897 1 1 1 ILE O O -7.510 -2.680 -0.310 1.00 . A A . 1 ILE O 1 1 18 3898 1 1 2 LEU C C -7.545 -0.520 1.727 1.00 . A A . 2 LEU C 1 1 18 3899 1 1 2 LEU CA C -8.867 -1.269 1.540 1.00 . A A . 2 LEU CA 1 1 18 3900 1 1 2 LEU CB C -9.811 -0.987 2.709 1.00 . A A . 2 LEU CB 1 1 18 3901 1 1 2 LEU CD1 C -10.530 1.083 1.510 1.00 . A A . 2 LEU CD1 1 1 18 3902 1 1 2 LEU CD2 C -11.818 -1.038 1.225 1.00 . A A . 2 LEU CD2 1 1 18 3903 1 1 2 LEU CG C -11.015 -0.187 2.211 1.00 . A A . 2 LEU CG 1 1 18 3904 1 1 2 LEU H H -8.986 -3.275 2.319 1.00 . A A . 2 LEU H 1 1 18 3905 1 1 2 LEU HA H -9.335 -0.984 0.611 1.00 . A A . 2 LEU HA 1 1 18 3906 1 1 2 LEU HB2 H -10.148 -1.923 3.133 1.00 . A A . 2 LEU HB2 1 1 18 3907 1 1 2 LEU HB3 H -9.289 -0.418 3.463 1.00 . A A . 2 LEU HB3 1 1 18 3908 1 1 2 LEU HD11 H -10.216 1.806 2.249 1.00 . A A . 2 LEU HD11 1 1 18 3909 1 1 2 LEU HD12 H -11.334 1.497 0.920 1.00 . A A . 2 LEU HD12 1 1 18 3910 1 1 2 LEU HD13 H -9.698 0.843 0.865 1.00 . A A . 2 LEU HD13 1 1 18 3911 1 1 2 LEU HD21 H -12.526 -1.647 1.768 1.00 . A A . 2 LEU HD21 1 1 18 3912 1 1 2 LEU HD22 H -11.146 -1.676 0.670 1.00 . A A . 2 LEU HD22 1 1 18 3913 1 1 2 LEU HD23 H -12.348 -0.392 0.541 1.00 . A A . 2 LEU HD23 1 1 18 3914 1 1 2 LEU HG H -11.640 0.082 3.051 1.00 . A A . 2 LEU HG 1 1 18 3915 1 1 2 LEU N N -8.633 -2.742 1.577 1.00 . A A . 2 LEU N 1 1 18 3916 1 1 2 LEU O O -7.479 0.686 1.594 1.00 . A A . 2 LEU O 1 1 18 3917 1 1 3 GLY C C -4.592 -0.177 0.872 1.00 . A A . 3 GLY C 1 1 18 3918 1 1 3 GLY CA C -5.176 -0.558 2.230 1.00 . A A . 3 GLY CA 1 1 18 3919 1 1 3 GLY H H -6.569 -2.196 2.136 1.00 . A A . 3 GLY H 1 1 18 3920 1 1 3 GLY HA2 H -5.309 0.332 2.829 1.00 . A A . 3 GLY HA2 1 1 18 3921 1 1 3 GLY HA3 H -4.502 -1.232 2.730 1.00 . A A . 3 GLY HA3 1 1 18 3922 1 1 3 GLY N N -6.493 -1.227 2.035 1.00 . A A . 3 GLY N 1 1 18 3923 1 1 3 GLY O O -3.487 -0.550 0.531 1.00 . A A . 3 GLY O 1 1 18 3924 1 1 4 LYS C C -3.543 1.804 -1.073 1.00 . A A . 4 LYS C 1 1 18 3925 1 1 4 LYS CA C -4.816 0.978 -1.242 1.00 . A A . 4 LYS CA 1 1 18 3926 1 1 4 LYS CB C -5.932 1.829 -1.849 1.00 . A A . 4 LYS CB 1 1 18 3927 1 1 4 LYS CD C -8.255 1.757 -2.766 1.00 . A A . 4 LYS CD 1 1 18 3928 1 1 4 LYS CE C -9.035 1.058 -3.882 1.00 . A A . 4 LYS CE 1 1 18 3929 1 1 4 LYS CG C -7.033 0.916 -2.394 1.00 . A A . 4 LYS CG 1 1 18 3930 1 1 4 LYS H H -6.210 0.856 0.397 1.00 . A A . 4 LYS H 1 1 18 3931 1 1 4 LYS HA H -4.629 0.116 -1.857 1.00 . A A . 4 LYS HA 1 1 18 3932 1 1 4 LYS HB2 H -6.344 2.477 -1.090 1.00 . A A . 4 LYS HB2 1 1 18 3933 1 1 4 LYS HB3 H -5.533 2.426 -2.655 1.00 . A A . 4 LYS HB3 1 1 18 3934 1 1 4 LYS HD2 H -8.889 1.873 -1.900 1.00 . A A . 4 LYS HD2 1 1 18 3935 1 1 4 LYS HD3 H -7.932 2.728 -3.110 1.00 . A A . 4 LYS HD3 1 1 18 3936 1 1 4 LYS HE2 H -8.502 1.139 -4.820 1.00 . A A . 4 LYS HE2 1 1 18 3937 1 1 4 LYS HE3 H -9.204 0.022 -3.632 1.00 . A A . 4 LYS HE3 1 1 18 3938 1 1 4 LYS HG2 H -6.670 0.397 -3.269 1.00 . A A . 4 LYS HG2 1 1 18 3939 1 1 4 LYS HG3 H -7.310 0.196 -1.637 1.00 . A A . 4 LYS HG3 1 1 18 3940 1 1 4 LYS HZ1 H -10.699 1.937 -2.993 1.00 . A A . 4 LYS HZ1 1 1 18 3941 1 1 4 LYS HZ2 H -11.016 1.217 -4.500 1.00 . A A . 4 LYS HZ2 1 1 18 3942 1 1 4 LYS HZ3 H -10.193 2.702 -4.420 1.00 . A A . 4 LYS HZ3 1 1 18 3943 1 1 4 LYS N N -5.327 0.566 0.097 1.00 . A A . 4 LYS N 1 1 18 3944 1 1 4 LYS NZ N -10.334 1.783 -3.954 1.00 . A A . 4 LYS NZ 1 1 18 3945 1 1 4 LYS O O -2.592 1.667 -1.817 1.00 . A A . 4 LYS O 1 1 18 3946 1 1 5 ILE C C -1.184 2.636 0.716 1.00 . A A . 5 ILE C 1 1 18 3947 1 1 5 ILE CA C -2.315 3.496 0.150 1.00 . A A . 5 ILE CA 1 1 18 3948 1 1 5 ILE CB C -2.772 4.533 1.174 1.00 . A A . 5 ILE CB 1 1 18 3949 1 1 5 ILE CD1 C -2.708 6.513 -0.357 1.00 . A A . 5 ILE CD1 1 1 18 3950 1 1 5 ILE CG1 C -3.615 5.600 0.471 1.00 . A A . 5 ILE CG1 1 1 18 3951 1 1 5 ILE CG2 C -1.551 5.188 1.825 1.00 . A A . 5 ILE CG2 1 1 18 3952 1 1 5 ILE H H -4.300 2.743 0.497 1.00 . A A . 5 ILE H 1 1 18 3953 1 1 5 ILE HA H -2.005 3.984 -0.760 1.00 . A A . 5 ILE HA 1 1 18 3954 1 1 5 ILE HB H -3.367 4.045 1.933 1.00 . A A . 5 ILE HB 1 1 18 3955 1 1 5 ILE HD11 H -2.384 7.345 0.249 1.00 . A A . 5 ILE HD11 1 1 18 3956 1 1 5 ILE HD12 H -3.253 6.881 -1.213 1.00 . A A . 5 ILE HD12 1 1 18 3957 1 1 5 ILE HD13 H -1.846 5.954 -0.693 1.00 . A A . 5 ILE HD13 1 1 18 3958 1 1 5 ILE HG12 H -4.333 5.119 -0.178 1.00 . A A . 5 ILE HG12 1 1 18 3959 1 1 5 ILE HG13 H -4.137 6.189 1.209 1.00 . A A . 5 ILE HG13 1 1 18 3960 1 1 5 ILE HG21 H -1.247 4.609 2.683 1.00 . A A . 5 ILE HG21 1 1 18 3961 1 1 5 ILE HG22 H -1.804 6.190 2.138 1.00 . A A . 5 ILE HG22 1 1 18 3962 1 1 5 ILE HG23 H -0.740 5.227 1.112 1.00 . A A . 5 ILE HG23 1 1 18 3963 1 1 5 ILE N N -3.521 2.657 -0.089 1.00 . A A . 5 ILE N 1 1 18 3964 1 1 5 ILE O O -0.017 2.925 0.533 1.00 . A A . 5 ILE O 1 1 18 3965 1 1 6 TRP C C 0.060 -0.262 0.904 1.00 . A A . 6 TRP C 1 1 18 3966 1 1 6 TRP CA C -0.468 0.693 1.978 1.00 . A A . 6 TRP CA 1 1 18 3967 1 1 6 TRP CB C -1.173 -0.080 3.094 1.00 . A A . 6 TRP CB 1 1 18 3968 1 1 6 TRP CD1 C -0.630 -2.548 3.155 1.00 . A A . 6 TRP CD1 1 1 18 3969 1 1 6 TRP CD2 C 0.874 -1.305 4.275 1.00 . A A . 6 TRP CD2 1 1 18 3970 1 1 6 TRP CE2 C 1.294 -2.651 4.388 1.00 . A A . 6 TRP CE2 1 1 18 3971 1 1 6 TRP CE3 C 1.654 -0.312 4.896 1.00 . A A . 6 TRP CE3 1 1 18 3972 1 1 6 TRP CG C -0.350 -1.267 3.486 1.00 . A A . 6 TRP CG 1 1 18 3973 1 1 6 TRP CH2 C 3.211 -2.003 5.705 1.00 . A A . 6 TRP CH2 1 1 18 3974 1 1 6 TRP CZ2 C 2.448 -3.001 5.093 1.00 . A A . 6 TRP CZ2 1 1 18 3975 1 1 6 TRP CZ3 C 2.815 -0.661 5.607 1.00 . A A . 6 TRP CZ3 1 1 18 3976 1 1 6 TRP H H -2.468 1.363 1.533 1.00 . A A . 6 TRP H 1 1 18 3977 1 1 6 TRP HA H 0.336 1.282 2.387 1.00 . A A . 6 TRP HA 1 1 18 3978 1 1 6 TRP HB2 H -1.303 0.565 3.951 1.00 . A A . 6 TRP HB2 1 1 18 3979 1 1 6 TRP HB3 H -2.140 -0.413 2.746 1.00 . A A . 6 TRP HB3 1 1 18 3980 1 1 6 TRP HD1 H -1.476 -2.875 2.569 1.00 . A A . 6 TRP HD1 1 1 18 3981 1 1 6 TRP HE1 H 0.378 -4.345 3.594 1.00 . A A . 6 TRP HE1 1 1 18 3982 1 1 6 TRP HE3 H 1.357 0.724 4.828 1.00 . A A . 6 TRP HE3 1 1 18 3983 1 1 6 TRP HH2 H 4.104 -2.263 6.253 1.00 . A A . 6 TRP HH2 1 1 18 3984 1 1 6 TRP HZ2 H 2.748 -4.035 5.165 1.00 . A A . 6 TRP HZ2 1 1 18 3985 1 1 6 TRP HZ3 H 3.406 0.109 6.080 1.00 . A A . 6 TRP HZ3 1 1 18 3986 1 1 6 TRP N N -1.521 1.577 1.401 1.00 . A A . 6 TRP N 1 1 18 3987 1 1 6 TRP NE1 N 0.346 -3.370 3.689 1.00 . A A . 6 TRP NE1 1 1 18 3988 1 1 6 TRP O O 1.196 -0.691 0.945 1.00 . A A . 6 TRP O 1 1 18 3989 1 1 7 GLU C C 0.875 -0.893 -1.895 1.00 . A A . 7 GLU C 1 1 18 3990 1 1 7 GLU CA C -0.299 -1.517 -1.136 1.00 . A A . 7 GLU CA 1 1 18 3991 1 1 7 GLU CB C -1.508 -1.682 -2.058 1.00 . A A . 7 GLU CB 1 1 18 3992 1 1 7 GLU CD C -3.109 -3.371 -2.968 1.00 . A A . 7 GLU CD 1 1 18 3993 1 1 7 GLU CG C -2.148 -3.051 -1.821 1.00 . A A . 7 GLU CG 1 1 18 3994 1 1 7 GLU H H -1.666 -0.233 -0.074 1.00 . A A . 7 GLU H 1 1 18 3995 1 1 7 GLU HA H -0.016 -2.470 -0.722 1.00 . A A . 7 GLU HA 1 1 18 3996 1 1 7 GLU HB2 H -2.228 -0.904 -1.848 1.00 . A A . 7 GLU HB2 1 1 18 3997 1 1 7 GLU HB3 H -1.189 -1.609 -3.087 1.00 . A A . 7 GLU HB3 1 1 18 3998 1 1 7 GLU HG2 H -1.376 -3.806 -1.774 1.00 . A A . 7 GLU HG2 1 1 18 3999 1 1 7 GLU HG3 H -2.695 -3.036 -0.890 1.00 . A A . 7 GLU HG3 1 1 18 4000 1 1 7 GLU N N -0.755 -0.594 -0.059 1.00 . A A . 7 GLU N 1 1 18 4001 1 1 7 GLU O O 1.747 -1.581 -2.388 1.00 . A A . 7 GLU O 1 1 18 4002 1 1 7 GLU OE1 O -3.381 -2.478 -3.753 1.00 . A A . 7 GLU OE1 1 1 18 4003 1 1 7 GLU OE2 O -3.554 -4.504 -3.042 1.00 . A A . 7 GLU OE2 1 1 18 4004 1 1 8 GLY C C 3.197 1.271 -1.757 1.00 . A A . 8 GLY C 1 1 18 4005 1 1 8 GLY CA C 2.018 1.081 -2.710 1.00 . A A . 8 GLY CA 1 1 18 4006 1 1 8 GLY H H 0.189 0.941 -1.581 1.00 . A A . 8 GLY H 1 1 18 4007 1 1 8 GLY HA2 H 2.325 0.471 -3.547 1.00 . A A . 8 GLY HA2 1 1 18 4008 1 1 8 GLY HA3 H 1.688 2.044 -3.067 1.00 . A A . 8 GLY HA3 1 1 18 4009 1 1 8 GLY N N 0.903 0.407 -1.988 1.00 . A A . 8 GLY N 1 1 18 4010 1 1 8 GLY O O 4.343 1.263 -2.160 1.00 . A A . 8 GLY O 1 1 18 4011 1 1 9 ILE C C 4.958 0.411 0.474 1.00 . A A . 9 ILE C 1 1 18 4012 1 1 9 ILE CA C 4.032 1.629 0.490 1.00 . A A . 9 ILE CA 1 1 18 4013 1 1 9 ILE CB C 3.340 1.758 1.848 1.00 . A A . 9 ILE CB 1 1 18 4014 1 1 9 ILE CD1 C 2.132 3.323 3.377 1.00 . A A . 9 ILE CD1 1 1 18 4015 1 1 9 ILE CG1 C 2.719 3.151 1.974 1.00 . A A . 9 ILE CG1 1 1 18 4016 1 1 9 ILE CG2 C 4.366 1.559 2.966 1.00 . A A . 9 ILE CG2 1 1 18 4017 1 1 9 ILE H H 1.994 1.442 -0.187 1.00 . A A . 9 ILE H 1 1 18 4018 1 1 9 ILE HA H 4.583 2.528 0.270 1.00 . A A . 9 ILE HA 1 1 18 4019 1 1 9 ILE HB H 2.567 1.008 1.931 1.00 . A A . 9 ILE HB 1 1 18 4020 1 1 9 ILE HD11 H 1.314 2.631 3.512 1.00 . A A . 9 ILE HD11 1 1 18 4021 1 1 9 ILE HD12 H 1.771 4.335 3.494 1.00 . A A . 9 ILE HD12 1 1 18 4022 1 1 9 ILE HD13 H 2.897 3.127 4.113 1.00 . A A . 9 ILE HD13 1 1 18 4023 1 1 9 ILE HG12 H 3.478 3.901 1.806 1.00 . A A . 9 ILE HG12 1 1 18 4024 1 1 9 ILE HG13 H 1.933 3.263 1.242 1.00 . A A . 9 ILE HG13 1 1 18 4025 1 1 9 ILE HG21 H 4.332 2.401 3.641 1.00 . A A . 9 ILE HG21 1 1 18 4026 1 1 9 ILE HG22 H 5.354 1.479 2.538 1.00 . A A . 9 ILE HG22 1 1 18 4027 1 1 9 ILE HG23 H 4.135 0.653 3.508 1.00 . A A . 9 ILE HG23 1 1 18 4028 1 1 9 ILE N N 2.925 1.440 -0.491 1.00 . A A . 9 ILE N 1 1 18 4029 1 1 9 ILE O O 6.123 0.509 0.139 1.00 . A A . 9 ILE O 1 1 18 4030 1 1 10 LYS C C 5.819 -2.243 -0.581 1.00 . A A . 10 LYS C 1 1 18 4031 1 1 10 LYS CA C 5.303 -1.960 0.833 1.00 . A A . 10 LYS CA 1 1 18 4032 1 1 10 LYS CB C 4.382 -3.087 1.305 1.00 . A A . 10 LYS CB 1 1 18 4033 1 1 10 LYS CD C 2.829 -4.744 0.266 1.00 . A A . 10 LYS CD 1 1 18 4034 1 1 10 LYS CE C 2.625 -5.182 -1.187 1.00 . A A . 10 LYS CE 1 1 18 4035 1 1 10 LYS CG C 3.241 -3.271 0.303 1.00 . A A . 10 LYS CG 1 1 18 4036 1 1 10 LYS H H 3.508 -0.796 1.096 1.00 . A A . 10 LYS H 1 1 18 4037 1 1 10 LYS HA H 6.126 -1.844 1.519 1.00 . A A . 10 LYS HA 1 1 18 4038 1 1 10 LYS HB2 H 4.947 -4.004 1.383 1.00 . A A . 10 LYS HB2 1 1 18 4039 1 1 10 LYS HB3 H 3.972 -2.834 2.272 1.00 . A A . 10 LYS HB3 1 1 18 4040 1 1 10 LYS HD2 H 3.603 -5.346 0.719 1.00 . A A . 10 LYS HD2 1 1 18 4041 1 1 10 LYS HD3 H 1.905 -4.874 0.810 1.00 . A A . 10 LYS HD3 1 1 18 4042 1 1 10 LYS HE2 H 2.034 -6.086 -1.226 1.00 . A A . 10 LYS HE2 1 1 18 4043 1 1 10 LYS HE3 H 2.152 -4.396 -1.754 1.00 . A A . 10 LYS HE3 1 1 18 4044 1 1 10 LYS HG2 H 2.398 -2.667 0.603 1.00 . A A . 10 LYS HG2 1 1 18 4045 1 1 10 LYS HG3 H 3.572 -2.968 -0.679 1.00 . A A . 10 LYS HG3 1 1 18 4046 1 1 10 LYS HZ1 H 4.631 -5.671 -0.918 1.00 . A A . 10 LYS HZ1 1 1 18 4047 1 1 10 LYS HZ2 H 4.348 -4.577 -2.187 1.00 . A A . 10 LYS HZ2 1 1 18 4048 1 1 10 LYS HZ3 H 3.975 -6.223 -2.381 1.00 . A A . 10 LYS HZ3 1 1 18 4049 1 1 10 LYS N N 4.450 -0.737 0.831 1.00 . A A . 10 LYS N 1 1 18 4050 1 1 10 LYS NZ N 3.998 -5.432 -1.707 1.00 . A A . 10 LYS NZ 1 1 18 4051 1 1 10 LYS O O 6.813 -2.917 -0.766 1.00 . A A . 10 LYS O 1 1 18 4052 1 1 11 SER C C 6.671 -0.943 -3.368 1.00 . A A . 11 SER C 1 1 18 4053 1 1 11 SER CA C 5.605 -1.969 -2.979 1.00 . A A . 11 SER CA 1 1 18 4054 1 1 11 SER CB C 4.351 -1.792 -3.836 1.00 . A A . 11 SER CB 1 1 18 4055 1 1 11 SER H H 4.353 -1.189 -1.407 1.00 . A A . 11 SER H 1 1 18 4056 1 1 11 SER HA H 5.987 -2.971 -3.087 1.00 . A A . 11 SER HA 1 1 18 4057 1 1 11 SER HB2 H 3.641 -2.567 -3.603 1.00 . A A . 11 SER HB2 1 1 18 4058 1 1 11 SER HB3 H 3.908 -0.827 -3.628 1.00 . A A . 11 SER HB3 1 1 18 4059 1 1 11 SER HG H 5.305 -1.156 -5.407 1.00 . A A . 11 SER HG 1 1 18 4060 1 1 11 SER N N 5.152 -1.732 -1.579 1.00 . A A . 11 SER N 1 1 18 4061 1 1 11 SER O O 7.514 -1.195 -4.208 1.00 . A A . 11 SER O 1 1 18 4062 1 1 11 SER OG O 4.706 -1.879 -5.209 1.00 . A A . 11 SER OG 1 1 18 4063 1 1 12 LEU C C 8.982 0.944 -2.407 1.00 . A A . 12 LEU C 1 1 18 4064 1 1 12 LEU CA C 7.653 1.256 -3.098 1.00 . A A . 12 LEU CA 1 1 18 4065 1 1 12 LEU CB C 7.064 2.563 -2.563 1.00 . A A . 12 LEU CB 1 1 18 4066 1 1 12 LEU CD1 C 6.381 4.720 -3.621 1.00 . A A . 12 LEU CD1 1 1 18 4067 1 1 12 LEU CD2 C 8.706 4.434 -2.755 1.00 . A A . 12 LEU CD2 1 1 18 4068 1 1 12 LEU CG C 7.531 3.728 -3.435 1.00 . A A . 12 LEU CG 1 1 18 4069 1 1 12 LEU H H 5.954 0.395 -2.091 1.00 . A A . 12 LEU H 1 1 18 4070 1 1 12 LEU HA H 7.788 1.323 -4.166 1.00 . A A . 12 LEU HA 1 1 18 4071 1 1 12 LEU HB2 H 5.986 2.506 -2.584 1.00 . A A . 12 LEU HB2 1 1 18 4072 1 1 12 LEU HB3 H 7.398 2.718 -1.549 1.00 . A A . 12 LEU HB3 1 1 18 4073 1 1 12 LEU HD11 H 6.258 5.302 -2.719 1.00 . A A . 12 LEU HD11 1 1 18 4074 1 1 12 LEU HD12 H 5.469 4.180 -3.828 1.00 . A A . 12 LEU HD12 1 1 18 4075 1 1 12 LEU HD13 H 6.603 5.379 -4.447 1.00 . A A . 12 LEU HD13 1 1 18 4076 1 1 12 LEU HD21 H 9.377 4.822 -3.507 1.00 . A A . 12 LEU HD21 1 1 18 4077 1 1 12 LEU HD22 H 9.235 3.730 -2.129 1.00 . A A . 12 LEU HD22 1 1 18 4078 1 1 12 LEU HD23 H 8.336 5.247 -2.149 1.00 . A A . 12 LEU HD23 1 1 18 4079 1 1 12 LEU HG H 7.842 3.354 -4.400 1.00 . A A . 12 LEU HG 1 1 18 4080 1 1 12 LEU N N 6.641 0.213 -2.764 1.00 . A A . 12 LEU N 1 1 18 4081 1 1 12 LEU O O 9.970 1.624 -2.603 1.00 . A A . 12 LEU O 1 1 18 4082 1 1 13 PHE C C 11.422 -0.590 -1.902 1.00 . A A . 13 PHE C 1 1 18 4083 1 1 13 PHE CA C 10.280 -0.435 -0.894 1.00 . A A . 13 PHE CA 1 1 18 4084 1 1 13 PHE CB C 9.988 -1.769 -0.205 1.00 . A A . 13 PHE CB 1 1 18 4085 1 1 13 PHE CD1 C 9.744 -0.422 1.905 1.00 . A A . 13 PHE CD1 1 1 18 4086 1 1 13 PHE CD2 C 10.701 -2.644 2.049 1.00 . A A . 13 PHE CD2 1 1 18 4087 1 1 13 PHE CE1 C 9.890 -0.268 3.286 1.00 . A A . 13 PHE CE1 1 1 18 4088 1 1 13 PHE CE2 C 10.849 -2.491 3.433 1.00 . A A . 13 PHE CE2 1 1 18 4089 1 1 13 PHE CG C 10.148 -1.608 1.286 1.00 . A A . 13 PHE CG 1 1 18 4090 1 1 13 PHE CZ C 10.442 -1.302 4.051 1.00 . A A . 13 PHE CZ 1 1 18 4091 1 1 13 PHE H H 8.207 -0.615 -1.453 1.00 . A A . 13 PHE H 1 1 18 4092 1 1 13 PHE HA H 10.525 0.314 -0.157 1.00 . A A . 13 PHE HA 1 1 18 4093 1 1 13 PHE HB2 H 8.976 -2.074 -0.426 1.00 . A A . 13 PHE HB2 1 1 18 4094 1 1 13 PHE HB3 H 10.677 -2.519 -0.562 1.00 . A A . 13 PHE HB3 1 1 18 4095 1 1 13 PHE HD1 H 9.317 0.376 1.315 1.00 . A A . 13 PHE HD1 1 1 18 4096 1 1 13 PHE HD2 H 11.013 -3.561 1.571 1.00 . A A . 13 PHE HD2 1 1 18 4097 1 1 13 PHE HE1 H 9.577 0.649 3.758 1.00 . A A . 13 PHE HE1 1 1 18 4098 1 1 13 PHE HE2 H 11.275 -3.288 4.023 1.00 . A A . 13 PHE HE2 1 1 18 4099 1 1 13 PHE HZ H 10.556 -1.182 5.119 1.00 . A A . 13 PHE HZ 1 1 18 4100 1 1 13 PHE N N 9.015 -0.079 -1.598 1.00 . A A . 13 PHE N 1 1 18 4101 1 1 13 PHE O O 11.275 -1.243 -2.916 1.00 . A A . 13 PHE O 1 1 18 4102 1 1 14 NH2 HN1 H 12.688 0.516 -0.845 1.00 . A A . 14 NH2 HN1 1 1 18 4103 1 1 14 NH2 HN2 H 13.305 -0.103 -2.301 1.00 . A A . 14 NH2 HN2 1 1 18 4104 1 1 14 NH2 N N 12.567 -0.011 -1.662 1.00 . A A . 14 NH2 N 1 1 19 4105 1 1 1 ILE C C -10.133 -0.669 2.520 1.00 . A A . 1 ILE C 1 1 19 4106 1 1 1 ILE CA C -11.169 0.096 1.691 1.00 . A A . 1 ILE CA 1 1 19 4107 1 1 1 ILE CB C -10.605 1.444 1.242 1.00 . A A . 1 ILE CB 1 1 19 4108 1 1 1 ILE CD1 C -10.089 0.970 -1.159 1.00 . A A . 1 ILE CD1 1 1 19 4109 1 1 1 ILE CG1 C -9.484 1.212 0.226 1.00 . A A . 1 ILE CG1 1 1 19 4110 1 1 1 ILE CG2 C -10.047 2.194 2.452 1.00 . A A . 1 ILE CG2 1 1 19 4111 1 1 1 ILE H1 H -13.207 0.444 1.942 1.00 . A A . 1 ILE H1 1 1 19 4112 1 1 1 ILE H2 H -12.216 1.373 2.961 1.00 . A A . 1 ILE H2 1 1 19 4113 1 1 1 ILE H3 H -12.461 -0.277 3.283 1.00 . A A . 1 ILE H3 1 1 19 4114 1 1 1 ILE HA H -11.469 -0.483 0.833 1.00 . A A . 1 ILE HA 1 1 19 4115 1 1 1 ILE HB H -11.390 2.029 0.787 1.00 . A A . 1 ILE HB 1 1 19 4116 1 1 1 ILE HD11 H -9.367 1.231 -1.918 1.00 . A A . 1 ILE HD11 1 1 19 4117 1 1 1 ILE HD12 H -10.972 1.580 -1.276 1.00 . A A . 1 ILE HD12 1 1 19 4118 1 1 1 ILE HD13 H -10.355 -0.072 -1.258 1.00 . A A . 1 ILE HD13 1 1 19 4119 1 1 1 ILE HG12 H -8.843 2.081 0.192 1.00 . A A . 1 ILE HG12 1 1 19 4120 1 1 1 ILE HG13 H -8.904 0.348 0.518 1.00 . A A . 1 ILE HG13 1 1 19 4121 1 1 1 ILE HG21 H -10.382 1.714 3.359 1.00 . A A . 1 ILE HG21 1 1 19 4122 1 1 1 ILE HG22 H -10.396 3.216 2.435 1.00 . A A . 1 ILE HG22 1 1 19 4123 1 1 1 ILE HG23 H -8.967 2.182 2.417 1.00 . A A . 1 ILE HG23 1 1 19 4124 1 1 1 ILE N N -12.353 0.435 2.533 1.00 . A A . 1 ILE N 1 1 19 4125 1 1 1 ILE O O -9.833 -0.311 3.641 1.00 . A A . 1 ILE O 1 1 19 4126 1 1 2 LEU C C -7.341 -1.641 3.023 1.00 . A A . 2 LEU C 1 1 19 4127 1 1 2 LEU CA C -8.569 -2.508 2.733 1.00 . A A . 2 LEU CA 1 1 19 4128 1 1 2 LEU CB C -8.199 -3.670 1.811 1.00 . A A . 2 LEU CB 1 1 19 4129 1 1 2 LEU CD1 C -10.175 -4.695 0.680 1.00 . A A . 2 LEU CD1 1 1 19 4130 1 1 2 LEU CD2 C -8.590 -6.131 1.968 1.00 . A A . 2 LEU CD2 1 1 19 4131 1 1 2 LEU CG C -9.267 -4.760 1.908 1.00 . A A . 2 LEU CG 1 1 19 4132 1 1 2 LEU H H -9.839 -1.994 1.070 1.00 . A A . 2 LEU H 1 1 19 4133 1 1 2 LEU HA H -8.990 -2.884 3.650 1.00 . A A . 2 LEU HA 1 1 19 4134 1 1 2 LEU HB2 H -8.136 -3.315 0.792 1.00 . A A . 2 LEU HB2 1 1 19 4135 1 1 2 LEU HB3 H -7.244 -4.076 2.110 1.00 . A A . 2 LEU HB3 1 1 19 4136 1 1 2 LEU HD11 H -9.587 -4.451 -0.191 1.00 . A A . 2 LEU HD11 1 1 19 4137 1 1 2 LEU HD12 H -10.929 -3.937 0.829 1.00 . A A . 2 LEU HD12 1 1 19 4138 1 1 2 LEU HD13 H -10.652 -5.654 0.535 1.00 . A A . 2 LEU HD13 1 1 19 4139 1 1 2 LEU HD21 H -9.154 -6.783 2.617 1.00 . A A . 2 LEU HD21 1 1 19 4140 1 1 2 LEU HD22 H -7.586 -6.020 2.353 1.00 . A A . 2 LEU HD22 1 1 19 4141 1 1 2 LEU HD23 H -8.549 -6.556 0.976 1.00 . A A . 2 LEU HD23 1 1 19 4142 1 1 2 LEU HG H -9.857 -4.608 2.801 1.00 . A A . 2 LEU HG 1 1 19 4143 1 1 2 LEU N N -9.584 -1.722 1.976 1.00 . A A . 2 LEU N 1 1 19 4144 1 1 2 LEU O O -7.257 -0.988 4.045 1.00 . A A . 2 LEU O 1 1 19 4145 1 1 3 GLY C C -4.668 -0.260 1.016 1.00 . A A . 3 GLY C 1 1 19 4146 1 1 3 GLY CA C -5.168 -0.804 2.354 1.00 . A A . 3 GLY CA 1 1 19 4147 1 1 3 GLY H H -6.477 -2.162 1.314 1.00 . A A . 3 GLY H 1 1 19 4148 1 1 3 GLY HA2 H -5.404 0.019 3.013 1.00 . A A . 3 GLY HA2 1 1 19 4149 1 1 3 GLY HA3 H -4.399 -1.412 2.799 1.00 . A A . 3 GLY HA3 1 1 19 4150 1 1 3 GLY N N -6.389 -1.629 2.131 1.00 . A A . 3 GLY N 1 1 19 4151 1 1 3 GLY O O -3.732 -0.773 0.436 1.00 . A A . 3 GLY O 1 1 19 4152 1 1 4 LYS C C -3.503 2.071 -0.597 1.00 . A A . 4 LYS C 1 1 19 4153 1 1 4 LYS CA C -4.844 1.360 -0.775 1.00 . A A . 4 LYS CA 1 1 19 4154 1 1 4 LYS CB C -5.937 2.359 -1.155 1.00 . A A . 4 LYS CB 1 1 19 4155 1 1 4 LYS CD C -5.125 2.161 -3.510 1.00 . A A . 4 LYS CD 1 1 19 4156 1 1 4 LYS CE C -5.345 3.171 -4.639 1.00 . A A . 4 LYS CE 1 1 19 4157 1 1 4 LYS CG C -6.360 2.127 -2.607 1.00 . A A . 4 LYS CG 1 1 19 4158 1 1 4 LYS H H -6.034 1.175 1.012 1.00 . A A . 4 LYS H 1 1 19 4159 1 1 4 LYS HA H -4.766 0.592 -1.525 1.00 . A A . 4 LYS HA 1 1 19 4160 1 1 4 LYS HB2 H -6.790 2.223 -0.505 1.00 . A A . 4 LYS HB2 1 1 19 4161 1 1 4 LYS HB3 H -5.559 3.365 -1.048 1.00 . A A . 4 LYS HB3 1 1 19 4162 1 1 4 LYS HD2 H -4.262 2.450 -2.929 1.00 . A A . 4 LYS HD2 1 1 19 4163 1 1 4 LYS HD3 H -4.962 1.181 -3.934 1.00 . A A . 4 LYS HD3 1 1 19 4164 1 1 4 LYS HE2 H -4.595 3.043 -5.407 1.00 . A A . 4 LYS HE2 1 1 19 4165 1 1 4 LYS HE3 H -6.335 3.062 -5.054 1.00 . A A . 4 LYS HE3 1 1 19 4166 1 1 4 LYS HG2 H -6.843 1.165 -2.691 1.00 . A A . 4 LYS HG2 1 1 19 4167 1 1 4 LYS HG3 H -7.046 2.903 -2.910 1.00 . A A . 4 LYS HG3 1 1 19 4168 1 1 4 LYS HZ1 H -5.433 4.426 -2.980 1.00 . A A . 4 LYS HZ1 1 1 19 4169 1 1 4 LYS HZ2 H -5.861 5.178 -4.442 1.00 . A A . 4 LYS HZ2 1 1 19 4170 1 1 4 LYS HZ3 H -4.231 4.844 -4.100 1.00 . A A . 4 LYS HZ3 1 1 19 4171 1 1 4 LYS N N -5.284 0.778 0.525 1.00 . A A . 4 LYS N 1 1 19 4172 1 1 4 LYS NZ N -5.207 4.506 -3.991 1.00 . A A . 4 LYS NZ 1 1 19 4173 1 1 4 LYS O O -2.632 2.000 -1.441 1.00 . A A . 4 LYS O 1 1 19 4174 1 1 5 ILE C C -0.959 2.449 1.117 1.00 . A A . 5 ILE C 1 1 19 4175 1 1 5 ILE CA C -2.046 3.460 0.745 1.00 . A A . 5 ILE CA 1 1 19 4176 1 1 5 ILE CB C -2.333 4.400 1.916 1.00 . A A . 5 ILE CB 1 1 19 4177 1 1 5 ILE CD1 C -2.441 6.501 0.562 1.00 . A A . 5 ILE CD1 1 1 19 4178 1 1 5 ILE CG1 C -3.241 5.539 1.443 1.00 . A A . 5 ILE CG1 1 1 19 4179 1 1 5 ILE CG2 C -1.018 4.979 2.442 1.00 . A A . 5 ILE CG2 1 1 19 4180 1 1 5 ILE H H -4.046 2.785 1.167 1.00 . A A . 5 ILE H 1 1 19 4181 1 1 5 ILE HA H -1.755 4.027 -0.124 1.00 . A A . 5 ILE HA 1 1 19 4182 1 1 5 ILE HB H -2.825 3.850 2.705 1.00 . A A . 5 ILE HB 1 1 19 4183 1 1 5 ILE HD11 H -2.989 6.697 -0.348 1.00 . A A . 5 ILE HD11 1 1 19 4184 1 1 5 ILE HD12 H -1.486 6.058 0.319 1.00 . A A . 5 ILE HD12 1 1 19 4185 1 1 5 ILE HD13 H -2.282 7.428 1.093 1.00 . A A . 5 ILE HD13 1 1 19 4186 1 1 5 ILE HG12 H -4.064 5.130 0.874 1.00 . A A . 5 ILE HG12 1 1 19 4187 1 1 5 ILE HG13 H -3.624 6.073 2.299 1.00 . A A . 5 ILE HG13 1 1 19 4188 1 1 5 ILE HG21 H -0.419 5.327 1.612 1.00 . A A . 5 ILE HG21 1 1 19 4189 1 1 5 ILE HG22 H -0.477 4.215 2.981 1.00 . A A . 5 ILE HG22 1 1 19 4190 1 1 5 ILE HG23 H -1.228 5.807 3.105 1.00 . A A . 5 ILE HG23 1 1 19 4191 1 1 5 ILE N N -3.331 2.749 0.501 1.00 . A A . 5 ILE N 1 1 19 4192 1 1 5 ILE O O 0.209 2.647 0.845 1.00 . A A . 5 ILE O 1 1 19 4193 1 1 6 TRP C C 0.005 -0.547 0.918 1.00 . A A . 6 TRP C 1 1 19 4194 1 1 6 TRP CA C -0.335 0.334 2.123 1.00 . A A . 6 TRP CA 1 1 19 4195 1 1 6 TRP CB C -1.018 -0.486 3.220 1.00 . A A . 6 TRP CB 1 1 19 4196 1 1 6 TRP CD1 C -0.870 -3.008 3.302 1.00 . A A . 6 TRP CD1 1 1 19 4197 1 1 6 TRP CD2 C 1.104 -2.011 3.717 1.00 . A A . 6 TRP CD2 1 1 19 4198 1 1 6 TRP CE2 C 1.329 -3.406 3.793 1.00 . A A . 6 TRP CE2 1 1 19 4199 1 1 6 TRP CE3 C 2.194 -1.152 3.940 1.00 . A A . 6 TRP CE3 1 1 19 4200 1 1 6 TRP CG C -0.300 -1.784 3.403 1.00 . A A . 6 TRP CG 1 1 19 4201 1 1 6 TRP CH2 C 3.662 -3.060 4.300 1.00 . A A . 6 TRP CH2 1 1 19 4202 1 1 6 TRP CZ2 C 2.590 -3.929 4.081 1.00 . A A . 6 TRP CZ2 1 1 19 4203 1 1 6 TRP CZ3 C 3.465 -1.674 4.230 1.00 . A A . 6 TRP CZ3 1 1 19 4204 1 1 6 TRP H H -2.287 1.227 1.940 1.00 . A A . 6 TRP H 1 1 19 4205 1 1 6 TRP HA H 0.555 0.802 2.512 1.00 . A A . 6 TRP HA 1 1 19 4206 1 1 6 TRP HB2 H -0.999 0.069 4.147 1.00 . A A . 6 TRP HB2 1 1 19 4207 1 1 6 TRP HB3 H -2.043 -0.677 2.938 1.00 . A A . 6 TRP HB3 1 1 19 4208 1 1 6 TRP HD1 H -1.909 -3.201 3.077 1.00 . A A . 6 TRP HD1 1 1 19 4209 1 1 6 TRP HE1 H -0.056 -4.938 3.518 1.00 . A A . 6 TRP HE1 1 1 19 4210 1 1 6 TRP HE3 H 2.053 -0.083 3.888 1.00 . A A . 6 TRP HE3 1 1 19 4211 1 1 6 TRP HH2 H 4.642 -3.456 4.523 1.00 . A A . 6 TRP HH2 1 1 19 4212 1 1 6 TRP HZ2 H 2.736 -4.998 4.134 1.00 . A A . 6 TRP HZ2 1 1 19 4213 1 1 6 TRP HZ3 H 4.295 -1.004 4.399 1.00 . A A . 6 TRP HZ3 1 1 19 4214 1 1 6 TRP N N -1.339 1.365 1.734 1.00 . A A . 6 TRP N 1 1 19 4215 1 1 6 TRP NE1 N 0.096 -3.971 3.534 1.00 . A A . 6 TRP NE1 1 1 19 4216 1 1 6 TRP O O 1.101 -1.057 0.797 1.00 . A A . 6 TRP O 1 1 19 4217 1 1 7 GLU C C 0.523 -1.008 -1.960 1.00 . A A . 7 GLU C 1 1 19 4218 1 1 7 GLU CA C -0.660 -1.572 -1.173 1.00 . A A . 7 GLU CA 1 1 19 4219 1 1 7 GLU CB C -1.942 -1.499 -2.004 1.00 . A A . 7 GLU CB 1 1 19 4220 1 1 7 GLU CD C -4.185 -2.555 -2.309 1.00 . A A . 7 GLU CD 1 1 19 4221 1 1 7 GLU CG C -2.763 -2.771 -1.788 1.00 . A A . 7 GLU CG 1 1 19 4222 1 1 7 GLU H H -1.805 -0.304 0.141 1.00 . A A . 7 GLU H 1 1 19 4223 1 1 7 GLU HA H -0.467 -2.590 -0.880 1.00 . A A . 7 GLU HA 1 1 19 4224 1 1 7 GLU HB2 H -2.520 -0.640 -1.698 1.00 . A A . 7 GLU HB2 1 1 19 4225 1 1 7 GLU HB3 H -1.688 -1.410 -3.050 1.00 . A A . 7 GLU HB3 1 1 19 4226 1 1 7 GLU HG2 H -2.303 -3.590 -2.323 1.00 . A A . 7 GLU HG2 1 1 19 4227 1 1 7 GLU HG3 H -2.799 -3.003 -0.735 1.00 . A A . 7 GLU HG3 1 1 19 4228 1 1 7 GLU N N -0.928 -0.727 0.025 1.00 . A A . 7 GLU N 1 1 19 4229 1 1 7 GLU O O 1.357 -1.737 -2.460 1.00 . A A . 7 GLU O 1 1 19 4230 1 1 7 GLU OE1 O -4.336 -1.834 -3.282 1.00 . A A . 7 GLU OE1 1 1 19 4231 1 1 7 GLU OE2 O -5.099 -3.115 -1.727 1.00 . A A . 7 GLU OE2 1 1 19 4232 1 1 8 GLY C C 3.001 0.838 -1.975 1.00 . A A . 8 GLY C 1 1 19 4233 1 1 8 GLY CA C 1.728 0.906 -2.820 1.00 . A A . 8 GLY CA 1 1 19 4234 1 1 8 GLY H H -0.082 0.852 -1.655 1.00 . A A . 8 GLY H 1 1 19 4235 1 1 8 GLY HA2 H 1.881 0.371 -3.745 1.00 . A A . 8 GLY HA2 1 1 19 4236 1 1 8 GLY HA3 H 1.496 1.938 -3.033 1.00 . A A . 8 GLY HA3 1 1 19 4237 1 1 8 GLY N N 0.601 0.287 -2.069 1.00 . A A . 8 GLY N 1 1 19 4238 1 1 8 GLY O O 4.092 0.697 -2.491 1.00 . A A . 8 GLY O 1 1 19 4239 1 1 9 ILE C C 4.805 -0.458 -0.007 1.00 . A A . 9 ILE C 1 1 19 4240 1 1 9 ILE CA C 4.075 0.874 0.194 1.00 . A A . 9 ILE CA 1 1 19 4241 1 1 9 ILE CB C 3.537 0.981 1.621 1.00 . A A . 9 ILE CB 1 1 19 4242 1 1 9 ILE CD1 C 2.882 2.604 3.405 1.00 . A A . 9 ILE CD1 1 1 19 4243 1 1 9 ILE CG1 C 3.142 2.432 1.908 1.00 . A A . 9 ILE CG1 1 1 19 4244 1 1 9 ILE CG2 C 4.619 0.543 2.610 1.00 . A A . 9 ILE CG2 1 1 19 4245 1 1 9 ILE H H 1.981 1.047 -0.287 1.00 . A A . 9 ILE H 1 1 19 4246 1 1 9 ILE HA H 4.735 1.701 -0.015 1.00 . A A . 9 ILE HA 1 1 19 4247 1 1 9 ILE HB H 2.672 0.342 1.727 1.00 . A A . 9 ILE HB 1 1 19 4248 1 1 9 ILE HD11 H 2.322 3.513 3.571 1.00 . A A . 9 ILE HD11 1 1 19 4249 1 1 9 ILE HD12 H 3.823 2.660 3.930 1.00 . A A . 9 ILE HD12 1 1 19 4250 1 1 9 ILE HD13 H 2.315 1.762 3.772 1.00 . A A . 9 ILE HD13 1 1 19 4251 1 1 9 ILE HG12 H 3.942 3.089 1.601 1.00 . A A . 9 ILE HG12 1 1 19 4252 1 1 9 ILE HG13 H 2.244 2.675 1.359 1.00 . A A . 9 ILE HG13 1 1 19 4253 1 1 9 ILE HG21 H 4.273 0.712 3.620 1.00 . A A . 9 ILE HG21 1 1 19 4254 1 1 9 ILE HG22 H 5.518 1.116 2.437 1.00 . A A . 9 ILE HG22 1 1 19 4255 1 1 9 ILE HG23 H 4.829 -0.507 2.473 1.00 . A A . 9 ILE HG23 1 1 19 4256 1 1 9 ILE N N 2.870 0.935 -0.682 1.00 . A A . 9 ILE N 1 1 19 4257 1 1 9 ILE O O 5.936 -0.496 -0.450 1.00 . A A . 9 ILE O 1 1 19 4258 1 1 10 LYS C C 5.396 -3.005 -1.266 1.00 . A A . 10 LYS C 1 1 19 4259 1 1 10 LYS CA C 4.826 -2.875 0.149 1.00 . A A . 10 LYS CA 1 1 19 4260 1 1 10 LYS CB C 3.718 -3.902 0.381 1.00 . A A . 10 LYS CB 1 1 19 4261 1 1 10 LYS CD C 1.605 -4.836 -0.571 1.00 . A A . 10 LYS CD 1 1 19 4262 1 1 10 LYS CE C 2.290 -6.079 -1.144 1.00 . A A . 10 LYS CE 1 1 19 4263 1 1 10 LYS CG C 2.575 -3.655 -0.607 1.00 . A A . 10 LYS CG 1 1 19 4264 1 1 10 LYS H H 3.257 -1.496 0.677 1.00 . A A . 10 LYS H 1 1 19 4265 1 1 10 LYS HA H 5.606 -3.004 0.881 1.00 . A A . 10 LYS HA 1 1 19 4266 1 1 10 LYS HB2 H 4.112 -4.896 0.234 1.00 . A A . 10 LYS HB2 1 1 19 4267 1 1 10 LYS HB3 H 3.345 -3.807 1.389 1.00 . A A . 10 LYS HB3 1 1 19 4268 1 1 10 LYS HD2 H 1.308 -5.027 0.451 1.00 . A A . 10 LYS HD2 1 1 19 4269 1 1 10 LYS HD3 H 0.732 -4.604 -1.162 1.00 . A A . 10 LYS HD3 1 1 19 4270 1 1 10 LYS HE2 H 3.186 -6.306 -0.583 1.00 . A A . 10 LYS HE2 1 1 19 4271 1 1 10 LYS HE3 H 1.615 -6.920 -1.134 1.00 . A A . 10 LYS HE3 1 1 19 4272 1 1 10 LYS HG2 H 2.054 -2.749 -0.333 1.00 . A A . 10 LYS HG2 1 1 19 4273 1 1 10 LYS HG3 H 2.978 -3.551 -1.604 1.00 . A A . 10 LYS HG3 1 1 19 4274 1 1 10 LYS HZ1 H 2.564 -6.560 -3.151 1.00 . A A . 10 LYS HZ1 1 1 19 4275 1 1 10 LYS HZ2 H 3.602 -5.341 -2.581 1.00 . A A . 10 LYS HZ2 1 1 19 4276 1 1 10 LYS HZ3 H 1.969 -4.993 -2.890 1.00 . A A . 10 LYS HZ3 1 1 19 4277 1 1 10 LYS N N 4.168 -1.549 0.319 1.00 . A A . 10 LYS N 1 1 19 4278 1 1 10 LYS NZ N 2.632 -5.715 -2.548 1.00 . A A . 10 LYS NZ 1 1 19 4279 1 1 10 LYS O O 6.359 -3.708 -1.496 1.00 . A A . 10 LYS O 1 1 19 4280 1 1 11 SER C C 6.600 -1.587 -3.756 1.00 . A A . 11 SER C 1 1 19 4281 1 1 11 SER CA C 5.320 -2.415 -3.615 1.00 . A A . 11 SER CA 1 1 19 4282 1 1 11 SER CB C 4.205 -1.832 -4.482 1.00 . A A . 11 SER CB 1 1 19 4283 1 1 11 SER H H 4.034 -1.767 -2.010 1.00 . A A . 11 SER H 1 1 19 4284 1 1 11 SER HA H 5.501 -3.441 -3.888 1.00 . A A . 11 SER HA 1 1 19 4285 1 1 11 SER HB2 H 3.539 -1.245 -3.871 1.00 . A A . 11 SER HB2 1 1 19 4286 1 1 11 SER HB3 H 4.637 -1.201 -5.247 1.00 . A A . 11 SER HB3 1 1 19 4287 1 1 11 SER HG H 4.098 -3.576 -5.339 1.00 . A A . 11 SER HG 1 1 19 4288 1 1 11 SER N N 4.808 -2.330 -2.216 1.00 . A A . 11 SER N 1 1 19 4289 1 1 11 SER O O 7.431 -1.852 -4.603 1.00 . A A . 11 SER O 1 1 19 4290 1 1 11 SER OG O 3.474 -2.894 -5.082 1.00 . A A . 11 SER OG 1 1 19 4291 1 1 12 LEU C C 8.889 -0.004 -1.804 1.00 . A A . 12 LEU C 1 1 19 4292 1 1 12 LEU CA C 7.992 0.253 -3.015 1.00 . A A . 12 LEU CA 1 1 19 4293 1 1 12 LEU CB C 7.483 1.695 -3.010 1.00 . A A . 12 LEU CB 1 1 19 4294 1 1 12 LEU CD1 C 5.662 2.339 -4.594 1.00 . A A . 12 LEU CD1 1 1 19 4295 1 1 12 LEU CD2 C 7.896 3.444 -4.744 1.00 . A A . 12 LEU CD2 1 1 19 4296 1 1 12 LEU CG C 7.170 2.132 -4.441 1.00 . A A . 12 LEU CG 1 1 19 4297 1 1 12 LEU H H 6.083 -0.396 -2.255 1.00 . A A . 12 LEU H 1 1 19 4298 1 1 12 LEU HA H 8.525 0.054 -3.928 1.00 . A A . 12 LEU HA 1 1 19 4299 1 1 12 LEU HB2 H 6.588 1.759 -2.408 1.00 . A A . 12 LEU HB2 1 1 19 4300 1 1 12 LEU HB3 H 8.242 2.342 -2.597 1.00 . A A . 12 LEU HB3 1 1 19 4301 1 1 12 LEU HD11 H 5.379 3.277 -4.139 1.00 . A A . 12 LEU HD11 1 1 19 4302 1 1 12 LEU HD12 H 5.137 1.530 -4.108 1.00 . A A . 12 LEU HD12 1 1 19 4303 1 1 12 LEU HD13 H 5.405 2.356 -5.643 1.00 . A A . 12 LEU HD13 1 1 19 4304 1 1 12 LEU HD21 H 7.327 4.271 -4.345 1.00 . A A . 12 LEU HD21 1 1 19 4305 1 1 12 LEU HD22 H 7.999 3.562 -5.813 1.00 . A A . 12 LEU HD22 1 1 19 4306 1 1 12 LEU HD23 H 8.875 3.428 -4.288 1.00 . A A . 12 LEU HD23 1 1 19 4307 1 1 12 LEU HG H 7.499 1.369 -5.132 1.00 . A A . 12 LEU HG 1 1 19 4308 1 1 12 LEU N N 6.765 -0.591 -2.931 1.00 . A A . 12 LEU N 1 1 19 4309 1 1 12 LEU O O 9.906 -0.664 -1.898 1.00 . A A . 12 LEU O 1 1 19 4310 1 1 13 PHE C C 9.098 -1.100 1.124 1.00 . A A . 13 PHE C 1 1 19 4311 1 1 13 PHE CA C 9.347 0.299 0.555 1.00 . A A . 13 PHE CA 1 1 19 4312 1 1 13 PHE CB C 8.881 1.370 1.542 1.00 . A A . 13 PHE CB 1 1 19 4313 1 1 13 PHE CD1 C 11.230 2.273 1.498 1.00 . A A . 13 PHE CD1 1 1 19 4314 1 1 13 PHE CD2 C 10.055 2.191 3.618 1.00 . A A . 13 PHE CD2 1 1 19 4315 1 1 13 PHE CE1 C 12.347 2.814 2.137 1.00 . A A . 13 PHE CE1 1 1 19 4316 1 1 13 PHE CE2 C 11.174 2.734 4.259 1.00 . A A . 13 PHE CE2 1 1 19 4317 1 1 13 PHE CG C 10.083 1.960 2.237 1.00 . A A . 13 PHE CG 1 1 19 4318 1 1 13 PHE CZ C 12.321 3.047 3.518 1.00 . A A . 13 PHE CZ 1 1 19 4319 1 1 13 PHE H H 7.696 1.038 -0.617 1.00 . A A . 13 PHE H 1 1 19 4320 1 1 13 PHE HA H 10.394 0.435 0.331 1.00 . A A . 13 PHE HA 1 1 19 4321 1 1 13 PHE HB2 H 8.353 2.148 1.009 1.00 . A A . 13 PHE HB2 1 1 19 4322 1 1 13 PHE HB3 H 8.225 0.925 2.275 1.00 . A A . 13 PHE HB3 1 1 19 4323 1 1 13 PHE HD1 H 11.250 2.095 0.433 1.00 . A A . 13 PHE HD1 1 1 19 4324 1 1 13 PHE HD2 H 9.169 1.949 4.187 1.00 . A A . 13 PHE HD2 1 1 19 4325 1 1 13 PHE HE1 H 13.230 3.054 1.565 1.00 . A A . 13 PHE HE1 1 1 19 4326 1 1 13 PHE HE2 H 11.154 2.914 5.323 1.00 . A A . 13 PHE HE2 1 1 19 4327 1 1 13 PHE HZ H 13.185 3.466 4.012 1.00 . A A . 13 PHE HZ 1 1 19 4328 1 1 13 PHE N N 8.520 0.512 -0.666 1.00 . A A . 13 PHE N 1 1 19 4329 1 1 13 PHE O O 8.711 -2.004 0.411 1.00 . A A . 13 PHE O 1 1 19 4330 1 1 14 NH2 HN1 H 9.618 -0.590 2.971 1.00 . A A . 14 NH2 HN1 1 1 19 4331 1 1 14 NH2 HN2 H 9.151 -2.209 2.771 1.00 . A A . 14 NH2 HN2 1 1 19 4332 1 1 14 NH2 N N 9.307 -1.318 2.394 1.00 . A A . 14 NH2 N 1 1 20 4333 1 1 1 ILE C C -9.078 -2.881 3.592 1.00 . A A . 1 ILE C 1 1 20 4334 1 1 1 ILE CA C -10.315 -2.503 2.771 1.00 . A A . 1 ILE CA 1 1 20 4335 1 1 1 ILE CB C -10.291 -1.016 2.419 1.00 . A A . 1 ILE CB 1 1 20 4336 1 1 1 ILE CD1 C -9.150 0.571 0.865 1.00 . A A . 1 ILE CD1 1 1 20 4337 1 1 1 ILE CG1 C -8.970 -0.680 1.726 1.00 . A A . 1 ILE CG1 1 1 20 4338 1 1 1 ILE CG2 C -10.421 -0.186 3.697 1.00 . A A . 1 ILE CG2 1 1 20 4339 1 1 1 ILE H1 H -11.368 -2.390 4.566 1.00 . A A . 1 ILE H1 1 1 20 4340 1 1 1 ILE H2 H -11.829 -3.688 3.572 1.00 . A A . 1 ILE H2 1 1 20 4341 1 1 1 ILE H3 H -12.317 -2.107 3.189 1.00 . A A . 1 ILE H3 1 1 20 4342 1 1 1 ILE HA H -10.366 -3.094 1.871 1.00 . A A . 1 ILE HA 1 1 20 4343 1 1 1 ILE HB H -11.116 -0.790 1.758 1.00 . A A . 1 ILE HB 1 1 20 4344 1 1 1 ILE HD11 H -8.262 1.183 0.928 1.00 . A A . 1 ILE HD11 1 1 20 4345 1 1 1 ILE HD12 H -10.000 1.134 1.221 1.00 . A A . 1 ILE HD12 1 1 20 4346 1 1 1 ILE HD13 H -9.315 0.281 -0.163 1.00 . A A . 1 ILE HD13 1 1 20 4347 1 1 1 ILE HG12 H -8.209 -0.500 2.470 1.00 . A A . 1 ILE HG12 1 1 20 4348 1 1 1 ILE HG13 H -8.672 -1.506 1.098 1.00 . A A . 1 ILE HG13 1 1 20 4349 1 1 1 ILE HG21 H -11.412 0.241 3.751 1.00 . A A . 1 ILE HG21 1 1 20 4350 1 1 1 ILE HG22 H -9.688 0.608 3.686 1.00 . A A . 1 ILE HG22 1 1 20 4351 1 1 1 ILE HG23 H -10.254 -0.818 4.557 1.00 . A A . 1 ILE HG23 1 1 20 4352 1 1 1 ILE N N -11.551 -2.686 3.587 1.00 . A A . 1 ILE N 1 1 20 4353 1 1 1 ILE O O -9.002 -2.613 4.775 1.00 . A A . 1 ILE O 1 1 20 4354 1 1 2 LEU C C -5.890 -2.732 3.765 1.00 . A A . 2 LEU C 1 1 20 4355 1 1 2 LEU CA C -6.882 -3.896 3.719 1.00 . A A . 2 LEU CA 1 1 20 4356 1 1 2 LEU CB C -6.300 -5.069 2.931 1.00 . A A . 2 LEU CB 1 1 20 4357 1 1 2 LEU CD1 C -6.292 -6.370 5.062 1.00 . A A . 2 LEU CD1 1 1 20 4358 1 1 2 LEU CD2 C -8.236 -6.537 3.503 1.00 . A A . 2 LEU CD2 1 1 20 4359 1 1 2 LEU CG C -6.716 -6.383 3.593 1.00 . A A . 2 LEU CG 1 1 20 4360 1 1 2 LEU H H -8.193 -3.707 2.018 1.00 . A A . 2 LEU H 1 1 20 4361 1 1 2 LEU HA H -7.134 -4.214 4.719 1.00 . A A . 2 LEU HA 1 1 20 4362 1 1 2 LEU HB2 H -6.672 -5.040 1.917 1.00 . A A . 2 LEU HB2 1 1 20 4363 1 1 2 LEU HB3 H -5.223 -4.998 2.921 1.00 . A A . 2 LEU HB3 1 1 20 4364 1 1 2 LEU HD11 H -6.162 -7.384 5.409 1.00 . A A . 2 LEU HD11 1 1 20 4365 1 1 2 LEU HD12 H -7.055 -5.884 5.652 1.00 . A A . 2 LEU HD12 1 1 20 4366 1 1 2 LEU HD13 H -5.361 -5.831 5.164 1.00 . A A . 2 LEU HD13 1 1 20 4367 1 1 2 LEU HD21 H -8.615 -5.907 2.712 1.00 . A A . 2 LEU HD21 1 1 20 4368 1 1 2 LEU HD22 H -8.683 -6.245 4.442 1.00 . A A . 2 LEU HD22 1 1 20 4369 1 1 2 LEU HD23 H -8.482 -7.568 3.291 1.00 . A A . 2 LEU HD23 1 1 20 4370 1 1 2 LEU HG H -6.236 -7.208 3.087 1.00 . A A . 2 LEU HG 1 1 20 4371 1 1 2 LEU N N -8.111 -3.501 2.973 1.00 . A A . 2 LEU N 1 1 20 4372 1 1 2 LEU O O -5.065 -2.641 4.654 1.00 . A A . 2 LEU O 1 1 20 4373 1 1 3 GLY C C -4.747 -0.249 1.369 1.00 . A A . 3 GLY C 1 1 20 4374 1 1 3 GLY CA C -5.015 -0.688 2.808 1.00 . A A . 3 GLY CA 1 1 20 4375 1 1 3 GLY H H -6.629 -1.932 2.105 1.00 . A A . 3 GLY H 1 1 20 4376 1 1 3 GLY HA2 H -5.447 0.134 3.361 1.00 . A A . 3 GLY HA2 1 1 20 4377 1 1 3 GLY HA3 H -4.085 -0.982 3.269 1.00 . A A . 3 GLY HA3 1 1 20 4378 1 1 3 GLY N N -5.959 -1.841 2.814 1.00 . A A . 3 GLY N 1 1 20 4379 1 1 3 GLY O O -3.832 -0.724 0.726 1.00 . A A . 3 GLY O 1 1 20 4380 1 1 4 LYS C C -3.988 1.897 -0.601 1.00 . A A . 4 LYS C 1 1 20 4381 1 1 4 LYS CA C -5.306 1.133 -0.535 1.00 . A A . 4 LYS CA 1 1 20 4382 1 1 4 LYS CB C -6.484 2.060 -0.842 1.00 . A A . 4 LYS CB 1 1 20 4383 1 1 4 LYS CD C -6.658 0.988 -3.093 1.00 . A A . 4 LYS CD 1 1 20 4384 1 1 4 LYS CE C -7.187 1.795 -4.281 1.00 . A A . 4 LYS CE 1 1 20 4385 1 1 4 LYS CG C -7.431 1.373 -1.829 1.00 . A A . 4 LYS CG 1 1 20 4386 1 1 4 LYS H H -6.258 1.040 1.396 1.00 . A A . 4 LYS H 1 1 20 4387 1 1 4 LYS HA H -5.296 0.303 -1.218 1.00 . A A . 4 LYS HA 1 1 20 4388 1 1 4 LYS HB2 H -7.015 2.283 0.072 1.00 . A A . 4 LYS HB2 1 1 20 4389 1 1 4 LYS HB3 H -6.116 2.976 -1.277 1.00 . A A . 4 LYS HB3 1 1 20 4390 1 1 4 LYS HD2 H -5.608 1.200 -2.951 1.00 . A A . 4 LYS HD2 1 1 20 4391 1 1 4 LYS HD3 H -6.790 -0.065 -3.289 1.00 . A A . 4 LYS HD3 1 1 20 4392 1 1 4 LYS HE2 H -8.133 2.256 -4.029 1.00 . A A . 4 LYS HE2 1 1 20 4393 1 1 4 LYS HE3 H -6.469 2.543 -4.577 1.00 . A A . 4 LYS HE3 1 1 20 4394 1 1 4 LYS HG2 H -7.843 0.485 -1.373 1.00 . A A . 4 LYS HG2 1 1 20 4395 1 1 4 LYS HG3 H -8.231 2.050 -2.090 1.00 . A A . 4 LYS HG3 1 1 20 4396 1 1 4 LYS HZ1 H -8.205 0.217 -5.178 1.00 . A A . 4 LYS HZ1 1 1 20 4397 1 1 4 LYS HZ2 H -6.525 0.189 -5.427 1.00 . A A . 4 LYS HZ2 1 1 20 4398 1 1 4 LYS HZ3 H -7.495 1.295 -6.278 1.00 . A A . 4 LYS HZ3 1 1 20 4399 1 1 4 LYS N N -5.531 0.662 0.860 1.00 . A A . 4 LYS N 1 1 20 4400 1 1 4 LYS NZ N -7.367 0.798 -5.374 1.00 . A A . 4 LYS NZ 1 1 20 4401 1 1 4 LYS O O -3.156 1.657 -1.453 1.00 . A A . 4 LYS O 1 1 20 4402 1 1 5 ILE C C -1.373 2.675 0.754 1.00 . A A . 5 ILE C 1 1 20 4403 1 1 5 ILE CA C -2.523 3.585 0.321 1.00 . A A . 5 ILE CA 1 1 20 4404 1 1 5 ILE CB C -2.756 4.689 1.351 1.00 . A A . 5 ILE CB 1 1 20 4405 1 1 5 ILE CD1 C -3.005 6.502 -0.353 1.00 . A A . 5 ILE CD1 1 1 20 4406 1 1 5 ILE CG1 C -3.710 5.733 0.766 1.00 . A A . 5 ILE CG1 1 1 20 4407 1 1 5 ILE CG2 C -1.422 5.352 1.703 1.00 . A A . 5 ILE CG2 1 1 20 4408 1 1 5 ILE H H -4.475 2.974 0.986 1.00 . A A . 5 ILE H 1 1 20 4409 1 1 5 ILE HA H -2.326 4.015 -0.649 1.00 . A A . 5 ILE HA 1 1 20 4410 1 1 5 ILE HB H -3.191 4.260 2.241 1.00 . A A . 5 ILE HB 1 1 20 4411 1 1 5 ILE HD11 H -2.034 6.066 -0.534 1.00 . A A . 5 ILE HD11 1 1 20 4412 1 1 5 ILE HD12 H -2.886 7.535 -0.061 1.00 . A A . 5 ILE HD12 1 1 20 4413 1 1 5 ILE HD13 H -3.597 6.448 -1.254 1.00 . A A . 5 ILE HD13 1 1 20 4414 1 1 5 ILE HG12 H -4.584 5.238 0.370 1.00 . A A . 5 ILE HG12 1 1 20 4415 1 1 5 ILE HG13 H -4.007 6.421 1.542 1.00 . A A . 5 ILE HG13 1 1 20 4416 1 1 5 ILE HG21 H -1.090 5.956 0.872 1.00 . A A . 5 ILE HG21 1 1 20 4417 1 1 5 ILE HG22 H -0.686 4.591 1.913 1.00 . A A . 5 ILE HG22 1 1 20 4418 1 1 5 ILE HG23 H -1.551 5.979 2.574 1.00 . A A . 5 ILE HG23 1 1 20 4419 1 1 5 ILE N N -3.790 2.809 0.306 1.00 . A A . 5 ILE N 1 1 20 4420 1 1 5 ILE O O -0.225 2.905 0.428 1.00 . A A . 5 ILE O 1 1 20 4421 1 1 6 TRP C C -0.206 -0.228 0.795 1.00 . A A . 6 TRP C 1 1 20 4422 1 1 6 TRP CA C -0.609 0.704 1.940 1.00 . A A . 6 TRP CA 1 1 20 4423 1 1 6 TRP CB C -1.238 -0.092 3.085 1.00 . A A . 6 TRP CB 1 1 20 4424 1 1 6 TRP CD1 C -0.674 -2.555 3.027 1.00 . A A . 6 TRP CD1 1 1 20 4425 1 1 6 TRP CD2 C 0.874 -1.338 4.117 1.00 . A A . 6 TRP CD2 1 1 20 4426 1 1 6 TRP CE2 C 1.310 -2.683 4.160 1.00 . A A . 6 TRP CE2 1 1 20 4427 1 1 6 TRP CE3 C 1.674 -0.361 4.735 1.00 . A A . 6 TRP CE3 1 1 20 4428 1 1 6 TRP CG C -0.389 -1.283 3.392 1.00 . A A . 6 TRP CG 1 1 20 4429 1 1 6 TRP CH2 C 3.283 -2.063 5.403 1.00 . A A . 6 TRP CH2 1 1 20 4430 1 1 6 TRP CZ2 C 2.499 -3.047 4.793 1.00 . A A . 6 TRP CZ2 1 1 20 4431 1 1 6 TRP CZ3 C 2.872 -0.722 5.375 1.00 . A A . 6 TRP CZ3 1 1 20 4432 1 1 6 TRP H H -2.613 1.470 1.735 1.00 . A A . 6 TRP H 1 1 20 4433 1 1 6 TRP HA H 0.246 1.254 2.299 1.00 . A A . 6 TRP HA 1 1 20 4434 1 1 6 TRP HB2 H -1.309 0.534 3.962 1.00 . A A . 6 TRP HB2 1 1 20 4435 1 1 6 TRP HB3 H -2.225 -0.420 2.795 1.00 . A A . 6 TRP HB3 1 1 20 4436 1 1 6 TRP HD1 H -1.544 -2.868 2.471 1.00 . A A . 6 TRP HD1 1 1 20 4437 1 1 6 TRP HE1 H 0.369 -4.357 3.350 1.00 . A A . 6 TRP HE1 1 1 20 4438 1 1 6 TRP HE3 H 1.367 0.674 4.718 1.00 . A A . 6 TRP HE3 1 1 20 4439 1 1 6 TRP HH2 H 4.204 -2.335 5.896 1.00 . A A . 6 TRP HH2 1 1 20 4440 1 1 6 TRP HZ2 H 2.812 -4.080 4.813 1.00 . A A . 6 TRP HZ2 1 1 20 4441 1 1 6 TRP HZ3 H 3.479 0.035 5.846 1.00 . A A . 6 TRP HZ3 1 1 20 4442 1 1 6 TRP N N -1.678 1.637 1.486 1.00 . A A . 6 TRP N 1 1 20 4443 1 1 6 TRP NE1 N 0.334 -3.386 3.481 1.00 . A A . 6 TRP NE1 1 1 20 4444 1 1 6 TRP O O 0.907 -0.711 0.738 1.00 . A A . 6 TRP O 1 1 20 4445 1 1 7 GLU C C 0.469 -0.854 -1.993 1.00 . A A . 7 GLU C 1 1 20 4446 1 1 7 GLU CA C -0.765 -1.380 -1.260 1.00 . A A . 7 GLU CA 1 1 20 4447 1 1 7 GLU CB C -1.991 -1.342 -2.173 1.00 . A A . 7 GLU CB 1 1 20 4448 1 1 7 GLU CD C -3.359 -2.836 -3.637 1.00 . A A . 7 GLU CD 1 1 20 4449 1 1 7 GLU CG C -2.545 -2.758 -2.345 1.00 . A A . 7 GLU CG 1 1 20 4450 1 1 7 GLU H H -1.995 -0.081 -0.057 1.00 . A A . 7 GLU H 1 1 20 4451 1 1 7 GLU HA H -0.596 -2.384 -0.911 1.00 . A A . 7 GLU HA 1 1 20 4452 1 1 7 GLU HB2 H -2.749 -0.709 -1.733 1.00 . A A . 7 GLU HB2 1 1 20 4453 1 1 7 GLU HB3 H -1.710 -0.948 -3.138 1.00 . A A . 7 GLU HB3 1 1 20 4454 1 1 7 GLU HG2 H -1.726 -3.461 -2.392 1.00 . A A . 7 GLU HG2 1 1 20 4455 1 1 7 GLU HG3 H -3.180 -3.000 -1.506 1.00 . A A . 7 GLU HG3 1 1 20 4456 1 1 7 GLU N N -1.102 -0.482 -0.119 1.00 . A A . 7 GLU N 1 1 20 4457 1 1 7 GLU O O 1.344 -1.605 -2.379 1.00 . A A . 7 GLU O 1 1 20 4458 1 1 7 GLU OE1 O -3.665 -1.790 -4.186 1.00 . A A . 7 GLU OE1 1 1 20 4459 1 1 7 GLU OE2 O -3.664 -3.941 -4.056 1.00 . A A . 7 GLU OE2 1 1 20 4460 1 1 8 GLY C C 2.907 1.081 -1.918 1.00 . A A . 8 GLY C 1 1 20 4461 1 1 8 GLY CA C 1.724 1.015 -2.884 1.00 . A A . 8 GLY CA 1 1 20 4462 1 1 8 GLY H H -0.170 1.015 -1.857 1.00 . A A . 8 GLY H 1 1 20 4463 1 1 8 GLY HA2 H 1.981 0.395 -3.731 1.00 . A A . 8 GLY HA2 1 1 20 4464 1 1 8 GLY HA3 H 1.485 2.011 -3.224 1.00 . A A . 8 GLY HA3 1 1 20 4465 1 1 8 GLY N N 0.546 0.432 -2.182 1.00 . A A . 8 GLY N 1 1 20 4466 1 1 8 GLY O O 4.052 1.014 -2.318 1.00 . A A . 8 GLY O 1 1 20 4467 1 1 9 ILE C C 4.557 -0.021 0.324 1.00 . A A . 9 ILE C 1 1 20 4468 1 1 9 ILE CA C 3.746 1.278 0.347 1.00 . A A . 9 ILE CA 1 1 20 4469 1 1 9 ILE CB C 3.052 1.454 1.698 1.00 . A A . 9 ILE CB 1 1 20 4470 1 1 9 ILE CD1 C 1.880 3.082 3.188 1.00 . A A . 9 ILE CD1 1 1 20 4471 1 1 9 ILE CG1 C 2.546 2.893 1.824 1.00 . A A . 9 ILE CG1 1 1 20 4472 1 1 9 ILE CG2 C 4.043 1.162 2.826 1.00 . A A . 9 ILE CG2 1 1 20 4473 1 1 9 ILE H H 1.707 1.261 -0.348 1.00 . A A . 9 ILE H 1 1 20 4474 1 1 9 ILE HA H 4.383 2.124 0.146 1.00 . A A . 9 ILE HA 1 1 20 4475 1 1 9 ILE HB H 2.219 0.770 1.765 1.00 . A A . 9 ILE HB 1 1 20 4476 1 1 9 ILE HD11 H 1.060 3.779 3.095 1.00 . A A . 9 ILE HD11 1 1 20 4477 1 1 9 ILE HD12 H 2.602 3.468 3.892 1.00 . A A . 9 ILE HD12 1 1 20 4478 1 1 9 ILE HD13 H 1.505 2.132 3.541 1.00 . A A . 9 ILE HD13 1 1 20 4479 1 1 9 ILE HG12 H 3.378 3.576 1.731 1.00 . A A . 9 ILE HG12 1 1 20 4480 1 1 9 ILE HG13 H 1.828 3.092 1.043 1.00 . A A . 9 ILE HG13 1 1 20 4481 1 1 9 ILE HG21 H 4.145 0.094 2.948 1.00 . A A . 9 ILE HG21 1 1 20 4482 1 1 9 ILE HG22 H 3.681 1.596 3.745 1.00 . A A . 9 ILE HG22 1 1 20 4483 1 1 9 ILE HG23 H 5.005 1.589 2.580 1.00 . A A . 9 ILE HG23 1 1 20 4484 1 1 9 ILE N N 2.638 1.209 -0.648 1.00 . A A . 9 ILE N 1 1 20 4485 1 1 9 ILE O O 5.750 -0.015 0.097 1.00 . A A . 9 ILE O 1 1 20 4486 1 1 10 LYS C C 5.297 -2.663 -0.823 1.00 . A A . 10 LYS C 1 1 20 4487 1 1 10 LYS CA C 4.653 -2.432 0.547 1.00 . A A . 10 LYS CA 1 1 20 4488 1 1 10 LYS CB C 3.587 -3.493 0.824 1.00 . A A . 10 LYS CB 1 1 20 4489 1 1 10 LYS CD C 1.843 -4.845 -0.349 1.00 . A A . 10 LYS CD 1 1 20 4490 1 1 10 LYS CE C 2.264 -5.614 -1.602 1.00 . A A . 10 LYS CE 1 1 20 4491 1 1 10 LYS CG C 2.561 -3.495 -0.312 1.00 . A A . 10 LYS CG 1 1 20 4492 1 1 10 LYS H H 2.954 -1.118 0.737 1.00 . A A . 10 LYS H 1 1 20 4493 1 1 10 LYS HA H 5.400 -2.449 1.324 1.00 . A A . 10 LYS HA 1 1 20 4494 1 1 10 LYS HB2 H 4.055 -4.464 0.888 1.00 . A A . 10 LYS HB2 1 1 20 4495 1 1 10 LYS HB3 H 3.089 -3.270 1.755 1.00 . A A . 10 LYS HB3 1 1 20 4496 1 1 10 LYS HD2 H 2.106 -5.415 0.531 1.00 . A A . 10 LYS HD2 1 1 20 4497 1 1 10 LYS HD3 H 0.775 -4.684 -0.368 1.00 . A A . 10 LYS HD3 1 1 20 4498 1 1 10 LYS HE2 H 3.325 -5.820 -1.576 1.00 . A A . 10 LYS HE2 1 1 20 4499 1 1 10 LYS HE3 H 1.703 -6.531 -1.687 1.00 . A A . 10 LYS HE3 1 1 20 4500 1 1 10 LYS HG2 H 1.841 -2.706 -0.148 1.00 . A A . 10 LYS HG2 1 1 20 4501 1 1 10 LYS HG3 H 3.065 -3.332 -1.252 1.00 . A A . 10 LYS HG3 1 1 20 4502 1 1 10 LYS HZ1 H 1.643 -5.274 -3.560 1.00 . A A . 10 LYS HZ1 1 1 20 4503 1 1 10 LYS HZ2 H 2.775 -4.144 -2.984 1.00 . A A . 10 LYS HZ2 1 1 20 4504 1 1 10 LYS HZ3 H 1.160 -4.074 -2.463 1.00 . A A . 10 LYS HZ3 1 1 20 4505 1 1 10 LYS N N 3.918 -1.135 0.557 1.00 . A A . 10 LYS N 1 1 20 4506 1 1 10 LYS NZ N 1.935 -4.708 -2.738 1.00 . A A . 10 LYS NZ 1 1 20 4507 1 1 10 LYS O O 6.252 -3.403 -0.954 1.00 . A A . 10 LYS O 1 1 20 4508 1 1 11 SER C C 6.553 -1.269 -3.400 1.00 . A A . 11 SER C 1 1 20 4509 1 1 11 SER CA C 5.366 -2.216 -3.204 1.00 . A A . 11 SER CA 1 1 20 4510 1 1 11 SER CB C 4.236 -1.867 -4.170 1.00 . A A . 11 SER CB 1 1 20 4511 1 1 11 SER H H 4.013 -1.441 -1.717 1.00 . A A . 11 SER H 1 1 20 4512 1 1 11 SER HA H 5.671 -3.241 -3.349 1.00 . A A . 11 SER HA 1 1 20 4513 1 1 11 SER HB2 H 3.383 -2.495 -3.972 1.00 . A A . 11 SER HB2 1 1 20 4514 1 1 11 SER HB3 H 3.954 -0.830 -4.034 1.00 . A A . 11 SER HB3 1 1 20 4515 1 1 11 SER HG H 4.800 -1.222 -5.916 1.00 . A A . 11 SER HG 1 1 20 4516 1 1 11 SER N N 4.782 -2.034 -1.843 1.00 . A A . 11 SER N 1 1 20 4517 1 1 11 SER O O 7.421 -1.507 -4.215 1.00 . A A . 11 SER O 1 1 20 4518 1 1 11 SER OG O 4.675 -2.080 -5.505 1.00 . A A . 11 SER OG 1 1 20 4519 1 1 12 LEU C C 8.923 0.302 -1.968 1.00 . A A . 12 LEU C 1 1 20 4520 1 1 12 LEU CA C 7.726 0.766 -2.801 1.00 . A A . 12 LEU CA 1 1 20 4521 1 1 12 LEU CB C 7.185 2.094 -2.269 1.00 . A A . 12 LEU CB 1 1 20 4522 1 1 12 LEU CD1 C 7.555 4.547 -2.569 1.00 . A A . 12 LEU CD1 1 1 20 4523 1 1 12 LEU CD2 C 9.173 3.193 -1.233 1.00 . A A . 12 LEU CD2 1 1 20 4524 1 1 12 LEU CG C 8.242 3.185 -2.447 1.00 . A A . 12 LEU CG 1 1 20 4525 1 1 12 LEU H H 5.885 -0.023 -2.007 1.00 . A A . 12 LEU H 1 1 20 4526 1 1 12 LEU HA H 8.005 0.869 -3.838 1.00 . A A . 12 LEU HA 1 1 20 4527 1 1 12 LEU HB2 H 6.293 2.363 -2.817 1.00 . A A . 12 LEU HB2 1 1 20 4528 1 1 12 LEU HB3 H 6.948 1.991 -1.222 1.00 . A A . 12 LEU HB3 1 1 20 4529 1 1 12 LEU HD11 H 7.098 4.806 -1.626 1.00 . A A . 12 LEU HD11 1 1 20 4530 1 1 12 LEU HD12 H 6.794 4.499 -3.336 1.00 . A A . 12 LEU HD12 1 1 20 4531 1 1 12 LEU HD13 H 8.286 5.296 -2.834 1.00 . A A . 12 LEU HD13 1 1 20 4532 1 1 12 LEU HD21 H 10.108 2.720 -1.493 1.00 . A A . 12 LEU HD21 1 1 20 4533 1 1 12 LEU HD22 H 8.710 2.653 -0.420 1.00 . A A . 12 LEU HD22 1 1 20 4534 1 1 12 LEU HD23 H 9.358 4.213 -0.929 1.00 . A A . 12 LEU HD23 1 1 20 4535 1 1 12 LEU HG H 8.814 2.989 -3.342 1.00 . A A . 12 LEU HG 1 1 20 4536 1 1 12 LEU N N 6.596 -0.196 -2.658 1.00 . A A . 12 LEU N 1 1 20 4537 1 1 12 LEU O O 10.054 0.659 -2.234 1.00 . A A . 12 LEU O 1 1 20 4538 1 1 13 PHE C C 9.446 -2.327 0.520 1.00 . A A . 13 PHE C 1 1 20 4539 1 1 13 PHE CA C 9.806 -0.978 -0.108 1.00 . A A . 13 PHE CA 1 1 20 4540 1 1 13 PHE CB C 9.975 0.089 0.974 1.00 . A A . 13 PHE CB 1 1 20 4541 1 1 13 PHE CD1 C 12.339 0.382 0.166 1.00 . A A . 13 PHE CD1 1 1 20 4542 1 1 13 PHE CD2 C 11.914 0.416 2.552 1.00 . A A . 13 PHE CD2 1 1 20 4543 1 1 13 PHE CE1 C 13.702 0.575 0.405 1.00 . A A . 13 PHE CE1 1 1 20 4544 1 1 13 PHE CE2 C 13.279 0.610 2.792 1.00 . A A . 13 PHE CE2 1 1 20 4545 1 1 13 PHE CG C 11.444 0.302 1.238 1.00 . A A . 13 PHE CG 1 1 20 4546 1 1 13 PHE CZ C 14.173 0.690 1.719 1.00 . A A . 13 PHE CZ 1 1 20 4547 1 1 13 PHE H H 7.764 -0.767 -0.762 1.00 . A A . 13 PHE H 1 1 20 4548 1 1 13 PHE HA H 10.714 -1.062 -0.688 1.00 . A A . 13 PHE HA 1 1 20 4549 1 1 13 PHE HB2 H 9.529 1.014 0.639 1.00 . A A . 13 PHE HB2 1 1 20 4550 1 1 13 PHE HB3 H 9.491 -0.239 1.882 1.00 . A A . 13 PHE HB3 1 1 20 4551 1 1 13 PHE HD1 H 11.978 0.295 -0.848 1.00 . A A . 13 PHE HD1 1 1 20 4552 1 1 13 PHE HD2 H 11.222 0.354 3.380 1.00 . A A . 13 PHE HD2 1 1 20 4553 1 1 13 PHE HE1 H 14.390 0.635 -0.423 1.00 . A A . 13 PHE HE1 1 1 20 4554 1 1 13 PHE HE2 H 13.642 0.699 3.806 1.00 . A A . 13 PHE HE2 1 1 20 4555 1 1 13 PHE HZ H 15.227 0.840 1.903 1.00 . A A . 13 PHE HZ 1 1 20 4556 1 1 13 PHE N N 8.683 -0.491 -0.959 1.00 . A A . 13 PHE N 1 1 20 4557 1 1 13 PHE O O 9.309 -2.439 1.723 1.00 . A A . 13 PHE O 1 1 20 4558 1 1 14 NH2 HN1 H 9.394 -3.280 -1.221 1.00 . A A . 14 NH2 HN1 1 1 20 4559 1 1 14 NH2 HN2 H 9.052 -4.235 0.140 1.00 . A A . 14 NH2 HN2 1 1 20 4560 1 1 14 NH2 N N 9.284 -3.367 -0.250 1.00 . A A . 14 NH2 N 1 1 stop_ save_
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