NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
654168 | 7jgx | 30775 | cing | 4-filtered-FRED | STAR | entry | full | 61 |
data_FRED_restraints_with_modified_coordinates_PDB_code_7jgx # This FRED archive file contains, for PDB entry <7jgx>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396. save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.PDB_coordinate_file_version . _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_7jgx _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 7jgx _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 1534.84 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 $neuroVAL_derived_peptide_ILE_PHE_TRP_LEU_PHE_ARG_GLY_LYS_ALA_ASP_ A . 1 1 stop_ save_ save_neuroVAL_derived_peptide_ILE_PHE_TRP_LEU_PHE_ARG_GLY_LYS_ALA_ASP_ _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "neuroVAL derived peptide ILE PHE TRP LEU PHE ARG GLY LYS ALA ASP " _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code IFWLFRGKADVALX _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 PHE . 1 1 3 TRP . 1 1 4 LEU . 1 1 5 PHE . 1 1 6 ARG . 1 1 7 GLY . 1 1 8 LYS . 1 1 9 ALA . 1 1 10 ASP . 1 1 11 VAL . 1 1 12 ALA . 1 1 13 LEU . 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 PHE 2 2 1 1 TRP 3 3 1 1 LEU 4 4 1 1 PHE 5 5 1 1 ARG 6 6 1 1 GLY 7 7 1 1 LYS 8 8 1 1 ALA 9 9 1 1 ASP 10 10 1 1 VAL 11 11 1 1 ALA 12 12 1 1 LEU 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_DYANA/DIANA_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 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 12 ALA HA . 12 ALA HA 1 1 1 1 2 1 1 13 LEU H . 13 LEU H 1 1 2 1 1 1 1 11 VAL HB . 11 VAL HB 1 1 2 1 2 1 1 12 ALA H . 12 ALA H 1 1 3 1 1 1 1 11 VAL H . 11 VAL H 1 1 3 1 2 1 1 11 VAL HB . 11 VAL HB 1 1 4 1 1 1 1 13 LEU H . 13 LEU H 1 1 4 1 2 1 1 13 LEU HG . 13 LEU HG 1 1 5 1 1 1 1 6 ARG H . 6 ARG H 1 1 5 1 2 1 1 6 ARG HG2 . 6 ARG HG2 1 1 6 1 1 1 1 6 ARG H . 6 ARG H 1 1 6 1 2 1 1 6 ARG HG3 . 6 ARG HG3 1 1 7 1 1 1 1 8 LYS H . 8 LYS H 1 1 7 1 2 1 1 8 LYS HG2 . 8 LYS HG2 1 1 8 1 1 1 1 8 LYS H . 8 LYS H 1 1 8 1 2 1 1 8 LYS HG3 . 8 LYS HG3 1 1 9 1 1 1 1 12 ALA H . 12 ALA H 1 1 9 1 2 1 1 12 ALA MB . 12 ALA QB 1 1 10 1 1 1 1 12 ALA MB . 12 ALA QB 1 1 10 1 2 1 1 13 LEU H . 13 LEU H 1 1 11 1 1 1 1 9 ALA H . 9 ALA H 1 1 11 1 2 1 1 9 ALA MB . 9 ALA QB 1 1 12 1 1 1 1 9 ALA MB . 9 ALA QB 1 1 12 1 2 1 1 10 ASP H . 10 ASP H 1 1 13 1 1 1 1 4 LEU H . 4 LEU H 1 1 13 1 2 1 1 4 LEU HG . 4 LEU HG 1 1 14 1 1 1 1 11 VAL MG1 . 11 VAL QG1 1 1 14 1 2 1 1 12 ALA H . 12 ALA H 1 1 15 1 1 1 1 11 VAL MG2 . 11 VAL QG2 1 1 15 1 2 1 1 12 ALA H . 12 ALA H 1 1 16 1 1 1 1 11 VAL H . 11 VAL H 1 1 16 1 2 1 1 11 VAL MG1 . 11 VAL QG1 1 1 17 1 1 1 1 11 VAL H . 11 VAL H 1 1 17 1 2 1 1 11 VAL MG2 . 11 VAL QG2 1 1 18 1 1 1 1 13 LEU HA . 13 LEU HA 1 1 18 1 2 1 1 13 LEU MD1 . 13 LEU QD1 1 1 19 1 1 1 1 13 LEU HA . 13 LEU HA 1 1 19 1 2 1 1 13 LEU MD2 . 13 LEU QD2 1 1 20 1 1 1 1 4 LEU HA . 4 LEU HA 1 1 20 1 2 1 1 4 LEU MD1 . 4 LEU QD1 1 1 21 1 1 1 1 4 LEU HA . 4 LEU HA 1 1 21 1 2 1 1 4 LEU MD2 . 4 LEU QD2 1 1 22 1 1 1 1 6 ARG HA . 6 ARG HA 1 1 22 1 2 1 1 6 ARG HD2 . 6 ARG HD2 1 1 23 1 1 1 1 6 ARG HA . 6 ARG HA 1 1 23 1 2 1 1 6 ARG HD3 . 6 ARG HD3 1 1 24 1 1 1 1 4 LEU HA . 4 LEU HA 1 1 24 1 2 1 1 4 LEU QD . 4 LEU QQD 1 1 25 1 1 1 1 5 PHE H . 5 PHE H 1 1 25 1 2 1 1 5 PHE QB . 5 PHE QB 1 1 26 1 1 1 1 6 ARG H . 6 ARG H 1 1 26 1 2 1 1 6 ARG QB . 6 ARG QB 1 1 27 1 1 1 1 6 ARG H . 6 ARG H 1 1 27 1 2 1 1 6 ARG QG . 6 ARG QG 1 1 28 1 1 1 1 6 ARG HA . 6 ARG HA 1 1 28 1 2 1 1 6 ARG QD . 6 ARG QD 1 1 29 1 1 1 1 8 LYS H . 8 LYS H 1 1 29 1 2 1 1 8 LYS QB . 8 LYS QB 1 1 30 1 1 1 1 8 LYS H . 8 LYS H 1 1 30 1 2 1 1 8 LYS QG . 8 LYS QG 1 1 31 1 1 1 1 10 ASP H . 10 ASP H 1 1 31 1 2 1 1 10 ASP QB . 10 ASP QB 1 1 32 1 1 1 1 11 VAL H . 11 VAL H 1 1 32 1 2 1 1 11 VAL QG . 11 VAL QQG 1 1 33 1 1 1 1 11 VAL QG . 11 VAL QQG 1 1 33 1 2 1 1 12 ALA H . 12 ALA H 1 1 34 1 1 1 1 13 LEU H . 13 LEU H 1 1 34 1 2 1 1 13 LEU QB . 13 LEU QB 1 1 35 1 1 1 1 13 LEU HA . 13 LEU HA 1 1 35 1 2 1 1 13 LEU QD . 13 LEU QQD 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 . . . . . . . 3.45 1 1 2 1 . . . . . . . 4.52 1 1 3 1 . . . . . . . 3.82 1 1 4 1 . . . . . . . 4.41 1 1 5 1 . . . . . . . 5.35 1 1 6 1 . . . . . . . 5.35 1 1 7 1 . . . . . . . 5.34 1 1 8 1 . . . . . . . 5.34 1 1 9 1 . . . . . . . 3.66 1 1 10 1 . . . . . . . 4.55 1 1 11 1 . . . . . . . 3.55 1 1 12 1 . . . . . . . 4.51 1 1 13 1 . . . . . . . 4.32 1 1 14 1 . . . . . . . 5.47 1 1 15 1 . . . . . . . 5.47 1 1 16 1 . . . . . . . 4.58 1 1 17 1 . . . . . . . 4.58 1 1 18 1 . . . . . . . 4.52 1 1 19 1 . . . . . . . 4.52 1 1 20 1 . . . . . . . 4.25 1 1 21 1 . . . . . . . 4.25 1 1 22 1 . . . . . . . 5.39 1 1 23 1 . . . . . . . 5.39 1 1 24 1 . . . . . . . 3.54 1 1 25 1 . . . . . . . 3.61 1 1 26 1 . . . . . . . 3.64 1 1 27 1 . . . . . . . 4.6 1 1 28 1 . . . . . . . 4.61 1 1 29 1 . . . . . . . 3.59 1 1 30 1 . . . . . . . 4.58 1 1 31 1 . . . . . . . 3.62 1 1 32 1 . . . . . . . 3.97 1 1 33 1 . . . . . . . 4.64 1 1 34 1 . . . . . . . 3.56 1 1 35 1 . . . . . . . 3.87 1 1 stop_ save_ save_DYANA/DIANA_distance_constraints_4_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 6 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 1 ILE O . 1 ILE O 1 2 1 1 2 1 1 5 PHE H . 5 PHE H 1 2 2 1 1 1 1 1 ILE O . 1 ILE O 1 2 2 1 2 1 1 5 PHE N . 5 PHE N 1 2 3 1 1 1 1 2 PHE O . 2 PHE O 1 2 3 1 2 1 1 6 ARG H . 6 ARG H 1 2 4 1 1 1 1 2 PHE O . 2 PHE O 1 2 4 1 2 1 1 6 ARG N . 6 ARG N 1 2 5 1 1 1 1 6 ARG O . 6 ARG O 1 2 5 1 2 1 1 10 ASP H . 10 ASP H 1 2 6 1 1 1 1 6 ARG O . 6 ARG O 1 2 6 1 2 1 1 10 ASP N . 10 ASP 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 . . . . . . . 2.0 1 2 2 1 . . . . . . . 3.0 1 2 3 1 . . . . . . . 2.0 1 2 4 1 . . . . . . . 3.0 1 2 5 1 . . . . . . . 2.0 1 2 6 1 . . . . . . . 3.0 1 2 stop_ save_ save_DYANA/DIANA_dihedral_3 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 PHI 1 1 1 ILE C 1 1 2 PHE N 1 1 2 PHE CA 1 1 2 PHE C -83.399994 -43.4 . 2 PHE . . 2 PHE . . 2 PHE . . 2 PHE . 1 1 2 PSI 1 1 2 PHE N 1 1 2 PHE CA 1 1 2 PHE C 1 1 3 TRP N -58.300003 -18.3 . 2 PHE . . 2 PHE . . 2 PHE . . 2 PHE . 1 1 3 PHI 1 1 2 PHE C 1 1 3 TRP N 1 1 3 TRP CA 1 1 3 TRP C -84.5 -44.5 . 3 TRP . . 3 TRP . . 3 TRP . . 3 TRP . 1 1 4 PSI 1 1 3 TRP N 1 1 3 TRP CA 1 1 3 TRP C 1 1 4 LEU N -63.3 -23.3 . 3 TRP . . 3 TRP . . 3 TRP . . 3 TRP . 1 1 5 PHI 1 1 3 TRP C 1 1 4 LEU N 1 1 4 LEU CA 1 1 4 LEU C -86.1 -46.099995 . 4 LEU . . 4 LEU . . 4 LEU . . 4 LEU . 1 1 6 PSI 1 1 4 LEU N 1 1 4 LEU CA 1 1 4 LEU C 1 1 5 PHE N -62.899998 -22.9 . 4 LEU . . 4 LEU . . 4 LEU . . 4 LEU . 1 1 7 PHI 1 1 4 LEU C 1 1 5 PHE N 1 1 5 PHE CA 1 1 5 PHE C -85.8 -45.8 . 5 PHE . . 5 PHE . . 5 PHE . . 5 PHE . 1 1 8 PSI 1 1 5 PHE N 1 1 5 PHE CA 1 1 5 PHE C 1 1 6 ARG N -60.5 -20.5 . 5 PHE . . 5 PHE . . 5 PHE . . 5 PHE . 1 1 9 PHI 1 1 5 PHE C 1 1 6 ARG N 1 1 6 ARG CA 1 1 6 ARG C -84.7 -44.699997 . 6 ARG . . 6 ARG . . 6 ARG . . 6 ARG . 1 1 10 PSI 1 1 6 ARG N 1 1 6 ARG CA 1 1 6 ARG C 1 1 7 GLY N -62.700005 -22.7 . 6 ARG . . 6 ARG . . 6 ARG . . 6 ARG . 1 1 11 PHI 1 1 6 ARG C 1 1 7 GLY N 1 1 7 GLY CA 1 1 7 GLY C -85.59999 -45.6 . 7 GLY . . 7 GLY . . 7 GLY . . 7 GLY . 1 1 12 PSI 1 1 7 GLY N 1 1 7 GLY CA 1 1 7 GLY C 1 1 8 LYS N -59.9 -19.899998 . 7 GLY . . 7 GLY . . 7 GLY . . 7 GLY . 1 1 13 PHI 1 1 7 GLY C 1 1 8 LYS N 1 1 8 LYS CA 1 1 8 LYS C -85.5 -45.5 . 8 LYS . . 8 LYS . . 8 LYS . . 8 LYS . 1 1 14 PSI 1 1 8 LYS N 1 1 8 LYS CA 1 1 8 LYS C 1 1 9 ALA N -59.6 -19.6 . 8 LYS . . 8 LYS . . 8 LYS . . 8 LYS . 1 1 15 PHI 1 1 8 LYS C 1 1 9 ALA N 1 1 9 ALA CA 1 1 9 ALA C -86.1 -46.099995 . 9 ALA . . 9 ALA . . 9 ALA . . 9 ALA . 1 1 16 PSI 1 1 9 ALA N 1 1 9 ALA CA 1 1 9 ALA C 1 1 10 ASP N -59.499996 -19.5 . 9 ALA . . 9 ALA . . 9 ALA . . 9 ALA . 1 1 17 PHI 1 1 9 ALA C 1 1 10 ASP N 1 1 10 ASP CA 1 1 10 ASP C -85.0 -44.999996 . 10 ASP . . 10 ASP . . 10 ASP . . 10 ASP . 1 1 18 PSI 1 1 10 ASP N 1 1 10 ASP CA 1 1 10 ASP C 1 1 11 VAL N -60.399998 -20.4 . 10 ASP . . 10 ASP . . 10 ASP . . 10 ASP . 1 1 19 PHI 1 1 10 ASP C 1 1 11 VAL N 1 1 11 VAL CA 1 1 11 VAL C -84.0 -44.0 . 11 VAL . . 11 VAL . . 11 VAL . . 11 VAL . 1 1 20 PSI 1 1 11 VAL N 1 1 11 VAL CA 1 1 11 VAL C 1 1 12 ALA N -55.5 -15.499999 . 11 VAL . . 11 VAL . . 11 VAL . . 11 VAL . 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 ILE C C -6.304 0.321 -3.540 1.00 . A A . 1 ILE C 1 1 1 2 1 1 1 ILE CA C -7.178 -0.397 -4.562 1.00 . A A . 1 ILE CA 1 1 1 3 1 1 1 ILE CB C -7.619 0.610 -5.641 1.00 . A A . 1 ILE CB 1 1 1 4 1 1 1 ILE CD1 C -8.118 -1.228 -7.330 1.00 . A A . 1 ILE CD1 1 1 1 5 1 1 1 ILE CG1 C -8.648 -0.029 -6.575 1.00 . A A . 1 ILE CG1 1 1 1 6 1 1 1 ILE CG2 C -6.413 1.102 -6.428 1.00 . A A . 1 ILE CG2 1 1 1 7 1 1 1 ILE H1 H -8.952 -0.471 -3.410 1.00 . A A . 1 ILE H1 1 1 1 8 1 1 1 ILE HA H -6.596 -1.173 -5.038 1.00 . A A . 1 ILE HA 1 1 1 9 1 1 1 ILE HB H -8.068 1.460 -5.148 1.00 . A A . 1 ILE HB 1 1 1 10 1 1 1 ILE HD11 H -7.828 -1.995 -6.628 1.00 . A A . 1 ILE HD11 1 1 1 11 1 1 1 ILE HD12 H -8.888 -1.610 -7.984 1.00 . A A . 1 ILE HD12 1 1 1 12 1 1 1 ILE HD13 H -7.260 -0.933 -7.916 1.00 . A A . 1 ILE HD13 1 1 1 13 1 1 1 ILE HG12 H -9.500 -0.351 -5.997 1.00 . A A . 1 ILE HG12 1 1 1 14 1 1 1 ILE HG13 H -8.968 0.706 -7.300 1.00 . A A . 1 ILE HG13 1 1 1 15 1 1 1 ILE HG21 H -5.711 0.292 -6.556 1.00 . A A . 1 ILE HG21 1 1 1 16 1 1 1 ILE HG22 H -6.736 1.454 -7.397 1.00 . A A . 1 ILE HG22 1 1 1 17 1 1 1 ILE HG23 H -5.940 1.911 -5.892 1.00 . A A . 1 ILE HG23 1 1 1 18 1 1 1 ILE N N -8.326 -1.025 -3.920 1.00 . A A . 1 ILE N 1 1 1 19 1 1 1 ILE O O -5.119 0.014 -3.398 1.00 . A A . 1 ILE O 1 1 1 20 1 1 2 PHE C C -5.490 1.105 -0.818 1.00 . A A . 2 PHE C 1 1 1 21 1 1 2 PHE CA C -6.168 2.037 -1.818 1.00 . A A . 2 PHE CA 1 1 1 22 1 1 2 PHE CB C -7.118 2.986 -1.085 1.00 . A A . 2 PHE CB 1 1 1 23 1 1 2 PHE CD1 C -8.973 4.020 -2.420 1.00 . A A . 2 PHE CD1 1 1 1 24 1 1 2 PHE CD2 C -6.880 5.157 -2.321 1.00 . A A . 2 PHE CD2 1 1 1 25 1 1 2 PHE CE1 C -9.484 5.020 -3.225 1.00 . A A . 2 PHE CE1 1 1 1 26 1 1 2 PHE CE2 C -7.385 6.162 -3.125 1.00 . A A . 2 PHE CE2 1 1 1 27 1 1 2 PHE CG C -7.668 4.076 -1.960 1.00 . A A . 2 PHE CG 1 1 1 28 1 1 2 PHE CZ C -8.687 6.094 -3.578 1.00 . A A . 2 PHE CZ 1 1 1 29 1 1 2 PHE H H -7.841 1.472 -2.988 1.00 . A A . 2 PHE H 1 1 1 30 1 1 2 PHE HA H -5.410 2.616 -2.323 1.00 . A A . 2 PHE HA 1 1 1 31 1 1 2 PHE HB2 H -7.950 2.421 -0.696 1.00 . A A . 2 PHE HB2 1 1 1 32 1 1 2 PHE HB3 H -6.588 3.451 -0.267 1.00 . A A . 2 PHE HB3 1 1 1 33 1 1 2 PHE HD1 H -9.597 3.181 -2.144 1.00 . A A . 2 PHE HD1 1 1 1 34 1 1 2 PHE HD2 H -5.862 5.211 -1.968 1.00 . A A . 2 PHE HD2 1 1 1 35 1 1 2 PHE HE1 H -10.504 4.964 -3.578 1.00 . A A . 2 PHE HE1 1 1 1 36 1 1 2 PHE HE2 H -6.761 6.999 -3.400 1.00 . A A . 2 PHE HE2 1 1 1 37 1 1 2 PHE HZ H -9.084 6.877 -4.206 1.00 . A A . 2 PHE HZ 1 1 1 38 1 1 2 PHE N N -6.893 1.275 -2.830 1.00 . A A . 2 PHE N 1 1 1 39 1 1 2 PHE O O -4.335 1.311 -0.446 1.00 . A A . 2 PHE O 1 1 1 40 1 1 3 TRP C C -4.459 -1.590 0.008 1.00 . A A . 3 TRP C 1 1 1 41 1 1 3 TRP CA C -5.687 -0.885 0.570 1.00 . A A . 3 TRP CA 1 1 1 42 1 1 3 TRP CB C -6.759 -1.912 0.937 1.00 . A A . 3 TRP CB 1 1 1 43 1 1 3 TRP CD1 C -8.121 -0.731 2.758 1.00 . A A . 3 TRP CD1 1 1 1 44 1 1 3 TRP CD2 C -9.278 -1.193 0.897 1.00 . A A . 3 TRP CD2 1 1 1 45 1 1 3 TRP CE2 C -10.136 -0.550 1.811 1.00 . A A . 3 TRP CE2 1 1 1 46 1 1 3 TRP CE3 C -9.786 -1.577 -0.346 1.00 . A A . 3 TRP CE3 1 1 1 47 1 1 3 TRP CG C -7.995 -1.299 1.523 1.00 . A A . 3 TRP CG 1 1 1 48 1 1 3 TRP CH2 C -11.942 -0.672 0.293 1.00 . A A . 3 TRP CH2 1 1 1 49 1 1 3 TRP CZ2 C -11.471 -0.286 1.518 1.00 . A A . 3 TRP CZ2 1 1 1 50 1 1 3 TRP CZ3 C -11.111 -1.314 -0.635 1.00 . A A . 3 TRP CZ3 1 1 1 51 1 1 3 TRP H H -7.133 -0.032 -0.721 1.00 . A A . 3 TRP H 1 1 1 52 1 1 3 TRP HA H -5.400 -0.342 1.460 1.00 . A A . 3 TRP HA 1 1 1 53 1 1 3 TRP HB2 H -7.045 -2.457 0.049 1.00 . A A . 3 TRP HB2 1 1 1 54 1 1 3 TRP HB3 H -6.351 -2.602 1.663 1.00 . A A . 3 TRP HB3 1 1 1 55 1 1 3 TRP HD1 H -7.321 -0.657 3.479 1.00 . A A . 3 TRP HD1 1 1 1 56 1 1 3 TRP HE1 H -9.745 0.165 3.743 1.00 . A A . 3 TRP HE1 1 1 1 57 1 1 3 TRP HE3 H -9.161 -2.072 -1.077 1.00 . A A . 3 TRP HE3 1 1 1 58 1 1 3 TRP HH2 H -12.970 -0.488 0.026 1.00 . A A . 3 TRP HH2 1 1 1 59 1 1 3 TRP HZ2 H -12.123 0.209 2.224 1.00 . A A . 3 TRP HZ2 1 1 1 60 1 1 3 TRP HZ3 H -11.522 -1.604 -1.592 1.00 . A A . 3 TRP HZ3 1 1 1 61 1 1 3 TRP N N -6.217 0.080 -0.388 1.00 . A A . 3 TRP N 1 1 1 62 1 1 3 TRP NE1 N -9.406 -0.279 2.938 1.00 . A A . 3 TRP NE1 1 1 1 63 1 1 3 TRP O O -3.452 -1.752 0.700 1.00 . A A . 3 TRP O 1 1 1 64 1 1 4 LEU C C -2.254 -1.761 -2.103 1.00 . A A . 4 LEU C 1 1 1 65 1 1 4 LEU CA C -3.440 -2.700 -1.905 1.00 . A A . 4 LEU CA 1 1 1 66 1 1 4 LEU CB C -3.893 -3.261 -3.254 1.00 . A A . 4 LEU CB 1 1 1 67 1 1 4 LEU CD1 C -3.586 -5.696 -2.738 1.00 . A A . 4 LEU CD1 1 1 1 68 1 1 4 LEU CD2 C -5.797 -4.602 -2.327 1.00 . A A . 4 LEU CD2 1 1 1 69 1 1 4 LEU CG C -4.563 -4.635 -3.218 1.00 . A A . 4 LEU CG 1 1 1 70 1 1 4 LEU H H -5.373 -1.853 -1.750 1.00 . A A . 4 LEU H 1 1 1 71 1 1 4 LEU HA H -3.135 -3.516 -1.267 1.00 . A A . 4 LEU HA 1 1 1 72 1 1 4 LEU HB2 H -4.591 -2.563 -3.686 1.00 . A A . 4 LEU HB2 1 1 1 73 1 1 4 LEU HB3 H -3.020 -3.335 -3.888 1.00 . A A . 4 LEU HB3 1 1 1 74 1 1 4 LEU HD11 H -2.697 -5.217 -2.353 1.00 . A A . 4 LEU HD11 1 1 1 75 1 1 4 LEU HD12 H -4.046 -6.283 -1.957 1.00 . A A . 4 LEU HD12 1 1 1 76 1 1 4 LEU HD13 H -3.318 -6.339 -3.563 1.00 . A A . 4 LEU HD13 1 1 1 77 1 1 4 LEU HD21 H -5.493 -4.618 -1.292 1.00 . A A . 4 LEU HD21 1 1 1 78 1 1 4 LEU HD22 H -6.360 -3.701 -2.523 1.00 . A A . 4 LEU HD22 1 1 1 79 1 1 4 LEU HD23 H -6.414 -5.463 -2.536 1.00 . A A . 4 LEU HD23 1 1 1 80 1 1 4 LEU HG H -4.879 -4.900 -4.218 1.00 . A A . 4 LEU HG 1 1 1 81 1 1 4 LEU N N -4.547 -2.010 -1.249 1.00 . A A . 4 LEU N 1 1 1 82 1 1 4 LEU O O -1.105 -2.139 -1.874 1.00 . A A . 4 LEU O 1 1 1 83 1 1 5 PHE C C -0.784 0.805 -1.453 1.00 . A A . 5 PHE C 1 1 1 84 1 1 5 PHE CA C -1.499 0.458 -2.756 1.00 . A A . 5 PHE CA 1 1 1 85 1 1 5 PHE CB C -2.096 1.723 -3.375 1.00 . A A . 5 PHE CB 1 1 1 86 1 1 5 PHE CD1 C -0.415 2.834 -4.871 1.00 . A A . 5 PHE CD1 1 1 1 87 1 1 5 PHE CD2 C -0.786 3.754 -2.702 1.00 . A A . 5 PHE CD2 1 1 1 88 1 1 5 PHE CE1 C 0.521 3.817 -5.133 1.00 . A A . 5 PHE CE1 1 1 1 89 1 1 5 PHE CE2 C 0.149 4.739 -2.958 1.00 . A A . 5 PHE CE2 1 1 1 90 1 1 5 PHE CG C -1.079 2.793 -3.656 1.00 . A A . 5 PHE CG 1 1 1 91 1 1 5 PHE CZ C 0.805 4.770 -4.174 1.00 . A A . 5 PHE CZ 1 1 1 92 1 1 5 PHE H H -3.477 -0.293 -2.693 1.00 . A A . 5 PHE H 1 1 1 93 1 1 5 PHE HA H -0.783 0.035 -3.443 1.00 . A A . 5 PHE HA 1 1 1 94 1 1 5 PHE HB2 H -2.573 1.468 -4.309 1.00 . A A . 5 PHE HB2 1 1 1 95 1 1 5 PHE HB3 H -2.832 2.132 -2.700 1.00 . A A . 5 PHE HB3 1 1 1 96 1 1 5 PHE HD1 H -0.637 2.088 -5.622 1.00 . A A . 5 PHE HD1 1 1 1 97 1 1 5 PHE HD2 H -1.296 3.731 -1.750 1.00 . A A . 5 PHE HD2 1 1 1 98 1 1 5 PHE HE1 H 1.031 3.838 -6.084 1.00 . A A . 5 PHE HE1 1 1 1 99 1 1 5 PHE HE2 H 0.370 5.483 -2.208 1.00 . A A . 5 PHE HE2 1 1 1 100 1 1 5 PHE HZ H 1.536 5.538 -4.376 1.00 . A A . 5 PHE HZ 1 1 1 101 1 1 5 PHE N N -2.541 -0.535 -2.528 1.00 . A A . 5 PHE N 1 1 1 102 1 1 5 PHE O O 0.439 0.952 -1.423 1.00 . A A . 5 PHE O 1 1 1 103 1 1 6 ARG C C -0.157 0.116 1.467 1.00 . A A . 6 ARG C 1 1 1 104 1 1 6 ARG CA C -0.998 1.268 0.927 1.00 . A A . 6 ARG CA 1 1 1 105 1 1 6 ARG CB C -2.118 1.603 1.913 1.00 . A A . 6 ARG CB 1 1 1 106 1 1 6 ARG CD C -1.012 3.530 3.089 1.00 . A A . 6 ARG CD 1 1 1 107 1 1 6 ARG CG C -1.615 2.143 3.242 1.00 . A A . 6 ARG CG 1 1 1 108 1 1 6 ARG CZ C 0.061 5.244 4.488 1.00 . A A . 6 ARG CZ 1 1 1 109 1 1 6 ARG H H -2.523 0.808 -0.465 1.00 . A A . 6 ARG H 1 1 1 110 1 1 6 ARG HA H -0.364 2.134 0.807 1.00 . A A . 6 ARG HA 1 1 1 111 1 1 6 ARG HB2 H -2.762 2.349 1.468 1.00 . A A . 6 ARG HB2 1 1 1 112 1 1 6 ARG HB3 H -2.692 0.710 2.106 1.00 . A A . 6 ARG HB3 1 1 1 113 1 1 6 ARG HD2 H -0.209 3.482 2.367 1.00 . A A . 6 ARG HD2 1 1 1 114 1 1 6 ARG HD3 H -1.776 4.204 2.731 1.00 . A A . 6 ARG HD3 1 1 1 115 1 1 6 ARG HE H -0.535 3.454 5.135 1.00 . A A . 6 ARG HE 1 1 1 116 1 1 6 ARG HG2 H -2.444 2.199 3.934 1.00 . A A . 6 ARG HG2 1 1 1 117 1 1 6 ARG HG3 H -0.864 1.474 3.632 1.00 . A A . 6 ARG HG3 1 1 1 118 1 1 6 ARG HH11 H -0.201 5.767 2.554 1.00 . A A . 6 ARG HH11 1 1 1 119 1 1 6 ARG HH12 H 0.554 6.966 3.549 1.00 . A A . 6 ARG HH12 1 1 1 120 1 1 6 ARG HH21 H 0.458 5.026 6.457 1.00 . A A . 6 ARG HH21 1 1 1 121 1 1 6 ARG HH22 H 0.929 6.544 5.771 1.00 . A A . 6 ARG HH22 1 1 1 122 1 1 6 ARG N N -1.556 0.937 -0.379 1.00 . A A . 6 ARG N 1 1 1 123 1 1 6 ARG NE N -0.482 4.040 4.352 1.00 . A A . 6 ARG NE 1 1 1 124 1 1 6 ARG NH1 N 0.146 6.059 3.445 1.00 . A A . 6 ARG NH1 1 1 1 125 1 1 6 ARG NH2 N 0.520 5.637 5.669 1.00 . A A . 6 ARG NH2 1 1 1 126 1 1 6 ARG O O 0.908 0.326 2.045 1.00 . A A . 6 ARG O 1 1 1 127 1 1 7 GLY C C 1.438 -2.417 1.112 1.00 . A A . 7 GLY C 1 1 1 128 1 1 7 GLY CA C 0.071 -2.275 1.752 1.00 . A A . 7 GLY CA 1 1 1 129 1 1 7 GLY H H -1.501 -1.216 0.810 1.00 . A A . 7 GLY H 1 1 1 130 1 1 7 GLY HA2 H 0.193 -2.199 2.824 1.00 . A A . 7 GLY HA2 1 1 1 131 1 1 7 GLY HA3 H -0.511 -3.157 1.528 1.00 . A A . 7 GLY HA3 1 1 1 132 1 1 7 GLY N N -0.645 -1.107 1.278 1.00 . A A . 7 GLY N 1 1 1 133 1 1 7 GLY O O 2.399 -2.825 1.764 1.00 . A A . 7 GLY O 1 1 1 134 1 1 8 LYS C C 3.810 -1.191 -0.344 1.00 . A A . 8 LYS C 1 1 1 135 1 1 8 LYS CA C 2.784 -2.173 -0.901 1.00 . A A . 8 LYS CA 1 1 1 136 1 1 8 LYS CB C 2.555 -1.898 -2.389 1.00 . A A . 8 LYS CB 1 1 1 137 1 1 8 LYS CD C 3.219 -2.384 -4.762 1.00 . A A . 8 LYS CD 1 1 1 138 1 1 8 LYS CE C 2.204 -3.417 -5.224 1.00 . A A . 8 LYS CE 1 1 1 139 1 1 8 LYS CG C 3.574 -2.568 -3.295 1.00 . A A . 8 LYS CG 1 1 1 140 1 1 8 LYS H H 0.725 -1.762 -0.636 1.00 . A A . 8 LYS H 1 1 1 141 1 1 8 LYS HA H 3.164 -3.177 -0.784 1.00 . A A . 8 LYS HA 1 1 1 142 1 1 8 LYS HB2 H 1.573 -2.252 -2.662 1.00 . A A . 8 LYS HB2 1 1 1 143 1 1 8 LYS HB3 H 2.602 -0.831 -2.557 1.00 . A A . 8 LYS HB3 1 1 1 144 1 1 8 LYS HD2 H 2.802 -1.398 -4.903 1.00 . A A . 8 LYS HD2 1 1 1 145 1 1 8 LYS HD3 H 4.118 -2.484 -5.355 1.00 . A A . 8 LYS HD3 1 1 1 146 1 1 8 LYS HE2 H 2.727 -4.325 -5.486 1.00 . A A . 8 LYS HE2 1 1 1 147 1 1 8 LYS HE3 H 1.520 -3.619 -4.412 1.00 . A A . 8 LYS HE3 1 1 1 148 1 1 8 LYS HG2 H 4.545 -2.133 -3.114 1.00 . A A . 8 LYS HG2 1 1 1 149 1 1 8 LYS HG3 H 3.602 -3.624 -3.071 1.00 . A A . 8 LYS HG3 1 1 1 150 1 1 8 LYS HZ1 H 0.942 -2.053 -6.179 1.00 . A A . 8 LYS HZ1 1 1 1 151 1 1 8 LYS HZ2 H 2.067 -2.785 -7.210 1.00 . A A . 8 LYS HZ2 1 1 1 152 1 1 8 LYS HZ3 H 0.719 -3.657 -6.675 1.00 . A A . 8 LYS HZ3 1 1 1 153 1 1 8 LYS N N 1.527 -2.081 -0.171 1.00 . A A . 8 LYS N 1 1 1 154 1 1 8 LYS NZ N 1.429 -2.945 -6.404 1.00 . A A . 8 LYS NZ 1 1 1 155 1 1 8 LYS O O 4.959 -1.554 -0.096 1.00 . A A . 8 LYS O 1 1 1 156 1 1 9 ALA C C 4.659 0.785 1.826 1.00 . A A . 9 ALA C 1 1 1 157 1 1 9 ALA CA C 4.266 1.086 0.383 1.00 . A A . 9 ALA CA 1 1 1 158 1 1 9 ALA CB C 3.596 2.449 0.290 1.00 . A A . 9 ALA CB 1 1 1 159 1 1 9 ALA H H 2.458 0.282 -0.365 1.00 . A A . 9 ALA H 1 1 1 160 1 1 9 ALA HA H 5.160 1.109 -0.224 1.00 . A A . 9 ALA HA 1 1 1 161 1 1 9 ALA HB1 H 3.869 3.043 1.151 1.00 . A A . 9 ALA HB1 1 1 1 162 1 1 9 ALA HB2 H 3.923 2.949 -0.610 1.00 . A A . 9 ALA HB2 1 1 1 163 1 1 9 ALA HB3 H 2.525 2.324 0.265 1.00 . A A . 9 ALA HB3 1 1 1 164 1 1 9 ALA N N 3.385 0.054 -0.147 1.00 . A A . 9 ALA N 1 1 1 165 1 1 9 ALA O O 5.786 1.048 2.241 1.00 . A A . 9 ALA O 1 1 1 166 1 1 10 ASP C C 5.209 -0.984 4.118 1.00 . A A . 10 ASP C 1 1 1 167 1 1 10 ASP CA C 3.968 -0.108 3.982 1.00 . A A . 10 ASP CA 1 1 1 168 1 1 10 ASP CB C 2.756 -0.824 4.579 1.00 . A A . 10 ASP CB 1 1 1 169 1 1 10 ASP CG C 2.815 -0.904 6.092 1.00 . A A . 10 ASP CG 1 1 1 170 1 1 10 ASP H H 2.839 0.044 2.197 1.00 . A A . 10 ASP H 1 1 1 171 1 1 10 ASP HA H 4.131 0.812 4.523 1.00 . A A . 10 ASP HA 1 1 1 172 1 1 10 ASP HB2 H 1.858 -0.292 4.299 1.00 . A A . 10 ASP HB2 1 1 1 173 1 1 10 ASP HB3 H 2.710 -1.829 4.185 1.00 . A A . 10 ASP HB3 1 1 1 174 1 1 10 ASP N N 3.719 0.231 2.586 1.00 . A A . 10 ASP N 1 1 1 175 1 1 10 ASP O O 5.987 -0.834 5.059 1.00 . A A . 10 ASP O 1 1 1 176 1 1 10 ASP OD1 O 2.915 0.161 6.738 1.00 . A A . 10 ASP OD1 1 1 1 177 1 1 10 ASP OD2 O 2.762 -2.029 6.629 1.00 . A A . 10 ASP OD2 1 1 1 178 1 1 11 VAL C C 7.840 -2.024 3.312 1.00 . A A . 11 VAL C 1 1 1 179 1 1 11 VAL CA C 6.535 -2.800 3.183 1.00 . A A . 11 VAL CA 1 1 1 180 1 1 11 VAL CB C 6.586 -3.661 1.908 1.00 . A A . 11 VAL CB 1 1 1 181 1 1 11 VAL CG1 C 7.746 -4.642 1.971 1.00 . A A . 11 VAL CG1 1 1 1 182 1 1 11 VAL CG2 C 5.267 -4.394 1.707 1.00 . A A . 11 VAL CG2 1 1 1 183 1 1 11 VAL H H 4.732 -1.970 2.446 1.00 . A A . 11 VAL H 1 1 1 184 1 1 11 VAL HA H 6.431 -3.459 4.034 1.00 . A A . 11 VAL HA 1 1 1 185 1 1 11 VAL HB H 6.743 -3.007 1.061 1.00 . A A . 11 VAL HB 1 1 1 186 1 1 11 VAL HG11 H 7.369 -5.652 1.896 1.00 . A A . 11 VAL HG11 1 1 1 187 1 1 11 VAL HG12 H 8.426 -4.449 1.155 1.00 . A A . 11 VAL HG12 1 1 1 188 1 1 11 VAL HG13 H 8.266 -4.522 2.911 1.00 . A A . 11 VAL HG13 1 1 1 189 1 1 11 VAL HG21 H 4.766 -4.499 2.656 1.00 . A A . 11 VAL HG21 1 1 1 190 1 1 11 VAL HG22 H 4.642 -3.831 1.029 1.00 . A A . 11 VAL HG22 1 1 1 191 1 1 11 VAL HG23 H 5.459 -5.372 1.291 1.00 . A A . 11 VAL HG23 1 1 1 192 1 1 11 VAL N N 5.387 -1.900 3.171 1.00 . A A . 11 VAL N 1 1 1 193 1 1 11 VAL O O 8.774 -2.469 3.978 1.00 . A A . 11 VAL O 1 1 1 194 1 1 12 ALA C C 9.380 0.439 4.142 1.00 . A A . 12 ALA C 1 1 1 195 1 1 12 ALA CA C 9.088 -0.021 2.719 1.00 . A A . 12 ALA CA 1 1 1 196 1 1 12 ALA CB C 8.924 1.179 1.797 1.00 . A A . 12 ALA CB 1 1 1 197 1 1 12 ALA H H 7.119 -0.560 2.159 1.00 . A A . 12 ALA H 1 1 1 198 1 1 12 ALA HA H 9.923 -0.606 2.363 1.00 . A A . 12 ALA HA 1 1 1 199 1 1 12 ALA HB1 H 8.396 1.963 2.319 1.00 . A A . 12 ALA HB1 1 1 1 200 1 1 12 ALA HB2 H 9.896 1.538 1.498 1.00 . A A . 12 ALA HB2 1 1 1 201 1 1 12 ALA HB3 H 8.362 0.887 0.922 1.00 . A A . 12 ALA HB3 1 1 1 202 1 1 12 ALA N N 7.897 -0.860 2.673 1.00 . A A . 12 ALA N 1 1 1 203 1 1 12 ALA O O 8.480 0.509 4.982 1.00 . A A . 12 ALA O 1 1 1 204 1 1 13 LEU C C 10.977 2.724 5.839 1.00 . A A . 13 LEU C 1 1 1 205 1 1 13 LEU CA C 11.056 1.203 5.735 1.00 . A A . 13 LEU CA 1 1 1 206 1 1 13 LEU CB C 12.479 0.734 6.037 1.00 . A A . 13 LEU CB 1 1 1 207 1 1 13 LEU CD1 C 14.108 -1.104 6.538 1.00 . A A . 13 LEU CD1 1 1 1 208 1 1 13 LEU CD2 C 11.859 -1.097 7.633 1.00 . A A . 13 LEU CD2 1 1 1 209 1 1 13 LEU CG C 12.639 -0.749 6.374 1.00 . A A . 13 LEU CG 1 1 1 210 1 1 13 LEU H H 11.316 0.675 3.703 1.00 . A A . 13 LEU H 1 1 1 211 1 1 13 LEU HA H 10.381 0.771 6.459 1.00 . A A . 13 LEU HA 1 1 1 212 1 1 13 LEU HB2 H 13.087 0.942 5.170 1.00 . A A . 13 LEU HB2 1 1 1 213 1 1 13 LEU HB3 H 12.845 1.306 6.877 1.00 . A A . 13 LEU HB3 1 1 1 214 1 1 13 LEU HD11 H 14.647 -0.834 5.642 1.00 . A A . 13 LEU HD11 1 1 1 215 1 1 13 LEU HD12 H 14.517 -0.564 7.380 1.00 . A A . 13 LEU HD12 1 1 1 216 1 1 13 LEU HD13 H 14.206 -2.166 6.711 1.00 . A A . 13 LEU HD13 1 1 1 217 1 1 13 LEU HD21 H 12.340 -1.922 8.138 1.00 . A A . 13 LEU HD21 1 1 1 218 1 1 13 LEU HD22 H 11.833 -0.239 8.289 1.00 . A A . 13 LEU HD22 1 1 1 219 1 1 13 LEU HD23 H 10.851 -1.377 7.367 1.00 . A A . 13 LEU HD23 1 1 1 220 1 1 13 LEU HG H 12.243 -1.342 5.560 1.00 . A A . 13 LEU HG 1 1 1 221 1 1 13 LEU N N 10.644 0.751 4.411 1.00 . A A . 13 LEU N 1 1 1 222 1 1 13 LEU O O 11.485 3.442 4.978 1.00 . A A . 13 LEU O 1 1 1 223 1 1 14 NH2 HN1 H 9.955 2.585 7.553 1.00 . A A . 14 NH2 HN1 1 1 1 224 1 1 14 NH2 HN2 H 10.243 4.192 7.050 1.00 . A A . 14 NH2 HN2 1 1 1 225 1 1 14 NH2 N N 10.339 3.207 6.900 1.00 . A A . 14 NH2 N 1 1 2 226 1 1 1 ILE C C -6.160 0.314 -3.787 1.00 . A A . 1 ILE C 1 1 2 227 1 1 1 ILE CA C -6.865 -0.538 -4.838 1.00 . A A . 1 ILE CA 1 1 2 228 1 1 1 ILE CB C -7.209 0.343 -6.052 1.00 . A A . 1 ILE CB 1 1 2 229 1 1 1 ILE CD1 C -8.760 2.191 -6.861 1.00 . A A . 1 ILE CD1 1 1 2 230 1 1 1 ILE CG1 C -8.377 1.275 -5.721 1.00 . A A . 1 ILE CG1 1 1 2 231 1 1 1 ILE CG2 C -7.540 -0.522 -7.259 1.00 . A A . 1 ILE CG2 1 1 2 232 1 1 1 ILE H1 H -8.796 -0.611 -3.977 1.00 . A A . 1 ILE H1 1 1 2 233 1 1 1 ILE HA H -6.193 -1.319 -5.162 1.00 . A A . 1 ILE HA 1 1 2 234 1 1 1 ILE HB H -6.341 0.938 -6.294 1.00 . A A . 1 ILE HB 1 1 2 235 1 1 1 ILE HD11 H -7.872 2.488 -7.400 1.00 . A A . 1 ILE HD11 1 1 2 236 1 1 1 ILE HD12 H -9.432 1.674 -7.528 1.00 . A A . 1 ILE HD12 1 1 2 237 1 1 1 ILE HD13 H -9.251 3.070 -6.466 1.00 . A A . 1 ILE HD13 1 1 2 238 1 1 1 ILE HG12 H -9.240 0.682 -5.466 1.00 . A A . 1 ILE HG12 1 1 2 239 1 1 1 ILE HG13 H -8.106 1.890 -4.875 1.00 . A A . 1 ILE HG13 1 1 2 240 1 1 1 ILE HG21 H -8.594 -0.438 -7.483 1.00 . A A . 1 ILE HG21 1 1 2 241 1 1 1 ILE HG22 H -6.964 -0.193 -8.109 1.00 . A A . 1 ILE HG22 1 1 2 242 1 1 1 ILE HG23 H -7.302 -1.553 -7.039 1.00 . A A . 1 ILE HG23 1 1 2 243 1 1 1 ILE N N -8.056 -1.172 -4.286 1.00 . A A . 1 ILE N 1 1 2 244 1 1 1 ILE O O -4.931 0.391 -3.757 1.00 . A A . 1 ILE O 1 1 2 245 1 1 2 PHE C C -5.568 0.977 -0.891 1.00 . A A . 2 PHE C 1 1 2 246 1 1 2 PHE CA C -6.397 1.800 -1.875 1.00 . A A . 2 PHE CA 1 1 2 247 1 1 2 PHE CB C -7.524 2.521 -1.132 1.00 . A A . 2 PHE CB 1 1 2 248 1 1 2 PHE CD1 C -9.218 4.063 -2.156 1.00 . A A . 2 PHE CD1 1 1 2 249 1 1 2 PHE CD2 C -6.970 4.829 -1.946 1.00 . A A . 2 PHE CD2 1 1 2 250 1 1 2 PHE CE1 C -9.579 5.266 -2.733 1.00 . A A . 2 PHE CE1 1 1 2 251 1 1 2 PHE CE2 C -7.325 6.035 -2.521 1.00 . A A . 2 PHE CE2 1 1 2 252 1 1 2 PHE CG C -7.912 3.830 -1.757 1.00 . A A . 2 PHE CG 1 1 2 253 1 1 2 PHE CZ C -8.630 6.254 -2.914 1.00 . A A . 2 PHE CZ 1 1 2 254 1 1 2 PHE H H -7.918 0.852 -3.002 1.00 . A A . 2 PHE H 1 1 2 255 1 1 2 PHE HA H -5.757 2.533 -2.340 1.00 . A A . 2 PHE HA 1 1 2 256 1 1 2 PHE HB2 H -8.398 1.889 -1.118 1.00 . A A . 2 PHE HB2 1 1 2 257 1 1 2 PHE HB3 H -7.209 2.717 -0.118 1.00 . A A . 2 PHE HB3 1 1 2 258 1 1 2 PHE HD1 H -9.961 3.291 -2.013 1.00 . A A . 2 PHE HD1 1 1 2 259 1 1 2 PHE HD2 H -5.947 4.658 -1.639 1.00 . A A . 2 PHE HD2 1 1 2 260 1 1 2 PHE HE1 H -10.600 5.434 -3.039 1.00 . A A . 2 PHE HE1 1 1 2 261 1 1 2 PHE HE2 H -6.581 6.805 -2.662 1.00 . A A . 2 PHE HE2 1 1 2 262 1 1 2 PHE HZ H -8.909 7.195 -3.364 1.00 . A A . 2 PHE HZ 1 1 2 263 1 1 2 PHE N N -6.945 0.953 -2.926 1.00 . A A . 2 PHE N 1 1 2 264 1 1 2 PHE O O -4.405 1.286 -0.633 1.00 . A A . 2 PHE O 1 1 2 265 1 1 3 TRP C C -4.256 -1.566 -0.013 1.00 . A A . 3 TRP C 1 1 2 266 1 1 3 TRP CA C -5.498 -0.936 0.610 1.00 . A A . 3 TRP CA 1 1 2 267 1 1 3 TRP CB C -6.447 -2.029 1.103 1.00 . A A . 3 TRP CB 1 1 2 268 1 1 3 TRP CD1 C -5.175 -3.546 2.731 1.00 . A A . 3 TRP CD1 1 1 2 269 1 1 3 TRP CD2 C -6.624 -2.150 3.715 1.00 . A A . 3 TRP CD2 1 1 2 270 1 1 3 TRP CE2 C -5.996 -2.922 4.712 1.00 . A A . 3 TRP CE2 1 1 2 271 1 1 3 TRP CE3 C -7.574 -1.200 4.097 1.00 . A A . 3 TRP CE3 1 1 2 272 1 1 3 TRP CG C -6.084 -2.565 2.455 1.00 . A A . 3 TRP CG 1 1 2 273 1 1 3 TRP CH2 C -7.226 -1.837 6.411 1.00 . A A . 3 TRP CH2 1 1 2 274 1 1 3 TRP CZ2 C -6.290 -2.774 6.064 1.00 . A A . 3 TRP CZ2 1 1 2 275 1 1 3 TRP CZ3 C -7.866 -1.054 5.440 1.00 . A A . 3 TRP CZ3 1 1 2 276 1 1 3 TRP H H -7.107 -0.263 -0.591 1.00 . A A . 3 TRP H 1 1 2 277 1 1 3 TRP HA H -5.195 -0.328 1.450 1.00 . A A . 3 TRP HA 1 1 2 278 1 1 3 TRP HB2 H -7.447 -1.629 1.161 1.00 . A A . 3 TRP HB2 1 1 2 279 1 1 3 TRP HB3 H -6.431 -2.852 0.403 1.00 . A A . 3 TRP HB3 1 1 2 280 1 1 3 TRP HD1 H -4.595 -4.066 1.983 1.00 . A A . 3 TRP HD1 1 1 2 281 1 1 3 TRP HE1 H -4.540 -4.421 4.532 1.00 . A A . 3 TRP HE1 1 1 2 282 1 1 3 TRP HE3 H -8.080 -0.589 3.363 1.00 . A A . 3 TRP HE3 1 1 2 283 1 1 3 TRP HH2 H -7.485 -1.688 7.447 1.00 . A A . 3 TRP HH2 1 1 2 284 1 1 3 TRP HZ2 H -5.805 -3.368 6.824 1.00 . A A . 3 TRP HZ2 1 1 2 285 1 1 3 TRP HZ3 H -8.599 -0.325 5.755 1.00 . A A . 3 TRP HZ3 1 1 2 286 1 1 3 TRP N N -6.178 -0.069 -0.346 1.00 . A A . 3 TRP N 1 1 2 287 1 1 3 TRP NE1 N -5.118 -3.767 4.086 1.00 . A A . 3 TRP NE1 1 1 2 288 1 1 3 TRP O O -3.209 -1.661 0.627 1.00 . A A . 3 TRP O 1 1 2 289 1 1 4 LEU C C -2.104 -1.637 -2.125 1.00 . A A . 4 LEU C 1 1 2 290 1 1 4 LEU CA C -3.267 -2.614 -1.976 1.00 . A A . 4 LEU CA 1 1 2 291 1 1 4 LEU CB C -3.722 -3.098 -3.354 1.00 . A A . 4 LEU CB 1 1 2 292 1 1 4 LEU CD1 C -5.616 -4.012 -4.716 1.00 . A A . 4 LEU CD1 1 1 2 293 1 1 4 LEU CD2 C -4.464 -5.472 -3.046 1.00 . A A . 4 LEU CD2 1 1 2 294 1 1 4 LEU CG C -4.915 -4.056 -3.369 1.00 . A A . 4 LEU CG 1 1 2 295 1 1 4 LEU H H -5.240 -1.888 -1.723 1.00 . A A . 4 LEU H 1 1 2 296 1 1 4 LEU HA H -2.937 -3.462 -1.396 1.00 . A A . 4 LEU HA 1 1 2 297 1 1 4 LEU HB2 H -3.989 -2.230 -3.937 1.00 . A A . 4 LEU HB2 1 1 2 298 1 1 4 LEU HB3 H -2.886 -3.599 -3.819 1.00 . A A . 4 LEU HB3 1 1 2 299 1 1 4 LEU HD11 H -6.657 -3.757 -4.573 1.00 . A A . 4 LEU HD11 1 1 2 300 1 1 4 LEU HD12 H -5.148 -3.267 -5.343 1.00 . A A . 4 LEU HD12 1 1 2 301 1 1 4 LEU HD13 H -5.545 -4.979 -5.192 1.00 . A A . 4 LEU HD13 1 1 2 302 1 1 4 LEU HD21 H -3.399 -5.558 -3.213 1.00 . A A . 4 LEU HD21 1 1 2 303 1 1 4 LEU HD22 H -4.684 -5.693 -2.013 1.00 . A A . 4 LEU HD22 1 1 2 304 1 1 4 LEU HD23 H -4.985 -6.170 -3.683 1.00 . A A . 4 LEU HD23 1 1 2 305 1 1 4 LEU HG H -5.624 -3.750 -2.613 1.00 . A A . 4 LEU HG 1 1 2 306 1 1 4 LEU N N -4.380 -1.993 -1.265 1.00 . A A . 4 LEU N 1 1 2 307 1 1 4 LEU O O -0.949 -1.992 -1.893 1.00 . A A . 4 LEU O 1 1 2 308 1 1 5 PHE C C -0.724 0.954 -1.364 1.00 . A A . 5 PHE C 1 1 2 309 1 1 5 PHE CA C -1.400 0.622 -2.690 1.00 . A A . 5 PHE CA 1 1 2 310 1 1 5 PHE CB C -2.021 1.887 -3.290 1.00 . A A . 5 PHE CB 1 1 2 311 1 1 5 PHE CD1 C -0.814 2.369 -5.435 1.00 . A A . 5 PHE CD1 1 1 2 312 1 1 5 PHE CD2 C -0.398 3.781 -3.560 1.00 . A A . 5 PHE CD2 1 1 2 313 1 1 5 PHE CE1 C 0.072 3.111 -6.195 1.00 . A A . 5 PHE CE1 1 1 2 314 1 1 5 PHE CE2 C 0.488 4.527 -4.314 1.00 . A A . 5 PHE CE2 1 1 2 315 1 1 5 PHE CG C -1.059 2.695 -4.112 1.00 . A A . 5 PHE CG 1 1 2 316 1 1 5 PHE CZ C 0.724 4.190 -5.633 1.00 . A A . 5 PHE CZ 1 1 2 317 1 1 5 PHE H H -3.359 -0.183 -2.681 1.00 . A A . 5 PHE H 1 1 2 318 1 1 5 PHE HA H -0.658 0.238 -3.373 1.00 . A A . 5 PHE HA 1 1 2 319 1 1 5 PHE HB2 H -2.846 1.606 -3.928 1.00 . A A . 5 PHE HB2 1 1 2 320 1 1 5 PHE HB3 H -2.386 2.513 -2.491 1.00 . A A . 5 PHE HB3 1 1 2 321 1 1 5 PHE HD1 H -1.323 1.524 -5.876 1.00 . A A . 5 PHE HD1 1 1 2 322 1 1 5 PHE HD2 H -0.580 4.044 -2.528 1.00 . A A . 5 PHE HD2 1 1 2 323 1 1 5 PHE HE1 H 0.254 2.846 -7.226 1.00 . A A . 5 PHE HE1 1 1 2 324 1 1 5 PHE HE2 H 0.997 5.370 -3.872 1.00 . A A . 5 PHE HE2 1 1 2 325 1 1 5 PHE HZ H 1.415 4.772 -6.225 1.00 . A A . 5 PHE HZ 1 1 2 326 1 1 5 PHE N N -2.419 -0.406 -2.511 1.00 . A A . 5 PHE N 1 1 2 327 1 1 5 PHE O O 0.500 1.067 -1.290 1.00 . A A . 5 PHE O 1 1 2 328 1 1 6 ARG C C -0.130 0.302 1.533 1.00 . A A . 6 ARG C 1 1 2 329 1 1 6 ARG CA C -1.009 1.432 1.006 1.00 . A A . 6 ARG CA 1 1 2 330 1 1 6 ARG CB C -2.161 1.693 1.979 1.00 . A A . 6 ARG CB 1 1 2 331 1 1 6 ARG CD C -3.455 3.466 3.202 1.00 . A A . 6 ARG CD 1 1 2 332 1 1 6 ARG CG C -2.676 3.122 1.942 1.00 . A A . 6 ARG CG 1 1 2 333 1 1 6 ARG CZ C -5.814 3.157 2.587 1.00 . A A . 6 ARG CZ 1 1 2 334 1 1 6 ARG H H -2.496 1.009 -0.440 1.00 . A A . 6 ARG H 1 1 2 335 1 1 6 ARG HA H -0.413 2.327 0.919 1.00 . A A . 6 ARG HA 1 1 2 336 1 1 6 ARG HB2 H -2.979 1.032 1.736 1.00 . A A . 6 ARG HB2 1 1 2 337 1 1 6 ARG HB3 H -1.823 1.482 2.982 1.00 . A A . 6 ARG HB3 1 1 2 338 1 1 6 ARG HD2 H -2.864 3.186 4.062 1.00 . A A . 6 ARG HD2 1 1 2 339 1 1 6 ARG HD3 H -3.631 4.532 3.220 1.00 . A A . 6 ARG HD3 1 1 2 340 1 1 6 ARG HE H -4.797 1.979 3.833 1.00 . A A . 6 ARG HE 1 1 2 341 1 1 6 ARG HG2 H -1.837 3.797 1.855 1.00 . A A . 6 ARG HG2 1 1 2 342 1 1 6 ARG HG3 H -3.325 3.239 1.085 1.00 . A A . 6 ARG HG3 1 1 2 343 1 1 6 ARG HH11 H -4.912 4.744 1.723 1.00 . A A . 6 ARG HH11 1 1 2 344 1 1 6 ARG HH12 H -6.575 4.515 1.297 1.00 . A A . 6 ARG HH12 1 1 2 345 1 1 6 ARG HH21 H -6.988 1.666 3.279 1.00 . A A . 6 ARG HH21 1 1 2 346 1 1 6 ARG HH22 H -7.756 2.764 2.183 1.00 . A A . 6 ARG HH22 1 1 2 347 1 1 6 ARG N N -1.529 1.110 -0.319 1.00 . A A . 6 ARG N 1 1 2 348 1 1 6 ARG NE N -4.737 2.772 3.261 1.00 . A A . 6 ARG NE 1 1 2 349 1 1 6 ARG NH1 N -5.762 4.228 1.805 1.00 . A A . 6 ARG NH1 1 1 2 350 1 1 6 ARG NH2 N -6.946 2.472 2.692 1.00 . A A . 6 ARG NH2 1 1 2 351 1 1 6 ARG O O 0.968 0.539 2.034 1.00 . A A . 6 ARG O 1 1 2 352 1 1 7 GLY C C 1.476 -2.207 1.198 1.00 . A A . 7 GLY C 1 1 2 353 1 1 7 GLY CA C 0.131 -2.076 1.886 1.00 . A A . 7 GLY CA 1 1 2 354 1 1 7 GLY H H -1.503 -1.057 1.008 1.00 . A A . 7 GLY H 1 1 2 355 1 1 7 GLY HA2 H 0.291 -1.977 2.950 1.00 . A A . 7 GLY HA2 1 1 2 356 1 1 7 GLY HA3 H -0.445 -2.970 1.701 1.00 . A A . 7 GLY HA3 1 1 2 357 1 1 7 GLY N N -0.622 -0.928 1.417 1.00 . A A . 7 GLY N 1 1 2 358 1 1 7 GLY O O 2.507 -2.346 1.856 1.00 . A A . 7 GLY O 1 1 2 359 1 1 8 LYS C C 3.734 -1.272 -0.438 1.00 . A A . 8 LYS C 1 1 2 360 1 1 8 LYS CA C 2.693 -2.282 -0.908 1.00 . A A . 8 LYS CA 1 1 2 361 1 1 8 LYS CB C 2.400 -2.075 -2.395 1.00 . A A . 8 LYS CB 1 1 2 362 1 1 8 LYS CD C 4.272 -3.590 -3.105 1.00 . A A . 8 LYS CD 1 1 2 363 1 1 8 LYS CE C 5.259 -3.887 -4.225 1.00 . A A . 8 LYS CE 1 1 2 364 1 1 8 LYS CG C 3.621 -2.228 -3.283 1.00 . A A . 8 LYS CG 1 1 2 365 1 1 8 LYS H H 0.611 -2.054 -0.597 1.00 . A A . 8 LYS H 1 1 2 366 1 1 8 LYS HA H 3.085 -3.278 -0.763 1.00 . A A . 8 LYS HA 1 1 2 367 1 1 8 LYS HB2 H 1.659 -2.795 -2.708 1.00 . A A . 8 LYS HB2 1 1 2 368 1 1 8 LYS HB3 H 2.001 -1.079 -2.534 1.00 . A A . 8 LYS HB3 1 1 2 369 1 1 8 LYS HD2 H 4.799 -3.606 -2.163 1.00 . A A . 8 LYS HD2 1 1 2 370 1 1 8 LYS HD3 H 3.504 -4.349 -3.103 1.00 . A A . 8 LYS HD3 1 1 2 371 1 1 8 LYS HE2 H 5.756 -2.969 -4.501 1.00 . A A . 8 LYS HE2 1 1 2 372 1 1 8 LYS HE3 H 5.988 -4.597 -3.864 1.00 . A A . 8 LYS HE3 1 1 2 373 1 1 8 LYS HG2 H 3.321 -2.117 -4.315 1.00 . A A . 8 LYS HG2 1 1 2 374 1 1 8 LYS HG3 H 4.338 -1.459 -3.030 1.00 . A A . 8 LYS HG3 1 1 2 375 1 1 8 LYS HZ1 H 4.956 -5.401 -5.631 1.00 . A A . 8 LYS HZ1 1 1 2 376 1 1 8 LYS HZ2 H 3.558 -4.524 -5.257 1.00 . A A . 8 LYS HZ2 1 1 2 377 1 1 8 LYS HZ3 H 4.746 -3.839 -6.249 1.00 . A A . 8 LYS HZ3 1 1 2 378 1 1 8 LYS N N 1.466 -2.166 -0.128 1.00 . A A . 8 LYS N 1 1 2 379 1 1 8 LYS NZ N 4.583 -4.452 -5.425 1.00 . A A . 8 LYS NZ 1 1 2 380 1 1 8 LYS O O 4.921 -1.584 -0.347 1.00 . A A . 8 LYS O 1 1 2 381 1 1 9 ALA C C 4.615 0.748 1.764 1.00 . A A . 9 ALA C 1 1 2 382 1 1 9 ALA CA C 4.172 0.997 0.327 1.00 . A A . 9 ALA CA 1 1 2 383 1 1 9 ALA CB C 3.491 2.352 0.209 1.00 . A A . 9 ALA CB 1 1 2 384 1 1 9 ALA H H 2.324 0.130 -0.229 1.00 . A A . 9 ALA H 1 1 2 385 1 1 9 ALA HA H 5.044 1.002 -0.312 1.00 . A A . 9 ALA HA 1 1 2 386 1 1 9 ALA HB1 H 2.578 2.249 -0.358 1.00 . A A . 9 ALA HB1 1 1 2 387 1 1 9 ALA HB2 H 3.261 2.726 1.197 1.00 . A A . 9 ALA HB2 1 1 2 388 1 1 9 ALA HB3 H 4.150 3.044 -0.293 1.00 . A A . 9 ALA HB3 1 1 2 389 1 1 9 ALA N N 3.280 -0.059 -0.137 1.00 . A A . 9 ALA N 1 1 2 390 1 1 9 ALA O O 5.765 1.007 2.124 1.00 . A A . 9 ALA O 1 1 2 391 1 1 10 ASP C C 5.193 -0.977 4.104 1.00 . A A . 10 ASP C 1 1 2 392 1 1 10 ASP CA C 3.996 -0.041 3.982 1.00 . A A . 10 ASP CA 1 1 2 393 1 1 10 ASP CB C 2.776 -0.659 4.668 1.00 . A A . 10 ASP CB 1 1 2 394 1 1 10 ASP CG C 2.909 -0.676 6.178 1.00 . A A . 10 ASP CG 1 1 2 395 1 1 10 ASP H H 2.800 0.059 2.237 1.00 . A A . 10 ASP H 1 1 2 396 1 1 10 ASP HA H 4.233 0.894 4.467 1.00 . A A . 10 ASP HA 1 1 2 397 1 1 10 ASP HB2 H 1.897 -0.089 4.410 1.00 . A A . 10 ASP HB2 1 1 2 398 1 1 10 ASP HB3 H 2.654 -1.675 4.324 1.00 . A A . 10 ASP HB3 1 1 2 399 1 1 10 ASP N N 3.699 0.244 2.583 1.00 . A A . 10 ASP N 1 1 2 400 1 1 10 ASP O O 6.054 -0.792 4.964 1.00 . A A . 10 ASP O 1 1 2 401 1 1 10 ASP OD1 O 1.872 -0.579 6.867 1.00 . A A . 10 ASP OD1 1 1 2 402 1 1 10 ASP OD2 O 4.051 -0.787 6.672 1.00 . A A . 10 ASP OD2 1 1 2 403 1 1 11 VAL C C 7.661 -2.283 2.903 1.00 . A A . 11 VAL C 1 1 2 404 1 1 11 VAL CA C 6.334 -2.949 3.247 1.00 . A A . 11 VAL CA 1 1 2 405 1 1 11 VAL CB C 6.077 -4.097 2.254 1.00 . A A . 11 VAL CB 1 1 2 406 1 1 11 VAL CG1 C 7.219 -5.102 2.291 1.00 . A A . 11 VAL CG1 1 1 2 407 1 1 11 VAL CG2 C 4.750 -4.775 2.556 1.00 . A A . 11 VAL CG2 1 1 2 408 1 1 11 VAL H H 4.527 -2.079 2.574 1.00 . A A . 11 VAL H 1 1 2 409 1 1 11 VAL HA H 6.400 -3.369 4.241 1.00 . A A . 11 VAL HA 1 1 2 410 1 1 11 VAL HB H 6.027 -3.682 1.259 1.00 . A A . 11 VAL HB 1 1 2 411 1 1 11 VAL HG11 H 7.722 -5.040 3.245 1.00 . A A . 11 VAL HG11 1 1 2 412 1 1 11 VAL HG12 H 6.826 -6.099 2.157 1.00 . A A . 11 VAL HG12 1 1 2 413 1 1 11 VAL HG13 H 7.919 -4.880 1.499 1.00 . A A . 11 VAL HG13 1 1 2 414 1 1 11 VAL HG21 H 4.905 -5.839 2.665 1.00 . A A . 11 VAL HG21 1 1 2 415 1 1 11 VAL HG22 H 4.341 -4.376 3.471 1.00 . A A . 11 VAL HG22 1 1 2 416 1 1 11 VAL HG23 H 4.060 -4.595 1.744 1.00 . A A . 11 VAL HG23 1 1 2 417 1 1 11 VAL N N 5.242 -1.983 3.236 1.00 . A A . 11 VAL N 1 1 2 418 1 1 11 VAL O O 8.635 -2.394 3.647 1.00 . A A . 11 VAL O 1 1 2 419 1 1 12 ALA C C 10.036 -1.884 1.092 1.00 . A A . 12 ALA C 1 1 2 420 1 1 12 ALA CA C 8.899 -0.898 1.330 1.00 . A A . 12 ALA CA 1 1 2 421 1 1 12 ALA CB C 9.310 0.151 2.352 1.00 . A A . 12 ALA CB 1 1 2 422 1 1 12 ALA H H 6.882 -1.532 1.221 1.00 . A A . 12 ALA H 1 1 2 423 1 1 12 ALA HA H 8.672 -0.392 0.401 1.00 . A A . 12 ALA HA 1 1 2 424 1 1 12 ALA HB1 H 9.709 1.016 1.840 1.00 . A A . 12 ALA HB1 1 1 2 425 1 1 12 ALA HB2 H 8.451 0.443 2.936 1.00 . A A . 12 ALA HB2 1 1 2 426 1 1 12 ALA HB3 H 10.067 -0.259 3.004 1.00 . A A . 12 ALA HB3 1 1 2 427 1 1 12 ALA N N 7.691 -1.586 1.771 1.00 . A A . 12 ALA N 1 1 2 428 1 1 12 ALA O O 11.200 -1.580 1.356 1.00 . A A . 12 ALA O 1 1 2 429 1 1 13 LEU C C 11.484 -4.434 1.574 1.00 . A A . 13 LEU C 1 1 2 430 1 1 13 LEU CA C 10.688 -4.098 0.316 1.00 . A A . 13 LEU CA 1 1 2 431 1 1 13 LEU CB C 11.636 -3.638 -0.793 1.00 . A A . 13 LEU CB 1 1 2 432 1 1 13 LEU CD1 C 10.397 -2.231 -2.456 1.00 . A A . 13 LEU CD1 1 1 2 433 1 1 13 LEU CD2 C 12.114 -3.869 -3.242 1.00 . A A . 13 LEU CD2 1 1 2 434 1 1 13 LEU CG C 11.043 -3.584 -2.201 1.00 . A A . 13 LEU CG 1 1 2 435 1 1 13 LEU H H 8.751 -3.249 0.399 1.00 . A A . 13 LEU H 1 1 2 436 1 1 13 LEU HA H 10.165 -4.983 -0.012 1.00 . A A . 13 LEU HA 1 1 2 437 1 1 13 LEU HB2 H 11.984 -2.649 -0.542 1.00 . A A . 13 LEU HB2 1 1 2 438 1 1 13 LEU HB3 H 12.475 -4.320 -0.812 1.00 . A A . 13 LEU HB3 1 1 2 439 1 1 13 LEU HD11 H 10.682 -1.873 -3.434 1.00 . A A . 13 LEU HD11 1 1 2 440 1 1 13 LEU HD12 H 9.323 -2.330 -2.406 1.00 . A A . 13 LEU HD12 1 1 2 441 1 1 13 LEU HD13 H 10.728 -1.527 -1.707 1.00 . A A . 13 LEU HD13 1 1 2 442 1 1 13 LEU HD21 H 11.732 -3.641 -4.226 1.00 . A A . 13 LEU HD21 1 1 2 443 1 1 13 LEU HD22 H 12.982 -3.257 -3.044 1.00 . A A . 13 LEU HD22 1 1 2 444 1 1 13 LEU HD23 H 12.392 -4.912 -3.197 1.00 . A A . 13 LEU HD23 1 1 2 445 1 1 13 LEU HG H 10.276 -4.341 -2.293 1.00 . A A . 13 LEU HG 1 1 2 446 1 1 13 LEU N N 9.694 -3.065 0.591 1.00 . A A . 13 LEU N 1 1 2 447 1 1 13 LEU O O 12.598 -3.947 1.764 1.00 . A A . 13 LEU O 1 1 2 448 1 1 14 NH2 HN1 H 10.014 -5.626 2.223 1.00 . A A . 14 NH2 HN1 1 1 2 449 1 1 14 NH2 HN2 H 11.356 -5.549 3.277 1.00 . A A . 14 NH2 HN2 1 1 2 450 1 1 14 NH2 N N 10.905 -5.271 2.428 1.00 . A A . 14 NH2 N 1 1 3 451 1 1 1 ILE C C -6.225 0.491 -3.587 1.00 . A A . 1 ILE C 1 1 3 452 1 1 1 ILE CA C -7.048 -0.226 -4.650 1.00 . A A . 1 ILE CA 1 1 3 453 1 1 1 ILE CB C -7.449 0.785 -5.740 1.00 . A A . 1 ILE CB 1 1 3 454 1 1 1 ILE CD1 C -9.813 0.172 -6.456 1.00 . A A . 1 ILE CD1 1 1 3 455 1 1 1 ILE CG1 C -8.339 0.112 -6.788 1.00 . A A . 1 ILE CG1 1 1 3 456 1 1 1 ILE CG2 C -6.210 1.380 -6.393 1.00 . A A . 1 ILE CG2 1 1 3 457 1 1 1 ILE H1 H -9.061 -0.374 -4.013 1.00 . A A . 1 ILE H1 1 1 3 458 1 1 1 ILE HA H -6.439 -0.993 -5.105 1.00 . A A . 1 ILE HA 1 1 3 459 1 1 1 ILE HB H -7.999 1.586 -5.272 1.00 . A A . 1 ILE HB 1 1 3 460 1 1 1 ILE HD11 H -10.124 -0.766 -6.021 1.00 . A A . 1 ILE HD11 1 1 3 461 1 1 1 ILE HD12 H -9.992 0.971 -5.753 1.00 . A A . 1 ILE HD12 1 1 3 462 1 1 1 ILE HD13 H -10.378 0.354 -7.359 1.00 . A A . 1 ILE HD13 1 1 3 463 1 1 1 ILE HG12 H -8.193 0.597 -7.739 1.00 . A A . 1 ILE HG12 1 1 3 464 1 1 1 ILE HG13 H -8.059 -0.928 -6.872 1.00 . A A . 1 ILE HG13 1 1 3 465 1 1 1 ILE HG21 H -6.495 1.910 -7.289 1.00 . A A . 1 ILE HG21 1 1 3 466 1 1 1 ILE HG22 H -5.734 2.063 -5.705 1.00 . A A . 1 ILE HG22 1 1 3 467 1 1 1 ILE HG23 H -5.522 0.586 -6.648 1.00 . A A . 1 ILE HG23 1 1 3 468 1 1 1 ILE N N -8.217 -0.871 -4.064 1.00 . A A . 1 ILE N 1 1 3 469 1 1 1 ILE O O -5.018 0.278 -3.470 1.00 . A A . 1 ILE O 1 1 3 470 1 1 2 PHE C C -5.482 1.150 -0.799 1.00 . A A . 2 PHE C 1 1 3 471 1 1 2 PHE CA C -6.216 2.089 -1.750 1.00 . A A . 2 PHE CA 1 1 3 472 1 1 2 PHE CB C -7.228 2.933 -0.973 1.00 . A A . 2 PHE CB 1 1 3 473 1 1 2 PHE CD1 C -8.590 4.442 -2.445 1.00 . A A . 2 PHE CD1 1 1 3 474 1 1 2 PHE CD2 C -6.678 5.352 -1.348 1.00 . A A . 2 PHE CD2 1 1 3 475 1 1 2 PHE CE1 C -8.845 5.670 -3.025 1.00 . A A . 2 PHE CE1 1 1 3 476 1 1 2 PHE CE2 C -6.930 6.583 -1.924 1.00 . A A . 2 PHE CE2 1 1 3 477 1 1 2 PHE CG C -7.504 4.270 -1.601 1.00 . A A . 2 PHE CG 1 1 3 478 1 1 2 PHE CZ C -8.014 6.742 -2.765 1.00 . A A . 2 PHE CZ 1 1 3 479 1 1 2 PHE H H -7.849 1.468 -2.948 1.00 . A A . 2 PHE H 1 1 3 480 1 1 2 PHE HA H -5.496 2.745 -2.215 1.00 . A A . 2 PHE HA 1 1 3 481 1 1 2 PHE HB2 H -8.163 2.397 -0.912 1.00 . A A . 2 PHE HB2 1 1 3 482 1 1 2 PHE HB3 H -6.852 3.106 0.025 1.00 . A A . 2 PHE HB3 1 1 3 483 1 1 2 PHE HD1 H -9.240 3.604 -2.650 1.00 . A A . 2 PHE HD1 1 1 3 484 1 1 2 PHE HD2 H -5.829 5.230 -0.692 1.00 . A A . 2 PHE HD2 1 1 3 485 1 1 2 PHE HE1 H -9.695 5.791 -3.681 1.00 . A A . 2 PHE HE1 1 1 3 486 1 1 2 PHE HE2 H -6.278 7.419 -1.719 1.00 . A A . 2 PHE HE2 1 1 3 487 1 1 2 PHE HZ H -8.214 7.703 -3.216 1.00 . A A . 2 PHE HZ 1 1 3 488 1 1 2 PHE N N -6.886 1.341 -2.807 1.00 . A A . 2 PHE N 1 1 3 489 1 1 2 PHE O O -4.333 1.394 -0.431 1.00 . A A . 2 PHE O 1 1 3 490 1 1 3 TRP C C -4.336 -1.553 -0.115 1.00 . A A . 3 TRP C 1 1 3 491 1 1 3 TRP CA C -5.568 -0.902 0.505 1.00 . A A . 3 TRP CA 1 1 3 492 1 1 3 TRP CB C -6.597 -1.975 0.869 1.00 . A A . 3 TRP CB 1 1 3 493 1 1 3 TRP CD1 C -5.373 -3.757 2.245 1.00 . A A . 3 TRP CD1 1 1 3 494 1 1 3 TRP CD2 C -6.800 -2.499 3.426 1.00 . A A . 3 TRP CD2 1 1 3 495 1 1 3 TRP CE2 C -6.198 -3.432 4.294 1.00 . A A . 3 TRP CE2 1 1 3 496 1 1 3 TRP CE3 C -7.734 -1.600 3.949 1.00 . A A . 3 TRP CE3 1 1 3 497 1 1 3 TRP CG C -6.258 -2.724 2.121 1.00 . A A . 3 TRP CG 1 1 3 498 1 1 3 TRP CH2 C -7.419 -2.597 6.135 1.00 . A A . 3 TRP CH2 1 1 3 499 1 1 3 TRP CZ2 C -6.502 -3.489 5.652 1.00 . A A . 3 TRP CZ2 1 1 3 500 1 1 3 TRP CZ3 C -8.035 -1.658 5.296 1.00 . A A . 3 TRP CZ3 1 1 3 501 1 1 3 TRP H H -7.068 -0.065 -0.732 1.00 . A A . 3 TRP H 1 1 3 502 1 1 3 TRP HA H -5.272 -0.382 1.405 1.00 . A A . 3 TRP HA 1 1 3 503 1 1 3 TRP HB2 H -7.561 -1.508 1.008 1.00 . A A . 3 TRP HB2 1 1 3 504 1 1 3 TRP HB3 H -6.663 -2.688 0.060 1.00 . A A . 3 TRP HB3 1 1 3 505 1 1 3 TRP HD1 H -4.798 -4.166 1.428 1.00 . A A . 3 TRP HD1 1 1 3 506 1 1 3 TRP HE1 H -4.773 -4.917 3.889 1.00 . A A . 3 TRP HE1 1 1 3 507 1 1 3 TRP HE3 H -8.218 -0.869 3.318 1.00 . A A . 3 TRP HE3 1 1 3 508 1 1 3 TRP HH2 H -7.686 -2.607 7.182 1.00 . A A . 3 TRP HH2 1 1 3 509 1 1 3 TRP HZ2 H -6.036 -4.206 6.312 1.00 . A A . 3 TRP HZ2 1 1 3 510 1 1 3 TRP HZ3 H -8.754 -0.972 5.716 1.00 . A A . 3 TRP HZ3 1 1 3 511 1 1 3 TRP N N -6.155 0.074 -0.404 1.00 . A A . 3 TRP N 1 1 3 512 1 1 3 TRP NE1 N -5.332 -4.187 3.549 1.00 . A A . 3 TRP NE1 1 1 3 513 1 1 3 TRP O O -3.238 -1.482 0.440 1.00 . A A . 3 TRP O 1 1 3 514 1 1 4 LEU C C -2.246 -1.897 -2.151 1.00 . A A . 4 LEU C 1 1 3 515 1 1 4 LEU CA C -3.425 -2.848 -1.965 1.00 . A A . 4 LEU CA 1 1 3 516 1 1 4 LEU CB C -3.898 -3.367 -3.323 1.00 . A A . 4 LEU CB 1 1 3 517 1 1 4 LEU CD1 C -2.461 -5.414 -3.502 1.00 . A A . 4 LEU CD1 1 1 3 518 1 1 4 LEU CD2 C -4.707 -5.557 -2.410 1.00 . A A . 4 LEU CD2 1 1 3 519 1 1 4 LEU CG C -3.887 -4.886 -3.502 1.00 . A A . 4 LEU CG 1 1 3 520 1 1 4 LEU H H -5.420 -2.209 -1.661 1.00 . A A . 4 LEU H 1 1 3 521 1 1 4 LEU HA H -3.106 -3.684 -1.360 1.00 . A A . 4 LEU HA 1 1 3 522 1 1 4 LEU HB2 H -4.908 -3.023 -3.476 1.00 . A A . 4 LEU HB2 1 1 3 523 1 1 4 LEU HB3 H -3.255 -2.939 -4.081 1.00 . A A . 4 LEU HB3 1 1 3 524 1 1 4 LEU HD11 H -2.083 -5.426 -2.490 1.00 . A A . 4 LEU HD11 1 1 3 525 1 1 4 LEU HD12 H -2.448 -6.417 -3.902 1.00 . A A . 4 LEU HD12 1 1 3 526 1 1 4 LEU HD13 H -1.840 -4.774 -4.111 1.00 . A A . 4 LEU HD13 1 1 3 527 1 1 4 LEU HD21 H -5.231 -6.405 -2.823 1.00 . A A . 4 LEU HD21 1 1 3 528 1 1 4 LEU HD22 H -4.050 -5.889 -1.620 1.00 . A A . 4 LEU HD22 1 1 3 529 1 1 4 LEU HD23 H -5.421 -4.851 -2.011 1.00 . A A . 4 LEU HD23 1 1 3 530 1 1 4 LEU HG H -4.334 -5.132 -4.455 1.00 . A A . 4 LEU HG 1 1 3 531 1 1 4 LEU N N -4.523 -2.186 -1.268 1.00 . A A . 4 LEU N 1 1 3 532 1 1 4 LEU O O -1.091 -2.285 -1.981 1.00 . A A . 4 LEU O 1 1 3 533 1 1 5 PHE C C -0.810 0.691 -1.398 1.00 . A A . 5 PHE C 1 1 3 534 1 1 5 PHE CA C -1.513 0.355 -2.710 1.00 . A A . 5 PHE CA 1 1 3 535 1 1 5 PHE CB C -2.120 1.622 -3.316 1.00 . A A . 5 PHE CB 1 1 3 536 1 1 5 PHE CD1 C -2.706 0.501 -5.483 1.00 . A A . 5 PHE CD1 1 1 3 537 1 1 5 PHE CD2 C -1.719 2.669 -5.561 1.00 . A A . 5 PHE CD2 1 1 3 538 1 1 5 PHE CE1 C -2.766 0.474 -6.864 1.00 . A A . 5 PHE CE1 1 1 3 539 1 1 5 PHE CE2 C -1.777 2.649 -6.942 1.00 . A A . 5 PHE CE2 1 1 3 540 1 1 5 PHE CG C -2.183 1.596 -4.816 1.00 . A A . 5 PHE CG 1 1 3 541 1 1 5 PHE CZ C -2.300 1.549 -7.594 1.00 . A A . 5 PHE CZ 1 1 3 542 1 1 5 PHE H H -3.489 -0.402 -2.622 1.00 . A A . 5 PHE H 1 1 3 543 1 1 5 PHE HA H -0.790 -0.053 -3.398 1.00 . A A . 5 PHE HA 1 1 3 544 1 1 5 PHE HB2 H -3.126 1.746 -2.944 1.00 . A A . 5 PHE HB2 1 1 3 545 1 1 5 PHE HB3 H -1.525 2.474 -3.022 1.00 . A A . 5 PHE HB3 1 1 3 546 1 1 5 PHE HD1 H -3.071 -0.342 -4.913 1.00 . A A . 5 PHE HD1 1 1 3 547 1 1 5 PHE HD2 H -1.308 3.529 -5.053 1.00 . A A . 5 PHE HD2 1 1 3 548 1 1 5 PHE HE1 H -3.176 -0.387 -7.370 1.00 . A A . 5 PHE HE1 1 1 3 549 1 1 5 PHE HE2 H -1.412 3.492 -7.511 1.00 . A A . 5 PHE HE2 1 1 3 550 1 1 5 PHE HZ H -2.348 1.531 -8.673 1.00 . A A . 5 PHE HZ 1 1 3 551 1 1 5 PHE N N -2.548 -0.651 -2.500 1.00 . A A . 5 PHE N 1 1 3 552 1 1 5 PHE O O 0.419 0.664 -1.315 1.00 . A A . 5 PHE O 1 1 3 553 1 1 6 ARG C C -0.163 0.234 1.462 1.00 . A A . 6 ARG C 1 1 3 554 1 1 6 ARG CA C -1.051 1.355 0.931 1.00 . A A . 6 ARG CA 1 1 3 555 1 1 6 ARG CB C -2.182 1.636 1.922 1.00 . A A . 6 ARG CB 1 1 3 556 1 1 6 ARG CD C -1.931 4.011 2.707 1.00 . A A . 6 ARG CD 1 1 3 557 1 1 6 ARG CG C -2.729 3.052 1.836 1.00 . A A . 6 ARG CG 1 1 3 558 1 1 6 ARG CZ C 0.294 5.055 2.678 1.00 . A A . 6 ARG CZ 1 1 3 559 1 1 6 ARG H H -2.569 1.015 -0.504 1.00 . A A . 6 ARG H 1 1 3 560 1 1 6 ARG HA H -0.455 2.248 0.817 1.00 . A A . 6 ARG HA 1 1 3 561 1 1 6 ARG HB2 H -2.993 0.949 1.730 1.00 . A A . 6 ARG HB2 1 1 3 562 1 1 6 ARG HB3 H -1.814 1.477 2.924 1.00 . A A . 6 ARG HB3 1 1 3 563 1 1 6 ARG HD2 H -2.549 4.867 2.934 1.00 . A A . 6 ARG HD2 1 1 3 564 1 1 6 ARG HD3 H -1.662 3.507 3.621 1.00 . A A . 6 ARG HD3 1 1 3 565 1 1 6 ARG HE H -0.646 4.333 1.074 1.00 . A A . 6 ARG HE 1 1 3 566 1 1 6 ARG HG2 H -2.677 3.387 0.810 1.00 . A A . 6 ARG HG2 1 1 3 567 1 1 6 ARG HG3 H -3.757 3.051 2.166 1.00 . A A . 6 ARG HG3 1 1 3 568 1 1 6 ARG HH11 H -0.577 4.959 4.498 1.00 . A A . 6 ARG HH11 1 1 3 569 1 1 6 ARG HH12 H 0.993 5.692 4.464 1.00 . A A . 6 ARG HH12 1 1 3 570 1 1 6 ARG HH21 H 1.420 5.297 1.017 1.00 . A A . 6 ARG HH21 1 1 3 571 1 1 6 ARG HH22 H 2.128 5.883 2.483 1.00 . A A . 6 ARG HH22 1 1 3 572 1 1 6 ARG N N -1.597 1.011 -0.376 1.00 . A A . 6 ARG N 1 1 3 573 1 1 6 ARG NE N -0.714 4.469 2.041 1.00 . A A . 6 ARG NE 1 1 3 574 1 1 6 ARG NH1 N 0.232 5.252 3.988 1.00 . A A . 6 ARG NH1 1 1 3 575 1 1 6 ARG NH2 N 1.370 5.443 2.005 1.00 . A A . 6 ARG NH2 1 1 3 576 1 1 6 ARG O O 0.900 0.485 2.028 1.00 . A A . 6 ARG O 1 1 3 577 1 1 7 GLY C C 1.542 -2.208 1.123 1.00 . A A . 7 GLY C 1 1 3 578 1 1 7 GLY CA C 0.158 -2.148 1.740 1.00 . A A . 7 GLY CA 1 1 3 579 1 1 7 GLY H H -1.463 -1.146 0.816 1.00 . A A . 7 GLY H 1 1 3 580 1 1 7 GLY HA2 H 0.256 -2.087 2.814 1.00 . A A . 7 GLY HA2 1 1 3 581 1 1 7 GLY HA3 H -0.375 -3.052 1.488 1.00 . A A . 7 GLY HA3 1 1 3 582 1 1 7 GLY N N -0.608 -1.006 1.274 1.00 . A A . 7 GLY N 1 1 3 583 1 1 7 GLY O O 2.542 -2.329 1.832 1.00 . A A . 7 GLY O 1 1 3 584 1 1 8 LYS C C 3.826 -1.099 -0.397 1.00 . A A . 8 LYS C 1 1 3 585 1 1 8 LYS CA C 2.872 -2.171 -0.915 1.00 . A A . 8 LYS CA 1 1 3 586 1 1 8 LYS CB C 2.644 -1.984 -2.417 1.00 . A A . 8 LYS CB 1 1 3 587 1 1 8 LYS CD C 3.470 -2.376 -4.757 1.00 . A A . 8 LYS CD 1 1 3 588 1 1 8 LYS CE C 4.000 -1.012 -5.175 1.00 . A A . 8 LYS CE 1 1 3 589 1 1 8 LYS CG C 3.710 -2.637 -3.279 1.00 . A A . 8 LYS CG 1 1 3 590 1 1 8 LYS H H 0.769 -2.029 -0.712 1.00 . A A . 8 LYS H 1 1 3 591 1 1 8 LYS HA H 3.314 -3.141 -0.744 1.00 . A A . 8 LYS HA 1 1 3 592 1 1 8 LYS HB2 H 1.688 -2.411 -2.679 1.00 . A A . 8 LYS HB2 1 1 3 593 1 1 8 LYS HB3 H 2.631 -0.926 -2.637 1.00 . A A . 8 LYS HB3 1 1 3 594 1 1 8 LYS HD2 H 3.971 -3.136 -5.335 1.00 . A A . 8 LYS HD2 1 1 3 595 1 1 8 LYS HD3 H 2.408 -2.413 -4.951 1.00 . A A . 8 LYS HD3 1 1 3 596 1 1 8 LYS HE2 H 3.566 -0.748 -6.127 1.00 . A A . 8 LYS HE2 1 1 3 597 1 1 8 LYS HE3 H 3.710 -0.284 -4.432 1.00 . A A . 8 LYS HE3 1 1 3 598 1 1 8 LYS HG2 H 4.676 -2.236 -3.007 1.00 . A A . 8 LYS HG2 1 1 3 599 1 1 8 LYS HG3 H 3.698 -3.704 -3.106 1.00 . A A . 8 LYS HG3 1 1 3 600 1 1 8 LYS HZ1 H 5.842 -1.987 -5.333 1.00 . A A . 8 LYS HZ1 1 1 3 601 1 1 8 LYS HZ2 H 5.768 -0.522 -6.176 1.00 . A A . 8 LYS HZ2 1 1 3 602 1 1 8 LYS HZ3 H 5.912 -0.521 -4.491 1.00 . A A . 8 LYS HZ3 1 1 3 603 1 1 8 LYS N N 1.601 -2.124 -0.201 1.00 . A A . 8 LYS N 1 1 3 604 1 1 8 LYS NZ N 5.484 -1.011 -5.302 1.00 . A A . 8 LYS NZ 1 1 3 605 1 1 8 LYS O O 5.033 -1.324 -0.299 1.00 . A A . 8 LYS O 1 1 3 606 1 1 9 ALA C C 4.593 0.872 1.849 1.00 . A A . 9 ALA C 1 1 3 607 1 1 9 ALA CA C 4.080 1.170 0.444 1.00 . A A . 9 ALA CA 1 1 3 608 1 1 9 ALA CB C 3.268 2.458 0.438 1.00 . A A . 9 ALA CB 1 1 3 609 1 1 9 ALA H H 2.310 0.183 -0.167 1.00 . A A . 9 ALA H 1 1 3 610 1 1 9 ALA HA H 4.925 1.303 -0.217 1.00 . A A . 9 ALA HA 1 1 3 611 1 1 9 ALA HB1 H 3.353 2.940 1.401 1.00 . A A . 9 ALA HB1 1 1 3 612 1 1 9 ALA HB2 H 3.647 3.118 -0.329 1.00 . A A . 9 ALA HB2 1 1 3 613 1 1 9 ALA HB3 H 2.232 2.230 0.239 1.00 . A A . 9 ALA HB3 1 1 3 614 1 1 9 ALA N N 3.278 0.066 -0.066 1.00 . A A . 9 ALA N 1 1 3 615 1 1 9 ALA O O 5.752 1.140 2.166 1.00 . A A . 9 ALA O 1 1 3 616 1 1 10 ASP C C 5.342 -0.889 4.087 1.00 . A A . 10 ASP C 1 1 3 617 1 1 10 ASP CA C 4.091 -0.018 4.057 1.00 . A A . 10 ASP CA 1 1 3 618 1 1 10 ASP CB C 2.936 -0.737 4.755 1.00 . A A . 10 ASP CB 1 1 3 619 1 1 10 ASP CG C 3.206 -0.973 6.228 1.00 . A A . 10 ASP CG 1 1 3 620 1 1 10 ASP H H 2.815 0.128 2.374 1.00 . A A . 10 ASP H 1 1 3 621 1 1 10 ASP HA H 4.297 0.904 4.580 1.00 . A A . 10 ASP HA 1 1 3 622 1 1 10 ASP HB2 H 2.041 -0.140 4.664 1.00 . A A . 10 ASP HB2 1 1 3 623 1 1 10 ASP HB3 H 2.776 -1.693 4.279 1.00 . A A . 10 ASP HB3 1 1 3 624 1 1 10 ASP N N 3.724 0.317 2.686 1.00 . A A . 10 ASP N 1 1 3 625 1 1 10 ASP O O 6.351 -0.525 4.692 1.00 . A A . 10 ASP O 1 1 3 626 1 1 10 ASP OD1 O 3.871 -0.121 6.853 1.00 . A A . 10 ASP OD1 1 1 3 627 1 1 10 ASP OD2 O 2.755 -2.012 6.756 1.00 . A A . 10 ASP OD2 1 1 3 628 1 1 11 VAL C C 7.613 -2.318 2.733 1.00 . A A . 11 VAL C 1 1 3 629 1 1 11 VAL CA C 6.397 -2.968 3.384 1.00 . A A . 11 VAL CA 1 1 3 630 1 1 11 VAL CB C 6.038 -4.250 2.609 1.00 . A A . 11 VAL CB 1 1 3 631 1 1 11 VAL CG1 C 5.549 -3.911 1.209 1.00 . A A . 11 VAL CG1 1 1 3 632 1 1 11 VAL CG2 C 7.233 -5.190 2.553 1.00 . A A . 11 VAL CG2 1 1 3 633 1 1 11 VAL H H 4.439 -2.279 2.969 1.00 . A A . 11 VAL H 1 1 3 634 1 1 11 VAL HA H 6.647 -3.243 4.399 1.00 . A A . 11 VAL HA 1 1 3 635 1 1 11 VAL HB H 5.238 -4.751 3.135 1.00 . A A . 11 VAL HB 1 1 3 636 1 1 11 VAL HG11 H 6.363 -3.490 0.638 1.00 . A A . 11 VAL HG11 1 1 3 637 1 1 11 VAL HG12 H 5.196 -4.808 0.724 1.00 . A A . 11 VAL HG12 1 1 3 638 1 1 11 VAL HG13 H 4.744 -3.194 1.273 1.00 . A A . 11 VAL HG13 1 1 3 639 1 1 11 VAL HG21 H 6.917 -6.153 2.182 1.00 . A A . 11 VAL HG21 1 1 3 640 1 1 11 VAL HG22 H 7.984 -4.779 1.894 1.00 . A A . 11 VAL HG22 1 1 3 641 1 1 11 VAL HG23 H 7.647 -5.305 3.545 1.00 . A A . 11 VAL HG23 1 1 3 642 1 1 11 VAL N N 5.269 -2.044 3.432 1.00 . A A . 11 VAL N 1 1 3 643 1 1 11 VAL O O 8.750 -2.567 3.133 1.00 . A A . 11 VAL O 1 1 3 644 1 1 12 ALA C C 9.090 0.260 1.912 1.00 . A A . 12 ALA C 1 1 3 645 1 1 12 ALA CA C 8.440 -0.796 1.025 1.00 . A A . 12 ALA CA 1 1 3 646 1 1 12 ALA CB C 7.911 -0.161 -0.253 1.00 . A A . 12 ALA CB 1 1 3 647 1 1 12 ALA H H 6.437 -1.326 1.457 1.00 . A A . 12 ALA H 1 1 3 648 1 1 12 ALA HA H 9.184 -1.530 0.751 1.00 . A A . 12 ALA HA 1 1 3 649 1 1 12 ALA HB1 H 6.896 0.170 -0.098 1.00 . A A . 12 ALA HB1 1 1 3 650 1 1 12 ALA HB2 H 8.530 0.683 -0.518 1.00 . A A . 12 ALA HB2 1 1 3 651 1 1 12 ALA HB3 H 7.935 -0.888 -1.052 1.00 . A A . 12 ALA HB3 1 1 3 652 1 1 12 ALA N N 7.364 -1.483 1.729 1.00 . A A . 12 ALA N 1 1 3 653 1 1 12 ALA O O 8.481 1.285 2.224 1.00 . A A . 12 ALA O 1 1 3 654 1 1 13 LEU C C 11.221 2.289 2.488 1.00 . A A . 13 LEU C 1 1 3 655 1 1 13 LEU CA C 11.063 0.934 3.169 1.00 . A A . 13 LEU CA 1 1 3 656 1 1 13 LEU CB C 12.437 0.360 3.517 1.00 . A A . 13 LEU CB 1 1 3 657 1 1 13 LEU CD1 C 14.177 0.157 5.310 1.00 . A A . 13 LEU CD1 1 1 3 658 1 1 13 LEU CD2 C 13.971 2.283 4.007 1.00 . A A . 13 LEU CD2 1 1 3 659 1 1 13 LEU CG C 13.218 1.102 4.604 1.00 . A A . 13 LEU CG 1 1 3 660 1 1 13 LEU H H 10.762 -0.828 2.036 1.00 . A A . 13 LEU H 1 1 3 661 1 1 13 LEU HA H 10.496 1.066 4.078 1.00 . A A . 13 LEU HA 1 1 3 662 1 1 13 LEU HB2 H 12.297 -0.657 3.847 1.00 . A A . 13 LEU HB2 1 1 3 663 1 1 13 LEU HB3 H 13.035 0.366 2.616 1.00 . A A . 13 LEU HB3 1 1 3 664 1 1 13 LEU HD11 H 14.290 0.463 6.340 1.00 . A A . 13 LEU HD11 1 1 3 665 1 1 13 LEU HD12 H 13.785 -0.848 5.274 1.00 . A A . 13 LEU HD12 1 1 3 666 1 1 13 LEU HD13 H 15.138 0.186 4.819 1.00 . A A . 13 LEU HD13 1 1 3 667 1 1 13 LEU HD21 H 13.343 3.160 4.032 1.00 . A A . 13 LEU HD21 1 1 3 668 1 1 13 LEU HD22 H 14.867 2.465 4.581 1.00 . A A . 13 LEU HD22 1 1 3 669 1 1 13 LEU HD23 H 14.239 2.060 2.984 1.00 . A A . 13 LEU HD23 1 1 3 670 1 1 13 LEU HG H 12.524 1.484 5.339 1.00 . A A . 13 LEU HG 1 1 3 671 1 1 13 LEU N N 10.329 0.004 2.316 1.00 . A A . 13 LEU N 1 1 3 672 1 1 13 LEU O O 11.701 2.373 1.357 1.00 . A A . 13 LEU O 1 1 3 673 1 1 14 NH2 HN1 H 10.445 3.216 4.080 1.00 . A A . 14 NH2 HN1 1 1 3 674 1 1 14 NH2 HN2 H 10.887 4.274 2.815 1.00 . A A . 14 NH2 HN2 1 1 3 675 1 1 14 NH2 N N 10.818 3.347 3.183 1.00 . A A . 14 NH2 N 1 1 4 676 1 1 1 ILE C C -6.358 0.165 -3.315 1.00 . A A . 1 ILE C 1 1 4 677 1 1 1 ILE CA C -7.285 -0.511 -4.319 1.00 . A A . 1 ILE CA 1 1 4 678 1 1 1 ILE CB C -8.454 -1.167 -3.561 1.00 . A A . 1 ILE CB 1 1 4 679 1 1 1 ILE CD1 C -8.994 -2.950 -1.828 1.00 . A A . 1 ILE CD1 1 1 4 680 1 1 1 ILE CG1 C -7.966 -2.395 -2.790 1.00 . A A . 1 ILE CG1 1 1 4 681 1 1 1 ILE CG2 C -9.566 -1.547 -4.528 1.00 . A A . 1 ILE CG2 1 1 4 682 1 1 1 ILE H1 H -5.647 -1.729 -4.880 1.00 . A A . 1 ILE H1 1 1 4 683 1 1 1 ILE HA H -7.688 0.239 -4.983 1.00 . A A . 1 ILE HA 1 1 4 684 1 1 1 ILE HB H -8.849 -0.444 -2.862 1.00 . A A . 1 ILE HB 1 1 4 685 1 1 1 ILE HD11 H -9.947 -3.035 -2.328 1.00 . A A . 1 ILE HD11 1 1 4 686 1 1 1 ILE HD12 H -8.677 -3.926 -1.489 1.00 . A A . 1 ILE HD12 1 1 4 687 1 1 1 ILE HD13 H -9.088 -2.288 -0.980 1.00 . A A . 1 ILE HD13 1 1 4 688 1 1 1 ILE HG12 H -7.714 -3.174 -3.491 1.00 . A A . 1 ILE HG12 1 1 4 689 1 1 1 ILE HG13 H -7.088 -2.127 -2.222 1.00 . A A . 1 ILE HG13 1 1 4 690 1 1 1 ILE HG21 H -9.451 -2.581 -4.820 1.00 . A A . 1 ILE HG21 1 1 4 691 1 1 1 ILE HG22 H -10.523 -1.414 -4.046 1.00 . A A . 1 ILE HG22 1 1 4 692 1 1 1 ILE HG23 H -9.513 -0.917 -5.403 1.00 . A A . 1 ILE HG23 1 1 4 693 1 1 1 ILE N N -6.563 -1.486 -5.129 1.00 . A A . 1 ILE N 1 1 4 694 1 1 1 ILE O O -5.174 -0.161 -3.232 1.00 . A A . 1 ILE O 1 1 4 695 1 1 2 PHE C C -5.431 0.861 -0.603 1.00 . A A . 2 PHE C 1 1 4 696 1 1 2 PHE CA C -6.127 1.829 -1.555 1.00 . A A . 2 PHE CA 1 1 4 697 1 1 2 PHE CB C -7.029 2.779 -0.764 1.00 . A A . 2 PHE CB 1 1 4 698 1 1 2 PHE CD1 C -7.842 1.796 1.396 1.00 . A A . 2 PHE CD1 1 1 4 699 1 1 2 PHE CD2 C -9.273 1.684 -0.507 1.00 . A A . 2 PHE CD2 1 1 4 700 1 1 2 PHE CE1 C -8.797 1.145 2.155 1.00 . A A . 2 PHE CE1 1 1 4 701 1 1 2 PHE CE2 C -10.232 1.034 0.245 1.00 . A A . 2 PHE CE2 1 1 4 702 1 1 2 PHE CG C -8.069 2.072 0.057 1.00 . A A . 2 PHE CG 1 1 4 703 1 1 2 PHE CZ C -9.994 0.766 1.578 1.00 . A A . 2 PHE CZ 1 1 4 704 1 1 2 PHE H H -7.854 1.323 -2.669 1.00 . A A . 2 PHE H 1 1 4 705 1 1 2 PHE HA H -5.377 2.408 -2.073 1.00 . A A . 2 PHE HA 1 1 4 706 1 1 2 PHE HB2 H -6.421 3.367 -0.095 1.00 . A A . 2 PHE HB2 1 1 4 707 1 1 2 PHE HB3 H -7.539 3.436 -1.453 1.00 . A A . 2 PHE HB3 1 1 4 708 1 1 2 PHE HD1 H -6.908 2.094 1.849 1.00 . A A . 2 PHE HD1 1 1 4 709 1 1 2 PHE HD2 H -9.460 1.896 -1.552 1.00 . A A . 2 PHE HD2 1 1 4 710 1 1 2 PHE HE1 H -8.609 0.937 3.197 1.00 . A A . 2 PHE HE1 1 1 4 711 1 1 2 PHE HE2 H -11.166 0.739 -0.209 1.00 . A A . 2 PHE HE2 1 1 4 712 1 1 2 PHE HZ H -10.741 0.256 2.169 1.00 . A A . 2 PHE HZ 1 1 4 713 1 1 2 PHE N N -6.904 1.107 -2.555 1.00 . A A . 2 PHE N 1 1 4 714 1 1 2 PHE O O -4.306 1.104 -0.165 1.00 . A A . 2 PHE O 1 1 4 715 1 1 3 TRP C C -4.284 -1.854 0.033 1.00 . A A . 3 TRP C 1 1 4 716 1 1 3 TRP CA C -5.555 -1.243 0.612 1.00 . A A . 3 TRP CA 1 1 4 717 1 1 3 TRP CB C -6.587 -2.340 0.880 1.00 . A A . 3 TRP CB 1 1 4 718 1 1 3 TRP CD1 C -5.604 -4.440 1.972 1.00 . A A . 3 TRP CD1 1 1 4 719 1 1 3 TRP CD2 C -6.470 -2.967 3.421 1.00 . A A . 3 TRP CD2 1 1 4 720 1 1 3 TRP CE2 C -5.967 -4.067 4.144 1.00 . A A . 3 TRP CE2 1 1 4 721 1 1 3 TRP CE3 C -7.061 -1.914 4.123 1.00 . A A . 3 TRP CE3 1 1 4 722 1 1 3 TRP CG C -6.227 -3.226 2.033 1.00 . A A . 3 TRP CG 1 1 4 723 1 1 3 TRP CH2 C -6.625 -3.095 6.195 1.00 . A A . 3 TRP CH2 1 1 4 724 1 1 3 TRP CZ2 C -6.040 -4.141 5.531 1.00 . A A . 3 TRP CZ2 1 1 4 725 1 1 3 TRP CZ3 C -7.134 -1.989 5.501 1.00 . A A . 3 TRP CZ3 1 1 4 726 1 1 3 TRP H H -6.999 -0.376 -0.670 1.00 . A A . 3 TRP H 1 1 4 727 1 1 3 TRP HA H -5.312 -0.755 1.545 1.00 . A A . 3 TRP HA 1 1 4 728 1 1 3 TRP HB2 H -7.541 -1.884 1.096 1.00 . A A . 3 TRP HB2 1 1 4 729 1 1 3 TRP HB3 H -6.679 -2.960 0.000 1.00 . A A . 3 TRP HB3 1 1 4 730 1 1 3 TRP HD1 H -5.289 -4.916 1.056 1.00 . A A . 3 TRP HD1 1 1 4 731 1 1 3 TRP HE1 H -5.024 -5.810 3.455 1.00 . A A . 3 TRP HE1 1 1 4 732 1 1 3 TRP HE3 H -7.460 -1.053 3.607 1.00 . A A . 3 TRP HE3 1 1 4 733 1 1 3 TRP HH2 H -6.703 -3.112 7.269 1.00 . A A . 3 TRP HH2 1 1 4 734 1 1 3 TRP HZ2 H -5.652 -4.987 6.081 1.00 . A A . 3 TRP HZ2 1 1 4 735 1 1 3 TRP HZ3 H -7.588 -1.184 6.059 1.00 . A A . 3 TRP HZ3 1 1 4 736 1 1 3 TRP N N -6.108 -0.237 -0.288 1.00 . A A . 3 TRP N 1 1 4 737 1 1 3 TRP NE1 N -5.444 -4.951 3.238 1.00 . A A . 3 TRP NE1 1 1 4 738 1 1 3 TRP O O -3.333 -2.142 0.760 1.00 . A A . 3 TRP O 1 1 4 739 1 1 4 LEU C C -2.012 -1.591 -2.127 1.00 . A A . 4 LEU C 1 1 4 740 1 1 4 LEU CA C -3.119 -2.628 -1.960 1.00 . A A . 4 LEU CA 1 1 4 741 1 1 4 LEU CB C -3.528 -3.179 -3.327 1.00 . A A . 4 LEU CB 1 1 4 742 1 1 4 LEU CD1 C -1.637 -4.774 -3.732 1.00 . A A . 4 LEU CD1 1 1 4 743 1 1 4 LEU CD2 C -2.911 -3.832 -5.668 1.00 . A A . 4 LEU CD2 1 1 4 744 1 1 4 LEU CG C -2.383 -3.562 -4.265 1.00 . A A . 4 LEU CG 1 1 4 745 1 1 4 LEU H H -5.061 -1.802 -1.809 1.00 . A A . 4 LEU H 1 1 4 746 1 1 4 LEU HA H -2.748 -3.438 -1.351 1.00 . A A . 4 LEU HA 1 1 4 747 1 1 4 LEU HB2 H -4.127 -4.060 -3.162 1.00 . A A . 4 LEU HB2 1 1 4 748 1 1 4 LEU HB3 H -4.125 -2.426 -3.821 1.00 . A A . 4 LEU HB3 1 1 4 749 1 1 4 LEU HD11 H -1.077 -5.233 -4.532 1.00 . A A . 4 LEU HD11 1 1 4 750 1 1 4 LEU HD12 H -0.959 -4.465 -2.950 1.00 . A A . 4 LEU HD12 1 1 4 751 1 1 4 LEU HD13 H -2.346 -5.486 -3.335 1.00 . A A . 4 LEU HD13 1 1 4 752 1 1 4 LEU HD21 H -2.106 -4.189 -6.292 1.00 . A A . 4 LEU HD21 1 1 4 753 1 1 4 LEU HD22 H -3.690 -4.579 -5.621 1.00 . A A . 4 LEU HD22 1 1 4 754 1 1 4 LEU HD23 H -3.314 -2.919 -6.083 1.00 . A A . 4 LEU HD23 1 1 4 755 1 1 4 LEU HG H -1.684 -2.739 -4.324 1.00 . A A . 4 LEU HG 1 1 4 756 1 1 4 LEU N N -4.274 -2.051 -1.282 1.00 . A A . 4 LEU N 1 1 4 757 1 1 4 LEU O O -0.851 -1.848 -1.804 1.00 . A A . 4 LEU O 1 1 4 758 1 1 5 PHE C C -0.707 1.014 -1.537 1.00 . A A . 5 PHE C 1 1 4 759 1 1 5 PHE CA C -1.416 0.658 -2.840 1.00 . A A . 5 PHE CA 1 1 4 760 1 1 5 PHE CB C -2.118 1.895 -3.406 1.00 . A A . 5 PHE CB 1 1 4 761 1 1 5 PHE CD1 C -0.003 2.876 -4.332 1.00 . A A . 5 PHE CD1 1 1 4 762 1 1 5 PHE CD2 C -1.509 4.318 -3.178 1.00 . A A . 5 PHE CD2 1 1 4 763 1 1 5 PHE CE1 C 0.852 3.940 -4.554 1.00 . A A . 5 PHE CE1 1 1 4 764 1 1 5 PHE CE2 C -0.658 5.386 -3.396 1.00 . A A . 5 PHE CE2 1 1 4 765 1 1 5 PHE CG C -1.191 3.053 -3.644 1.00 . A A . 5 PHE CG 1 1 4 766 1 1 5 PHE CZ C 0.524 5.196 -4.084 1.00 . A A . 5 PHE CZ 1 1 4 767 1 1 5 PHE H H -3.317 -0.272 -2.870 1.00 . A A . 5 PHE H 1 1 4 768 1 1 5 PHE HA H -0.683 0.313 -3.553 1.00 . A A . 5 PHE HA 1 1 4 769 1 1 5 PHE HB2 H -2.577 1.640 -4.349 1.00 . A A . 5 PHE HB2 1 1 4 770 1 1 5 PHE HB3 H -2.881 2.216 -2.713 1.00 . A A . 5 PHE HB3 1 1 4 771 1 1 5 PHE HD1 H 0.255 1.893 -4.700 1.00 . A A . 5 PHE HD1 1 1 4 772 1 1 5 PHE HD2 H -2.434 4.469 -2.639 1.00 . A A . 5 PHE HD2 1 1 4 773 1 1 5 PHE HE1 H 1.776 3.788 -5.091 1.00 . A A . 5 PHE HE1 1 1 4 774 1 1 5 PHE HE2 H -0.918 6.368 -3.027 1.00 . A A . 5 PHE HE2 1 1 4 775 1 1 5 PHE HZ H 1.189 6.029 -4.257 1.00 . A A . 5 PHE HZ 1 1 4 776 1 1 5 PHE N N -2.378 -0.418 -2.632 1.00 . A A . 5 PHE N 1 1 4 777 1 1 5 PHE O O 0.519 1.119 -1.495 1.00 . A A . 5 PHE O 1 1 4 778 1 1 6 ARG C C -0.084 0.401 1.378 1.00 . A A . 6 ARG C 1 1 4 779 1 1 6 ARG CA C -0.933 1.543 0.828 1.00 . A A . 6 ARG CA 1 1 4 780 1 1 6 ARG CB C -2.057 1.875 1.810 1.00 . A A . 6 ARG CB 1 1 4 781 1 1 6 ARG CD C -2.736 2.973 3.966 1.00 . A A . 6 ARG CD 1 1 4 782 1 1 6 ARG CG C -1.573 2.537 3.090 1.00 . A A . 6 ARG CG 1 1 4 783 1 1 6 ARG CZ C -3.293 5.209 3.114 1.00 . A A . 6 ARG CZ 1 1 4 784 1 1 6 ARG H H -2.456 1.099 -0.574 1.00 . A A . 6 ARG H 1 1 4 785 1 1 6 ARG HA H -0.307 2.413 0.702 1.00 . A A . 6 ARG HA 1 1 4 786 1 1 6 ARG HB2 H -2.756 2.543 1.328 1.00 . A A . 6 ARG HB2 1 1 4 787 1 1 6 ARG HB3 H -2.570 0.962 2.075 1.00 . A A . 6 ARG HB3 1 1 4 788 1 1 6 ARG HD2 H -3.315 2.101 4.232 1.00 . A A . 6 ARG HD2 1 1 4 789 1 1 6 ARG HD3 H -2.342 3.430 4.862 1.00 . A A . 6 ARG HD3 1 1 4 790 1 1 6 ARG HE H -4.463 3.601 2.947 1.00 . A A . 6 ARG HE 1 1 4 791 1 1 6 ARG HG2 H -0.965 1.834 3.639 1.00 . A A . 6 ARG HG2 1 1 4 792 1 1 6 ARG HG3 H -0.982 3.403 2.832 1.00 . A A . 6 ARG HG3 1 1 4 793 1 1 6 ARG HH11 H -1.502 5.075 4.037 1.00 . A A . 6 ARG HH11 1 1 4 794 1 1 6 ARG HH12 H -1.908 6.646 3.430 1.00 . A A . 6 ARG HH12 1 1 4 795 1 1 6 ARG HH21 H -5.008 5.666 2.144 1.00 . A A . 6 ARG HH21 1 1 4 796 1 1 6 ARG HH22 H -3.903 6.982 2.354 1.00 . A A . 6 ARG HH22 1 1 4 797 1 1 6 ARG N N -1.486 1.197 -0.477 1.00 . A A . 6 ARG N 1 1 4 798 1 1 6 ARG NE N -3.605 3.930 3.288 1.00 . A A . 6 ARG NE 1 1 4 799 1 1 6 ARG NH1 N -2.140 5.683 3.564 1.00 . A A . 6 ARG NH1 1 1 4 800 1 1 6 ARG NH2 N -4.138 6.019 2.485 1.00 . A A . 6 ARG NH2 1 1 4 801 1 1 6 ARG O O 1.039 0.612 1.833 1.00 . A A . 6 ARG O 1 1 4 802 1 1 7 GLY C C 1.448 -2.134 1.170 1.00 . A A . 7 GLY C 1 1 4 803 1 1 7 GLY CA C 0.092 -1.968 1.830 1.00 . A A . 7 GLY CA 1 1 4 804 1 1 7 GLY H H -1.528 -0.921 0.957 1.00 . A A . 7 GLY H 1 1 4 805 1 1 7 GLY HA2 H 0.232 -1.862 2.894 1.00 . A A . 7 GLY HA2 1 1 4 806 1 1 7 GLY HA3 H -0.497 -2.854 1.639 1.00 . A A . 7 GLY HA3 1 1 4 807 1 1 7 GLY N N -0.628 -0.811 1.331 1.00 . A A . 7 GLY N 1 1 4 808 1 1 7 GLY O O 2.466 -2.254 1.851 1.00 . A A . 7 GLY O 1 1 4 809 1 1 8 LYS C C 3.725 -1.244 -0.490 1.00 . A A . 8 LYS C 1 1 4 810 1 1 8 LYS CA C 2.702 -2.294 -0.910 1.00 . A A . 8 LYS CA 1 1 4 811 1 1 8 LYS CB C 2.428 -2.184 -2.412 1.00 . A A . 8 LYS CB 1 1 4 812 1 1 8 LYS CD C 2.723 -4.473 -3.404 1.00 . A A . 8 LYS CD 1 1 4 813 1 1 8 LYS CE C 3.024 -5.423 -2.256 1.00 . A A . 8 LYS CE 1 1 4 814 1 1 8 LYS CG C 1.728 -3.400 -2.993 1.00 . A A . 8 LYS CG 1 1 4 815 1 1 8 LYS H H 0.617 -2.042 -0.645 1.00 . A A . 8 LYS H 1 1 4 816 1 1 8 LYS HA H 3.101 -3.274 -0.696 1.00 . A A . 8 LYS HA 1 1 4 817 1 1 8 LYS HB2 H 1.806 -1.318 -2.590 1.00 . A A . 8 LYS HB2 1 1 4 818 1 1 8 LYS HB3 H 3.368 -2.054 -2.929 1.00 . A A . 8 LYS HB3 1 1 4 819 1 1 8 LYS HD2 H 2.312 -5.039 -4.226 1.00 . A A . 8 LYS HD2 1 1 4 820 1 1 8 LYS HD3 H 3.643 -3.998 -3.716 1.00 . A A . 8 LYS HD3 1 1 4 821 1 1 8 LYS HE2 H 3.848 -5.025 -1.681 1.00 . A A . 8 LYS HE2 1 1 4 822 1 1 8 LYS HE3 H 2.149 -5.495 -1.626 1.00 . A A . 8 LYS HE3 1 1 4 823 1 1 8 LYS HG2 H 1.060 -3.810 -2.252 1.00 . A A . 8 LYS HG2 1 1 4 824 1 1 8 LYS HG3 H 1.162 -3.097 -3.863 1.00 . A A . 8 LYS HG3 1 1 4 825 1 1 8 LYS HZ1 H 3.394 -7.456 -1.947 1.00 . A A . 8 LYS HZ1 1 1 4 826 1 1 8 LYS HZ2 H 2.694 -7.106 -3.447 1.00 . A A . 8 LYS HZ2 1 1 4 827 1 1 8 LYS HZ3 H 4.329 -6.769 -3.177 1.00 . A A . 8 LYS HZ3 1 1 4 828 1 1 8 LYS N N 1.462 -2.142 -0.159 1.00 . A A . 8 LYS N 1 1 4 829 1 1 8 LYS NZ N 3.385 -6.784 -2.741 1.00 . A A . 8 LYS NZ 1 1 4 830 1 1 8 LYS O O 4.923 -1.519 -0.437 1.00 . A A . 8 LYS O 1 1 4 831 1 1 9 ALA C C 4.587 0.855 1.661 1.00 . A A . 9 ALA C 1 1 4 832 1 1 9 ALA CA C 4.117 1.048 0.224 1.00 . A A . 9 ALA CA 1 1 4 833 1 1 9 ALA CB C 3.401 2.384 0.075 1.00 . A A . 9 ALA CB 1 1 4 834 1 1 9 ALA H H 2.279 0.117 -0.256 1.00 . A A . 9 ALA H 1 1 4 835 1 1 9 ALA HA H 4.978 1.055 -0.428 1.00 . A A . 9 ALA HA 1 1 4 836 1 1 9 ALA HB1 H 3.696 3.042 0.881 1.00 . A A . 9 ALA HB1 1 1 4 837 1 1 9 ALA HB2 H 3.668 2.832 -0.872 1.00 . A A . 9 ALA HB2 1 1 4 838 1 1 9 ALA HB3 H 2.335 2.226 0.111 1.00 . A A . 9 ALA HB3 1 1 4 839 1 1 9 ALA N N 3.244 -0.041 -0.194 1.00 . A A . 9 ALA N 1 1 4 840 1 1 9 ALA O O 5.729 1.167 1.999 1.00 . A A . 9 ALA O 1 1 4 841 1 1 10 ASP C C 5.179 -0.883 4.039 1.00 . A A . 10 ASP C 1 1 4 842 1 1 10 ASP CA C 4.023 0.104 3.906 1.00 . A A . 10 ASP CA 1 1 4 843 1 1 10 ASP CB C 2.797 -0.424 4.655 1.00 . A A . 10 ASP CB 1 1 4 844 1 1 10 ASP CG C 3.109 -0.784 6.094 1.00 . A A . 10 ASP CG 1 1 4 845 1 1 10 ASP H H 2.804 0.111 2.176 1.00 . A A . 10 ASP H 1 1 4 846 1 1 10 ASP HA H 4.321 1.046 4.342 1.00 . A A . 10 ASP HA 1 1 4 847 1 1 10 ASP HB2 H 2.028 0.335 4.651 1.00 . A A . 10 ASP HB2 1 1 4 848 1 1 10 ASP HB3 H 2.430 -1.305 4.152 1.00 . A A . 10 ASP HB3 1 1 4 849 1 1 10 ASP N N 3.699 0.339 2.504 1.00 . A A . 10 ASP N 1 1 4 850 1 1 10 ASP O O 6.199 -0.582 4.658 1.00 . A A . 10 ASP O 1 1 4 851 1 1 10 ASP OD1 O 3.820 -0.004 6.760 1.00 . A A . 10 ASP OD1 1 1 4 852 1 1 10 ASP OD2 O 2.639 -1.847 6.554 1.00 . A A . 10 ASP OD2 1 1 4 853 1 1 11 VAL C C 7.382 -2.561 3.019 1.00 . A A . 11 VAL C 1 1 4 854 1 1 11 VAL CA C 6.039 -3.096 3.505 1.00 . A A . 11 VAL CA 1 1 4 855 1 1 11 VAL CB C 5.650 -4.321 2.656 1.00 . A A . 11 VAL CB 1 1 4 856 1 1 11 VAL CG1 C 4.492 -5.071 3.297 1.00 . A A . 11 VAL CG1 1 1 4 857 1 1 11 VAL CG2 C 5.300 -3.895 1.238 1.00 . A A . 11 VAL CG2 1 1 4 858 1 1 11 VAL H H 4.175 -2.246 2.975 1.00 . A A . 11 VAL H 1 1 4 859 1 1 11 VAL HA H 6.141 -3.416 4.533 1.00 . A A . 11 VAL HA 1 1 4 860 1 1 11 VAL HB H 6.499 -4.987 2.610 1.00 . A A . 11 VAL HB 1 1 4 861 1 1 11 VAL HG11 H 3.678 -5.148 2.591 1.00 . A A . 11 VAL HG11 1 1 4 862 1 1 11 VAL HG12 H 4.817 -6.060 3.582 1.00 . A A . 11 VAL HG12 1 1 4 863 1 1 11 VAL HG13 H 4.158 -4.535 4.174 1.00 . A A . 11 VAL HG13 1 1 4 864 1 1 11 VAL HG21 H 4.938 -4.749 0.685 1.00 . A A . 11 VAL HG21 1 1 4 865 1 1 11 VAL HG22 H 4.533 -3.135 1.269 1.00 . A A . 11 VAL HG22 1 1 4 866 1 1 11 VAL HG23 H 6.180 -3.499 0.753 1.00 . A A . 11 VAL HG23 1 1 4 867 1 1 11 VAL N N 5.011 -2.065 3.453 1.00 . A A . 11 VAL N 1 1 4 868 1 1 11 VAL O O 8.430 -2.899 3.565 1.00 . A A . 11 VAL O 1 1 4 869 1 1 12 ALA C C 9.376 -0.445 2.513 1.00 . A A . 12 ALA C 1 1 4 870 1 1 12 ALA CA C 8.551 -1.136 1.432 1.00 . A A . 12 ALA CA 1 1 4 871 1 1 12 ALA CB C 8.200 -0.152 0.324 1.00 . A A . 12 ALA CB 1 1 4 872 1 1 12 ALA H H 6.471 -1.490 1.597 1.00 . A A . 12 ALA H 1 1 4 873 1 1 12 ALA HA H 9.139 -1.933 0.999 1.00 . A A . 12 ALA HA 1 1 4 874 1 1 12 ALA HB1 H 8.285 -0.643 -0.633 1.00 . A A . 12 ALA HB1 1 1 4 875 1 1 12 ALA HB2 H 7.189 0.198 0.462 1.00 . A A . 12 ALA HB2 1 1 4 876 1 1 12 ALA HB3 H 8.881 0.687 0.359 1.00 . A A . 12 ALA HB3 1 1 4 877 1 1 12 ALA N N 7.339 -1.721 1.991 1.00 . A A . 12 ALA N 1 1 4 878 1 1 12 ALA O O 8.885 0.441 3.212 1.00 . A A . 12 ALA O 1 1 4 879 1 1 13 LEU C C 10.891 -0.318 5.030 1.00 . A A . 13 LEU C 1 1 4 880 1 1 13 LEU CA C 11.526 -0.281 3.644 1.00 . A A . 13 LEU CA 1 1 4 881 1 1 13 LEU CB C 11.876 1.161 3.270 1.00 . A A . 13 LEU CB 1 1 4 882 1 1 13 LEU CD1 C 12.869 2.825 1.680 1.00 . A A . 13 LEU CD1 1 1 4 883 1 1 13 LEU CD2 C 13.817 0.515 1.820 1.00 . A A . 13 LEU CD2 1 1 4 884 1 1 13 LEU CG C 12.553 1.356 1.912 1.00 . A A . 13 LEU CG 1 1 4 885 1 1 13 LEU H H 10.967 -1.569 2.060 1.00 . A A . 13 LEU H 1 1 4 886 1 1 13 LEU HA H 12.430 -0.870 3.659 1.00 . A A . 13 LEU HA 1 1 4 887 1 1 13 LEU HB2 H 10.961 1.733 3.268 1.00 . A A . 13 LEU HB2 1 1 4 888 1 1 13 LEU HB3 H 12.540 1.547 4.029 1.00 . A A . 13 LEU HB3 1 1 4 889 1 1 13 LEU HD11 H 12.060 3.286 1.135 1.00 . A A . 13 LEU HD11 1 1 4 890 1 1 13 LEU HD12 H 12.992 3.321 2.631 1.00 . A A . 13 LEU HD12 1 1 4 891 1 1 13 LEU HD13 H 13.783 2.911 1.109 1.00 . A A . 13 LEU HD13 1 1 4 892 1 1 13 LEU HD21 H 14.415 0.664 2.708 1.00 . A A . 13 LEU HD21 1 1 4 893 1 1 13 LEU HD22 H 13.550 -0.528 1.738 1.00 . A A . 13 LEU HD22 1 1 4 894 1 1 13 LEU HD23 H 14.384 0.810 0.950 1.00 . A A . 13 LEU HD23 1 1 4 895 1 1 13 LEU HG H 11.879 1.033 1.130 1.00 . A A . 13 LEU HG 1 1 4 896 1 1 13 LEU N N 10.631 -0.859 2.646 1.00 . A A . 13 LEU N 1 1 4 897 1 1 13 LEU O O 10.973 0.648 5.787 1.00 . A A . 13 LEU O 1 1 4 898 1 1 14 NH2 HN1 H 10.229 -2.177 4.710 1.00 . A A . 14 NH2 HN1 1 1 4 899 1 1 14 NH2 HN2 H 9.818 -1.554 6.246 1.00 . A A . 14 NH2 HN2 1 1 4 900 1 1 14 NH2 N N 10.260 -1.441 5.356 1.00 . A A . 14 NH2 N 1 1 5 901 1 1 1 ILE C C -6.087 0.478 -3.850 1.00 . A A . 1 ILE C 1 1 5 902 1 1 1 ILE CA C -6.918 -0.219 -4.923 1.00 . A A . 1 ILE CA 1 1 5 903 1 1 1 ILE CB C -5.973 -0.809 -5.986 1.00 . A A . 1 ILE CB 1 1 5 904 1 1 1 ILE CD1 C -4.068 -0.158 -7.543 1.00 . A A . 1 ILE CD1 1 1 5 905 1 1 1 ILE CG1 C -5.269 0.312 -6.753 1.00 . A A . 1 ILE CG1 1 1 5 906 1 1 1 ILE CG2 C -6.745 -1.708 -6.941 1.00 . A A . 1 ILE CG2 1 1 5 907 1 1 1 ILE H1 H -8.404 0.404 -6.293 1.00 . A A . 1 ILE H1 1 1 5 908 1 1 1 ILE HA H -7.467 -1.031 -4.466 1.00 . A A . 1 ILE HA 1 1 5 909 1 1 1 ILE HB H -5.233 -1.413 -5.483 1.00 . A A . 1 ILE HB 1 1 5 910 1 1 1 ILE HD11 H -3.174 -0.024 -6.953 1.00 . A A . 1 ILE HD11 1 1 5 911 1 1 1 ILE HD12 H -4.185 -1.204 -7.787 1.00 . A A . 1 ILE HD12 1 1 5 912 1 1 1 ILE HD13 H -3.988 0.417 -8.453 1.00 . A A . 1 ILE HD13 1 1 5 913 1 1 1 ILE HG12 H -5.965 0.759 -7.444 1.00 . A A . 1 ILE HG12 1 1 5 914 1 1 1 ILE HG13 H -4.933 1.061 -6.052 1.00 . A A . 1 ILE HG13 1 1 5 915 1 1 1 ILE HG21 H -6.103 -2.505 -7.284 1.00 . A A . 1 ILE HG21 1 1 5 916 1 1 1 ILE HG22 H -7.598 -2.127 -6.428 1.00 . A A . 1 ILE HG22 1 1 5 917 1 1 1 ILE HG23 H -7.083 -1.127 -7.787 1.00 . A A . 1 ILE HG23 1 1 5 918 1 1 1 ILE N N -7.883 0.696 -5.518 1.00 . A A . 1 ILE N 1 1 5 919 1 1 1 ILE O O -4.867 0.320 -3.796 1.00 . A A . 1 ILE O 1 1 5 920 1 1 2 PHE C C -5.523 0.998 -0.886 1.00 . A A . 2 PHE C 1 1 5 921 1 1 2 PHE CA C -6.080 1.966 -1.926 1.00 . A A . 2 PHE CA 1 1 5 922 1 1 2 PHE CB C -7.043 2.950 -1.258 1.00 . A A . 2 PHE CB 1 1 5 923 1 1 2 PHE CD1 C -8.758 4.126 -2.661 1.00 . A A . 2 PHE CD1 1 1 5 924 1 1 2 PHE CD2 C -6.580 5.083 -2.497 1.00 . A A . 2 PHE CD2 1 1 5 925 1 1 2 PHE CE1 C -9.153 5.159 -3.490 1.00 . A A . 2 PHE CE1 1 1 5 926 1 1 2 PHE CE2 C -6.971 6.119 -3.324 1.00 . A A . 2 PHE CE2 1 1 5 927 1 1 2 PHE CG C -7.468 4.075 -2.157 1.00 . A A . 2 PHE CG 1 1 5 928 1 1 2 PHE CZ C -8.258 6.158 -3.821 1.00 . A A . 2 PHE CZ 1 1 5 929 1 1 2 PHE H H -7.728 1.331 -3.091 1.00 . A A . 2 PHE H 1 1 5 930 1 1 2 PHE HA H -5.261 2.517 -2.361 1.00 . A A . 2 PHE HA 1 1 5 931 1 1 2 PHE HB2 H -7.929 2.420 -0.947 1.00 . A A . 2 PHE HB2 1 1 5 932 1 1 2 PHE HB3 H -6.562 3.380 -0.391 1.00 . A A . 2 PHE HB3 1 1 5 933 1 1 2 PHE HD1 H -9.459 3.345 -2.402 1.00 . A A . 2 PHE HD1 1 1 5 934 1 1 2 PHE HD2 H -5.572 5.055 -2.110 1.00 . A A . 2 PHE HD2 1 1 5 935 1 1 2 PHE HE1 H -10.162 5.186 -3.877 1.00 . A A . 2 PHE HE1 1 1 5 936 1 1 2 PHE HE2 H -6.269 6.897 -3.583 1.00 . A A . 2 PHE HE2 1 1 5 937 1 1 2 PHE HZ H -8.566 6.966 -4.468 1.00 . A A . 2 PHE HZ 1 1 5 938 1 1 2 PHE N N -6.756 1.246 -2.998 1.00 . A A . 2 PHE N 1 1 5 939 1 1 2 PHE O O -4.350 1.073 -0.517 1.00 . A A . 2 PHE O 1 1 5 940 1 1 3 TRP C C -4.704 -1.630 0.135 1.00 . A A . 3 TRP C 1 1 5 941 1 1 3 TRP CA C -5.964 -0.894 0.579 1.00 . A A . 3 TRP CA 1 1 5 942 1 1 3 TRP CB C -7.094 -1.895 0.827 1.00 . A A . 3 TRP CB 1 1 5 943 1 1 3 TRP CD1 C -9.216 -0.477 1.056 1.00 . A A . 3 TRP CD1 1 1 5 944 1 1 3 TRP CD2 C -8.584 -1.500 2.946 1.00 . A A . 3 TRP CD2 1 1 5 945 1 1 3 TRP CE2 C -9.753 -0.759 3.206 1.00 . A A . 3 TRP CE2 1 1 5 946 1 1 3 TRP CE3 C -8.003 -2.228 3.988 1.00 . A A . 3 TRP CE3 1 1 5 947 1 1 3 TRP CG C -8.258 -1.306 1.566 1.00 . A A . 3 TRP CG 1 1 5 948 1 1 3 TRP CH2 C -9.761 -1.450 5.464 1.00 . A A . 3 TRP CH2 1 1 5 949 1 1 3 TRP CZ2 C -10.350 -0.726 4.463 1.00 . A A . 3 TRP CZ2 1 1 5 950 1 1 3 TRP CZ3 C -8.597 -2.195 5.235 1.00 . A A . 3 TRP CZ3 1 1 5 951 1 1 3 TRP H H -7.293 0.079 -0.751 1.00 . A A . 3 TRP H 1 1 5 952 1 1 3 TRP HA H -5.755 -0.366 1.497 1.00 . A A . 3 TRP HA 1 1 5 953 1 1 3 TRP HB2 H -7.453 -2.267 -0.121 1.00 . A A . 3 TRP HB2 1 1 5 954 1 1 3 TRP HB3 H -6.712 -2.720 1.411 1.00 . A A . 3 TRP HB3 1 1 5 955 1 1 3 TRP HD1 H -9.246 -0.140 0.031 1.00 . A A . 3 TRP HD1 1 1 5 956 1 1 3 TRP HE1 H -10.898 0.439 1.919 1.00 . A A . 3 TRP HE1 1 1 5 957 1 1 3 TRP HE3 H -7.106 -2.809 3.830 1.00 . A A . 3 TRP HE3 1 1 5 958 1 1 3 TRP HH2 H -10.189 -1.452 6.455 1.00 . A A . 3 TRP HH2 1 1 5 959 1 1 3 TRP HZ2 H -11.248 -0.157 4.655 1.00 . A A . 3 TRP HZ2 1 1 5 960 1 1 3 TRP HZ3 H -8.162 -2.751 6.051 1.00 . A A . 3 TRP HZ3 1 1 5 961 1 1 3 TRP N N -6.372 0.090 -0.419 1.00 . A A . 3 TRP N 1 1 5 962 1 1 3 TRP NE1 N -10.117 -0.143 2.037 1.00 . A A . 3 TRP NE1 1 1 5 963 1 1 3 TRP O O -3.763 -1.794 0.912 1.00 . A A . 3 TRP O 1 1 5 964 1 1 4 LEU C C -2.371 -1.847 -1.896 1.00 . A A . 4 LEU C 1 1 5 965 1 1 4 LEU CA C -3.547 -2.791 -1.665 1.00 . A A . 4 LEU CA 1 1 5 966 1 1 4 LEU CB C -3.930 -3.478 -2.977 1.00 . A A . 4 LEU CB 1 1 5 967 1 1 4 LEU CD1 C -1.970 -5.039 -3.050 1.00 . A A . 4 LEU CD1 1 1 5 968 1 1 4 LEU CD2 C -3.286 -4.588 -5.130 1.00 . A A . 4 LEU CD2 1 1 5 969 1 1 4 LEU CG C -2.770 -4.002 -3.822 1.00 . A A . 4 LEU CG 1 1 5 970 1 1 4 LEU H H -5.471 -1.910 -1.689 1.00 . A A . 4 LEU H 1 1 5 971 1 1 4 LEU HA H -3.253 -3.541 -0.946 1.00 . A A . 4 LEU HA 1 1 5 972 1 1 4 LEU HB2 H -4.568 -4.314 -2.737 1.00 . A A . 4 LEU HB2 1 1 5 973 1 1 4 LEU HB3 H -4.482 -2.765 -3.573 1.00 . A A . 4 LEU HB3 1 1 5 974 1 1 4 LEU HD11 H -1.857 -5.929 -3.653 1.00 . A A . 4 LEU HD11 1 1 5 975 1 1 4 LEU HD12 H -0.996 -4.639 -2.812 1.00 . A A . 4 LEU HD12 1 1 5 976 1 1 4 LEU HD13 H -2.491 -5.289 -2.137 1.00 . A A . 4 LEU HD13 1 1 5 977 1 1 4 LEU HD21 H -3.950 -5.412 -4.917 1.00 . A A . 4 LEU HD21 1 1 5 978 1 1 4 LEU HD22 H -3.819 -3.827 -5.679 1.00 . A A . 4 LEU HD22 1 1 5 979 1 1 4 LEU HD23 H -2.452 -4.940 -5.719 1.00 . A A . 4 LEU HD23 1 1 5 980 1 1 4 LEU HG H -2.107 -3.181 -4.062 1.00 . A A . 4 LEU HG 1 1 5 981 1 1 4 LEU N N -4.693 -2.071 -1.117 1.00 . A A . 4 LEU N 1 1 5 982 1 1 4 LEU O O -1.229 -2.172 -1.577 1.00 . A A . 4 LEU O 1 1 5 983 1 1 5 PHE C C -0.834 0.638 -1.464 1.00 . A A . 5 PHE C 1 1 5 984 1 1 5 PHE CA C -1.630 0.319 -2.726 1.00 . A A . 5 PHE CA 1 1 5 985 1 1 5 PHE CB C -2.257 1.597 -3.283 1.00 . A A . 5 PHE CB 1 1 5 986 1 1 5 PHE CD1 C -0.548 2.782 -4.690 1.00 . A A . 5 PHE CD1 1 1 5 987 1 1 5 PHE CD2 C -1.049 3.666 -2.534 1.00 . A A . 5 PHE CD2 1 1 5 988 1 1 5 PHE CE1 C 0.364 3.798 -4.900 1.00 . A A . 5 PHE CE1 1 1 5 989 1 1 5 PHE CE2 C -0.138 4.684 -2.737 1.00 . A A . 5 PHE CE2 1 1 5 990 1 1 5 PHE CG C -1.265 2.703 -3.507 1.00 . A A . 5 PHE CG 1 1 5 991 1 1 5 PHE CZ C 0.570 4.751 -3.921 1.00 . A A . 5 PHE CZ 1 1 5 992 1 1 5 PHE H H -3.593 -0.472 -2.684 1.00 . A A . 5 PHE H 1 1 5 993 1 1 5 PHE HA H -0.960 -0.095 -3.463 1.00 . A A . 5 PHE HA 1 1 5 994 1 1 5 PHE HB2 H -2.725 1.377 -4.231 1.00 . A A . 5 PHE HB2 1 1 5 995 1 1 5 PHE HB3 H -3.004 1.955 -2.592 1.00 . A A . 5 PHE HB3 1 1 5 996 1 1 5 PHE HD1 H -0.709 2.036 -5.457 1.00 . A A . 5 PHE HD1 1 1 5 997 1 1 5 PHE HD2 H -1.602 3.614 -1.607 1.00 . A A . 5 PHE HD2 1 1 5 998 1 1 5 PHE HE1 H 0.916 3.846 -5.826 1.00 . A A . 5 PHE HE1 1 1 5 999 1 1 5 PHE HE2 H 0.021 5.427 -1.969 1.00 . A A . 5 PHE HE2 1 1 5 1000 1 1 5 PHE HZ H 1.282 5.546 -4.082 1.00 . A A . 5 PHE HZ 1 1 5 1001 1 1 5 PHE N N -2.661 -0.673 -2.452 1.00 . A A . 5 PHE N 1 1 5 1002 1 1 5 PHE O O 0.393 0.539 -1.448 1.00 . A A . 5 PHE O 1 1 5 1003 1 1 6 ARG C C -0.018 0.213 1.344 1.00 . A A . 6 ARG C 1 1 5 1004 1 1 6 ARG CA C -0.903 1.358 0.860 1.00 . A A . 6 ARG CA 1 1 5 1005 1 1 6 ARG CB C -1.959 1.682 1.919 1.00 . A A . 6 ARG CB 1 1 5 1006 1 1 6 ARG CD C -0.463 3.113 3.344 1.00 . A A . 6 ARG CD 1 1 5 1007 1 1 6 ARG CG C -1.383 1.901 3.306 1.00 . A A . 6 ARG CG 1 1 5 1008 1 1 6 ARG CZ C -0.354 3.678 5.734 1.00 . A A . 6 ARG CZ 1 1 5 1009 1 1 6 ARG H H -2.518 1.082 -0.480 1.00 . A A . 6 ARG H 1 1 5 1010 1 1 6 ARG HA H -0.287 2.231 0.700 1.00 . A A . 6 ARG HA 1 1 5 1011 1 1 6 ARG HB2 H -2.483 2.579 1.624 1.00 . A A . 6 ARG HB2 1 1 5 1012 1 1 6 ARG HB3 H -2.662 0.864 1.969 1.00 . A A . 6 ARG HB3 1 1 5 1013 1 1 6 ARG HD2 H 0.271 3.016 2.557 1.00 . A A . 6 ARG HD2 1 1 5 1014 1 1 6 ARG HD3 H -1.055 4.001 3.176 1.00 . A A . 6 ARG HD3 1 1 5 1015 1 1 6 ARG HE H 1.172 2.981 4.656 1.00 . A A . 6 ARG HE 1 1 5 1016 1 1 6 ARG HG2 H -2.193 2.058 4.003 1.00 . A A . 6 ARG HG2 1 1 5 1017 1 1 6 ARG HG3 H -0.821 1.026 3.596 1.00 . A A . 6 ARG HG3 1 1 5 1018 1 1 6 ARG HH11 H -2.158 3.969 4.873 1.00 . A A . 6 ARG HH11 1 1 5 1019 1 1 6 ARG HH12 H -2.068 4.363 6.558 1.00 . A A . 6 ARG HH12 1 1 5 1020 1 1 6 ARG HH21 H 1.305 3.495 6.876 1.00 . A A . 6 ARG HH21 1 1 5 1021 1 1 6 ARG HH22 H -0.098 4.094 7.696 1.00 . A A . 6 ARG HH22 1 1 5 1022 1 1 6 ARG N N -1.541 1.023 -0.406 1.00 . A A . 6 ARG N 1 1 5 1023 1 1 6 ARG NE N 0.228 3.237 4.624 1.00 . A A . 6 ARG NE 1 1 5 1024 1 1 6 ARG NH1 N -1.632 4.034 5.720 1.00 . A A . 6 ARG NH1 1 1 5 1025 1 1 6 ARG NH2 N 0.342 3.763 6.861 1.00 . A A . 6 ARG NH2 1 1 5 1026 1 1 6 ARG O O 1.058 0.437 1.896 1.00 . A A . 6 ARG O 1 1 5 1027 1 1 7 GLY C C 1.702 -2.163 1.017 1.00 . A A . 7 GLY C 1 1 5 1028 1 1 7 GLY CA C 0.283 -2.177 1.551 1.00 . A A . 7 GLY CA 1 1 5 1029 1 1 7 GLY H H -1.344 -1.134 0.685 1.00 . A A . 7 GLY H 1 1 5 1030 1 1 7 GLY HA2 H 0.314 -2.201 2.630 1.00 . A A . 7 GLY HA2 1 1 5 1031 1 1 7 GLY HA3 H -0.215 -3.067 1.194 1.00 . A A . 7 GLY HA3 1 1 5 1032 1 1 7 GLY N N -0.479 -1.015 1.130 1.00 . A A . 7 GLY N 1 1 5 1033 1 1 7 GLY O O 2.661 -2.273 1.781 1.00 . A A . 7 GLY O 1 1 5 1034 1 1 8 LYS C C 4.028 -0.918 -0.321 1.00 . A A . 8 LYS C 1 1 5 1035 1 1 8 LYS CA C 3.148 -2.003 -0.933 1.00 . A A . 8 LYS CA 1 1 5 1036 1 1 8 LYS CB C 3.005 -1.768 -2.438 1.00 . A A . 8 LYS CB 1 1 5 1037 1 1 8 LYS CD C 5.346 -1.297 -3.214 1.00 . A A . 8 LYS CD 1 1 5 1038 1 1 8 LYS CE C 6.180 -1.377 -4.484 1.00 . A A . 8 LYS CE 1 1 5 1039 1 1 8 LYS CG C 4.184 -2.275 -3.249 1.00 . A A . 8 LYS CG 1 1 5 1040 1 1 8 LYS H H 1.034 -1.947 -0.855 1.00 . A A . 8 LYS H 1 1 5 1041 1 1 8 LYS HA H 3.617 -2.963 -0.770 1.00 . A A . 8 LYS HA 1 1 5 1042 1 1 8 LYS HB2 H 2.113 -2.271 -2.786 1.00 . A A . 8 LYS HB2 1 1 5 1043 1 1 8 LYS HB3 H 2.902 -0.708 -2.618 1.00 . A A . 8 LYS HB3 1 1 5 1044 1 1 8 LYS HD2 H 4.959 -0.295 -3.114 1.00 . A A . 8 LYS HD2 1 1 5 1045 1 1 8 LYS HD3 H 5.975 -1.531 -2.367 1.00 . A A . 8 LYS HD3 1 1 5 1046 1 1 8 LYS HE2 H 6.917 -2.156 -4.367 1.00 . A A . 8 LYS HE2 1 1 5 1047 1 1 8 LYS HE3 H 5.529 -1.619 -5.312 1.00 . A A . 8 LYS HE3 1 1 5 1048 1 1 8 LYS HG2 H 4.510 -3.221 -2.842 1.00 . A A . 8 LYS HG2 1 1 5 1049 1 1 8 LYS HG3 H 3.871 -2.413 -4.276 1.00 . A A . 8 LYS HG3 1 1 5 1050 1 1 8 LYS HZ1 H 6.993 0.027 -5.800 1.00 . A A . 8 LYS HZ1 1 1 5 1051 1 1 8 LYS HZ2 H 6.317 0.706 -4.406 1.00 . A A . 8 LYS HZ2 1 1 5 1052 1 1 8 LYS HZ3 H 7.811 -0.083 -4.323 1.00 . A A . 8 LYS HZ3 1 1 5 1053 1 1 8 LYS N N 1.837 -2.030 -0.297 1.00 . A A . 8 LYS N 1 1 5 1054 1 1 8 LYS NZ N 6.875 -0.092 -4.773 1.00 . A A . 8 LYS NZ 1 1 5 1055 1 1 8 LYS O O 5.218 -1.128 -0.090 1.00 . A A . 8 LYS O 1 1 5 1056 1 1 9 ALA C C 4.616 1.030 1.948 1.00 . A A . 9 ALA C 1 1 5 1057 1 1 9 ALA CA C 4.162 1.359 0.530 1.00 . A A . 9 ALA CA 1 1 5 1058 1 1 9 ALA CB C 3.300 2.611 0.526 1.00 . A A . 9 ALA CB 1 1 5 1059 1 1 9 ALA H H 2.481 0.348 -0.266 1.00 . A A . 9 ALA H 1 1 5 1060 1 1 9 ALA HA H 5.032 1.549 -0.082 1.00 . A A . 9 ALA HA 1 1 5 1061 1 1 9 ALA HB1 H 2.880 2.758 -0.458 1.00 . A A . 9 ALA HB1 1 1 5 1062 1 1 9 ALA HB2 H 2.501 2.502 1.245 1.00 . A A . 9 ALA HB2 1 1 5 1063 1 1 9 ALA HB3 H 3.905 3.467 0.789 1.00 . A A . 9 ALA HB3 1 1 5 1064 1 1 9 ALA N N 3.433 0.241 -0.060 1.00 . A A . 9 ALA N 1 1 5 1065 1 1 9 ALA O O 5.702 1.427 2.369 1.00 . A A . 9 ALA O 1 1 5 1066 1 1 10 ASP C C 5.289 -1.022 4.092 1.00 . A A . 10 ASP C 1 1 5 1067 1 1 10 ASP CA C 4.093 -0.076 4.052 1.00 . A A . 10 ASP CA 1 1 5 1068 1 1 10 ASP CB C 2.883 -0.737 4.712 1.00 . A A . 10 ASP CB 1 1 5 1069 1 1 10 ASP CG C 3.169 -1.183 6.131 1.00 . A A . 10 ASP CG 1 1 5 1070 1 1 10 ASP H H 2.926 0.019 2.288 1.00 . A A . 10 ASP H 1 1 5 1071 1 1 10 ASP HA H 4.343 0.822 4.597 1.00 . A A . 10 ASP HA 1 1 5 1072 1 1 10 ASP HB2 H 2.063 -0.032 4.735 1.00 . A A . 10 ASP HB2 1 1 5 1073 1 1 10 ASP HB3 H 2.592 -1.601 4.132 1.00 . A A . 10 ASP HB3 1 1 5 1074 1 1 10 ASP N N 3.777 0.306 2.680 1.00 . A A . 10 ASP N 1 1 5 1075 1 1 10 ASP O O 6.291 -0.746 4.750 1.00 . A A . 10 ASP O 1 1 5 1076 1 1 10 ASP OD1 O 2.975 -0.370 7.059 1.00 . A A . 10 ASP OD1 1 1 5 1077 1 1 10 ASP OD2 O 3.587 -2.346 6.316 1.00 . A A . 10 ASP OD2 1 1 5 1078 1 1 11 VAL C C 7.542 -2.511 2.817 1.00 . A A . 11 VAL C 1 1 5 1079 1 1 11 VAL CA C 6.247 -3.129 3.334 1.00 . A A . 11 VAL CA 1 1 5 1080 1 1 11 VAL CB C 5.869 -4.324 2.440 1.00 . A A . 11 VAL CB 1 1 5 1081 1 1 11 VAL CG1 C 4.726 -5.113 3.059 1.00 . A A . 11 VAL CG1 1 1 5 1082 1 1 11 VAL CG2 C 5.505 -3.850 1.042 1.00 . A A . 11 VAL CG2 1 1 5 1083 1 1 11 VAL H H 4.353 -2.304 2.876 1.00 . A A . 11 VAL H 1 1 5 1084 1 1 11 VAL HA H 6.409 -3.493 4.338 1.00 . A A . 11 VAL HA 1 1 5 1085 1 1 11 VAL HB H 6.727 -4.977 2.365 1.00 . A A . 11 VAL HB 1 1 5 1086 1 1 11 VAL HG11 H 5.104 -6.042 3.460 1.00 . A A . 11 VAL HG11 1 1 5 1087 1 1 11 VAL HG12 H 4.277 -4.534 3.854 1.00 . A A . 11 VAL HG12 1 1 5 1088 1 1 11 VAL HG13 H 3.982 -5.323 2.303 1.00 . A A . 11 VAL HG13 1 1 5 1089 1 1 11 VAL HG21 H 5.108 -4.677 0.473 1.00 . A A . 11 VAL HG21 1 1 5 1090 1 1 11 VAL HG22 H 4.763 -3.069 1.109 1.00 . A A . 11 VAL HG22 1 1 5 1091 1 1 11 VAL HG23 H 6.388 -3.467 0.550 1.00 . A A . 11 VAL HG23 1 1 5 1092 1 1 11 VAL N N 5.176 -2.140 3.381 1.00 . A A . 11 VAL N 1 1 5 1093 1 1 11 VAL O O 8.632 -2.852 3.277 1.00 . A A . 11 VAL O 1 1 5 1094 1 1 12 ALA C C 8.274 0.534 0.987 1.00 . A A . 12 ALA C 1 1 5 1095 1 1 12 ALA CA C 8.575 -0.931 1.281 1.00 . A A . 12 ALA CA 1 1 5 1096 1 1 12 ALA CB C 9.018 -1.647 0.013 1.00 . A A . 12 ALA CB 1 1 5 1097 1 1 12 ALA H H 6.520 -1.368 1.535 1.00 . A A . 12 ALA H 1 1 5 1098 1 1 12 ALA HA H 9.382 -0.986 1.997 1.00 . A A . 12 ALA HA 1 1 5 1099 1 1 12 ALA HB1 H 8.324 -2.443 -0.211 1.00 . A A . 12 ALA HB1 1 1 5 1100 1 1 12 ALA HB2 H 9.039 -0.945 -0.808 1.00 . A A . 12 ALA HB2 1 1 5 1101 1 1 12 ALA HB3 H 10.005 -2.060 0.160 1.00 . A A . 12 ALA HB3 1 1 5 1102 1 1 12 ALA N N 7.415 -1.598 1.860 1.00 . A A . 12 ALA N 1 1 5 1103 1 1 12 ALA O O 7.300 0.854 0.301 1.00 . A A . 12 ALA O 1 1 5 1104 1 1 13 LEU C C 9.331 3.254 -0.119 1.00 . A A . 13 LEU C 1 1 5 1105 1 1 13 LEU CA C 8.937 2.856 1.299 1.00 . A A . 13 LEU CA 1 1 5 1106 1 1 13 LEU CB C 9.770 3.644 2.312 1.00 . A A . 13 LEU CB 1 1 5 1107 1 1 13 LEU CD1 C 11.741 4.733 1.211 1.00 . A A . 13 LEU CD1 1 1 5 1108 1 1 13 LEU CD2 C 12.000 3.662 3.457 1.00 . A A . 13 LEU CD2 1 1 5 1109 1 1 13 LEU CG C 11.285 3.598 2.115 1.00 . A A . 13 LEU CG 1 1 5 1110 1 1 13 LEU H H 9.870 1.107 2.043 1.00 . A A . 13 LEU H 1 1 5 1111 1 1 13 LEU HA H 7.893 3.085 1.448 1.00 . A A . 13 LEU HA 1 1 5 1112 1 1 13 LEU HB2 H 9.462 4.676 2.261 1.00 . A A . 13 LEU HB2 1 1 5 1113 1 1 13 LEU HB3 H 9.551 3.252 3.295 1.00 . A A . 13 LEU HB3 1 1 5 1114 1 1 13 LEU HD11 H 12.230 4.324 0.339 1.00 . A A . 13 LEU HD11 1 1 5 1115 1 1 13 LEU HD12 H 10.885 5.314 0.905 1.00 . A A . 13 LEU HD12 1 1 5 1116 1 1 13 LEU HD13 H 12.432 5.365 1.748 1.00 . A A . 13 LEU HD13 1 1 5 1117 1 1 13 LEU HD21 H 12.933 4.195 3.343 1.00 . A A . 13 LEU HD21 1 1 5 1118 1 1 13 LEU HD22 H 11.376 4.179 4.173 1.00 . A A . 13 LEU HD22 1 1 5 1119 1 1 13 LEU HD23 H 12.197 2.661 3.809 1.00 . A A . 13 LEU HD23 1 1 5 1120 1 1 13 LEU HG H 11.552 2.664 1.638 1.00 . A A . 13 LEU HG 1 1 5 1121 1 1 13 LEU N N 9.114 1.423 1.507 1.00 . A A . 13 LEU N 1 1 5 1122 1 1 13 LEU O O 8.699 4.113 -0.732 1.00 . A A . 13 LEU O 1 1 5 1123 1 1 14 NH2 HN1 H 10.841 1.942 -0.100 1.00 . A A . 14 NH2 HN1 1 1 5 1124 1 1 14 NH2 HN2 H 10.705 2.814 -1.563 1.00 . A A . 14 NH2 HN2 1 1 5 1125 1 1 14 NH2 N N 10.378 2.618 -0.638 1.00 . A A . 14 NH2 N 1 1 6 1126 1 1 1 ILE C C -6.116 0.630 -3.658 1.00 . A A . 1 ILE C 1 1 6 1127 1 1 1 ILE CA C -6.929 -0.003 -4.782 1.00 . A A . 1 ILE CA 1 1 6 1128 1 1 1 ILE CB C -6.988 0.975 -5.970 1.00 . A A . 1 ILE CB 1 1 6 1129 1 1 1 ILE CD1 C -5.499 1.789 -7.867 1.00 . A A . 1 ILE CD1 1 1 6 1130 1 1 1 ILE CG1 C -5.575 1.351 -6.421 1.00 . A A . 1 ILE CG1 1 1 6 1131 1 1 1 ILE CG2 C -7.778 2.220 -5.592 1.00 . A A . 1 ILE CG2 1 1 6 1132 1 1 1 ILE H1 H -8.850 0.325 -3.958 1.00 . A A . 1 ILE H1 1 1 6 1133 1 1 1 ILE HA H -6.430 -0.903 -5.108 1.00 . A A . 1 ILE HA 1 1 6 1134 1 1 1 ILE HB H -7.501 0.487 -6.784 1.00 . A A . 1 ILE HB 1 1 6 1135 1 1 1 ILE HD11 H -6.208 1.222 -8.452 1.00 . A A . 1 ILE HD11 1 1 6 1136 1 1 1 ILE HD12 H -5.732 2.841 -7.938 1.00 . A A . 1 ILE HD12 1 1 6 1137 1 1 1 ILE HD13 H -4.501 1.614 -8.244 1.00 . A A . 1 ILE HD13 1 1 6 1138 1 1 1 ILE HG12 H -5.213 2.164 -5.811 1.00 . A A . 1 ILE HG12 1 1 6 1139 1 1 1 ILE HG13 H -4.927 0.497 -6.297 1.00 . A A . 1 ILE HG13 1 1 6 1140 1 1 1 ILE HG21 H -7.226 2.788 -4.858 1.00 . A A . 1 ILE HG21 1 1 6 1141 1 1 1 ILE HG22 H -7.936 2.827 -6.471 1.00 . A A . 1 ILE HG22 1 1 6 1142 1 1 1 ILE HG23 H -8.732 1.929 -5.178 1.00 . A A . 1 ILE HG23 1 1 6 1143 1 1 1 ILE N N -8.263 -0.369 -4.325 1.00 . A A . 1 ILE N 1 1 6 1144 1 1 1 ILE O O -4.908 0.417 -3.552 1.00 . A A . 1 ILE O 1 1 6 1145 1 1 2 PHE C C -5.463 1.054 -0.775 1.00 . A A . 2 PHE C 1 1 6 1146 1 1 2 PHE CA C -6.129 2.072 -1.696 1.00 . A A . 2 PHE CA 1 1 6 1147 1 1 2 PHE CB C -7.139 2.906 -0.904 1.00 . A A . 2 PHE CB 1 1 6 1148 1 1 2 PHE CD1 C -8.806 3.841 -2.531 1.00 . A A . 2 PHE CD1 1 1 6 1149 1 1 2 PHE CD2 C -7.189 5.321 -1.591 1.00 . A A . 2 PHE CD2 1 1 6 1150 1 1 2 PHE CE1 C -9.344 4.887 -3.257 1.00 . A A . 2 PHE CE1 1 1 6 1151 1 1 2 PHE CE2 C -7.723 6.370 -2.314 1.00 . A A . 2 PHE CE2 1 1 6 1152 1 1 2 PHE CG C -7.723 4.045 -1.691 1.00 . A A . 2 PHE CG 1 1 6 1153 1 1 2 PHE CZ C -8.803 6.153 -3.147 1.00 . A A . 2 PHE CZ 1 1 6 1154 1 1 2 PHE H H -7.751 1.539 -2.949 1.00 . A A . 2 PHE H 1 1 6 1155 1 1 2 PHE HA H -5.372 2.726 -2.099 1.00 . A A . 2 PHE HA 1 1 6 1156 1 1 2 PHE HB2 H -7.952 2.271 -0.589 1.00 . A A . 2 PHE HB2 1 1 6 1157 1 1 2 PHE HB3 H -6.651 3.318 -0.034 1.00 . A A . 2 PHE HB3 1 1 6 1158 1 1 2 PHE HD1 H -9.231 2.852 -2.617 1.00 . A A . 2 PHE HD1 1 1 6 1159 1 1 2 PHE HD2 H -6.343 5.490 -0.939 1.00 . A A . 2 PHE HD2 1 1 6 1160 1 1 2 PHE HE1 H -10.189 4.716 -3.906 1.00 . A A . 2 PHE HE1 1 1 6 1161 1 1 2 PHE HE2 H -7.297 7.358 -2.225 1.00 . A A . 2 PHE HE2 1 1 6 1162 1 1 2 PHE HZ H -9.221 6.973 -3.713 1.00 . A A . 2 PHE HZ 1 1 6 1163 1 1 2 PHE N N -6.788 1.408 -2.815 1.00 . A A . 2 PHE N 1 1 6 1164 1 1 2 PHE O O -4.271 1.152 -0.484 1.00 . A A . 2 PHE O 1 1 6 1165 1 1 3 TRP C C -4.533 -1.671 -0.062 1.00 . A A . 3 TRP C 1 1 6 1166 1 1 3 TRP CA C -5.725 -0.958 0.567 1.00 . A A . 3 TRP CA 1 1 6 1167 1 1 3 TRP CB C -6.824 -1.971 0.895 1.00 . A A . 3 TRP CB 1 1 6 1168 1 1 3 TRP CD1 C -8.637 -2.078 -0.914 1.00 . A A . 3 TRP CD1 1 1 6 1169 1 1 3 TRP CD2 C -7.063 -3.662 -1.092 1.00 . A A . 3 TRP CD2 1 1 6 1170 1 1 3 TRP CE2 C -7.992 -3.831 -2.139 1.00 . A A . 3 TRP CE2 1 1 6 1171 1 1 3 TRP CE3 C -5.982 -4.544 -1.002 1.00 . A A . 3 TRP CE3 1 1 6 1172 1 1 3 TRP CG C -7.495 -2.535 -0.322 1.00 . A A . 3 TRP CG 1 1 6 1173 1 1 3 TRP CH2 C -6.803 -5.696 -2.971 1.00 . A A . 3 TRP CH2 1 1 6 1174 1 1 3 TRP CZ2 C -7.872 -4.847 -3.083 1.00 . A A . 3 TRP CZ2 1 1 6 1175 1 1 3 TRP CZ3 C -5.865 -5.551 -1.940 1.00 . A A . 3 TRP CZ3 1 1 6 1176 1 1 3 TRP H H -7.183 0.053 -0.589 1.00 . A A . 3 TRP H 1 1 6 1177 1 1 3 TRP HA H -5.404 -0.481 1.481 1.00 . A A . 3 TRP HA 1 1 6 1178 1 1 3 TRP HB2 H -6.396 -2.790 1.449 1.00 . A A . 3 TRP HB2 1 1 6 1179 1 1 3 TRP HB3 H -7.580 -1.487 1.498 1.00 . A A . 3 TRP HB3 1 1 6 1180 1 1 3 TRP HD1 H -9.207 -1.231 -0.564 1.00 . A A . 3 TRP HD1 1 1 6 1181 1 1 3 TRP HE1 H -9.714 -2.725 -2.597 1.00 . A A . 3 TRP HE1 1 1 6 1182 1 1 3 TRP HE3 H -5.249 -4.448 -0.215 1.00 . A A . 3 TRP HE3 1 1 6 1183 1 1 3 TRP HH2 H -6.671 -6.496 -3.681 1.00 . A A . 3 TRP HH2 1 1 6 1184 1 1 3 TRP HZ2 H -8.586 -4.971 -3.883 1.00 . A A . 3 TRP HZ2 1 1 6 1185 1 1 3 TRP HZ3 H -5.037 -6.242 -1.887 1.00 . A A . 3 TRP HZ3 1 1 6 1186 1 1 3 TRP N N -6.240 0.078 -0.321 1.00 . A A . 3 TRP N 1 1 6 1187 1 1 3 TRP NE1 N -8.942 -2.854 -2.007 1.00 . A A . 3 TRP NE1 1 1 6 1188 1 1 3 TRP O O -3.583 -2.044 0.630 1.00 . A A . 3 TRP O 1 1 6 1189 1 1 4 LEU C C -2.242 -1.676 -2.093 1.00 . A A . 4 LEU C 1 1 6 1190 1 1 4 LEU CA C -3.508 -2.525 -2.099 1.00 . A A . 4 LEU CA 1 1 6 1191 1 1 4 LEU CB C -3.936 -2.815 -3.538 1.00 . A A . 4 LEU CB 1 1 6 1192 1 1 4 LEU CD1 C -3.988 -4.389 -5.489 1.00 . A A . 4 LEU CD1 1 1 6 1193 1 1 4 LEU CD2 C -1.796 -3.678 -4.517 1.00 . A A . 4 LEU CD2 1 1 6 1194 1 1 4 LEU CG C -3.252 -4.003 -4.216 1.00 . A A . 4 LEU CG 1 1 6 1195 1 1 4 LEU H H -5.367 -1.538 -1.874 1.00 . A A . 4 LEU H 1 1 6 1196 1 1 4 LEU HA H -3.304 -3.459 -1.598 1.00 . A A . 4 LEU HA 1 1 6 1197 1 1 4 LEU HB2 H -4.998 -3.004 -3.536 1.00 . A A . 4 LEU HB2 1 1 6 1198 1 1 4 LEU HB3 H -3.731 -1.933 -4.127 1.00 . A A . 4 LEU HB3 1 1 6 1199 1 1 4 LEU HD11 H -4.693 -5.178 -5.272 1.00 . A A . 4 LEU HD11 1 1 6 1200 1 1 4 LEU HD12 H -4.519 -3.529 -5.873 1.00 . A A . 4 LEU HD12 1 1 6 1201 1 1 4 LEU HD13 H -3.277 -4.731 -6.226 1.00 . A A . 4 LEU HD13 1 1 6 1202 1 1 4 LEU HD21 H -1.668 -2.607 -4.560 1.00 . A A . 4 LEU HD21 1 1 6 1203 1 1 4 LEU HD22 H -1.168 -4.085 -3.739 1.00 . A A . 4 LEU HD22 1 1 6 1204 1 1 4 LEU HD23 H -1.521 -4.112 -5.467 1.00 . A A . 4 LEU HD23 1 1 6 1205 1 1 4 LEU HG H -3.274 -4.852 -3.547 1.00 . A A . 4 LEU HG 1 1 6 1206 1 1 4 LEU N N -4.586 -1.857 -1.377 1.00 . A A . 4 LEU N 1 1 6 1207 1 1 4 LEU O O -1.196 -2.105 -1.607 1.00 . A A . 4 LEU O 1 1 6 1208 1 1 5 PHE C C -0.595 0.640 -1.310 1.00 . A A . 5 PHE C 1 1 6 1209 1 1 5 PHE CA C -1.205 0.444 -2.694 1.00 . A A . 5 PHE CA 1 1 6 1210 1 1 5 PHE CB C -1.636 1.795 -3.270 1.00 . A A . 5 PHE CB 1 1 6 1211 1 1 5 PHE CD1 C 0.104 2.273 -5.014 1.00 . A A . 5 PHE CD1 1 1 6 1212 1 1 5 PHE CD2 C -0.017 3.707 -3.113 1.00 . A A . 5 PHE CD2 1 1 6 1213 1 1 5 PHE CE1 C 1.154 3.018 -5.512 1.00 . A A . 5 PHE CE1 1 1 6 1214 1 1 5 PHE CE2 C 1.033 4.456 -3.606 1.00 . A A . 5 PHE CE2 1 1 6 1215 1 1 5 PHE CG C -0.494 2.607 -3.810 1.00 . A A . 5 PHE CG 1 1 6 1216 1 1 5 PHE CZ C 1.619 4.112 -4.809 1.00 . A A . 5 PHE CZ 1 1 6 1217 1 1 5 PHE H H -3.205 -0.180 -3.009 1.00 . A A . 5 PHE H 1 1 6 1218 1 1 5 PHE HA H -0.465 0.005 -3.344 1.00 . A A . 5 PHE HA 1 1 6 1219 1 1 5 PHE HB2 H -2.335 1.629 -4.076 1.00 . A A . 5 PHE HB2 1 1 6 1220 1 1 5 PHE HB3 H -2.117 2.371 -2.494 1.00 . A A . 5 PHE HB3 1 1 6 1221 1 1 5 PHE HD1 H -0.260 1.418 -5.567 1.00 . A A . 5 PHE HD1 1 1 6 1222 1 1 5 PHE HD2 H -0.477 3.977 -2.171 1.00 . A A . 5 PHE HD2 1 1 6 1223 1 1 5 PHE HE1 H 1.611 2.747 -6.453 1.00 . A A . 5 PHE HE1 1 1 6 1224 1 1 5 PHE HE2 H 1.393 5.311 -3.054 1.00 . A A . 5 PHE HE2 1 1 6 1225 1 1 5 PHE HZ H 2.440 4.696 -5.196 1.00 . A A . 5 PHE HZ 1 1 6 1226 1 1 5 PHE N N -2.344 -0.467 -2.638 1.00 . A A . 5 PHE N 1 1 6 1227 1 1 5 PHE O O 0.612 0.481 -1.126 1.00 . A A . 5 PHE O 1 1 6 1228 1 1 6 ARG C C -0.177 0.005 1.528 1.00 . A A . 6 ARG C 1 1 6 1229 1 1 6 ARG CA C -0.981 1.201 1.025 1.00 . A A . 6 ARG CA 1 1 6 1230 1 1 6 ARG CB C -2.173 1.453 1.951 1.00 . A A . 6 ARG CB 1 1 6 1231 1 1 6 ARG CD C -1.814 3.882 2.481 1.00 . A A . 6 ARG CD 1 1 6 1232 1 1 6 ARG CG C -2.740 2.859 1.844 1.00 . A A . 6 ARG CG 1 1 6 1233 1 1 6 ARG CZ C -2.962 6.022 2.099 1.00 . A A . 6 ARG CZ 1 1 6 1234 1 1 6 ARG H H -2.388 1.092 -0.551 1.00 . A A . 6 ARG H 1 1 6 1235 1 1 6 ARG HA H -0.344 2.073 1.028 1.00 . A A . 6 ARG HA 1 1 6 1236 1 1 6 ARG HB2 H -2.958 0.752 1.705 1.00 . A A . 6 ARG HB2 1 1 6 1237 1 1 6 ARG HB3 H -1.862 1.289 2.971 1.00 . A A . 6 ARG HB3 1 1 6 1238 1 1 6 ARG HD2 H -1.330 3.430 3.334 1.00 . A A . 6 ARG HD2 1 1 6 1239 1 1 6 ARG HD3 H -1.068 4.173 1.757 1.00 . A A . 6 ARG HD3 1 1 6 1240 1 1 6 ARG HE H -2.709 5.168 3.883 1.00 . A A . 6 ARG HE 1 1 6 1241 1 1 6 ARG HG2 H -2.869 3.107 0.801 1.00 . A A . 6 ARG HG2 1 1 6 1242 1 1 6 ARG HG3 H -3.696 2.890 2.344 1.00 . A A . 6 ARG HG3 1 1 6 1243 1 1 6 ARG HH11 H -2.252 5.130 0.433 1.00 . A A . 6 ARG HH11 1 1 6 1244 1 1 6 ARG HH12 H -3.064 6.638 0.176 1.00 . A A . 6 ARG HH12 1 1 6 1245 1 1 6 ARG HH21 H -3.780 7.155 3.559 1.00 . A A . 6 ARG HH21 1 1 6 1246 1 1 6 ARG HH22 H -3.932 7.790 1.957 1.00 . A A . 6 ARG HH22 1 1 6 1247 1 1 6 ARG N N -1.436 0.983 -0.341 1.00 . A A . 6 ARG N 1 1 6 1248 1 1 6 ARG NE N -2.536 5.073 2.924 1.00 . A A . 6 ARG NE 1 1 6 1249 1 1 6 ARG NH1 N -2.741 5.921 0.796 1.00 . A A . 6 ARG NH1 1 1 6 1250 1 1 6 ARG NH2 N -3.612 7.077 2.577 1.00 . A A . 6 ARG NH2 1 1 6 1251 1 1 6 ARG O O 0.897 0.164 2.106 1.00 . A A . 6 ARG O 1 1 6 1252 1 1 7 GLY C C 1.400 -2.475 1.234 1.00 . A A . 7 GLY C 1 1 6 1253 1 1 7 GLY CA C -0.027 -2.399 1.742 1.00 . A A . 7 GLY CA 1 1 6 1254 1 1 7 GLY H H -1.567 -1.260 0.839 1.00 . A A . 7 GLY H 1 1 6 1255 1 1 7 GLY HA2 H -0.016 -2.422 2.821 1.00 . A A . 7 GLY HA2 1 1 6 1256 1 1 7 GLY HA3 H -0.572 -3.258 1.379 1.00 . A A . 7 GLY HA3 1 1 6 1257 1 1 7 GLY N N -0.707 -1.193 1.304 1.00 . A A . 7 GLY N 1 1 6 1258 1 1 7 GLY O O 2.335 -2.663 2.013 1.00 . A A . 7 GLY O 1 1 6 1259 1 1 8 LYS C C 3.780 -1.266 -0.161 1.00 . A A . 8 LYS C 1 1 6 1260 1 1 8 LYS CA C 2.891 -2.388 -0.688 1.00 . A A . 8 LYS CA 1 1 6 1261 1 1 8 LYS CB C 2.775 -2.288 -2.211 1.00 . A A . 8 LYS CB 1 1 6 1262 1 1 8 LYS CD C 3.213 -4.667 -2.890 1.00 . A A . 8 LYS CD 1 1 6 1263 1 1 8 LYS CE C 2.529 -6.024 -2.939 1.00 . A A . 8 LYS CE 1 1 6 1264 1 1 8 LYS CG C 2.199 -3.535 -2.859 1.00 . A A . 8 LYS CG 1 1 6 1265 1 1 8 LYS H H 0.783 -2.186 -0.646 1.00 . A A . 8 LYS H 1 1 6 1266 1 1 8 LYS HA H 3.337 -3.335 -0.430 1.00 . A A . 8 LYS HA 1 1 6 1267 1 1 8 LYS HB2 H 2.138 -1.452 -2.458 1.00 . A A . 8 LYS HB2 1 1 6 1268 1 1 8 LYS HB3 H 3.759 -2.115 -2.624 1.00 . A A . 8 LYS HB3 1 1 6 1269 1 1 8 LYS HD2 H 3.835 -4.557 -3.767 1.00 . A A . 8 LYS HD2 1 1 6 1270 1 1 8 LYS HD3 H 3.826 -4.614 -2.001 1.00 . A A . 8 LYS HD3 1 1 6 1271 1 1 8 LYS HE2 H 1.732 -5.987 -3.666 1.00 . A A . 8 LYS HE2 1 1 6 1272 1 1 8 LYS HE3 H 3.254 -6.767 -3.239 1.00 . A A . 8 LYS HE3 1 1 6 1273 1 1 8 LYS HG2 H 1.334 -3.855 -2.298 1.00 . A A . 8 LYS HG2 1 1 6 1274 1 1 8 LYS HG3 H 1.905 -3.299 -3.872 1.00 . A A . 8 LYS HG3 1 1 6 1275 1 1 8 LYS HZ1 H 1.052 -5.928 -1.465 1.00 . A A . 8 LYS HZ1 1 1 6 1276 1 1 8 LYS HZ2 H 1.809 -7.437 -1.579 1.00 . A A . 8 LYS HZ2 1 1 6 1277 1 1 8 LYS HZ3 H 2.617 -6.138 -0.855 1.00 . A A . 8 LYS HZ3 1 1 6 1278 1 1 8 LYS N N 1.568 -2.333 -0.076 1.00 . A A . 8 LYS N 1 1 6 1279 1 1 8 LYS NZ N 1.962 -6.409 -1.617 1.00 . A A . 8 LYS NZ 1 1 6 1280 1 1 8 LYS O O 4.911 -1.505 0.261 1.00 . A A . 8 LYS O 1 1 6 1281 1 1 9 ALA C C 4.499 0.900 1.716 1.00 . A A . 9 ALA C 1 1 6 1282 1 1 9 ALA CA C 4.009 1.115 0.289 1.00 . A A . 9 ALA CA 1 1 6 1283 1 1 9 ALA CB C 3.149 2.367 0.207 1.00 . A A . 9 ALA CB 1 1 6 1284 1 1 9 ALA H H 2.355 0.085 -0.538 1.00 . A A . 9 ALA H 1 1 6 1285 1 1 9 ALA HA H 4.863 1.251 -0.358 1.00 . A A . 9 ALA HA 1 1 6 1286 1 1 9 ALA HB1 H 3.783 3.242 0.229 1.00 . A A . 9 ALA HB1 1 1 6 1287 1 1 9 ALA HB2 H 2.583 2.356 -0.712 1.00 . A A . 9 ALA HB2 1 1 6 1288 1 1 9 ALA HB3 H 2.472 2.395 1.047 1.00 . A A . 9 ALA HB3 1 1 6 1289 1 1 9 ALA N N 3.261 -0.042 -0.189 1.00 . A A . 9 ALA N 1 1 6 1290 1 1 9 ALA O O 5.623 1.268 2.059 1.00 . A A . 9 ALA O 1 1 6 1291 1 1 10 ASP C C 5.244 -0.837 4.028 1.00 . A A . 10 ASP C 1 1 6 1292 1 1 10 ASP CA C 3.998 0.038 3.937 1.00 . A A . 10 ASP CA 1 1 6 1293 1 1 10 ASP CB C 2.831 -0.637 4.657 1.00 . A A . 10 ASP CB 1 1 6 1294 1 1 10 ASP CG C 3.230 -1.201 6.006 1.00 . A A . 10 ASP CG 1 1 6 1295 1 1 10 ASP H H 2.769 0.034 2.213 1.00 . A A . 10 ASP H 1 1 6 1296 1 1 10 ASP HA H 4.203 0.986 4.413 1.00 . A A . 10 ASP HA 1 1 6 1297 1 1 10 ASP HB2 H 2.042 0.086 4.810 1.00 . A A . 10 ASP HB2 1 1 6 1298 1 1 10 ASP HB3 H 2.459 -1.446 4.044 1.00 . A A . 10 ASP HB3 1 1 6 1299 1 1 10 ASP N N 3.650 0.303 2.546 1.00 . A A . 10 ASP N 1 1 6 1300 1 1 10 ASP O O 6.091 -0.639 4.899 1.00 . A A . 10 ASP O 1 1 6 1301 1 1 10 ASP OD1 O 3.530 -0.402 6.918 1.00 . A A . 10 ASP OD1 1 1 6 1302 1 1 10 ASP OD2 O 3.245 -2.442 6.151 1.00 . A A . 10 ASP OD2 1 1 6 1303 1 1 11 VAL C C 7.805 -1.938 3.076 1.00 . A A . 11 VAL C 1 1 6 1304 1 1 11 VAL CA C 6.491 -2.712 3.103 1.00 . A A . 11 VAL CA 1 1 6 1305 1 1 11 VAL CB C 6.438 -3.653 1.886 1.00 . A A . 11 VAL CB 1 1 6 1306 1 1 11 VAL CG1 C 7.608 -4.624 1.909 1.00 . A A . 11 VAL CG1 1 1 6 1307 1 1 11 VAL CG2 C 5.114 -4.403 1.851 1.00 . A A . 11 VAL CG2 1 1 6 1308 1 1 11 VAL H H 4.641 -1.913 2.455 1.00 . A A . 11 VAL H 1 1 6 1309 1 1 11 VAL HA H 6.457 -3.312 3.999 1.00 . A A . 11 VAL HA 1 1 6 1310 1 1 11 VAL HB H 6.512 -3.056 0.990 1.00 . A A . 11 VAL HB 1 1 6 1311 1 1 11 VAL HG11 H 8.532 -4.072 1.991 1.00 . A A . 11 VAL HG11 1 1 6 1312 1 1 11 VAL HG12 H 7.510 -5.287 2.757 1.00 . A A . 11 VAL HG12 1 1 6 1313 1 1 11 VAL HG13 H 7.614 -5.204 0.999 1.00 . A A . 11 VAL HG13 1 1 6 1314 1 1 11 VAL HG21 H 4.867 -4.743 2.846 1.00 . A A . 11 VAL HG21 1 1 6 1315 1 1 11 VAL HG22 H 4.336 -3.744 1.493 1.00 . A A . 11 VAL HG22 1 1 6 1316 1 1 11 VAL HG23 H 5.199 -5.252 1.190 1.00 . A A . 11 VAL HG23 1 1 6 1317 1 1 11 VAL N N 5.349 -1.805 3.125 1.00 . A A . 11 VAL N 1 1 6 1318 1 1 11 VAL O O 8.674 -2.140 3.924 1.00 . A A . 11 VAL O 1 1 6 1319 1 1 12 ALA C C 8.808 1.211 1.661 1.00 . A A . 12 ALA C 1 1 6 1320 1 1 12 ALA CA C 9.151 -0.245 1.958 1.00 . A A . 12 ALA CA 1 1 6 1321 1 1 12 ALA CB C 10.043 -0.814 0.865 1.00 . A A . 12 ALA CB 1 1 6 1322 1 1 12 ALA H H 7.217 -0.936 1.450 1.00 . A A . 12 ALA H 1 1 6 1323 1 1 12 ALA HA H 9.692 -0.294 2.892 1.00 . A A . 12 ALA HA 1 1 6 1324 1 1 12 ALA HB1 H 10.540 -0.006 0.350 1.00 . A A . 12 ALA HB1 1 1 6 1325 1 1 12 ALA HB2 H 10.782 -1.468 1.306 1.00 . A A . 12 ALA HB2 1 1 6 1326 1 1 12 ALA HB3 H 9.441 -1.372 0.163 1.00 . A A . 12 ALA HB3 1 1 6 1327 1 1 12 ALA N N 7.943 -1.051 2.095 1.00 . A A . 12 ALA N 1 1 6 1328 1 1 12 ALA O O 8.307 1.534 0.584 1.00 . A A . 12 ALA O 1 1 6 1329 1 1 13 LEU C C 9.927 4.203 1.709 1.00 . A A . 13 LEU C 1 1 6 1330 1 1 13 LEU CA C 8.800 3.509 2.465 1.00 . A A . 13 LEU CA 1 1 6 1331 1 1 13 LEU CB C 8.605 4.164 3.833 1.00 . A A . 13 LEU CB 1 1 6 1332 1 1 13 LEU CD1 C 10.676 5.385 4.545 1.00 . A A . 13 LEU CD1 1 1 6 1333 1 1 13 LEU CD2 C 9.375 4.055 6.217 1.00 . A A . 13 LEU CD2 1 1 6 1334 1 1 13 LEU CG C 9.818 4.148 4.764 1.00 . A A . 13 LEU CG 1 1 6 1335 1 1 13 LEU H H 9.479 1.768 3.460 1.00 . A A . 13 LEU H 1 1 6 1336 1 1 13 LEU HA H 7.887 3.604 1.896 1.00 . A A . 13 LEU HA 1 1 6 1337 1 1 13 LEU HB2 H 8.329 5.194 3.669 1.00 . A A . 13 LEU HB2 1 1 6 1338 1 1 13 LEU HB3 H 7.796 3.652 4.333 1.00 . A A . 13 LEU HB3 1 1 6 1339 1 1 13 LEU HD11 H 10.660 5.997 5.434 1.00 . A A . 13 LEU HD11 1 1 6 1340 1 1 13 LEU HD12 H 11.693 5.085 4.332 1.00 . A A . 13 LEU HD12 1 1 6 1341 1 1 13 LEU HD13 H 10.286 5.951 3.711 1.00 . A A . 13 LEU HD13 1 1 6 1342 1 1 13 LEU HD21 H 9.073 5.032 6.563 1.00 . A A . 13 LEU HD21 1 1 6 1343 1 1 13 LEU HD22 H 8.543 3.371 6.296 1.00 . A A . 13 LEU HD22 1 1 6 1344 1 1 13 LEU HD23 H 10.194 3.695 6.821 1.00 . A A . 13 LEU HD23 1 1 6 1345 1 1 13 LEU HG H 10.423 3.279 4.542 1.00 . A A . 13 LEU HG 1 1 6 1346 1 1 13 LEU N N 9.080 2.085 2.624 1.00 . A A . 13 LEU N 1 1 6 1347 1 1 13 LEU O O 9.684 5.092 0.894 1.00 . A A . 13 LEU O 1 1 6 1348 1 1 14 NH2 HN1 H 11.291 3.079 2.646 1.00 . A A . 14 NH2 HN1 1 1 6 1349 1 1 14 NH2 HN2 H 11.959 4.191 1.535 1.00 . A A . 14 NH2 HN2 1 1 6 1350 1 1 14 NH2 N N 11.161 3.792 1.986 1.00 . A A . 14 NH2 N 1 1 7 1351 1 1 1 ILE C C -6.366 0.355 -3.625 1.00 . A A . 1 ILE C 1 1 7 1352 1 1 1 ILE CA C -7.329 -0.276 -4.625 1.00 . A A . 1 ILE CA 1 1 7 1353 1 1 1 ILE CB C -7.822 -1.624 -4.067 1.00 . A A . 1 ILE CB 1 1 7 1354 1 1 1 ILE CD1 C -7.955 -3.220 -6.046 1.00 . A A . 1 ILE CD1 1 1 7 1355 1 1 1 ILE CG1 C -8.717 -2.329 -5.089 1.00 . A A . 1 ILE CG1 1 1 7 1356 1 1 1 ILE CG2 C -8.567 -1.414 -2.758 1.00 . A A . 1 ILE CG2 1 1 7 1357 1 1 1 ILE H1 H -5.982 -1.095 -6.037 1.00 . A A . 1 ILE H1 1 1 7 1358 1 1 1 ILE HA H -8.183 0.375 -4.746 1.00 . A A . 1 ILE HA 1 1 7 1359 1 1 1 ILE HB H -6.960 -2.242 -3.868 1.00 . A A . 1 ILE HB 1 1 7 1360 1 1 1 ILE HD11 H -6.970 -3.414 -5.649 1.00 . A A . 1 ILE HD11 1 1 7 1361 1 1 1 ILE HD12 H -8.485 -4.153 -6.166 1.00 . A A . 1 ILE HD12 1 1 7 1362 1 1 1 ILE HD13 H -7.868 -2.729 -7.003 1.00 . A A . 1 ILE HD13 1 1 7 1363 1 1 1 ILE HG12 H -9.435 -2.939 -4.567 1.00 . A A . 1 ILE HG12 1 1 7 1364 1 1 1 ILE HG13 H -9.238 -1.584 -5.673 1.00 . A A . 1 ILE HG13 1 1 7 1365 1 1 1 ILE HG21 H -9.545 -1.867 -2.824 1.00 . A A . 1 ILE HG21 1 1 7 1366 1 1 1 ILE HG22 H -8.013 -1.871 -1.951 1.00 . A A . 1 ILE HG22 1 1 7 1367 1 1 1 ILE HG23 H -8.672 -0.355 -2.569 1.00 . A A . 1 ILE HG23 1 1 7 1368 1 1 1 ILE N N -6.700 -0.437 -5.931 1.00 . A A . 1 ILE N 1 1 7 1369 1 1 1 ILE O O -5.199 -0.027 -3.546 1.00 . A A . 1 ILE O 1 1 7 1370 1 1 2 PHE C C -5.471 1.014 -0.861 1.00 . A A . 2 PHE C 1 1 7 1371 1 1 2 PHE CA C -6.048 2.007 -1.866 1.00 . A A . 2 PHE CA 1 1 7 1372 1 1 2 PHE CB C -6.878 3.066 -1.137 1.00 . A A . 2 PHE CB 1 1 7 1373 1 1 2 PHE CD1 C -7.793 4.385 -3.065 1.00 . A A . 2 PHE CD1 1 1 7 1374 1 1 2 PHE CD2 C -6.410 5.507 -1.479 1.00 . A A . 2 PHE CD2 1 1 7 1375 1 1 2 PHE CE1 C -7.934 5.561 -3.777 1.00 . A A . 2 PHE CE1 1 1 7 1376 1 1 2 PHE CE2 C -6.549 6.686 -2.187 1.00 . A A . 2 PHE CE2 1 1 7 1377 1 1 2 PHE CG C -7.030 4.345 -1.909 1.00 . A A . 2 PHE CG 1 1 7 1378 1 1 2 PHE CZ C -7.312 6.713 -3.336 1.00 . A A . 2 PHE CZ 1 1 7 1379 1 1 2 PHE H H -7.803 1.583 -2.973 1.00 . A A . 2 PHE H 1 1 7 1380 1 1 2 PHE HA H -5.233 2.492 -2.382 1.00 . A A . 2 PHE HA 1 1 7 1381 1 1 2 PHE HB2 H -7.865 2.673 -0.949 1.00 . A A . 2 PHE HB2 1 1 7 1382 1 1 2 PHE HB3 H -6.402 3.299 -0.195 1.00 . A A . 2 PHE HB3 1 1 7 1383 1 1 2 PHE HD1 H -8.281 3.485 -3.409 1.00 . A A . 2 PHE HD1 1 1 7 1384 1 1 2 PHE HD2 H -5.813 5.487 -0.578 1.00 . A A . 2 PHE HD2 1 1 7 1385 1 1 2 PHE HE1 H -8.531 5.579 -4.676 1.00 . A A . 2 PHE HE1 1 1 7 1386 1 1 2 PHE HE2 H -6.061 7.585 -1.840 1.00 . A A . 2 PHE HE2 1 1 7 1387 1 1 2 PHE HZ H -7.420 7.632 -3.892 1.00 . A A . 2 PHE HZ 1 1 7 1388 1 1 2 PHE N N -6.864 1.322 -2.863 1.00 . A A . 2 PHE N 1 1 7 1389 1 1 2 PHE O O -4.334 1.160 -0.411 1.00 . A A . 2 PHE O 1 1 7 1390 1 1 3 TRP C C -4.534 -1.667 -0.016 1.00 . A A . 3 TRP C 1 1 7 1391 1 1 3 TRP CA C -5.832 -1.012 0.438 1.00 . A A . 3 TRP CA 1 1 7 1392 1 1 3 TRP CB C -6.921 -2.072 0.609 1.00 . A A . 3 TRP CB 1 1 7 1393 1 1 3 TRP CD1 C -6.705 -2.851 3.042 1.00 . A A . 3 TRP CD1 1 1 7 1394 1 1 3 TRP CD2 C -6.185 -4.415 1.525 1.00 . A A . 3 TRP CD2 1 1 7 1395 1 1 3 TRP CE2 C -6.027 -4.966 2.811 1.00 . A A . 3 TRP CE2 1 1 7 1396 1 1 3 TRP CE3 C -5.917 -5.216 0.412 1.00 . A A . 3 TRP CE3 1 1 7 1397 1 1 3 TRP CG C -6.620 -3.061 1.696 1.00 . A A . 3 TRP CG 1 1 7 1398 1 1 3 TRP CH2 C -5.355 -7.040 1.904 1.00 . A A . 3 TRP CH2 1 1 7 1399 1 1 3 TRP CZ2 C -5.610 -6.280 3.012 1.00 . A A . 3 TRP CZ2 1 1 7 1400 1 1 3 TRP CZ3 C -5.503 -6.518 0.612 1.00 . A A . 3 TRP CZ3 1 1 7 1401 1 1 3 TRP H H -7.158 -0.056 -0.908 1.00 . A A . 3 TRP H 1 1 7 1402 1 1 3 TRP HA H -5.663 -0.524 1.387 1.00 . A A . 3 TRP HA 1 1 7 1403 1 1 3 TRP HB2 H -7.854 -1.586 0.851 1.00 . A A . 3 TRP HB2 1 1 7 1404 1 1 3 TRP HB3 H -7.031 -2.616 -0.317 1.00 . A A . 3 TRP HB3 1 1 7 1405 1 1 3 TRP HD1 H -7.006 -1.917 3.493 1.00 . A A . 3 TRP HD1 1 1 7 1406 1 1 3 TRP HE1 H -6.330 -4.093 4.694 1.00 . A A . 3 TRP HE1 1 1 7 1407 1 1 3 TRP HE3 H -6.026 -4.830 -0.591 1.00 . A A . 3 TRP HE3 1 1 7 1408 1 1 3 TRP HH2 H -5.030 -8.064 2.014 1.00 . A A . 3 TRP HH2 1 1 7 1409 1 1 3 TRP HZ2 H -5.492 -6.697 4.002 1.00 . A A . 3 TRP HZ2 1 1 7 1410 1 1 3 TRP HZ3 H -5.292 -7.151 -0.237 1.00 . A A . 3 TRP HZ3 1 1 7 1411 1 1 3 TRP N N -6.263 0.005 -0.515 1.00 . A A . 3 TRP N 1 1 7 1412 1 1 3 TRP NE1 N -6.349 -3.992 3.719 1.00 . A A . 3 TRP NE1 1 1 7 1413 1 1 3 TRP O O -3.630 -1.902 0.789 1.00 . A A . 3 TRP O 1 1 7 1414 1 1 4 LEU C C -2.131 -1.570 -2.047 1.00 . A A . 4 LEU C 1 1 7 1415 1 1 4 LEU CA C -3.253 -2.588 -1.871 1.00 . A A . 4 LEU CA 1 1 7 1416 1 1 4 LEU CB C -3.582 -3.240 -3.214 1.00 . A A . 4 LEU CB 1 1 7 1417 1 1 4 LEU CD1 C -1.479 -4.604 -3.246 1.00 . A A . 4 LEU CD1 1 1 7 1418 1 1 4 LEU CD2 C -2.855 -4.385 -5.323 1.00 . A A . 4 LEU CD2 1 1 7 1419 1 1 4 LEU CG C -2.385 -3.688 -4.054 1.00 . A A . 4 LEU CG 1 1 7 1420 1 1 4 LEU H H -5.195 -1.748 -1.900 1.00 . A A . 4 LEU H 1 1 7 1421 1 1 4 LEU HA H -2.925 -3.352 -1.180 1.00 . A A . 4 LEU HA 1 1 7 1422 1 1 4 LEU HB2 H -4.193 -4.109 -3.020 1.00 . A A . 4 LEU HB2 1 1 7 1423 1 1 4 LEU HB3 H -4.149 -2.528 -3.797 1.00 . A A . 4 LEU HB3 1 1 7 1424 1 1 4 LEU HD11 H -0.626 -4.043 -2.891 1.00 . A A . 4 LEU HD11 1 1 7 1425 1 1 4 LEU HD12 H -2.026 -5.000 -2.404 1.00 . A A . 4 LEU HD12 1 1 7 1426 1 1 4 LEU HD13 H -1.138 -5.416 -3.870 1.00 . A A . 4 LEU HD13 1 1 7 1427 1 1 4 LEU HD21 H -3.053 -5.424 -5.110 1.00 . A A . 4 LEU HD21 1 1 7 1428 1 1 4 LEU HD22 H -3.758 -3.912 -5.680 1.00 . A A . 4 LEU HD22 1 1 7 1429 1 1 4 LEU HD23 H -2.088 -4.312 -6.080 1.00 . A A . 4 LEU HD23 1 1 7 1430 1 1 4 LEU HG H -1.810 -2.819 -4.342 1.00 . A A . 4 LEU HG 1 1 7 1431 1 1 4 LEU N N -4.443 -1.960 -1.310 1.00 . A A . 4 LEU N 1 1 7 1432 1 1 4 LEU O O -0.971 -1.851 -1.745 1.00 . A A . 4 LEU O 1 1 7 1433 1 1 5 PHE C C -0.763 0.998 -1.462 1.00 . A A . 5 PHE C 1 1 7 1434 1 1 5 PHE CA C -1.508 0.674 -2.753 1.00 . A A . 5 PHE CA 1 1 7 1435 1 1 5 PHE CB C -2.199 1.932 -3.287 1.00 . A A . 5 PHE CB 1 1 7 1436 1 1 5 PHE CD1 C -2.879 0.938 -5.488 1.00 . A A . 5 PHE CD1 1 1 7 1437 1 1 5 PHE CD2 C -1.785 3.058 -5.490 1.00 . A A . 5 PHE CD2 1 1 7 1438 1 1 5 PHE CE1 C -2.963 0.979 -6.867 1.00 . A A . 5 PHE CE1 1 1 7 1439 1 1 5 PHE CE2 C -1.867 3.102 -6.869 1.00 . A A . 5 PHE CE2 1 1 7 1440 1 1 5 PHE CG C -2.290 1.977 -4.784 1.00 . A A . 5 PHE CG 1 1 7 1441 1 1 5 PHE CZ C -2.456 2.061 -7.558 1.00 . A A . 5 PHE CZ 1 1 7 1442 1 1 5 PHE H H -3.426 -0.224 -2.760 1.00 . A A . 5 PHE H 1 1 7 1443 1 1 5 PHE HA H -0.798 0.325 -3.488 1.00 . A A . 5 PHE HA 1 1 7 1444 1 1 5 PHE HB2 H -3.204 1.976 -2.892 1.00 . A A . 5 PHE HB2 1 1 7 1445 1 1 5 PHE HB3 H -1.650 2.801 -2.958 1.00 . A A . 5 PHE HB3 1 1 7 1446 1 1 5 PHE HD1 H -3.276 0.091 -4.948 1.00 . A A . 5 PHE HD1 1 1 7 1447 1 1 5 PHE HD2 H -1.323 3.873 -4.951 1.00 . A A . 5 PHE HD2 1 1 7 1448 1 1 5 PHE HE1 H -3.426 0.164 -7.404 1.00 . A A . 5 PHE HE1 1 1 7 1449 1 1 5 PHE HE2 H -1.469 3.952 -7.405 1.00 . A A . 5 PHE HE2 1 1 7 1450 1 1 5 PHE HZ H -2.520 2.095 -8.636 1.00 . A A . 5 PHE HZ 1 1 7 1451 1 1 5 PHE N N -2.485 -0.386 -2.538 1.00 . A A . 5 PHE N 1 1 7 1452 1 1 5 PHE O O 0.439 1.267 -1.478 1.00 . A A . 5 PHE O 1 1 7 1453 1 1 6 ARG C C -0.161 0.042 1.504 1.00 . A A . 6 ARG C 1 1 7 1454 1 1 6 ARG CA C -0.893 1.263 0.953 1.00 . A A . 6 ARG CA 1 1 7 1455 1 1 6 ARG CB C -1.972 1.712 1.939 1.00 . A A . 6 ARG CB 1 1 7 1456 1 1 6 ARG CD C -2.340 3.141 3.974 1.00 . A A . 6 ARG CD 1 1 7 1457 1 1 6 ARG CG C -1.423 2.139 3.291 1.00 . A A . 6 ARG CG 1 1 7 1458 1 1 6 ARG CZ C -1.075 5.235 3.737 1.00 . A A . 6 ARG CZ 1 1 7 1459 1 1 6 ARG H H -2.437 0.749 -0.399 1.00 . A A . 6 ARG H 1 1 7 1460 1 1 6 ARG HA H -0.181 2.065 0.822 1.00 . A A . 6 ARG HA 1 1 7 1461 1 1 6 ARG HB2 H -2.507 2.549 1.513 1.00 . A A . 6 ARG HB2 1 1 7 1462 1 1 6 ARG HB3 H -2.661 0.897 2.097 1.00 . A A . 6 ARG HB3 1 1 7 1463 1 1 6 ARG HD2 H -3.365 2.847 3.802 1.00 . A A . 6 ARG HD2 1 1 7 1464 1 1 6 ARG HD3 H -2.136 3.130 5.035 1.00 . A A . 6 ARG HD3 1 1 7 1465 1 1 6 ARG HE H -2.846 4.873 2.897 1.00 . A A . 6 ARG HE 1 1 7 1466 1 1 6 ARG HG2 H -1.326 1.267 3.922 1.00 . A A . 6 ARG HG2 1 1 7 1467 1 1 6 ARG HG3 H -0.452 2.590 3.148 1.00 . A A . 6 ARG HG3 1 1 7 1468 1 1 6 ARG HH11 H -0.183 3.829 4.882 1.00 . A A . 6 ARG HH11 1 1 7 1469 1 1 6 ARG HH12 H 0.698 5.310 4.708 1.00 . A A . 6 ARG HH12 1 1 7 1470 1 1 6 ARG HH21 H -1.695 6.828 2.659 1.00 . A A . 6 ARG HH21 1 1 7 1471 1 1 6 ARG HH22 H -0.164 7.015 3.443 1.00 . A A . 6 ARG HH22 1 1 7 1472 1 1 6 ARG N N -1.484 0.971 -0.346 1.00 . A A . 6 ARG N 1 1 7 1473 1 1 6 ARG NE N -2.145 4.497 3.467 1.00 . A A . 6 ARG NE 1 1 7 1474 1 1 6 ARG NH1 N -0.108 4.752 4.505 1.00 . A A . 6 ARG NH1 1 1 7 1475 1 1 6 ARG NH2 N -0.969 6.461 3.238 1.00 . A A . 6 ARG NH2 1 1 7 1476 1 1 6 ARG O O 0.922 0.161 2.076 1.00 . A A . 6 ARG O 1 1 7 1477 1 1 7 GLY C C 1.239 -2.572 1.258 1.00 . A A . 7 GLY C 1 1 7 1478 1 1 7 GLY CA C -0.155 -2.355 1.814 1.00 . A A . 7 GLY CA 1 1 7 1479 1 1 7 GLY H H -1.625 -1.165 0.866 1.00 . A A . 7 GLY H 1 1 7 1480 1 1 7 GLY HA2 H -0.097 -2.313 2.893 1.00 . A A . 7 GLY HA2 1 1 7 1481 1 1 7 GLY HA3 H -0.777 -3.191 1.529 1.00 . A A . 7 GLY HA3 1 1 7 1482 1 1 7 GLY N N -0.762 -1.130 1.330 1.00 . A A . 7 GLY N 1 1 7 1483 1 1 7 GLY O O 2.129 -3.056 1.959 1.00 . A A . 7 GLY O 1 1 7 1484 1 1 8 LYS C C 3.715 -1.324 -0.165 1.00 . A A . 8 LYS C 1 1 7 1485 1 1 8 LYS CA C 2.725 -2.373 -0.659 1.00 . A A . 8 LYS CA 1 1 7 1486 1 1 8 LYS CB C 2.570 -2.267 -2.179 1.00 . A A . 8 LYS CB 1 1 7 1487 1 1 8 LYS CD C 3.520 -4.470 -2.923 1.00 . A A . 8 LYS CD 1 1 7 1488 1 1 8 LYS CE C 4.286 -5.133 -4.057 1.00 . A A . 8 LYS CE 1 1 7 1489 1 1 8 LYS CG C 3.678 -2.959 -2.952 1.00 . A A . 8 LYS CG 1 1 7 1490 1 1 8 LYS H H 0.683 -1.835 -0.515 1.00 . A A . 8 LYS H 1 1 7 1491 1 1 8 LYS HA H 3.104 -3.353 -0.412 1.00 . A A . 8 LYS HA 1 1 7 1492 1 1 8 LYS HB2 H 1.628 -2.711 -2.465 1.00 . A A . 8 LYS HB2 1 1 7 1493 1 1 8 LYS HB3 H 2.564 -1.223 -2.455 1.00 . A A . 8 LYS HB3 1 1 7 1494 1 1 8 LYS HD2 H 3.896 -4.845 -1.983 1.00 . A A . 8 LYS HD2 1 1 7 1495 1 1 8 LYS HD3 H 2.471 -4.716 -3.017 1.00 . A A . 8 LYS HD3 1 1 7 1496 1 1 8 LYS HE2 H 5.325 -4.848 -3.988 1.00 . A A . 8 LYS HE2 1 1 7 1497 1 1 8 LYS HE3 H 4.199 -6.205 -3.955 1.00 . A A . 8 LYS HE3 1 1 7 1498 1 1 8 LYS HG2 H 3.652 -2.625 -3.979 1.00 . A A . 8 LYS HG2 1 1 7 1499 1 1 8 LYS HG3 H 4.630 -2.697 -2.512 1.00 . A A . 8 LYS HG3 1 1 7 1500 1 1 8 LYS HZ1 H 4.461 -4.140 -5.887 1.00 . A A . 8 LYS HZ1 1 1 7 1501 1 1 8 LYS HZ2 H 3.564 -5.572 -5.968 1.00 . A A . 8 LYS HZ2 1 1 7 1502 1 1 8 LYS HZ3 H 2.882 -4.185 -5.279 1.00 . A A . 8 LYS HZ3 1 1 7 1503 1 1 8 LYS N N 1.430 -2.216 -0.007 1.00 . A A . 8 LYS N 1 1 7 1504 1 1 8 LYS NZ N 3.762 -4.729 -5.391 1.00 . A A . 8 LYS NZ 1 1 7 1505 1 1 8 LYS O O 4.858 -1.642 0.165 1.00 . A A . 8 LYS O 1 1 7 1506 1 1 9 ALA C C 4.600 0.780 1.771 1.00 . A A . 9 ALA C 1 1 7 1507 1 1 9 ALA CA C 4.114 1.021 0.345 1.00 . A A . 9 ALA CA 1 1 7 1508 1 1 9 ALA CB C 3.364 2.343 0.258 1.00 . A A . 9 ALA CB 1 1 7 1509 1 1 9 ALA H H 2.348 0.118 -0.388 1.00 . A A . 9 ALA H 1 1 7 1510 1 1 9 ALA HA H 4.971 1.080 -0.310 1.00 . A A . 9 ALA HA 1 1 7 1511 1 1 9 ALA HB1 H 3.544 2.796 -0.704 1.00 . A A . 9 ALA HB1 1 1 7 1512 1 1 9 ALA HB2 H 2.305 2.162 0.379 1.00 . A A . 9 ALA HB2 1 1 7 1513 1 1 9 ALA HB3 H 3.706 3.004 1.039 1.00 . A A . 9 ALA HB3 1 1 7 1514 1 1 9 ALA N N 3.268 -0.073 -0.112 1.00 . A A . 9 ALA N 1 1 7 1515 1 1 9 ALA O O 5.742 1.092 2.109 1.00 . A A . 9 ALA O 1 1 7 1516 1 1 10 ASP C C 5.352 -0.873 4.082 1.00 . A A . 10 ASP C 1 1 7 1517 1 1 10 ASP CA C 4.065 -0.057 3.993 1.00 . A A . 10 ASP CA 1 1 7 1518 1 1 10 ASP CB C 2.922 -0.809 4.677 1.00 . A A . 10 ASP CB 1 1 7 1519 1 1 10 ASP CG C 1.711 0.070 4.913 1.00 . A A . 10 ASP CG 1 1 7 1520 1 1 10 ASP H H 2.830 0.000 2.274 1.00 . A A . 10 ASP H 1 1 7 1521 1 1 10 ASP HA H 4.215 0.885 4.496 1.00 . A A . 10 ASP HA 1 1 7 1522 1 1 10 ASP HB2 H 2.624 -1.641 4.055 1.00 . A A . 10 ASP HB2 1 1 7 1523 1 1 10 ASP HB3 H 3.265 -1.182 5.630 1.00 . A A . 10 ASP HB3 1 1 7 1524 1 1 10 ASP N N 3.725 0.226 2.603 1.00 . A A . 10 ASP N 1 1 7 1525 1 1 10 ASP O O 6.202 -0.620 4.936 1.00 . A A . 10 ASP O 1 1 7 1526 1 1 10 ASP OD1 O 0.582 -0.464 4.928 1.00 . A A . 10 ASP OD1 1 1 7 1527 1 1 10 ASP OD2 O 1.890 1.296 5.082 1.00 . A A . 10 ASP OD2 1 1 7 1528 1 1 11 VAL C C 7.918 -1.908 2.814 1.00 . A A . 11 VAL C 1 1 7 1529 1 1 11 VAL CA C 6.670 -2.707 3.174 1.00 . A A . 11 VAL CA 1 1 7 1530 1 1 11 VAL CB C 6.509 -3.865 2.172 1.00 . A A . 11 VAL CB 1 1 7 1531 1 1 11 VAL CG1 C 7.680 -4.828 2.277 1.00 . A A . 11 VAL CG1 1 1 7 1532 1 1 11 VAL CG2 C 5.190 -4.588 2.401 1.00 . A A . 11 VAL CG2 1 1 7 1533 1 1 11 VAL H H 4.775 -2.007 2.539 1.00 . A A . 11 VAL H 1 1 7 1534 1 1 11 VAL HA H 6.796 -3.128 4.161 1.00 . A A . 11 VAL HA 1 1 7 1535 1 1 11 VAL HB H 6.498 -3.452 1.173 1.00 . A A . 11 VAL HB 1 1 7 1536 1 1 11 VAL HG11 H 8.594 -4.314 2.018 1.00 . A A . 11 VAL HG11 1 1 7 1537 1 1 11 VAL HG12 H 7.751 -5.202 3.287 1.00 . A A . 11 VAL HG12 1 1 7 1538 1 1 11 VAL HG13 H 7.529 -5.656 1.597 1.00 . A A . 11 VAL HG13 1 1 7 1539 1 1 11 VAL HG21 H 4.424 -4.147 1.779 1.00 . A A . 11 VAL HG21 1 1 7 1540 1 1 11 VAL HG22 H 5.303 -5.632 2.148 1.00 . A A . 11 VAL HG22 1 1 7 1541 1 1 11 VAL HG23 H 4.907 -4.498 3.439 1.00 . A A . 11 VAL HG23 1 1 7 1542 1 1 11 VAL N N 5.488 -1.855 3.195 1.00 . A A . 11 VAL N 1 1 7 1543 1 1 11 VAL O O 8.994 -2.139 3.362 1.00 . A A . 11 VAL O 1 1 7 1544 1 1 12 ALA C C 9.198 0.938 2.499 1.00 . A A . 12 ALA C 1 1 7 1545 1 1 12 ALA CA C 8.878 -0.130 1.458 1.00 . A A . 12 ALA CA 1 1 7 1546 1 1 12 ALA CB C 8.564 0.515 0.117 1.00 . A A . 12 ALA CB 1 1 7 1547 1 1 12 ALA H H 6.881 -0.829 1.489 1.00 . A A . 12 ALA H 1 1 7 1548 1 1 12 ALA HA H 9.742 -0.765 1.332 1.00 . A A . 12 ALA HA 1 1 7 1549 1 1 12 ALA HB1 H 7.873 -0.109 -0.431 1.00 . A A . 12 ALA HB1 1 1 7 1550 1 1 12 ALA HB2 H 8.120 1.486 0.279 1.00 . A A . 12 ALA HB2 1 1 7 1551 1 1 12 ALA HB3 H 9.476 0.627 -0.450 1.00 . A A . 12 ALA HB3 1 1 7 1552 1 1 12 ALA N N 7.764 -0.965 1.889 1.00 . A A . 12 ALA N 1 1 7 1553 1 1 12 ALA O O 8.542 1.023 3.538 1.00 . A A . 12 ALA O 1 1 7 1554 1 1 13 LEU C C 10.851 2.265 4.531 1.00 . A A . 13 LEU C 1 1 7 1555 1 1 13 LEU CA C 10.618 2.812 3.127 1.00 . A A . 13 LEU CA 1 1 7 1556 1 1 13 LEU CB C 9.557 3.913 3.166 1.00 . A A . 13 LEU CB 1 1 7 1557 1 1 13 LEU CD1 C 8.896 4.201 0.765 1.00 . A A . 13 LEU CD1 1 1 7 1558 1 1 13 LEU CD2 C 8.800 6.151 2.328 1.00 . A A . 13 LEU CD2 1 1 7 1559 1 1 13 LEU CG C 9.536 4.868 1.973 1.00 . A A . 13 LEU CG 1 1 7 1560 1 1 13 LEU H H 10.695 1.632 1.371 1.00 . A A . 13 LEU H 1 1 7 1561 1 1 13 LEU HA H 11.544 3.228 2.758 1.00 . A A . 13 LEU HA 1 1 7 1562 1 1 13 LEU HB2 H 8.590 3.438 3.225 1.00 . A A . 13 LEU HB2 1 1 7 1563 1 1 13 LEU HB3 H 9.724 4.500 4.058 1.00 . A A . 13 LEU HB3 1 1 7 1564 1 1 13 LEU HD11 H 8.055 3.606 1.088 1.00 . A A . 13 LEU HD11 1 1 7 1565 1 1 13 LEU HD12 H 8.557 4.957 0.073 1.00 . A A . 13 LEU HD12 1 1 7 1566 1 1 13 LEU HD13 H 9.622 3.566 0.278 1.00 . A A . 13 LEU HD13 1 1 7 1567 1 1 13 LEU HD21 H 9.515 6.918 2.587 1.00 . A A . 13 LEU HD21 1 1 7 1568 1 1 13 LEU HD22 H 8.214 6.477 1.481 1.00 . A A . 13 LEU HD22 1 1 7 1569 1 1 13 LEU HD23 H 8.145 5.970 3.168 1.00 . A A . 13 LEU HD23 1 1 7 1570 1 1 13 LEU HG H 10.554 5.127 1.710 1.00 . A A . 13 LEU HG 1 1 7 1571 1 1 13 LEU N N 10.210 1.749 2.215 1.00 . A A . 13 LEU N 1 1 7 1572 1 1 13 LEU O O 10.508 2.907 5.523 1.00 . A A . 13 LEU O 1 1 7 1573 1 1 14 NH2 HN1 H 11.690 0.612 3.781 1.00 . A A . 14 NH2 HN1 1 1 7 1574 1 1 14 NH2 HN2 H 11.633 0.642 5.487 1.00 . A A . 14 NH2 HN2 1 1 7 1575 1 1 14 NH2 N N 11.439 1.075 4.607 1.00 . A A . 14 NH2 N 1 1 8 1576 1 1 1 ILE C C -6.551 0.404 -3.384 1.00 . A A . 1 ILE C 1 1 8 1577 1 1 1 ILE CA C -7.541 -0.267 -4.331 1.00 . A A . 1 ILE CA 1 1 8 1578 1 1 1 ILE CB C -7.417 -1.795 -4.186 1.00 . A A . 1 ILE CB 1 1 8 1579 1 1 1 ILE CD1 C -8.153 -4.006 -5.210 1.00 . A A . 1 ILE CD1 1 1 8 1580 1 1 1 ILE CG1 C -8.281 -2.499 -5.233 1.00 . A A . 1 ILE CG1 1 1 8 1581 1 1 1 ILE CG2 C -7.815 -2.229 -2.784 1.00 . A A . 1 ILE CG2 1 1 8 1582 1 1 1 ILE H1 H -6.616 -0.268 -6.233 1.00 . A A . 1 ILE H1 1 1 8 1583 1 1 1 ILE HA H -8.543 0.022 -4.048 1.00 . A A . 1 ILE HA 1 1 8 1584 1 1 1 ILE HB H -6.383 -2.066 -4.342 1.00 . A A . 1 ILE HB 1 1 8 1585 1 1 1 ILE HD11 H -7.177 -4.277 -4.835 1.00 . A A . 1 ILE HD11 1 1 8 1586 1 1 1 ILE HD12 H -8.914 -4.423 -4.567 1.00 . A A . 1 ILE HD12 1 1 8 1587 1 1 1 ILE HD13 H -8.273 -4.394 -6.211 1.00 . A A . 1 ILE HD13 1 1 8 1588 1 1 1 ILE HG12 H -9.317 -2.254 -5.060 1.00 . A A . 1 ILE HG12 1 1 8 1589 1 1 1 ILE HG13 H -7.994 -2.156 -6.218 1.00 . A A . 1 ILE HG13 1 1 8 1590 1 1 1 ILE HG21 H -7.448 -3.228 -2.598 1.00 . A A . 1 ILE HG21 1 1 8 1591 1 1 1 ILE HG22 H -7.389 -1.549 -2.062 1.00 . A A . 1 ILE HG22 1 1 8 1592 1 1 1 ILE HG23 H -8.890 -2.219 -2.696 1.00 . A A . 1 ILE HG23 1 1 8 1593 1 1 1 ILE N N -7.323 0.158 -5.707 1.00 . A A . 1 ILE N 1 1 8 1594 1 1 1 ILE O O -5.394 -0.005 -3.290 1.00 . A A . 1 ILE O 1 1 8 1595 1 1 2 PHE C C -5.502 1.206 -0.762 1.00 . A A . 2 PHE C 1 1 8 1596 1 1 2 PHE CA C -6.170 2.162 -1.745 1.00 . A A . 2 PHE CA 1 1 8 1597 1 1 2 PHE CB C -6.995 3.201 -0.984 1.00 . A A . 2 PHE CB 1 1 8 1598 1 1 2 PHE CD1 C -7.876 2.398 1.224 1.00 . A A . 2 PHE CD1 1 1 8 1599 1 1 2 PHE CD2 C -9.292 2.239 -0.687 1.00 . A A . 2 PHE CD2 1 1 8 1600 1 1 2 PHE CE1 C -8.870 1.844 2.010 1.00 . A A . 2 PHE CE1 1 1 8 1601 1 1 2 PHE CE2 C -10.291 1.684 0.093 1.00 . A A . 2 PHE CE2 1 1 8 1602 1 1 2 PHE CG C -8.076 2.600 -0.132 1.00 . A A . 2 PHE CG 1 1 8 1603 1 1 2 PHE CZ C -10.079 1.489 1.444 1.00 . A A . 2 PHE CZ 1 1 8 1604 1 1 2 PHE H H -7.947 1.713 -2.804 1.00 . A A . 2 PHE H 1 1 8 1605 1 1 2 PHE HA H -5.403 2.669 -2.312 1.00 . A A . 2 PHE HA 1 1 8 1606 1 1 2 PHE HB2 H -6.341 3.767 -0.337 1.00 . A A . 2 PHE HB2 1 1 8 1607 1 1 2 PHE HB3 H -7.461 3.869 -1.692 1.00 . A A . 2 PHE HB3 1 1 8 1608 1 1 2 PHE HD1 H -6.932 2.676 1.668 1.00 . A A . 2 PHE HD1 1 1 8 1609 1 1 2 PHE HD2 H -9.461 2.391 -1.744 1.00 . A A . 2 PHE HD2 1 1 8 1610 1 1 2 PHE HE1 H -8.702 1.692 3.066 1.00 . A A . 2 PHE HE1 1 1 8 1611 1 1 2 PHE HE2 H -11.234 1.408 -0.352 1.00 . A A . 2 PHE HE2 1 1 8 1612 1 1 2 PHE HZ H -10.855 1.055 2.057 1.00 . A A . 2 PHE HZ 1 1 8 1613 1 1 2 PHE N N -7.015 1.434 -2.685 1.00 . A A . 2 PHE N 1 1 8 1614 1 1 2 PHE O O -4.352 1.405 -0.369 1.00 . A A . 2 PHE O 1 1 8 1615 1 1 3 TRP C C -4.468 -1.502 0.010 1.00 . A A . 3 TRP C 1 1 8 1616 1 1 3 TRP CA C -5.711 -0.819 0.571 1.00 . A A . 3 TRP CA 1 1 8 1617 1 1 3 TRP CB C -6.782 -1.864 0.890 1.00 . A A . 3 TRP CB 1 1 8 1618 1 1 3 TRP CD1 C -8.986 -1.444 2.126 1.00 . A A . 3 TRP CD1 1 1 8 1619 1 1 3 TRP CD2 C -7.155 -1.168 3.388 1.00 . A A . 3 TRP CD2 1 1 8 1620 1 1 3 TRP CE2 C -8.292 -0.908 4.181 1.00 . A A . 3 TRP CE2 1 1 8 1621 1 1 3 TRP CE3 C -5.889 -1.058 3.969 1.00 . A A . 3 TRP CE3 1 1 8 1622 1 1 3 TRP CG C -7.623 -1.509 2.078 1.00 . A A . 3 TRP CG 1 1 8 1623 1 1 3 TRP CH2 C -6.944 -0.446 6.065 1.00 . A A . 3 TRP CH2 1 1 8 1624 1 1 3 TRP CZ2 C -8.196 -0.546 5.521 1.00 . A A . 3 TRP CZ2 1 1 8 1625 1 1 3 TRP CZ3 C -5.797 -0.697 5.299 1.00 . A A . 3 TRP CZ3 1 1 8 1626 1 1 3 TRP H H -7.142 0.063 -0.716 1.00 . A A . 3 TRP H 1 1 8 1627 1 1 3 TRP HA H -5.443 -0.303 1.480 1.00 . A A . 3 TRP HA 1 1 8 1628 1 1 3 TRP HB2 H -7.436 -1.971 0.038 1.00 . A A . 3 TRP HB2 1 1 8 1629 1 1 3 TRP HB3 H -6.300 -2.811 1.092 1.00 . A A . 3 TRP HB3 1 1 8 1630 1 1 3 TRP HD1 H -9.635 -1.647 1.288 1.00 . A A . 3 TRP HD1 1 1 8 1631 1 1 3 TRP HE1 H -10.326 -0.970 3.673 1.00 . A A . 3 TRP HE1 1 1 8 1632 1 1 3 TRP HE3 H -4.994 -1.248 3.397 1.00 . A A . 3 TRP HE3 1 1 8 1633 1 1 3 TRP HH2 H -6.823 -0.166 7.099 1.00 . A A . 3 TRP HH2 1 1 8 1634 1 1 3 TRP HZ2 H -9.071 -0.348 6.124 1.00 . A A . 3 TRP HZ2 1 1 8 1635 1 1 3 TRP HZ3 H -4.827 -0.607 5.766 1.00 . A A . 3 TRP HZ3 1 1 8 1636 1 1 3 TRP N N -6.231 0.168 -0.368 1.00 . A A . 3 TRP N 1 1 8 1637 1 1 3 TRP NE1 N -9.395 -1.082 3.387 1.00 . A A . 3 TRP NE1 1 1 8 1638 1 1 3 TRP O O -3.382 -1.407 0.583 1.00 . A A . 3 TRP O 1 1 8 1639 1 1 4 LEU C C -2.344 -1.947 -1.979 1.00 . A A . 4 LEU C 1 1 8 1640 1 1 4 LEU CA C -3.523 -2.888 -1.754 1.00 . A A . 4 LEU CA 1 1 8 1641 1 1 4 LEU CB C -3.973 -3.487 -3.088 1.00 . A A . 4 LEU CB 1 1 8 1642 1 1 4 LEU CD1 C -2.232 -5.275 -3.322 1.00 . A A . 4 LEU CD1 1 1 8 1643 1 1 4 LEU CD2 C -4.383 -5.776 -2.148 1.00 . A A . 4 LEU CD2 1 1 8 1644 1 1 4 LEU CG C -3.723 -4.985 -3.268 1.00 . A A . 4 LEU CG 1 1 8 1645 1 1 4 LEU H H -5.521 -2.229 -1.525 1.00 . A A . 4 LEU H 1 1 8 1646 1 1 4 LEU HA H -3.212 -3.687 -1.097 1.00 . A A . 4 LEU HA 1 1 8 1647 1 1 4 LEU HB2 H -5.033 -3.314 -3.187 1.00 . A A . 4 LEU HB2 1 1 8 1648 1 1 4 LEU HB3 H -3.450 -2.965 -3.877 1.00 . A A . 4 LEU HB3 1 1 8 1649 1 1 4 LEU HD11 H -1.813 -5.192 -2.331 1.00 . A A . 4 LEU HD11 1 1 8 1650 1 1 4 LEU HD12 H -2.073 -6.275 -3.697 1.00 . A A . 4 LEU HD12 1 1 8 1651 1 1 4 LEU HD13 H -1.750 -4.564 -3.977 1.00 . A A . 4 LEU HD13 1 1 8 1652 1 1 4 LEU HD21 H -5.280 -5.266 -1.828 1.00 . A A . 4 LEU HD21 1 1 8 1653 1 1 4 LEU HD22 H -4.636 -6.762 -2.504 1.00 . A A . 4 LEU HD22 1 1 8 1654 1 1 4 LEU HD23 H -3.699 -5.857 -1.316 1.00 . A A . 4 LEU HD23 1 1 8 1655 1 1 4 LEU HG H -4.159 -5.306 -4.206 1.00 . A A . 4 LEU HG 1 1 8 1656 1 1 4 LEU N N -4.633 -2.190 -1.115 1.00 . A A . 4 LEU N 1 1 8 1657 1 1 4 LEU O O -1.203 -2.277 -1.657 1.00 . A A . 4 LEU O 1 1 8 1658 1 1 5 PHE C C -0.825 0.559 -1.523 1.00 . A A . 5 PHE C 1 1 8 1659 1 1 5 PHE CA C -1.591 0.218 -2.797 1.00 . A A . 5 PHE CA 1 1 8 1660 1 1 5 PHE CB C -2.208 1.488 -3.389 1.00 . A A . 5 PHE CB 1 1 8 1661 1 1 5 PHE CD1 C -0.360 2.661 -4.614 1.00 . A A . 5 PHE CD1 1 1 8 1662 1 1 5 PHE CD2 C -1.179 3.635 -2.599 1.00 . A A . 5 PHE CD2 1 1 8 1663 1 1 5 PHE CE1 C 0.542 3.699 -4.752 1.00 . A A . 5 PHE CE1 1 1 8 1664 1 1 5 PHE CE2 C -0.280 4.676 -2.731 1.00 . A A . 5 PHE CE2 1 1 8 1665 1 1 5 PHE CG C -1.229 2.616 -3.537 1.00 . A A . 5 PHE CG 1 1 8 1666 1 1 5 PHE CZ C 0.581 4.709 -3.811 1.00 . A A . 5 PHE CZ 1 1 8 1667 1 1 5 PHE H H -3.557 -0.567 -2.765 1.00 . A A . 5 PHE H 1 1 8 1668 1 1 5 PHE HA H -0.905 -0.207 -3.512 1.00 . A A . 5 PHE HA 1 1 8 1669 1 1 5 PHE HB2 H -2.606 1.263 -4.367 1.00 . A A . 5 PHE HB2 1 1 8 1670 1 1 5 PHE HB3 H -3.009 1.822 -2.748 1.00 . A A . 5 PHE HB3 1 1 8 1671 1 1 5 PHE HD1 H -0.389 1.873 -5.353 1.00 . A A . 5 PHE HD1 1 1 8 1672 1 1 5 PHE HD2 H -1.853 3.610 -1.754 1.00 . A A . 5 PHE HD2 1 1 8 1673 1 1 5 PHE HE1 H 1.215 3.723 -5.596 1.00 . A A . 5 PHE HE1 1 1 8 1674 1 1 5 PHE HE2 H -0.252 5.463 -1.992 1.00 . A A . 5 PHE HE2 1 1 8 1675 1 1 5 PHE HZ H 1.286 5.520 -3.915 1.00 . A A . 5 PHE HZ 1 1 8 1676 1 1 5 PHE N N -2.628 -0.772 -2.531 1.00 . A A . 5 PHE N 1 1 8 1677 1 1 5 PHE O O 0.406 0.526 -1.498 1.00 . A A . 5 PHE O 1 1 8 1678 1 1 6 ARG C C -0.022 0.123 1.292 1.00 . A A . 6 ARG C 1 1 8 1679 1 1 6 ARG CA C -0.951 1.234 0.811 1.00 . A A . 6 ARG CA 1 1 8 1680 1 1 6 ARG CB C -2.032 1.499 1.861 1.00 . A A . 6 ARG CB 1 1 8 1681 1 1 6 ARG CD C -2.401 2.199 4.246 1.00 . A A . 6 ARG CD 1 1 8 1682 1 1 6 ARG CG C -1.577 2.413 2.988 1.00 . A A . 6 ARG CG 1 1 8 1683 1 1 6 ARG CZ C -2.222 0.898 6.326 1.00 . A A . 6 ARG CZ 1 1 8 1684 1 1 6 ARG H H -2.538 0.894 -0.547 1.00 . A A . 6 ARG H 1 1 8 1685 1 1 6 ARG HA H -0.373 2.135 0.668 1.00 . A A . 6 ARG HA 1 1 8 1686 1 1 6 ARG HB2 H -2.882 1.957 1.378 1.00 . A A . 6 ARG HB2 1 1 8 1687 1 1 6 ARG HB3 H -2.337 0.557 2.292 1.00 . A A . 6 ARG HB3 1 1 8 1688 1 1 6 ARG HD2 H -2.377 3.103 4.836 1.00 . A A . 6 ARG HD2 1 1 8 1689 1 1 6 ARG HD3 H -3.420 1.985 3.961 1.00 . A A . 6 ARG HD3 1 1 8 1690 1 1 6 ARG HE H -1.274 0.466 4.625 1.00 . A A . 6 ARG HE 1 1 8 1691 1 1 6 ARG HG2 H -0.540 2.205 3.211 1.00 . A A . 6 ARG HG2 1 1 8 1692 1 1 6 ARG HG3 H -1.679 3.439 2.669 1.00 . A A . 6 ARG HG3 1 1 8 1693 1 1 6 ARG HH11 H -3.439 2.508 6.431 1.00 . A A . 6 ARG HH11 1 1 8 1694 1 1 6 ARG HH12 H -3.305 1.581 7.890 1.00 . A A . 6 ARG HH12 1 1 8 1695 1 1 6 ARG HH21 H -1.089 -0.761 6.540 1.00 . A A . 6 ARG HH21 1 1 8 1696 1 1 6 ARG HH22 H -1.967 -0.276 7.951 1.00 . A A . 6 ARG HH22 1 1 8 1697 1 1 6 ARG N N -1.560 0.886 -0.466 1.00 . A A . 6 ARG N 1 1 8 1698 1 1 6 ARG NE N -1.893 1.093 5.054 1.00 . A A . 6 ARG NE 1 1 8 1699 1 1 6 ARG NH1 N -3.057 1.731 6.932 1.00 . A A . 6 ARG NH1 1 1 8 1700 1 1 6 ARG NH2 N -1.718 -0.131 6.993 1.00 . A A . 6 ARG NH2 1 1 8 1701 1 1 6 ARG O O 1.075 0.386 1.783 1.00 . A A . 6 ARG O 1 1 8 1702 1 1 7 GLY C C 1.696 -2.277 0.909 1.00 . A A . 7 GLY C 1 1 8 1703 1 1 7 GLY CA C 0.333 -2.252 1.571 1.00 . A A . 7 GLY CA 1 1 8 1704 1 1 7 GLY H H -1.354 -1.269 0.749 1.00 . A A . 7 GLY H 1 1 8 1705 1 1 7 GLY HA2 H 0.465 -2.205 2.642 1.00 . A A . 7 GLY HA2 1 1 8 1706 1 1 7 GLY HA3 H -0.192 -3.164 1.323 1.00 . A A . 7 GLY HA3 1 1 8 1707 1 1 7 GLY N N -0.471 -1.119 1.148 1.00 . A A . 7 GLY N 1 1 8 1708 1 1 7 GLY O O 2.700 -2.583 1.550 1.00 . A A . 7 GLY O 1 1 8 1709 1 1 8 LYS C C 3.958 -0.927 -0.544 1.00 . A A . 8 LYS C 1 1 8 1710 1 1 8 LYS CA C 2.980 -1.940 -1.131 1.00 . A A . 8 LYS CA 1 1 8 1711 1 1 8 LYS CB C 2.712 -1.614 -2.602 1.00 . A A . 8 LYS CB 1 1 8 1712 1 1 8 LYS CD C 4.048 -3.275 -3.930 1.00 . A A . 8 LYS CD 1 1 8 1713 1 1 8 LYS CE C 5.471 -3.602 -4.361 1.00 . A A . 8 LYS CE 1 1 8 1714 1 1 8 LYS CG C 3.917 -1.823 -3.502 1.00 . A A . 8 LYS CG 1 1 8 1715 1 1 8 LYS H H 0.896 -1.718 -0.836 1.00 . A A . 8 LYS H 1 1 8 1716 1 1 8 LYS HA H 3.419 -2.925 -1.064 1.00 . A A . 8 LYS HA 1 1 8 1717 1 1 8 LYS HB2 H 1.909 -2.244 -2.957 1.00 . A A . 8 LYS HB2 1 1 8 1718 1 1 8 LYS HB3 H 2.407 -0.580 -2.679 1.00 . A A . 8 LYS HB3 1 1 8 1719 1 1 8 LYS HD2 H 3.781 -3.911 -3.101 1.00 . A A . 8 LYS HD2 1 1 8 1720 1 1 8 LYS HD3 H 3.378 -3.458 -4.758 1.00 . A A . 8 LYS HD3 1 1 8 1721 1 1 8 LYS HE2 H 6.156 -3.193 -3.636 1.00 . A A . 8 LYS HE2 1 1 8 1722 1 1 8 LYS HE3 H 5.583 -4.677 -4.397 1.00 . A A . 8 LYS HE3 1 1 8 1723 1 1 8 LYS HG2 H 3.809 -1.208 -4.382 1.00 . A A . 8 LYS HG2 1 1 8 1724 1 1 8 LYS HG3 H 4.809 -1.534 -2.965 1.00 . A A . 8 LYS HG3 1 1 8 1725 1 1 8 LYS HZ1 H 5.159 -2.235 -5.908 1.00 . A A . 8 LYS HZ1 1 1 8 1726 1 1 8 LYS HZ2 H 6.773 -2.708 -5.726 1.00 . A A . 8 LYS HZ2 1 1 8 1727 1 1 8 LYS HZ3 H 5.657 -3.764 -6.435 1.00 . A A . 8 LYS HZ3 1 1 8 1728 1 1 8 LYS N N 1.732 -1.954 -0.379 1.00 . A A . 8 LYS N 1 1 8 1729 1 1 8 LYS NZ N 5.788 -3.038 -5.702 1.00 . A A . 8 LYS NZ 1 1 8 1730 1 1 8 LYS O O 5.164 -1.166 -0.502 1.00 . A A . 8 LYS O 1 1 8 1731 1 1 9 ALA C C 4.632 0.912 1.932 1.00 . A A . 9 ALA C 1 1 8 1732 1 1 9 ALA CA C 4.253 1.254 0.495 1.00 . A A . 9 ALA CA 1 1 8 1733 1 1 9 ALA CB C 3.525 2.589 0.443 1.00 . A A . 9 ALA CB 1 1 8 1734 1 1 9 ALA H H 2.458 0.337 -0.154 1.00 . A A . 9 ALA H 1 1 8 1735 1 1 9 ALA HA H 5.154 1.339 -0.095 1.00 . A A . 9 ALA HA 1 1 8 1736 1 1 9 ALA HB1 H 2.543 2.481 0.878 1.00 . A A . 9 ALA HB1 1 1 8 1737 1 1 9 ALA HB2 H 4.086 3.327 0.998 1.00 . A A . 9 ALA HB2 1 1 8 1738 1 1 9 ALA HB3 H 3.431 2.907 -0.586 1.00 . A A . 9 ALA HB3 1 1 8 1739 1 1 9 ALA N N 3.428 0.204 -0.092 1.00 . A A . 9 ALA N 1 1 8 1740 1 1 9 ALA O O 5.749 1.192 2.371 1.00 . A A . 9 ALA O 1 1 8 1741 1 1 10 ASP C C 5.182 -0.946 4.165 1.00 . A A . 10 ASP C 1 1 8 1742 1 1 10 ASP CA C 3.938 -0.072 4.046 1.00 . A A . 10 ASP CA 1 1 8 1743 1 1 10 ASP CB C 2.724 -0.811 4.610 1.00 . A A . 10 ASP CB 1 1 8 1744 1 1 10 ASP CG C 2.825 -1.034 6.106 1.00 . A A . 10 ASP CG 1 1 8 1745 1 1 10 ASP H H 2.830 0.112 2.251 1.00 . A A . 10 ASP H 1 1 8 1746 1 1 10 ASP HA H 4.093 0.833 4.615 1.00 . A A . 10 ASP HA 1 1 8 1747 1 1 10 ASP HB2 H 1.833 -0.234 4.411 1.00 . A A . 10 ASP HB2 1 1 8 1748 1 1 10 ASP HB3 H 2.640 -1.773 4.125 1.00 . A A . 10 ASP HB3 1 1 8 1749 1 1 10 ASP N N 3.701 0.308 2.658 1.00 . A A . 10 ASP N 1 1 8 1750 1 1 10 ASP O O 6.131 -0.602 4.870 1.00 . A A . 10 ASP O 1 1 8 1751 1 1 10 ASP OD1 O 1.932 -0.560 6.838 1.00 . A A . 10 ASP OD1 1 1 8 1752 1 1 10 ASP OD2 O 3.799 -1.681 6.546 1.00 . A A . 10 ASP OD2 1 1 8 1753 1 1 11 VAL C C 7.605 -2.285 3.182 1.00 . A A . 11 VAL C 1 1 8 1754 1 1 11 VAL CA C 6.298 -3.004 3.497 1.00 . A A . 11 VAL CA 1 1 8 1755 1 1 11 VAL CB C 6.103 -4.156 2.494 1.00 . A A . 11 VAL CB 1 1 8 1756 1 1 11 VAL CG1 C 4.973 -5.070 2.943 1.00 . A A . 11 VAL CG1 1 1 8 1757 1 1 11 VAL CG2 C 5.837 -3.609 1.100 1.00 . A A . 11 VAL CG2 1 1 8 1758 1 1 11 VAL H H 4.386 -2.300 2.927 1.00 . A A . 11 VAL H 1 1 8 1759 1 1 11 VAL HA H 6.360 -3.425 4.489 1.00 . A A . 11 VAL HA 1 1 8 1760 1 1 11 VAL HB H 7.014 -4.736 2.462 1.00 . A A . 11 VAL HB 1 1 8 1761 1 1 11 VAL HG11 H 4.888 -5.901 2.257 1.00 . A A . 11 VAL HG11 1 1 8 1762 1 1 11 VAL HG12 H 5.184 -5.442 3.935 1.00 . A A . 11 VAL HG12 1 1 8 1763 1 1 11 VAL HG13 H 4.046 -4.516 2.954 1.00 . A A . 11 VAL HG13 1 1 8 1764 1 1 11 VAL HG21 H 5.565 -4.420 0.441 1.00 . A A . 11 VAL HG21 1 1 8 1765 1 1 11 VAL HG22 H 5.028 -2.894 1.143 1.00 . A A . 11 VAL HG22 1 1 8 1766 1 1 11 VAL HG23 H 6.727 -3.124 0.728 1.00 . A A . 11 VAL HG23 1 1 8 1767 1 1 11 VAL N N 5.171 -2.079 3.470 1.00 . A A . 11 VAL N 1 1 8 1768 1 1 11 VAL O O 8.651 -2.601 3.750 1.00 . A A . 11 VAL O 1 1 8 1769 1 1 12 ALA C C 9.051 0.509 2.928 1.00 . A A . 12 ALA C 1 1 8 1770 1 1 12 ALA CA C 8.716 -0.552 1.885 1.00 . A A . 12 ALA CA 1 1 8 1771 1 1 12 ALA CB C 8.501 0.091 0.524 1.00 . A A . 12 ALA CB 1 1 8 1772 1 1 12 ALA H H 6.677 -1.114 1.856 1.00 . A A . 12 ALA H 1 1 8 1773 1 1 12 ALA HA H 9.548 -1.239 1.804 1.00 . A A . 12 ALA HA 1 1 8 1774 1 1 12 ALA HB1 H 9.022 -0.479 -0.231 1.00 . A A . 12 ALA HB1 1 1 8 1775 1 1 12 ALA HB2 H 7.446 0.110 0.297 1.00 . A A . 12 ALA HB2 1 1 8 1776 1 1 12 ALA HB3 H 8.883 1.102 0.539 1.00 . A A . 12 ALA HB3 1 1 8 1777 1 1 12 ALA N N 7.539 -1.319 2.274 1.00 . A A . 12 ALA N 1 1 8 1778 1 1 12 ALA O O 8.532 1.625 2.881 1.00 . A A . 12 ALA O 1 1 8 1779 1 1 13 LEU C C 11.458 1.979 4.455 1.00 . A A . 13 LEU C 1 1 8 1780 1 1 13 LEU CA C 10.321 1.076 4.924 1.00 . A A . 13 LEU CA 1 1 8 1781 1 1 13 LEU CB C 10.754 0.299 6.170 1.00 . A A . 13 LEU CB 1 1 8 1782 1 1 13 LEU CD1 C 8.996 -1.441 6.574 1.00 . A A . 13 LEU CD1 1 1 8 1783 1 1 13 LEU CD2 C 10.155 -0.365 8.511 1.00 . A A . 13 LEU CD2 1 1 8 1784 1 1 13 LEU CG C 9.630 -0.162 7.098 1.00 . A A . 13 LEU CG 1 1 8 1785 1 1 13 LEU H H 10.298 -0.749 3.854 1.00 . A A . 13 LEU H 1 1 8 1786 1 1 13 LEU HA H 9.469 1.691 5.171 1.00 . A A . 13 LEU HA 1 1 8 1787 1 1 13 LEU HB2 H 11.293 -0.578 5.842 1.00 . A A . 13 LEU HB2 1 1 8 1788 1 1 13 LEU HB3 H 11.417 0.935 6.741 1.00 . A A . 13 LEU HB3 1 1 8 1789 1 1 13 LEU HD11 H 8.516 -1.964 7.387 1.00 . A A . 13 LEU HD11 1 1 8 1790 1 1 13 LEU HD12 H 8.261 -1.195 5.821 1.00 . A A . 13 LEU HD12 1 1 8 1791 1 1 13 LEU HD13 H 9.759 -2.069 6.140 1.00 . A A . 13 LEU HD13 1 1 8 1792 1 1 13 LEU HD21 H 11.134 -0.821 8.470 1.00 . A A . 13 LEU HD21 1 1 8 1793 1 1 13 LEU HD22 H 10.223 0.590 9.011 1.00 . A A . 13 LEU HD22 1 1 8 1794 1 1 13 LEU HD23 H 9.481 -1.009 9.057 1.00 . A A . 13 LEU HD23 1 1 8 1795 1 1 13 LEU HG H 8.864 0.601 7.131 1.00 . A A . 13 LEU HG 1 1 8 1796 1 1 13 LEU N N 9.919 0.154 3.870 1.00 . A A . 13 LEU N 1 1 8 1797 1 1 13 LEU O O 12.631 1.677 4.667 1.00 . A A . 13 LEU O 1 1 8 1798 1 1 14 NH2 HN1 H 10.148 3.275 3.680 1.00 . A A . 14 NH2 HN1 1 1 8 1799 1 1 14 NH2 HN2 H 11.778 3.740 3.478 1.00 . A A . 14 NH2 HN2 1 1 8 1800 1 1 14 NH2 N N 11.100 3.089 3.818 1.00 . A A . 14 NH2 N 1 1 9 1801 1 1 1 ILE C C -6.070 0.447 -3.761 1.00 . A A . 1 ILE C 1 1 9 1802 1 1 1 ILE CA C -6.929 -0.210 -4.835 1.00 . A A . 1 ILE CA 1 1 9 1803 1 1 1 ILE CB C -7.113 -1.699 -4.489 1.00 . A A . 1 ILE CB 1 1 9 1804 1 1 1 ILE CD1 C -9.292 -1.809 -5.802 1.00 . A A . 1 ILE CD1 1 1 9 1805 1 1 1 ILE CG1 C -7.919 -2.404 -5.583 1.00 . A A . 1 ILE CG1 1 1 9 1806 1 1 1 ILE CG2 C -7.801 -1.850 -3.140 1.00 . A A . 1 ILE CG2 1 1 9 1807 1 1 1 ILE H1 H -6.084 -0.831 -6.672 1.00 . A A . 1 ILE H1 1 1 9 1808 1 1 1 ILE HA H -7.903 0.261 -4.841 1.00 . A A . 1 ILE HA 1 1 9 1809 1 1 1 ILE HB H -6.137 -2.154 -4.422 1.00 . A A . 1 ILE HB 1 1 9 1810 1 1 1 ILE HD11 H -9.864 -1.877 -4.888 1.00 . A A . 1 ILE HD11 1 1 9 1811 1 1 1 ILE HD12 H -9.194 -0.771 -6.088 1.00 . A A . 1 ILE HD12 1 1 9 1812 1 1 1 ILE HD13 H -9.800 -2.351 -6.585 1.00 . A A . 1 ILE HD13 1 1 9 1813 1 1 1 ILE HG12 H -7.379 -2.342 -6.515 1.00 . A A . 1 ILE HG12 1 1 9 1814 1 1 1 ILE HG13 H -8.046 -3.443 -5.314 1.00 . A A . 1 ILE HG13 1 1 9 1815 1 1 1 ILE HG21 H -8.609 -1.138 -3.067 1.00 . A A . 1 ILE HG21 1 1 9 1816 1 1 1 ILE HG22 H -8.191 -2.851 -3.044 1.00 . A A . 1 ILE HG22 1 1 9 1817 1 1 1 ILE HG23 H -7.086 -1.664 -2.350 1.00 . A A . 1 ILE HG23 1 1 9 1818 1 1 1 ILE N N -6.341 -0.039 -6.157 1.00 . A A . 1 ILE N 1 1 9 1819 1 1 1 ILE O O -4.846 0.312 -3.761 1.00 . A A . 1 ILE O 1 1 9 1820 1 1 2 PHE C C -5.445 0.829 -0.767 1.00 . A A . 2 PHE C 1 1 9 1821 1 1 2 PHE CA C -6.013 1.836 -1.762 1.00 . A A . 2 PHE CA 1 1 9 1822 1 1 2 PHE CB C -6.951 2.808 -1.044 1.00 . A A . 2 PHE CB 1 1 9 1823 1 1 2 PHE CD1 C -8.325 4.395 -2.419 1.00 . A A . 2 PHE CD1 1 1 9 1824 1 1 2 PHE CD2 C -6.116 5.050 -1.801 1.00 . A A . 2 PHE CD2 1 1 9 1825 1 1 2 PHE CE1 C -8.498 5.594 -3.086 1.00 . A A . 2 PHE CE1 1 1 9 1826 1 1 2 PHE CE2 C -6.283 6.250 -2.467 1.00 . A A . 2 PHE CE2 1 1 9 1827 1 1 2 PHE CG C -7.135 4.110 -1.769 1.00 . A A . 2 PHE CG 1 1 9 1828 1 1 2 PHE CZ C -7.475 6.522 -3.111 1.00 . A A . 2 PHE CZ 1 1 9 1829 1 1 2 PHE H H -7.695 1.229 -2.897 1.00 . A A . 2 PHE H 1 1 9 1830 1 1 2 PHE HA H -5.197 2.393 -2.198 1.00 . A A . 2 PHE HA 1 1 9 1831 1 1 2 PHE HB2 H -7.922 2.348 -0.939 1.00 . A A . 2 PHE HB2 1 1 9 1832 1 1 2 PHE HB3 H -6.551 3.026 -0.065 1.00 . A A . 2 PHE HB3 1 1 9 1833 1 1 2 PHE HD1 H -9.126 3.670 -2.400 1.00 . A A . 2 PHE HD1 1 1 9 1834 1 1 2 PHE HD2 H -5.184 4.838 -1.299 1.00 . A A . 2 PHE HD2 1 1 9 1835 1 1 2 PHE HE1 H -9.430 5.802 -3.590 1.00 . A A . 2 PHE HE1 1 1 9 1836 1 1 2 PHE HE2 H -5.482 6.973 -2.485 1.00 . A A . 2 PHE HE2 1 1 9 1837 1 1 2 PHE HZ H -7.607 7.458 -3.631 1.00 . A A . 2 PHE HZ 1 1 9 1838 1 1 2 PHE N N -6.719 1.157 -2.845 1.00 . A A . 2 PHE N 1 1 9 1839 1 1 2 PHE O O -4.299 0.945 -0.335 1.00 . A A . 2 PHE O 1 1 9 1840 1 1 3 TRP C C -4.564 -1.878 0.061 1.00 . A A . 3 TRP C 1 1 9 1841 1 1 3 TRP CA C -5.838 -1.187 0.538 1.00 . A A . 3 TRP CA 1 1 9 1842 1 1 3 TRP CB C -6.952 -2.219 0.727 1.00 . A A . 3 TRP CB 1 1 9 1843 1 1 3 TRP CD1 C -8.244 -0.808 2.433 1.00 . A A . 3 TRP CD1 1 1 9 1844 1 1 3 TRP CD2 C -9.540 -1.887 0.960 1.00 . A A . 3 TRP CD2 1 1 9 1845 1 1 3 TRP CE2 C -10.366 -1.153 1.833 1.00 . A A . 3 TRP CE2 1 1 9 1846 1 1 3 TRP CE3 C -10.136 -2.644 -0.053 1.00 . A A . 3 TRP CE3 1 1 9 1847 1 1 3 TRP CG C -8.186 -1.651 1.361 1.00 . A A . 3 TRP CG 1 1 9 1848 1 1 3 TRP CH2 C -12.310 -1.908 0.724 1.00 . A A . 3 TRP CH2 1 1 9 1849 1 1 3 TRP CZ2 C -11.755 -1.158 1.723 1.00 . A A . 3 TRP CZ2 1 1 9 1850 1 1 3 TRP CZ3 C -11.512 -2.647 -0.161 1.00 . A A . 3 TRP CZ3 1 1 9 1851 1 1 3 TRP H H -7.161 -0.198 -0.787 1.00 . A A . 3 TRP H 1 1 9 1852 1 1 3 TRP HA H -5.641 -0.706 1.485 1.00 . A A . 3 TRP HA 1 1 9 1853 1 1 3 TRP HB2 H -7.226 -2.626 -0.234 1.00 . A A . 3 TRP HB2 1 1 9 1854 1 1 3 TRP HB3 H -6.589 -3.017 1.361 1.00 . A A . 3 TRP HB3 1 1 9 1855 1 1 3 TRP HD1 H -7.380 -0.442 2.966 1.00 . A A . 3 TRP HD1 1 1 9 1856 1 1 3 TRP HE1 H -9.853 0.082 3.449 1.00 . A A . 3 TRP HE1 1 1 9 1857 1 1 3 TRP HE3 H -9.537 -3.220 -0.744 1.00 . A A . 3 TRP HE3 1 1 9 1858 1 1 3 TRP HH2 H -13.382 -1.940 0.603 1.00 . A A . 3 TRP HH2 1 1 9 1859 1 1 3 TRP HZ2 H -12.383 -0.593 2.396 1.00 . A A . 3 TRP HZ2 1 1 9 1860 1 1 3 TRP HZ3 H -11.990 -3.227 -0.937 1.00 . A A . 3 TRP HZ3 1 1 9 1861 1 1 3 TRP N N -6.258 -0.158 -0.408 1.00 . A A . 3 TRP N 1 1 9 1862 1 1 3 TRP NE1 N -9.552 -0.505 2.724 1.00 . A A . 3 TRP NE1 1 1 9 1863 1 1 3 TRP O O -3.695 -2.218 0.864 1.00 . A A . 3 TRP O 1 1 9 1864 1 1 4 LEU C C -2.159 -1.732 -2.035 1.00 . A A . 4 LEU C 1 1 9 1865 1 1 4 LEU CA C -3.293 -2.731 -1.831 1.00 . A A . 4 LEU CA 1 1 9 1866 1 1 4 LEU CB C -3.661 -3.383 -3.164 1.00 . A A . 4 LEU CB 1 1 9 1867 1 1 4 LEU CD1 C -5.086 -5.050 -4.379 1.00 . A A . 4 LEU CD1 1 1 9 1868 1 1 4 LEU CD2 C -3.361 -5.837 -2.748 1.00 . A A . 4 LEU CD2 1 1 9 1869 1 1 4 LEU CG C -4.361 -4.740 -3.078 1.00 . A A . 4 LEU CG 1 1 9 1870 1 1 4 LEU H H -5.187 -1.787 -1.836 1.00 . A A . 4 LEU H 1 1 9 1871 1 1 4 LEU HA H -2.963 -3.496 -1.144 1.00 . A A . 4 LEU HA 1 1 9 1872 1 1 4 LEU HB2 H -4.312 -2.706 -3.695 1.00 . A A . 4 LEU HB2 1 1 9 1873 1 1 4 LEU HB3 H -2.748 -3.517 -3.729 1.00 . A A . 4 LEU HB3 1 1 9 1874 1 1 4 LEU HD11 H -5.825 -4.287 -4.571 1.00 . A A . 4 LEU HD11 1 1 9 1875 1 1 4 LEU HD12 H -4.373 -5.071 -5.191 1.00 . A A . 4 LEU HD12 1 1 9 1876 1 1 4 LEU HD13 H -5.571 -6.010 -4.300 1.00 . A A . 4 LEU HD13 1 1 9 1877 1 1 4 LEU HD21 H -3.666 -6.342 -1.843 1.00 . A A . 4 LEU HD21 1 1 9 1878 1 1 4 LEU HD22 H -3.324 -6.547 -3.561 1.00 . A A . 4 LEU HD22 1 1 9 1879 1 1 4 LEU HD23 H -2.383 -5.402 -2.604 1.00 . A A . 4 LEU HD23 1 1 9 1880 1 1 4 LEU HG H -5.098 -4.706 -2.287 1.00 . A A . 4 LEU HG 1 1 9 1881 1 1 4 LEU N N -4.461 -2.082 -1.247 1.00 . A A . 4 LEU N 1 1 9 1882 1 1 4 LEU O O -0.992 -2.043 -1.796 1.00 . A A . 4 LEU O 1 1 9 1883 1 1 5 PHE C C -0.759 0.843 -1.432 1.00 . A A . 5 PHE C 1 1 9 1884 1 1 5 PHE CA C -1.522 0.518 -2.712 1.00 . A A . 5 PHE CA 1 1 9 1885 1 1 5 PHE CB C -2.203 1.779 -3.248 1.00 . A A . 5 PHE CB 1 1 9 1886 1 1 5 PHE CD1 C -0.204 2.749 -4.414 1.00 . A A . 5 PHE CD1 1 1 9 1887 1 1 5 PHE CD2 C -1.395 4.125 -2.874 1.00 . A A . 5 PHE CD2 1 1 9 1888 1 1 5 PHE CE1 C 0.677 3.785 -4.663 1.00 . A A . 5 PHE CE1 1 1 9 1889 1 1 5 PHE CE2 C -0.517 5.165 -3.119 1.00 . A A . 5 PHE CE2 1 1 9 1890 1 1 5 PHE CG C -1.248 2.906 -3.518 1.00 . A A . 5 PHE CG 1 1 9 1891 1 1 5 PHE CZ C 0.518 4.995 -4.016 1.00 . A A . 5 PHE CZ 1 1 9 1892 1 1 5 PHE H H -3.457 -0.340 -2.650 1.00 . A A . 5 PHE H 1 1 9 1893 1 1 5 PHE HA H -0.825 0.154 -3.451 1.00 . A A . 5 PHE HA 1 1 9 1894 1 1 5 PHE HB2 H -2.705 1.543 -4.175 1.00 . A A . 5 PHE HB2 1 1 9 1895 1 1 5 PHE HB3 H -2.929 2.122 -2.527 1.00 . A A . 5 PHE HB3 1 1 9 1896 1 1 5 PHE HD1 H -0.080 1.805 -4.924 1.00 . A A . 5 PHE HD1 1 1 9 1897 1 1 5 PHE HD2 H -2.206 4.259 -2.172 1.00 . A A . 5 PHE HD2 1 1 9 1898 1 1 5 PHE HE1 H 1.485 3.650 -5.366 1.00 . A A . 5 PHE HE1 1 1 9 1899 1 1 5 PHE HE2 H -0.644 6.109 -2.611 1.00 . A A . 5 PHE HE2 1 1 9 1900 1 1 5 PHE HZ H 1.206 5.806 -4.208 1.00 . A A . 5 PHE HZ 1 1 9 1901 1 1 5 PHE N N -2.511 -0.528 -2.476 1.00 . A A . 5 PHE N 1 1 9 1902 1 1 5 PHE O O 0.472 0.823 -1.408 1.00 . A A . 5 PHE O 1 1 9 1903 1 1 6 ARG C C 0.014 0.347 1.395 1.00 . A A . 6 ARG C 1 1 9 1904 1 1 6 ARG CA C -0.892 1.477 0.915 1.00 . A A . 6 ARG CA 1 1 9 1905 1 1 6 ARG CB C -1.976 1.754 1.957 1.00 . A A . 6 ARG CB 1 1 9 1906 1 1 6 ARG CD C -2.639 2.969 4.055 1.00 . A A . 6 ARG CD 1 1 9 1907 1 1 6 ARG CG C -1.494 2.598 3.125 1.00 . A A . 6 ARG CG 1 1 9 1908 1 1 6 ARG CZ C -4.241 1.847 5.546 1.00 . A A . 6 ARG CZ 1 1 9 1909 1 1 6 ARG H H -2.476 1.145 -0.451 1.00 . A A . 6 ARG H 1 1 9 1910 1 1 6 ARG HA H -0.297 2.367 0.779 1.00 . A A . 6 ARG HA 1 1 9 1911 1 1 6 ARG HB2 H -2.794 2.274 1.480 1.00 . A A . 6 ARG HB2 1 1 9 1912 1 1 6 ARG HB3 H -2.336 0.814 2.345 1.00 . A A . 6 ARG HB3 1 1 9 1913 1 1 6 ARG HD2 H -2.252 3.581 4.855 1.00 . A A . 6 ARG HD2 1 1 9 1914 1 1 6 ARG HD3 H -3.373 3.529 3.495 1.00 . A A . 6 ARG HD3 1 1 9 1915 1 1 6 ARG HE H -2.981 0.912 4.316 1.00 . A A . 6 ARG HE 1 1 9 1916 1 1 6 ARG HG2 H -0.759 2.038 3.684 1.00 . A A . 6 ARG HG2 1 1 9 1917 1 1 6 ARG HG3 H -1.046 3.504 2.744 1.00 . A A . 6 ARG HG3 1 1 9 1918 1 1 6 ARG HH11 H -4.267 3.866 5.634 1.00 . A A . 6 ARG HH11 1 1 9 1919 1 1 6 ARG HH12 H -5.390 3.063 6.681 1.00 . A A . 6 ARG HH12 1 1 9 1920 1 1 6 ARG HH21 H -4.457 -0.156 5.689 1.00 . A A . 6 ARG HH21 1 1 9 1921 1 1 6 ARG HH22 H -5.497 0.775 6.711 1.00 . A A . 6 ARG HH22 1 1 9 1922 1 1 6 ARG N N -1.498 1.144 -0.370 1.00 . A A . 6 ARG N 1 1 9 1923 1 1 6 ARG NE N -3.281 1.790 4.630 1.00 . A A . 6 ARG NE 1 1 9 1924 1 1 6 ARG NH1 N -4.666 3.022 5.991 1.00 . A A . 6 ARG NH1 1 1 9 1925 1 1 6 ARG NH2 N -4.776 0.730 6.021 1.00 . A A . 6 ARG NH2 1 1 9 1926 1 1 6 ARG O O 1.181 0.568 1.714 1.00 . A A . 6 ARG O 1 1 9 1927 1 1 7 GLY C C 1.522 -2.184 1.100 1.00 . A A . 7 GLY C 1 1 9 1928 1 1 7 GLY CA C 0.240 -2.009 1.889 1.00 . A A . 7 GLY CA 1 1 9 1929 1 1 7 GLY H H -1.469 -0.981 1.177 1.00 . A A . 7 GLY H 1 1 9 1930 1 1 7 GLY HA2 H 0.485 -1.881 2.932 1.00 . A A . 7 GLY HA2 1 1 9 1931 1 1 7 GLY HA3 H -0.362 -2.899 1.777 1.00 . A A . 7 GLY HA3 1 1 9 1932 1 1 7 GLY N N -0.533 -0.864 1.445 1.00 . A A . 7 GLY N 1 1 9 1933 1 1 7 GLY O O 2.539 -2.615 1.642 1.00 . A A . 7 GLY O 1 1 9 1934 1 1 8 LYS C C 3.754 -1.034 -0.602 1.00 . A A . 8 LYS C 1 1 9 1935 1 1 8 LYS CA C 2.641 -1.974 -1.052 1.00 . A A . 8 LYS CA 1 1 9 1936 1 1 8 LYS CB C 2.259 -1.671 -2.503 1.00 . A A . 8 LYS CB 1 1 9 1937 1 1 8 LYS CD C 2.971 -1.754 -4.909 1.00 . A A . 8 LYS CD 1 1 9 1938 1 1 8 LYS CE C 3.349 -2.750 -5.997 1.00 . A A . 8 LYS CE 1 1 9 1939 1 1 8 LYS CG C 3.158 -2.347 -3.523 1.00 . A A . 8 LYS CG 1 1 9 1940 1 1 8 LYS H H 0.634 -1.513 -0.561 1.00 . A A . 8 LYS H 1 1 9 1941 1 1 8 LYS HA H 2.997 -2.992 -0.989 1.00 . A A . 8 LYS HA 1 1 9 1942 1 1 8 LYS HB2 H 1.244 -2.001 -2.673 1.00 . A A . 8 LYS HB2 1 1 9 1943 1 1 8 LYS HB3 H 2.309 -0.602 -2.660 1.00 . A A . 8 LYS HB3 1 1 9 1944 1 1 8 LYS HD2 H 1.936 -1.475 -5.037 1.00 . A A . 8 LYS HD2 1 1 9 1945 1 1 8 LYS HD3 H 3.597 -0.878 -5.005 1.00 . A A . 8 LYS HD3 1 1 9 1946 1 1 8 LYS HE2 H 3.682 -2.204 -6.866 1.00 . A A . 8 LYS HE2 1 1 9 1947 1 1 8 LYS HE3 H 4.152 -3.373 -5.631 1.00 . A A . 8 LYS HE3 1 1 9 1948 1 1 8 LYS HG2 H 4.188 -2.217 -3.224 1.00 . A A . 8 LYS HG2 1 1 9 1949 1 1 8 LYS HG3 H 2.921 -3.400 -3.557 1.00 . A A . 8 LYS HG3 1 1 9 1950 1 1 8 LYS HZ1 H 1.648 -3.872 -5.535 1.00 . A A . 8 LYS HZ1 1 1 9 1951 1 1 8 LYS HZ2 H 1.578 -3.110 -7.044 1.00 . A A . 8 LYS HZ2 1 1 9 1952 1 1 8 LYS HZ3 H 2.541 -4.485 -6.833 1.00 . A A . 8 LYS HZ3 1 1 9 1953 1 1 8 LYS N N 1.474 -1.852 -0.186 1.00 . A A . 8 LYS N 1 1 9 1954 1 1 8 LYS NZ N 2.199 -3.615 -6.379 1.00 . A A . 8 LYS NZ 1 1 9 1955 1 1 8 LYS O O 4.933 -1.383 -0.657 1.00 . A A . 8 LYS O 1 1 9 1956 1 1 9 ALA C C 4.773 0.859 1.740 1.00 . A A . 9 ALA C 1 1 9 1957 1 1 9 ALA CA C 4.338 1.147 0.307 1.00 . A A . 9 ALA CA 1 1 9 1958 1 1 9 ALA CB C 3.752 2.547 0.204 1.00 . A A . 9 ALA CB 1 1 9 1959 1 1 9 ALA H H 2.416 0.378 -0.136 1.00 . A A . 9 ALA H 1 1 9 1960 1 1 9 ALA HA H 5.202 1.095 -0.338 1.00 . A A . 9 ALA HA 1 1 9 1961 1 1 9 ALA HB1 H 2.716 2.527 0.507 1.00 . A A . 9 ALA HB1 1 1 9 1962 1 1 9 ALA HB2 H 4.304 3.217 0.845 1.00 . A A . 9 ALA HB2 1 1 9 1963 1 1 9 ALA HB3 H 3.821 2.890 -0.818 1.00 . A A . 9 ALA HB3 1 1 9 1964 1 1 9 ALA N N 3.372 0.159 -0.157 1.00 . A A . 9 ALA N 1 1 9 1965 1 1 9 ALA O O 5.938 1.049 2.096 1.00 . A A . 9 ALA O 1 1 9 1966 1 1 10 ASP C C 5.225 -0.959 4.059 1.00 . A A . 10 ASP C 1 1 9 1967 1 1 10 ASP CA C 4.121 0.086 3.954 1.00 . A A . 10 ASP CA 1 1 9 1968 1 1 10 ASP CB C 2.857 -0.417 4.656 1.00 . A A . 10 ASP CB 1 1 9 1969 1 1 10 ASP CG C 1.901 0.707 5.001 1.00 . A A . 10 ASP CG 1 1 9 1970 1 1 10 ASP H H 2.923 0.270 2.216 1.00 . A A . 10 ASP H 1 1 9 1971 1 1 10 ASP HA H 4.451 0.993 4.436 1.00 . A A . 10 ASP HA 1 1 9 1972 1 1 10 ASP HB2 H 2.346 -1.114 4.008 1.00 . A A . 10 ASP HB2 1 1 9 1973 1 1 10 ASP HB3 H 3.138 -0.920 5.569 1.00 . A A . 10 ASP HB3 1 1 9 1974 1 1 10 ASP N N 3.834 0.400 2.558 1.00 . A A . 10 ASP N 1 1 9 1975 1 1 10 ASP O O 6.238 -0.743 4.726 1.00 . A A . 10 ASP O 1 1 9 1976 1 1 10 ASP OD1 O 0.675 0.475 4.958 1.00 . A A . 10 ASP OD1 1 1 9 1977 1 1 10 ASP OD2 O 2.377 1.818 5.313 1.00 . A A . 10 ASP OD2 1 1 9 1978 1 1 11 VAL C C 7.386 -2.669 3.000 1.00 . A A . 11 VAL C 1 1 9 1979 1 1 11 VAL CA C 6.006 -3.172 3.413 1.00 . A A . 11 VAL CA 1 1 9 1980 1 1 11 VAL CB C 5.592 -4.325 2.479 1.00 . A A . 11 VAL CB 1 1 9 1981 1 1 11 VAL CG1 C 5.432 -3.824 1.052 1.00 . A A . 11 VAL CG1 1 1 9 1982 1 1 11 VAL CG2 C 6.605 -5.456 2.547 1.00 . A A . 11 VAL CG2 1 1 9 1983 1 1 11 VAL H H 4.201 -2.207 2.880 1.00 . A A . 11 VAL H 1 1 9 1984 1 1 11 VAL HA H 6.062 -3.556 4.422 1.00 . A A . 11 VAL HA 1 1 9 1985 1 1 11 VAL HB H 4.637 -4.704 2.812 1.00 . A A . 11 VAL HB 1 1 9 1986 1 1 11 VAL HG11 H 4.729 -3.005 1.034 1.00 . A A . 11 VAL HG11 1 1 9 1987 1 1 11 VAL HG12 H 6.389 -3.486 0.681 1.00 . A A . 11 VAL HG12 1 1 9 1988 1 1 11 VAL HG13 H 5.067 -4.626 0.428 1.00 . A A . 11 VAL HG13 1 1 9 1989 1 1 11 VAL HG21 H 7.572 -5.093 2.231 1.00 . A A . 11 VAL HG21 1 1 9 1990 1 1 11 VAL HG22 H 6.670 -5.822 3.561 1.00 . A A . 11 VAL HG22 1 1 9 1991 1 1 11 VAL HG23 H 6.292 -6.259 1.895 1.00 . A A . 11 VAL HG23 1 1 9 1992 1 1 11 VAL N N 5.027 -2.093 3.395 1.00 . A A . 11 VAL N 1 1 9 1993 1 1 11 VAL O O 8.405 -3.122 3.521 1.00 . A A . 11 VAL O 1 1 9 1994 1 1 12 ALA C C 8.437 0.199 0.933 1.00 . A A . 12 ALA C 1 1 9 1995 1 1 12 ALA CA C 8.662 -1.164 1.578 1.00 . A A . 12 ALA CA 1 1 9 1996 1 1 12 ALA CB C 9.326 -2.114 0.592 1.00 . A A . 12 ALA CB 1 1 9 1997 1 1 12 ALA H H 6.563 -1.411 1.683 1.00 . A A . 12 ALA H 1 1 9 1998 1 1 12 ALA HA H 9.323 -1.045 2.425 1.00 . A A . 12 ALA HA 1 1 9 1999 1 1 12 ALA HB1 H 9.134 -3.134 0.888 1.00 . A A . 12 ALA HB1 1 1 9 2000 1 1 12 ALA HB2 H 8.925 -1.944 -0.398 1.00 . A A . 12 ALA HB2 1 1 9 2001 1 1 12 ALA HB3 H 10.392 -1.937 0.582 1.00 . A A . 12 ALA HB3 1 1 9 2002 1 1 12 ALA N N 7.410 -1.730 2.060 1.00 . A A . 12 ALA N 1 1 9 2003 1 1 12 ALA O O 7.621 0.338 0.020 1.00 . A A . 12 ALA O 1 1 9 2004 1 1 13 LEU C C 9.873 2.722 -0.387 1.00 . A A . 13 LEU C 1 1 9 2005 1 1 13 LEU CA C 9.042 2.558 0.882 1.00 . A A . 13 LEU CA 1 1 9 2006 1 1 13 LEU CB C 9.483 3.579 1.932 1.00 . A A . 13 LEU CB 1 1 9 2007 1 1 13 LEU CD1 C 9.435 2.574 4.228 1.00 . A A . 13 LEU CD1 1 1 9 2008 1 1 13 LEU CD2 C 8.648 4.923 3.877 1.00 . A A . 13 LEU CD2 1 1 9 2009 1 1 13 LEU CG C 8.742 3.531 3.269 1.00 . A A . 13 LEU CG 1 1 9 2010 1 1 13 LEU H H 9.796 1.031 2.139 1.00 . A A . 13 LEU H 1 1 9 2011 1 1 13 LEU HA H 8.002 2.726 0.641 1.00 . A A . 13 LEU HA 1 1 9 2012 1 1 13 LEU HB2 H 10.533 3.417 2.129 1.00 . A A . 13 LEU HB2 1 1 9 2013 1 1 13 LEU HB3 H 9.346 4.564 1.511 1.00 . A A . 13 LEU HB3 1 1 9 2014 1 1 13 LEU HD11 H 9.196 1.557 3.955 1.00 . A A . 13 LEU HD11 1 1 9 2015 1 1 13 LEU HD12 H 10.502 2.720 4.176 1.00 . A A . 13 LEU HD12 1 1 9 2016 1 1 13 LEU HD13 H 9.093 2.765 5.234 1.00 . A A . 13 LEU HD13 1 1 9 2017 1 1 13 LEU HD21 H 9.179 4.941 4.816 1.00 . A A . 13 LEU HD21 1 1 9 2018 1 1 13 LEU HD22 H 9.088 5.640 3.200 1.00 . A A . 13 LEU HD22 1 1 9 2019 1 1 13 LEU HD23 H 7.611 5.172 4.043 1.00 . A A . 13 LEU HD23 1 1 9 2020 1 1 13 LEU HG H 7.737 3.167 3.103 1.00 . A A . 13 LEU HG 1 1 9 2021 1 1 13 LEU N N 9.164 1.204 1.412 1.00 . A A . 13 LEU N 1 1 9 2022 1 1 13 LEU O O 9.331 2.921 -1.474 1.00 . A A . 13 LEU O 1 1 9 2023 1 1 14 NH2 HN1 H 11.564 2.476 0.653 1.00 . A A . 14 NH2 HN1 1 1 9 2024 1 1 14 NH2 HN2 H 11.812 2.729 -1.017 1.00 . A A . 14 NH2 HN2 1 1 9 2025 1 1 14 NH2 N N 11.190 2.635 -0.240 1.00 . A A . 14 NH2 N 1 1 10 2026 1 1 1 ILE C C -6.141 0.227 -3.529 1.00 . A A . 1 ILE C 1 1 10 2027 1 1 1 ILE CA C -7.009 -0.395 -4.617 1.00 . A A . 1 ILE CA 1 1 10 2028 1 1 1 ILE CB C -7.512 0.719 -5.554 1.00 . A A . 1 ILE CB 1 1 10 2029 1 1 1 ILE CD1 C -9.092 1.181 -7.496 1.00 . A A . 1 ILE CD1 1 1 10 2030 1 1 1 ILE CG1 C -8.417 0.132 -6.639 1.00 . A A . 1 ILE CG1 1 1 10 2031 1 1 1 ILE CG2 C -6.337 1.457 -6.179 1.00 . A A . 1 ILE CG2 1 1 10 2032 1 1 1 ILE H1 H -8.661 -0.734 -3.340 1.00 . A A . 1 ILE H1 1 1 10 2033 1 1 1 ILE HA H -6.406 -1.079 -5.196 1.00 . A A . 1 ILE HA 1 1 10 2034 1 1 1 ILE HB H -8.077 1.424 -4.966 1.00 . A A . 1 ILE HB 1 1 10 2035 1 1 1 ILE HD11 H -8.412 1.505 -8.270 1.00 . A A . 1 ILE HD11 1 1 10 2036 1 1 1 ILE HD12 H -9.978 0.761 -7.949 1.00 . A A . 1 ILE HD12 1 1 10 2037 1 1 1 ILE HD13 H -9.367 2.025 -6.881 1.00 . A A . 1 ILE HD13 1 1 10 2038 1 1 1 ILE HG12 H -7.829 -0.498 -7.288 1.00 . A A . 1 ILE HG12 1 1 10 2039 1 1 1 ILE HG13 H -9.189 -0.461 -6.171 1.00 . A A . 1 ILE HG13 1 1 10 2040 1 1 1 ILE HG21 H -6.705 2.182 -6.891 1.00 . A A . 1 ILE HG21 1 1 10 2041 1 1 1 ILE HG22 H -5.779 1.964 -5.406 1.00 . A A . 1 ILE HG22 1 1 10 2042 1 1 1 ILE HG23 H -5.695 0.751 -6.683 1.00 . A A . 1 ILE HG23 1 1 10 2043 1 1 1 ILE N N -8.116 -1.147 -4.042 1.00 . A A . 1 ILE N 1 1 10 2044 1 1 1 ILE O O -4.957 -0.086 -3.409 1.00 . A A . 1 ILE O 1 1 10 2045 1 1 2 PHE C C -5.374 0.752 -0.720 1.00 . A A . 2 PHE C 1 1 10 2046 1 1 2 PHE CA C -6.021 1.772 -1.653 1.00 . A A . 2 PHE CA 1 1 10 2047 1 1 2 PHE CB C -6.969 2.674 -0.860 1.00 . A A . 2 PHE CB 1 1 10 2048 1 1 2 PHE CD1 C -7.952 1.474 1.113 1.00 . A A . 2 PHE CD1 1 1 10 2049 1 1 2 PHE CD2 C -9.273 1.677 -0.863 1.00 . A A . 2 PHE CD2 1 1 10 2050 1 1 2 PHE CE1 C -8.977 0.785 1.732 1.00 . A A . 2 PHE CE1 1 1 10 2051 1 1 2 PHE CE2 C -10.302 0.990 -0.248 1.00 . A A . 2 PHE CE2 1 1 10 2052 1 1 2 PHE CG C -8.087 1.927 -0.190 1.00 . A A . 2 PHE CG 1 1 10 2053 1 1 2 PHE CZ C -10.154 0.542 1.050 1.00 . A A . 2 PHE CZ 1 1 10 2054 1 1 2 PHE H H -7.685 1.316 -2.878 1.00 . A A . 2 PHE H 1 1 10 2055 1 1 2 PHE HA H -5.246 2.380 -2.095 1.00 . A A . 2 PHE HA 1 1 10 2056 1 1 2 PHE HB2 H -6.410 3.189 -0.094 1.00 . A A . 2 PHE HB2 1 1 10 2057 1 1 2 PHE HB3 H -7.408 3.399 -1.529 1.00 . A A . 2 PHE HB3 1 1 10 2058 1 1 2 PHE HD1 H -7.031 1.662 1.647 1.00 . A A . 2 PHE HD1 1 1 10 2059 1 1 2 PHE HD2 H -9.389 2.025 -1.877 1.00 . A A . 2 PHE HD2 1 1 10 2060 1 1 2 PHE HE1 H -8.858 0.436 2.747 1.00 . A A . 2 PHE HE1 1 1 10 2061 1 1 2 PHE HE2 H -11.221 0.802 -0.783 1.00 . A A . 2 PHE HE2 1 1 10 2062 1 1 2 PHE HZ H -10.958 0.006 1.533 1.00 . A A . 2 PHE HZ 1 1 10 2063 1 1 2 PHE N N -6.739 1.108 -2.733 1.00 . A A . 2 PHE N 1 1 10 2064 1 1 2 PHE O O -4.264 0.960 -0.229 1.00 . A A . 2 PHE O 1 1 10 2065 1 1 3 TRP C C -4.250 -1.957 -0.131 1.00 . A A . 3 TRP C 1 1 10 2066 1 1 3 TRP CA C -5.571 -1.402 0.392 1.00 . A A . 3 TRP CA 1 1 10 2067 1 1 3 TRP CB C -6.599 -2.529 0.513 1.00 . A A . 3 TRP CB 1 1 10 2068 1 1 3 TRP CD1 C -5.366 -4.576 1.442 1.00 . A A . 3 TRP CD1 1 1 10 2069 1 1 3 TRP CD2 C -6.779 -3.616 2.891 1.00 . A A . 3 TRP CD2 1 1 10 2070 1 1 3 TRP CE2 C -6.170 -4.720 3.520 1.00 . A A . 3 TRP CE2 1 1 10 2071 1 1 3 TRP CE3 C -7.705 -2.857 3.610 1.00 . A A . 3 TRP CE3 1 1 10 2072 1 1 3 TRP CG C -6.251 -3.542 1.563 1.00 . A A . 3 TRP CG 1 1 10 2073 1 1 3 TRP CH2 C -7.372 -4.320 5.514 1.00 . A A . 3 TRP CH2 1 1 10 2074 1 1 3 TRP CZ2 C -6.462 -5.082 4.833 1.00 . A A . 3 TRP CZ2 1 1 10 2075 1 1 3 TRP CZ3 C -7.993 -3.217 4.914 1.00 . A A . 3 TRP CZ3 1 1 10 2076 1 1 3 TRP H H -6.954 -0.458 -0.902 1.00 . A A . 3 TRP H 1 1 10 2077 1 1 3 TRP HA H -5.406 -0.971 1.368 1.00 . A A . 3 TRP HA 1 1 10 2078 1 1 3 TRP HB2 H -7.559 -2.106 0.765 1.00 . A A . 3 TRP HB2 1 1 10 2079 1 1 3 TRP HB3 H -6.674 -3.043 -0.434 1.00 . A A . 3 TRP HB3 1 1 10 2080 1 1 3 TRP HD1 H -4.800 -4.790 0.548 1.00 . A A . 3 TRP HD1 1 1 10 2081 1 1 3 TRP HE1 H -4.753 -6.077 2.778 1.00 . A A . 3 TRP HE1 1 1 10 2082 1 1 3 TRP HE3 H -8.194 -2.003 3.166 1.00 . A A . 3 TRP HE3 1 1 10 2083 1 1 3 TRP HH2 H -7.628 -4.565 6.534 1.00 . A A . 3 TRP HH2 1 1 10 2084 1 1 3 TRP HZ2 H -5.991 -5.929 5.309 1.00 . A A . 3 TRP HZ2 1 1 10 2085 1 1 3 TRP HZ3 H -8.707 -2.642 5.486 1.00 . A A . 3 TRP HZ3 1 1 10 2086 1 1 3 TRP N N -6.076 -0.350 -0.481 1.00 . A A . 3 TRP N 1 1 10 2087 1 1 3 TRP NE1 N -5.314 -5.290 2.615 1.00 . A A . 3 TRP NE1 1 1 10 2088 1 1 3 TRP O O -3.352 -2.283 0.646 1.00 . A A . 3 TRP O 1 1 10 2089 1 1 4 LEU C C -1.849 -1.499 -2.147 1.00 . A A . 4 LEU C 1 1 10 2090 1 1 4 LEU CA C -2.926 -2.578 -2.077 1.00 . A A . 4 LEU CA 1 1 10 2091 1 1 4 LEU CB C -3.236 -3.098 -3.481 1.00 . A A . 4 LEU CB 1 1 10 2092 1 1 4 LEU CD1 C -4.554 -4.572 -5.022 1.00 . A A . 4 LEU CD1 1 1 10 2093 1 1 4 LEU CD2 C -3.870 -5.417 -2.769 1.00 . A A . 4 LEU CD2 1 1 10 2094 1 1 4 LEU CG C -4.296 -4.196 -3.572 1.00 . A A . 4 LEU CG 1 1 10 2095 1 1 4 LEU H H -4.888 -1.787 -2.017 1.00 . A A . 4 LEU H 1 1 10 2096 1 1 4 LEU HA H -2.561 -3.395 -1.471 1.00 . A A . 4 LEU HA 1 1 10 2097 1 1 4 LEU HB2 H -3.573 -2.264 -4.076 1.00 . A A . 4 LEU HB2 1 1 10 2098 1 1 4 LEU HB3 H -2.318 -3.487 -3.898 1.00 . A A . 4 LEU HB3 1 1 10 2099 1 1 4 LEU HD11 H -5.298 -5.353 -5.066 1.00 . A A . 4 LEU HD11 1 1 10 2100 1 1 4 LEU HD12 H -4.907 -3.706 -5.562 1.00 . A A . 4 LEU HD12 1 1 10 2101 1 1 4 LEU HD13 H -3.636 -4.925 -5.471 1.00 . A A . 4 LEU HD13 1 1 10 2102 1 1 4 LEU HD21 H -2.886 -5.730 -3.086 1.00 . A A . 4 LEU HD21 1 1 10 2103 1 1 4 LEU HD22 H -3.847 -5.168 -1.718 1.00 . A A . 4 LEU HD22 1 1 10 2104 1 1 4 LEU HD23 H -4.574 -6.220 -2.934 1.00 . A A . 4 LEU HD23 1 1 10 2105 1 1 4 LEU HG H -5.224 -3.828 -3.154 1.00 . A A . 4 LEU HG 1 1 10 2106 1 1 4 LEU N N -4.138 -2.063 -1.450 1.00 . A A . 4 LEU N 1 1 10 2107 1 1 4 LEU O O -0.689 -1.745 -1.819 1.00 . A A . 4 LEU O 1 1 10 2108 1 1 5 PHE C C -0.635 1.091 -1.350 1.00 . A A . 5 PHE C 1 1 10 2109 1 1 5 PHE CA C -1.313 0.811 -2.689 1.00 . A A . 5 PHE CA 1 1 10 2110 1 1 5 PHE CB C -2.042 2.065 -3.177 1.00 . A A . 5 PHE CB 1 1 10 2111 1 1 5 PHE CD1 C -0.757 3.155 -5.037 1.00 . A A . 5 PHE CD1 1 1 10 2112 1 1 5 PHE CD2 C -0.618 4.106 -2.854 1.00 . A A . 5 PHE CD2 1 1 10 2113 1 1 5 PHE CE1 C 0.091 4.134 -5.521 1.00 . A A . 5 PHE CE1 1 1 10 2114 1 1 5 PHE CE2 C 0.229 5.087 -3.333 1.00 . A A . 5 PHE CE2 1 1 10 2115 1 1 5 PHE CG C -1.121 3.130 -3.700 1.00 . A A . 5 PHE CG 1 1 10 2116 1 1 5 PHE CZ C 0.585 5.100 -4.668 1.00 . A A . 5 PHE CZ 1 1 10 2117 1 1 5 PHE H H -3.183 -0.171 -2.822 1.00 . A A . 5 PHE H 1 1 10 2118 1 1 5 PHE HA H -0.557 0.541 -3.411 1.00 . A A . 5 PHE HA 1 1 10 2119 1 1 5 PHE HB2 H -2.718 1.792 -3.972 1.00 . A A . 5 PHE HB2 1 1 10 2120 1 1 5 PHE HB3 H -2.606 2.485 -2.358 1.00 . A A . 5 PHE HB3 1 1 10 2121 1 1 5 PHE HD1 H -1.143 2.398 -5.705 1.00 . A A . 5 PHE HD1 1 1 10 2122 1 1 5 PHE HD2 H -0.894 4.096 -1.810 1.00 . A A . 5 PHE HD2 1 1 10 2123 1 1 5 PHE HE1 H 0.366 4.140 -6.565 1.00 . A A . 5 PHE HE1 1 1 10 2124 1 1 5 PHE HE2 H 0.615 5.842 -2.664 1.00 . A A . 5 PHE HE2 1 1 10 2125 1 1 5 PHE HZ H 1.246 5.867 -5.044 1.00 . A A . 5 PHE HZ 1 1 10 2126 1 1 5 PHE N N -2.243 -0.306 -2.576 1.00 . A A . 5 PHE N 1 1 10 2127 1 1 5 PHE O O 0.592 1.091 -1.250 1.00 . A A . 5 PHE O 1 1 10 2128 1 1 6 ARG C C -0.195 0.405 1.578 1.00 . A A . 6 ARG C 1 1 10 2129 1 1 6 ARG CA C -0.925 1.619 1.007 1.00 . A A . 6 ARG CA 1 1 10 2130 1 1 6 ARG CB C -2.060 2.031 1.945 1.00 . A A . 6 ARG CB 1 1 10 2131 1 1 6 ARG CD C -2.759 2.370 4.336 1.00 . A A . 6 ARG CD 1 1 10 2132 1 1 6 ARG CG C -1.598 2.366 3.353 1.00 . A A . 6 ARG CG 1 1 10 2133 1 1 6 ARG CZ C -3.699 4.639 4.241 1.00 . A A . 6 ARG CZ 1 1 10 2134 1 1 6 ARG H H -2.414 1.323 -0.466 1.00 . A A . 6 ARG H 1 1 10 2135 1 1 6 ARG HA H -0.225 2.436 0.923 1.00 . A A . 6 ARG HA 1 1 10 2136 1 1 6 ARG HB2 H -2.553 2.901 1.536 1.00 . A A . 6 ARG HB2 1 1 10 2137 1 1 6 ARG HB3 H -2.772 1.221 2.006 1.00 . A A . 6 ARG HB3 1 1 10 2138 1 1 6 ARG HD2 H -3.646 2.027 3.824 1.00 . A A . 6 ARG HD2 1 1 10 2139 1 1 6 ARG HD3 H -2.529 1.695 5.147 1.00 . A A . 6 ARG HD3 1 1 10 2140 1 1 6 ARG HE H -2.647 3.904 5.768 1.00 . A A . 6 ARG HE 1 1 10 2141 1 1 6 ARG HG2 H -0.875 1.628 3.670 1.00 . A A . 6 ARG HG2 1 1 10 2142 1 1 6 ARG HG3 H -1.138 3.343 3.348 1.00 . A A . 6 ARG HG3 1 1 10 2143 1 1 6 ARG HH11 H -4.066 3.499 2.615 1.00 . A A . 6 ARG HH11 1 1 10 2144 1 1 6 ARG HH12 H -4.723 5.102 2.561 1.00 . A A . 6 ARG HH12 1 1 10 2145 1 1 6 ARG HH21 H -3.507 6.016 5.709 1.00 . A A . 6 ARG HH21 1 1 10 2146 1 1 6 ARG HH22 H -4.405 6.532 4.322 1.00 . A A . 6 ARG HH22 1 1 10 2147 1 1 6 ARG N N -1.444 1.334 -0.324 1.00 . A A . 6 ARG N 1 1 10 2148 1 1 6 ARG NE N -3.010 3.701 4.881 1.00 . A A . 6 ARG NE 1 1 10 2149 1 1 6 ARG NH1 N -4.203 4.393 3.041 1.00 . A A . 6 ARG NH1 1 1 10 2150 1 1 6 ARG NH2 N -3.885 5.827 4.804 1.00 . A A . 6 ARG NH2 1 1 10 2151 1 1 6 ARG O O 0.946 0.507 2.024 1.00 . A A . 6 ARG O 1 1 10 2152 1 1 7 GLY C C 1.098 -2.236 1.476 1.00 . A A . 7 GLY C 1 1 10 2153 1 1 7 GLY CA C -0.266 -1.960 2.077 1.00 . A A . 7 GLY CA 1 1 10 2154 1 1 7 GLY H H -1.773 -0.766 1.190 1.00 . A A . 7 GLY H 1 1 10 2155 1 1 7 GLY HA2 H -0.165 -1.870 3.148 1.00 . A A . 7 GLY HA2 1 1 10 2156 1 1 7 GLY HA3 H -0.919 -2.792 1.855 1.00 . A A . 7 GLY HA3 1 1 10 2157 1 1 7 GLY N N -0.865 -0.744 1.559 1.00 . A A . 7 GLY N 1 1 10 2158 1 1 7 GLY O O 2.059 -2.512 2.196 1.00 . A A . 7 GLY O 1 1 10 2159 1 1 8 LYS C C 3.486 -1.363 -0.169 1.00 . A A . 8 LYS C 1 1 10 2160 1 1 8 LYS CA C 2.441 -2.407 -0.547 1.00 . A A . 8 LYS CA 1 1 10 2161 1 1 8 LYS CB C 2.217 -2.395 -2.061 1.00 . A A . 8 LYS CB 1 1 10 2162 1 1 8 LYS CD C 3.238 -4.572 -2.788 1.00 . A A . 8 LYS CD 1 1 10 2163 1 1 8 LYS CE C 4.455 -5.234 -3.418 1.00 . A A . 8 LYS CE 1 1 10 2164 1 1 8 LYS CG C 3.336 -3.057 -2.847 1.00 . A A . 8 LYS CG 1 1 10 2165 1 1 8 LYS H H 0.385 -1.939 -0.368 1.00 . A A . 8 LYS H 1 1 10 2166 1 1 8 LYS HA H 2.801 -3.382 -0.253 1.00 . A A . 8 LYS HA 1 1 10 2167 1 1 8 LYS HB2 H 1.296 -2.914 -2.280 1.00 . A A . 8 LYS HB2 1 1 10 2168 1 1 8 LYS HB3 H 2.130 -1.371 -2.391 1.00 . A A . 8 LYS HB3 1 1 10 2169 1 1 8 LYS HD2 H 3.167 -4.881 -1.757 1.00 . A A . 8 LYS HD2 1 1 10 2170 1 1 8 LYS HD3 H 2.351 -4.887 -3.322 1.00 . A A . 8 LYS HD3 1 1 10 2171 1 1 8 LYS HE2 H 5.324 -4.629 -3.211 1.00 . A A . 8 LYS HE2 1 1 10 2172 1 1 8 LYS HE3 H 4.583 -6.212 -2.978 1.00 . A A . 8 LYS HE3 1 1 10 2173 1 1 8 LYS HG2 H 3.274 -2.743 -3.878 1.00 . A A . 8 LYS HG2 1 1 10 2174 1 1 8 LYS HG3 H 4.285 -2.751 -2.430 1.00 . A A . 8 LYS HG3 1 1 10 2175 1 1 8 LYS HZ1 H 5.043 -6.014 -5.264 1.00 . A A . 8 LYS HZ1 1 1 10 2176 1 1 8 LYS HZ2 H 3.373 -5.784 -5.119 1.00 . A A . 8 LYS HZ2 1 1 10 2177 1 1 8 LYS HZ3 H 4.393 -4.455 -5.355 1.00 . A A . 8 LYS HZ3 1 1 10 2178 1 1 8 LYS N N 1.185 -2.163 0.152 1.00 . A A . 8 LYS N 1 1 10 2179 1 1 8 LYS NZ N 4.305 -5.382 -4.892 1.00 . A A . 8 LYS NZ 1 1 10 2180 1 1 8 LYS O O 4.633 -1.698 0.129 1.00 . A A . 8 LYS O 1 1 10 2181 1 1 9 ALA C C 4.605 0.781 1.539 1.00 . A A . 9 ALA C 1 1 10 2182 1 1 9 ALA CA C 3.984 0.996 0.162 1.00 . A A . 9 ALA CA 1 1 10 2183 1 1 9 ALA CB C 3.245 2.325 0.116 1.00 . A A . 9 ALA CB 1 1 10 2184 1 1 9 ALA H H 2.156 0.107 -0.429 1.00 . A A . 9 ALA H 1 1 10 2185 1 1 9 ALA HA H 4.772 1.024 -0.576 1.00 . A A . 9 ALA HA 1 1 10 2186 1 1 9 ALA HB1 H 2.660 2.443 1.016 1.00 . A A . 9 ALA HB1 1 1 10 2187 1 1 9 ALA HB2 H 3.957 3.132 0.041 1.00 . A A . 9 ALA HB2 1 1 10 2188 1 1 9 ALA HB3 H 2.589 2.342 -0.743 1.00 . A A . 9 ALA HB3 1 1 10 2189 1 1 9 ALA N N 3.083 -0.096 -0.182 1.00 . A A . 9 ALA N 1 1 10 2190 1 1 9 ALA O O 5.810 0.957 1.720 1.00 . A A . 9 ALA O 1 1 10 2191 1 1 10 ASP C C 5.401 -0.827 3.875 1.00 . A A . 10 ASP C 1 1 10 2192 1 1 10 ASP CA C 4.243 0.165 3.864 1.00 . A A . 10 ASP CA 1 1 10 2193 1 1 10 ASP CB C 3.099 -0.356 4.736 1.00 . A A . 10 ASP CB 1 1 10 2194 1 1 10 ASP CG C 3.436 -0.322 6.213 1.00 . A A . 10 ASP CG 1 1 10 2195 1 1 10 ASP H H 2.825 0.281 2.298 1.00 . A A . 10 ASP H 1 1 10 2196 1 1 10 ASP HA H 4.588 1.106 4.266 1.00 . A A . 10 ASP HA 1 1 10 2197 1 1 10 ASP HB2 H 2.223 0.253 4.571 1.00 . A A . 10 ASP HB2 1 1 10 2198 1 1 10 ASP HB3 H 2.880 -1.376 4.458 1.00 . A A . 10 ASP HB3 1 1 10 2199 1 1 10 ASP N N 3.775 0.404 2.504 1.00 . A A . 10 ASP N 1 1 10 2200 1 1 10 ASP O O 6.472 -0.541 4.408 1.00 . A A . 10 ASP O 1 1 10 2201 1 1 10 ASP OD1 O 3.253 0.743 6.839 1.00 . A A . 10 ASP OD1 1 1 10 2202 1 1 10 ASP OD2 O 3.882 -1.360 6.746 1.00 . A A . 10 ASP OD2 1 1 10 2203 1 1 11 VAL C C 7.411 -2.564 2.423 1.00 . A A . 11 VAL C 1 1 10 2204 1 1 11 VAL CA C 6.202 -3.032 3.223 1.00 . A A . 11 VAL CA 1 1 10 2205 1 1 11 VAL CB C 5.654 -4.327 2.597 1.00 . A A . 11 VAL CB 1 1 10 2206 1 1 11 VAL CG1 C 6.715 -5.417 2.607 1.00 . A A . 11 VAL CG1 1 1 10 2207 1 1 11 VAL CG2 C 4.401 -4.786 3.328 1.00 . A A . 11 VAL CG2 1 1 10 2208 1 1 11 VAL H H 4.302 -2.166 2.875 1.00 . A A . 11 VAL H 1 1 10 2209 1 1 11 VAL HA H 6.514 -3.251 4.234 1.00 . A A . 11 VAL HA 1 1 10 2210 1 1 11 VAL HB H 5.391 -4.123 1.569 1.00 . A A . 11 VAL HB 1 1 10 2211 1 1 11 VAL HG11 H 6.261 -6.365 2.365 1.00 . A A . 11 VAL HG11 1 1 10 2212 1 1 11 VAL HG12 H 7.476 -5.186 1.877 1.00 . A A . 11 VAL HG12 1 1 10 2213 1 1 11 VAL HG13 H 7.164 -5.473 3.588 1.00 . A A . 11 VAL HG13 1 1 10 2214 1 1 11 VAL HG21 H 4.522 -5.811 3.644 1.00 . A A . 11 VAL HG21 1 1 10 2215 1 1 11 VAL HG22 H 4.239 -4.159 4.192 1.00 . A A . 11 VAL HG22 1 1 10 2216 1 1 11 VAL HG23 H 3.550 -4.711 2.666 1.00 . A A . 11 VAL HG23 1 1 10 2217 1 1 11 VAL N N 5.177 -1.996 3.283 1.00 . A A . 11 VAL N 1 1 10 2218 1 1 11 VAL O O 8.549 -2.665 2.880 1.00 . A A . 11 VAL O 1 1 10 2219 1 1 12 ALA C C 9.263 -2.652 0.103 1.00 . A A . 12 ALA C 1 1 10 2220 1 1 12 ALA CA C 8.224 -1.565 0.358 1.00 . A A . 12 ALA CA 1 1 10 2221 1 1 12 ALA CB C 8.881 -0.336 0.970 1.00 . A A . 12 ALA CB 1 1 10 2222 1 1 12 ALA H H 6.228 -1.997 0.914 1.00 . A A . 12 ALA H 1 1 10 2223 1 1 12 ALA HA H 7.783 -1.275 -0.585 1.00 . A A . 12 ALA HA 1 1 10 2224 1 1 12 ALA HB1 H 9.697 -0.014 0.342 1.00 . A A . 12 ALA HB1 1 1 10 2225 1 1 12 ALA HB2 H 8.153 0.458 1.051 1.00 . A A . 12 ALA HB2 1 1 10 2226 1 1 12 ALA HB3 H 9.258 -0.581 1.953 1.00 . A A . 12 ALA HB3 1 1 10 2227 1 1 12 ALA N N 7.156 -2.051 1.223 1.00 . A A . 12 ALA N 1 1 10 2228 1 1 12 ALA O O 10.465 -2.387 0.105 1.00 . A A . 12 ALA O 1 1 10 2229 1 1 13 LEU C C 10.305 -4.901 -1.757 1.00 . A A . 13 LEU C 1 1 10 2230 1 1 13 LEU CA C 9.681 -5.002 -0.368 1.00 . A A . 13 LEU CA 1 1 10 2231 1 1 13 LEU CB C 8.915 -6.321 -0.235 1.00 . A A . 13 LEU CB 1 1 10 2232 1 1 13 LEU CD1 C 10.790 -7.894 0.306 1.00 . A A . 13 LEU CD1 1 1 10 2233 1 1 13 LEU CD2 C 8.710 -8.758 -0.784 1.00 . A A . 13 LEU CD2 1 1 10 2234 1 1 13 LEU CG C 9.666 -7.579 -0.671 1.00 . A A . 13 LEU CG 1 1 10 2235 1 1 13 LEU H H 7.823 -4.023 -0.101 1.00 . A A . 13 LEU H 1 1 10 2236 1 1 13 LEU HA H 10.469 -4.978 0.370 1.00 . A A . 13 LEU HA 1 1 10 2237 1 1 13 LEU HB2 H 8.642 -6.440 0.800 1.00 . A A . 13 LEU HB2 1 1 10 2238 1 1 13 LEU HB3 H 8.020 -6.244 -0.837 1.00 . A A . 13 LEU HB3 1 1 10 2239 1 1 13 LEU HD11 H 11.083 -8.928 0.195 1.00 . A A . 13 LEU HD11 1 1 10 2240 1 1 13 LEU HD12 H 11.636 -7.256 0.098 1.00 . A A . 13 LEU HD12 1 1 10 2241 1 1 13 LEU HD13 H 10.448 -7.723 1.315 1.00 . A A . 13 LEU HD13 1 1 10 2242 1 1 13 LEU HD21 H 8.020 -8.743 0.046 1.00 . A A . 13 LEU HD21 1 1 10 2243 1 1 13 LEU HD22 H 8.161 -8.687 -1.711 1.00 . A A . 13 LEU HD22 1 1 10 2244 1 1 13 LEU HD23 H 9.273 -9.681 -0.770 1.00 . A A . 13 LEU HD23 1 1 10 2245 1 1 13 LEU HG H 10.108 -7.410 -1.643 1.00 . A A . 13 LEU HG 1 1 10 2246 1 1 13 LEU N N 8.792 -3.874 -0.113 1.00 . A A . 13 LEU N 1 1 10 2247 1 1 13 LEU O O 11.470 -5.246 -1.950 1.00 . A A . 13 LEU O 1 1 10 2248 1 1 14 NH2 HN1 H 8.601 -4.164 -2.502 1.00 . A A . 14 NH2 HN1 1 1 10 2249 1 1 14 NH2 HN2 H 9.850 -4.319 -3.657 1.00 . A A . 14 NH2 HN2 1 1 10 2250 1 1 14 NH2 N N 9.522 -4.423 -2.719 1.00 . A A . 14 NH2 N 1 1 11 2251 1 1 1 ILE C C -6.198 0.263 -3.680 1.00 . A A . 1 ILE C 1 1 11 2252 1 1 1 ILE CA C -6.900 -0.604 -4.718 1.00 . A A . 1 ILE CA 1 1 11 2253 1 1 1 ILE CB C -7.641 0.308 -5.715 1.00 . A A . 1 ILE CB 1 1 11 2254 1 1 1 ILE CD1 C -9.281 0.283 -7.662 1.00 . A A . 1 ILE CD1 1 1 11 2255 1 1 1 ILE CG1 C -8.389 -0.532 -6.752 1.00 . A A . 1 ILE CG1 1 1 11 2256 1 1 1 ILE CG2 C -6.661 1.251 -6.399 1.00 . A A . 1 ILE CG2 1 1 11 2257 1 1 1 ILE H1 H -8.773 -1.474 -4.254 1.00 . A A . 1 ILE H1 1 1 11 2258 1 1 1 ILE HA H -6.157 -1.169 -5.263 1.00 . A A . 1 ILE HA 1 1 11 2259 1 1 1 ILE HB H -8.352 0.905 -5.164 1.00 . A A . 1 ILE HB 1 1 11 2260 1 1 1 ILE HD11 H -10.297 -0.074 -7.586 1.00 . A A . 1 ILE HD11 1 1 11 2261 1 1 1 ILE HD12 H -9.240 1.321 -7.369 1.00 . A A . 1 ILE HD12 1 1 11 2262 1 1 1 ILE HD13 H -8.940 0.183 -8.682 1.00 . A A . 1 ILE HD13 1 1 11 2263 1 1 1 ILE HG12 H -7.674 -1.054 -7.368 1.00 . A A . 1 ILE HG12 1 1 11 2264 1 1 1 ILE HG13 H -9.010 -1.254 -6.238 1.00 . A A . 1 ILE HG13 1 1 11 2265 1 1 1 ILE HG21 H -6.763 2.241 -5.980 1.00 . A A . 1 ILE HG21 1 1 11 2266 1 1 1 ILE HG22 H -5.652 0.896 -6.244 1.00 . A A . 1 ILE HG22 1 1 11 2267 1 1 1 ILE HG23 H -6.873 1.284 -7.458 1.00 . A A . 1 ILE HG23 1 1 11 2268 1 1 1 ILE N N -7.811 -1.551 -4.086 1.00 . A A . 1 ILE N 1 1 11 2269 1 1 1 ILE O O -4.970 0.350 -3.656 1.00 . A A . 1 ILE O 1 1 11 2270 1 1 2 PHE C C -5.628 0.946 -0.770 1.00 . A A . 2 PHE C 1 1 11 2271 1 1 2 PHE CA C -6.440 1.759 -1.774 1.00 . A A . 2 PHE CA 1 1 11 2272 1 1 2 PHE CB C -7.567 2.501 -1.054 1.00 . A A . 2 PHE CB 1 1 11 2273 1 1 2 PHE CD1 C -9.396 3.266 -2.591 1.00 . A A . 2 PHE CD1 1 1 11 2274 1 1 2 PHE CD2 C -7.687 4.820 -2.001 1.00 . A A . 2 PHE CD2 1 1 11 2275 1 1 2 PHE CE1 C -10.008 4.230 -3.369 1.00 . A A . 2 PHE CE1 1 1 11 2276 1 1 2 PHE CE2 C -8.294 5.788 -2.778 1.00 . A A . 2 PHE CE2 1 1 11 2277 1 1 2 PHE CG C -8.230 3.550 -1.899 1.00 . A A . 2 PHE CG 1 1 11 2278 1 1 2 PHE CZ C -9.457 5.492 -3.464 1.00 . A A . 2 PHE CZ 1 1 11 2279 1 1 2 PHE H H -7.957 0.789 -2.889 1.00 . A A . 2 PHE H 1 1 11 2280 1 1 2 PHE HA H -5.789 2.479 -2.245 1.00 . A A . 2 PHE HA 1 1 11 2281 1 1 2 PHE HB2 H -8.323 1.790 -0.755 1.00 . A A . 2 PHE HB2 1 1 11 2282 1 1 2 PHE HB3 H -7.166 2.984 -0.176 1.00 . A A . 2 PHE HB3 1 1 11 2283 1 1 2 PHE HD1 H -9.829 2.278 -2.519 1.00 . A A . 2 PHE HD1 1 1 11 2284 1 1 2 PHE HD2 H -6.778 5.054 -1.467 1.00 . A A . 2 PHE HD2 1 1 11 2285 1 1 2 PHE HE1 H -10.917 3.995 -3.905 1.00 . A A . 2 PHE HE1 1 1 11 2286 1 1 2 PHE HE2 H -7.862 6.775 -2.850 1.00 . A A . 2 PHE HE2 1 1 11 2287 1 1 2 PHE HZ H -9.934 6.247 -4.071 1.00 . A A . 2 PHE HZ 1 1 11 2288 1 1 2 PHE N N -6.985 0.899 -2.818 1.00 . A A . 2 PHE N 1 1 11 2289 1 1 2 PHE O O -4.459 1.242 -0.516 1.00 . A A . 2 PHE O 1 1 11 2290 1 1 3 TRP C C -4.351 -1.588 0.172 1.00 . A A . 3 TRP C 1 1 11 2291 1 1 3 TRP CA C -5.590 -0.935 0.773 1.00 . A A . 3 TRP CA 1 1 11 2292 1 1 3 TRP CB C -6.555 -2.010 1.279 1.00 . A A . 3 TRP CB 1 1 11 2293 1 1 3 TRP CD1 C -4.972 -2.757 3.151 1.00 . A A . 3 TRP CD1 1 1 11 2294 1 1 3 TRP CD2 C -6.141 -4.422 2.214 1.00 . A A . 3 TRP CD2 1 1 11 2295 1 1 3 TRP CE2 C -5.316 -4.963 3.220 1.00 . A A . 3 TRP CE2 1 1 11 2296 1 1 3 TRP CE3 C -6.969 -5.282 1.488 1.00 . A A . 3 TRP CE3 1 1 11 2297 1 1 3 TRP CG C -5.906 -3.010 2.187 1.00 . A A . 3 TRP CG 1 1 11 2298 1 1 3 TRP CH2 C -6.118 -7.141 2.787 1.00 . A A . 3 TRP CH2 1 1 11 2299 1 1 3 TRP CZ2 C -5.297 -6.323 3.515 1.00 . A A . 3 TRP CZ2 1 1 11 2300 1 1 3 TRP CZ3 C -6.948 -6.633 1.781 1.00 . A A . 3 TRP CZ3 1 1 11 2301 1 1 3 TRP H H -7.185 -0.265 -0.448 1.00 . A A . 3 TRP H 1 1 11 2302 1 1 3 TRP HA H -5.288 -0.316 1.604 1.00 . A A . 3 TRP HA 1 1 11 2303 1 1 3 TRP HB2 H -7.357 -1.536 1.824 1.00 . A A . 3 TRP HB2 1 1 11 2304 1 1 3 TRP HB3 H -6.963 -2.542 0.433 1.00 . A A . 3 TRP HB3 1 1 11 2305 1 1 3 TRP HD1 H -4.582 -1.777 3.377 1.00 . A A . 3 TRP HD1 1 1 11 2306 1 1 3 TRP HE1 H -3.961 -4.006 4.503 1.00 . A A . 3 TRP HE1 1 1 11 2307 1 1 3 TRP HE3 H -7.616 -4.908 0.707 1.00 . A A . 3 TRP HE3 1 1 11 2308 1 1 3 TRP HH2 H -6.133 -8.204 2.983 1.00 . A A . 3 TRP HH2 1 1 11 2309 1 1 3 TRP HZ2 H -4.662 -6.731 4.288 1.00 . A A . 3 TRP HZ2 1 1 11 2310 1 1 3 TRP HZ3 H -7.581 -7.312 1.230 1.00 . A A . 3 TRP HZ3 1 1 11 2311 1 1 3 TRP N N -6.254 -0.079 -0.204 1.00 . A A . 3 TRP N 1 1 11 2312 1 1 3 TRP NE1 N -4.613 -3.926 3.777 1.00 . A A . 3 TRP NE1 1 1 11 2313 1 1 3 TRP O O -3.308 -1.679 0.820 1.00 . A A . 3 TRP O 1 1 11 2314 1 1 4 LEU C C -2.217 -1.706 -1.990 1.00 . A A . 4 LEU C 1 1 11 2315 1 1 4 LEU CA C -3.361 -2.688 -1.761 1.00 . A A . 4 LEU CA 1 1 11 2316 1 1 4 LEU CB C -3.829 -3.264 -3.098 1.00 . A A . 4 LEU CB 1 1 11 2317 1 1 4 LEU CD1 C -3.238 -5.677 -2.768 1.00 . A A . 4 LEU CD1 1 1 11 2318 1 1 4 LEU CD2 C -5.472 -4.830 -2.033 1.00 . A A . 4 LEU CD2 1 1 11 2319 1 1 4 LEU CG C -4.361 -4.697 -3.064 1.00 . A A . 4 LEU CG 1 1 11 2320 1 1 4 LEU H H -5.328 -1.944 -1.537 1.00 . A A . 4 LEU H 1 1 11 2321 1 1 4 LEU HA H -3.007 -3.496 -1.136 1.00 . A A . 4 LEU HA 1 1 11 2322 1 1 4 LEU HB2 H -4.617 -2.628 -3.474 1.00 . A A . 4 LEU HB2 1 1 11 2323 1 1 4 LEU HB3 H -2.991 -3.238 -3.781 1.00 . A A . 4 LEU HB3 1 1 11 2324 1 1 4 LEU HD11 H -3.636 -6.679 -2.716 1.00 . A A . 4 LEU HD11 1 1 11 2325 1 1 4 LEU HD12 H -2.497 -5.625 -3.553 1.00 . A A . 4 LEU HD12 1 1 11 2326 1 1 4 LEU HD13 H -2.778 -5.423 -1.823 1.00 . A A . 4 LEU HD13 1 1 11 2327 1 1 4 LEU HD21 H -5.041 -5.034 -1.063 1.00 . A A . 4 LEU HD21 1 1 11 2328 1 1 4 LEU HD22 H -6.034 -3.909 -1.988 1.00 . A A . 4 LEU HD22 1 1 11 2329 1 1 4 LEU HD23 H -6.129 -5.640 -2.311 1.00 . A A . 4 LEU HD23 1 1 11 2330 1 1 4 LEU HG H -4.773 -4.945 -4.032 1.00 . A A . 4 LEU HG 1 1 11 2331 1 1 4 LEU N N -4.472 -2.044 -1.071 1.00 . A A . 4 LEU N 1 1 11 2332 1 1 4 LEU O O -1.074 -1.971 -1.615 1.00 . A A . 4 LEU O 1 1 11 2333 1 1 5 PHE C C -0.774 0.830 -1.613 1.00 . A A . 5 PHE C 1 1 11 2334 1 1 5 PHE CA C -1.531 0.452 -2.881 1.00 . A A . 5 PHE CA 1 1 11 2335 1 1 5 PHE CB C -2.194 1.694 -3.482 1.00 . A A . 5 PHE CB 1 1 11 2336 1 1 5 PHE CD1 C -2.845 0.582 -5.636 1.00 . A A . 5 PHE CD1 1 1 11 2337 1 1 5 PHE CD2 C -1.787 2.716 -5.737 1.00 . A A . 5 PHE CD2 1 1 11 2338 1 1 5 PHE CE1 C -2.924 0.550 -7.015 1.00 . A A . 5 PHE CE1 1 1 11 2339 1 1 5 PHE CE2 C -1.864 2.690 -7.118 1.00 . A A . 5 PHE CE2 1 1 11 2340 1 1 5 PHE CG C -2.277 1.663 -4.982 1.00 . A A . 5 PHE CG 1 1 11 2341 1 1 5 PHE CZ C -2.431 1.606 -7.757 1.00 . A A . 5 PHE CZ 1 1 11 2342 1 1 5 PHE H H -3.462 -0.419 -2.878 1.00 . A A . 5 PHE H 1 1 11 2343 1 1 5 PHE HA H -0.833 0.046 -3.597 1.00 . A A . 5 PHE HA 1 1 11 2344 1 1 5 PHE HB2 H -3.198 1.778 -3.096 1.00 . A A . 5 PHE HB2 1 1 11 2345 1 1 5 PHE HB3 H -1.628 2.567 -3.199 1.00 . A A . 5 PHE HB3 1 1 11 2346 1 1 5 PHE HD1 H -3.231 -0.247 -5.055 1.00 . A A . 5 PHE HD1 1 1 11 2347 1 1 5 PHE HD2 H -1.342 3.563 -5.238 1.00 . A A . 5 PHE HD2 1 1 11 2348 1 1 5 PHE HE1 H -3.368 -0.300 -7.511 1.00 . A A . 5 PHE HE1 1 1 11 2349 1 1 5 PHE HE2 H -1.477 3.516 -7.696 1.00 . A A . 5 PHE HE2 1 1 11 2350 1 1 5 PHE HZ H -2.492 1.582 -8.834 1.00 . A A . 5 PHE HZ 1 1 11 2351 1 1 5 PHE N N -2.533 -0.572 -2.605 1.00 . A A . 5 PHE N 1 1 11 2352 1 1 5 PHE O O 0.456 0.873 -1.603 1.00 . A A . 5 PHE O 1 1 11 2353 1 1 6 ARG C C -0.025 0.358 1.260 1.00 . A A . 6 ARG C 1 1 11 2354 1 1 6 ARG CA C -0.916 1.477 0.728 1.00 . A A . 6 ARG CA 1 1 11 2355 1 1 6 ARG CB C -2.004 1.807 1.751 1.00 . A A . 6 ARG CB 1 1 11 2356 1 1 6 ARG CD C -3.733 3.438 2.571 1.00 . A A . 6 ARG CD 1 1 11 2357 1 1 6 ARG CG C -2.667 3.156 1.524 1.00 . A A . 6 ARG CG 1 1 11 2358 1 1 6 ARG CZ C -5.959 2.601 3.194 1.00 . A A . 6 ARG CZ 1 1 11 2359 1 1 6 ARG H H -2.493 1.049 -0.617 1.00 . A A . 6 ARG H 1 1 11 2360 1 1 6 ARG HA H -0.310 2.356 0.564 1.00 . A A . 6 ARG HA 1 1 11 2361 1 1 6 ARG HB2 H -2.767 1.044 1.708 1.00 . A A . 6 ARG HB2 1 1 11 2362 1 1 6 ARG HB3 H -1.565 1.809 2.739 1.00 . A A . 6 ARG HB3 1 1 11 2363 1 1 6 ARG HD2 H -3.277 3.398 3.549 1.00 . A A . 6 ARG HD2 1 1 11 2364 1 1 6 ARG HD3 H -4.132 4.426 2.401 1.00 . A A . 6 ARG HD3 1 1 11 2365 1 1 6 ARG HE H -4.703 1.680 1.947 1.00 . A A . 6 ARG HE 1 1 11 2366 1 1 6 ARG HG2 H -1.914 3.929 1.574 1.00 . A A . 6 ARG HG2 1 1 11 2367 1 1 6 ARG HG3 H -3.125 3.159 0.545 1.00 . A A . 6 ARG HG3 1 1 11 2368 1 1 6 ARG HH11 H -5.440 4.356 4.049 1.00 . A A . 6 ARG HH11 1 1 11 2369 1 1 6 ARG HH12 H -7.008 3.755 4.479 1.00 . A A . 6 ARG HH12 1 1 11 2370 1 1 6 ARG HH21 H -6.764 0.879 2.505 1.00 . A A . 6 ARG HH21 1 1 11 2371 1 1 6 ARG HH22 H -7.759 1.777 3.601 1.00 . A A . 6 ARG HH22 1 1 11 2372 1 1 6 ARG N N -1.517 1.101 -0.546 1.00 . A A . 6 ARG N 1 1 11 2373 1 1 6 ARG NE N -4.823 2.468 2.516 1.00 . A A . 6 ARG NE 1 1 11 2374 1 1 6 ARG NH1 N -6.151 3.658 3.972 1.00 . A A . 6 ARG NH1 1 1 11 2375 1 1 6 ARG NH2 N -6.905 1.676 3.092 1.00 . A A . 6 ARG NH2 1 1 11 2376 1 1 6 ARG O O 1.079 0.606 1.744 1.00 . A A . 6 ARG O 1 1 11 2377 1 1 7 GLY C C 1.597 -2.135 0.956 1.00 . A A . 7 GLY C 1 1 11 2378 1 1 7 GLY CA C 0.252 -2.013 1.643 1.00 . A A . 7 GLY CA 1 1 11 2379 1 1 7 GLY H H -1.400 -1.014 0.771 1.00 . A A . 7 GLY H 1 1 11 2380 1 1 7 GLY HA2 H 0.410 -1.908 2.706 1.00 . A A . 7 GLY HA2 1 1 11 2381 1 1 7 GLY HA3 H -0.315 -2.914 1.462 1.00 . A A . 7 GLY HA3 1 1 11 2382 1 1 7 GLY N N -0.512 -0.875 1.167 1.00 . A A . 7 GLY N 1 1 11 2383 1 1 7 GLY O O 2.597 -2.472 1.589 1.00 . A A . 7 GLY O 1 1 11 2384 1 1 8 LYS C C 3.915 -1.001 -0.559 1.00 . A A . 8 LYS C 1 1 11 2385 1 1 8 LYS CA C 2.856 -1.946 -1.120 1.00 . A A . 8 LYS CA 1 1 11 2386 1 1 8 LYS CB C 2.583 -1.608 -2.586 1.00 . A A . 8 LYS CB 1 1 11 2387 1 1 8 LYS CD C 1.283 -2.231 -4.644 1.00 . A A . 8 LYS CD 1 1 11 2388 1 1 8 LYS CE C 2.335 -1.969 -5.710 1.00 . A A . 8 LYS CE 1 1 11 2389 1 1 8 LYS CG C 1.910 -2.733 -3.355 1.00 . A A . 8 LYS CG 1 1 11 2390 1 1 8 LYS H H 0.792 -1.601 -0.794 1.00 . A A . 8 LYS H 1 1 11 2391 1 1 8 LYS HA H 3.222 -2.958 -1.053 1.00 . A A . 8 LYS HA 1 1 11 2392 1 1 8 LYS HB2 H 1.943 -0.739 -2.631 1.00 . A A . 8 LYS HB2 1 1 11 2393 1 1 8 LYS HB3 H 3.521 -1.380 -3.071 1.00 . A A . 8 LYS HB3 1 1 11 2394 1 1 8 LYS HD2 H 0.591 -2.975 -5.011 1.00 . A A . 8 LYS HD2 1 1 11 2395 1 1 8 LYS HD3 H 0.751 -1.312 -4.441 1.00 . A A . 8 LYS HD3 1 1 11 2396 1 1 8 LYS HE2 H 2.813 -1.024 -5.501 1.00 . A A . 8 LYS HE2 1 1 11 2397 1 1 8 LYS HE3 H 3.069 -2.760 -5.675 1.00 . A A . 8 LYS HE3 1 1 11 2398 1 1 8 LYS HG2 H 2.650 -3.483 -3.595 1.00 . A A . 8 LYS HG2 1 1 11 2399 1 1 8 LYS HG3 H 1.140 -3.169 -2.736 1.00 . A A . 8 LYS HG3 1 1 11 2400 1 1 8 LYS HZ1 H 2.247 -1.226 -7.661 1.00 . A A . 8 LYS HZ1 1 1 11 2401 1 1 8 LYS HZ2 H 1.809 -2.853 -7.529 1.00 . A A . 8 LYS HZ2 1 1 11 2402 1 1 8 LYS HZ3 H 0.738 -1.646 -7.019 1.00 . A A . 8 LYS HZ3 1 1 11 2403 1 1 8 LYS N N 1.624 -1.863 -0.344 1.00 . A A . 8 LYS N 1 1 11 2404 1 1 8 LYS NZ N 1.741 -1.920 -7.075 1.00 . A A . 8 LYS NZ 1 1 11 2405 1 1 8 LYS O O 5.101 -1.328 -0.536 1.00 . A A . 8 LYS O 1 1 11 2406 1 1 9 ALA C C 4.749 0.811 1.901 1.00 . A A . 9 ALA C 1 1 11 2407 1 1 9 ALA CA C 4.387 1.157 0.460 1.00 . A A . 9 ALA CA 1 1 11 2408 1 1 9 ALA CB C 3.770 2.546 0.388 1.00 . A A . 9 ALA CB 1 1 11 2409 1 1 9 ALA H H 2.520 0.370 -0.149 1.00 . A A . 9 ALA H 1 1 11 2410 1 1 9 ALA HA H 5.289 1.160 -0.136 1.00 . A A . 9 ALA HA 1 1 11 2411 1 1 9 ALA HB1 H 4.375 3.178 -0.246 1.00 . A A . 9 ALA HB1 1 1 11 2412 1 1 9 ALA HB2 H 2.774 2.475 -0.023 1.00 . A A . 9 ALA HB2 1 1 11 2413 1 1 9 ALA HB3 H 3.721 2.969 1.380 1.00 . A A . 9 ALA HB3 1 1 11 2414 1 1 9 ALA N N 3.477 0.169 -0.104 1.00 . A A . 9 ALA N 1 1 11 2415 1 1 9 ALA O O 5.887 1.005 2.330 1.00 . A A . 9 ALA O 1 1 11 2416 1 1 10 ASP C C 5.158 -1.045 4.165 1.00 . A A . 10 ASP C 1 1 11 2417 1 1 10 ASP CA C 3.990 -0.073 4.038 1.00 . A A . 10 ASP CA 1 1 11 2418 1 1 10 ASP CB C 2.723 -0.700 4.622 1.00 . A A . 10 ASP CB 1 1 11 2419 1 1 10 ASP CG C 2.984 -1.421 5.929 1.00 . A A . 10 ASP CG 1 1 11 2420 1 1 10 ASP H H 2.887 0.170 2.246 1.00 . A A . 10 ASP H 1 1 11 2421 1 1 10 ASP HA H 4.223 0.826 4.589 1.00 . A A . 10 ASP HA 1 1 11 2422 1 1 10 ASP HB2 H 1.995 0.079 4.801 1.00 . A A . 10 ASP HB2 1 1 11 2423 1 1 10 ASP HB3 H 2.319 -1.407 3.914 1.00 . A A . 10 ASP HB3 1 1 11 2424 1 1 10 ASP N N 3.773 0.301 2.644 1.00 . A A . 10 ASP N 1 1 11 2425 1 1 10 ASP O O 6.136 -0.769 4.860 1.00 . A A . 10 ASP O 1 1 11 2426 1 1 10 ASP OD1 O 3.194 -0.738 6.952 1.00 . A A . 10 ASP OD1 1 1 11 2427 1 1 10 ASP OD2 O 2.978 -2.670 5.928 1.00 . A A . 10 ASP OD2 1 1 11 2428 1 1 11 VAL C C 7.445 -2.612 3.122 1.00 . A A . 11 VAL C 1 1 11 2429 1 1 11 VAL CA C 6.097 -3.198 3.526 1.00 . A A . 11 VAL CA 1 1 11 2430 1 1 11 VAL CB C 5.765 -4.381 2.598 1.00 . A A . 11 VAL CB 1 1 11 2431 1 1 11 VAL CG1 C 5.532 -3.896 1.176 1.00 . A A . 11 VAL CG1 1 1 11 2432 1 1 11 VAL CG2 C 6.877 -5.420 2.641 1.00 . A A . 11 VAL CG2 1 1 11 2433 1 1 11 VAL H H 4.246 -2.347 2.952 1.00 . A A . 11 VAL H 1 1 11 2434 1 1 11 VAL HA H 6.167 -3.570 4.538 1.00 . A A . 11 VAL HA 1 1 11 2435 1 1 11 VAL HB H 4.857 -4.846 2.950 1.00 . A A . 11 VAL HB 1 1 11 2436 1 1 11 VAL HG11 H 5.139 -4.707 0.579 1.00 . A A . 11 VAL HG11 1 1 11 2437 1 1 11 VAL HG12 H 4.824 -3.080 1.186 1.00 . A A . 11 VAL HG12 1 1 11 2438 1 1 11 VAL HG13 H 6.466 -3.558 0.753 1.00 . A A . 11 VAL HG13 1 1 11 2439 1 1 11 VAL HG21 H 6.615 -6.255 2.008 1.00 . A A . 11 VAL HG21 1 1 11 2440 1 1 11 VAL HG22 H 7.798 -4.976 2.288 1.00 . A A . 11 VAL HG22 1 1 11 2441 1 1 11 VAL HG23 H 7.010 -5.764 3.655 1.00 . A A . 11 VAL HG23 1 1 11 2442 1 1 11 VAL N N 5.049 -2.185 3.488 1.00 . A A . 11 VAL N 1 1 11 2443 1 1 11 VAL O O 8.484 -2.987 3.662 1.00 . A A . 11 VAL O 1 1 11 2444 1 1 12 ALA C C 9.173 -0.054 2.718 1.00 . A A . 12 ALA C 1 1 11 2445 1 1 12 ALA CA C 8.638 -1.046 1.692 1.00 . A A . 12 ALA CA 1 1 11 2446 1 1 12 ALA CB C 8.384 -0.349 0.362 1.00 . A A . 12 ALA CB 1 1 11 2447 1 1 12 ALA H H 6.558 -1.430 1.774 1.00 . A A . 12 ALA H 1 1 11 2448 1 1 12 ALA HA H 9.379 -1.816 1.530 1.00 . A A . 12 ALA HA 1 1 11 2449 1 1 12 ALA HB1 H 7.349 -0.476 0.082 1.00 . A A . 12 ALA HB1 1 1 11 2450 1 1 12 ALA HB2 H 8.604 0.705 0.461 1.00 . A A . 12 ALA HB2 1 1 11 2451 1 1 12 ALA HB3 H 9.019 -0.780 -0.397 1.00 . A A . 12 ALA HB3 1 1 11 2452 1 1 12 ALA N N 7.418 -1.687 2.167 1.00 . A A . 12 ALA N 1 1 11 2453 1 1 12 ALA O O 8.604 0.105 3.800 1.00 . A A . 12 ALA O 1 1 11 2454 1 1 13 LEU C C 11.200 0.964 4.624 1.00 . A A . 13 LEU C 1 1 11 2455 1 1 13 LEU CA C 10.884 1.589 3.269 1.00 . A A . 13 LEU CA 1 1 11 2456 1 1 13 LEU CB C 9.957 2.793 3.452 1.00 . A A . 13 LEU CB 1 1 11 2457 1 1 13 LEU CD1 C 8.316 4.445 2.523 1.00 . A A . 13 LEU CD1 1 1 11 2458 1 1 13 LEU CD2 C 10.335 3.807 1.191 1.00 . A A . 13 LEU CD2 1 1 11 2459 1 1 13 LEU CG C 9.288 3.325 2.183 1.00 . A A . 13 LEU CG 1 1 11 2460 1 1 13 LEU H H 10.679 0.442 1.501 1.00 . A A . 13 LEU H 1 1 11 2461 1 1 13 LEU HA H 11.805 1.921 2.813 1.00 . A A . 13 LEU HA 1 1 11 2462 1 1 13 LEU HB2 H 9.178 2.506 4.142 1.00 . A A . 13 LEU HB2 1 1 11 2463 1 1 13 LEU HB3 H 10.540 3.594 3.881 1.00 . A A . 13 LEU HB3 1 1 11 2464 1 1 13 LEU HD11 H 8.846 5.241 3.025 1.00 . A A . 13 LEU HD11 1 1 11 2465 1 1 13 LEU HD12 H 7.872 4.823 1.614 1.00 . A A . 13 LEU HD12 1 1 11 2466 1 1 13 LEU HD13 H 7.542 4.064 3.172 1.00 . A A . 13 LEU HD13 1 1 11 2467 1 1 13 LEU HD21 H 10.883 4.633 1.619 1.00 . A A . 13 LEU HD21 1 1 11 2468 1 1 13 LEU HD22 H 11.018 3.000 0.967 1.00 . A A . 13 LEU HD22 1 1 11 2469 1 1 13 LEU HD23 H 9.848 4.128 0.281 1.00 . A A . 13 LEU HD23 1 1 11 2470 1 1 13 LEU HG H 8.727 2.526 1.718 1.00 . A A . 13 LEU HG 1 1 11 2471 1 1 13 LEU N N 10.270 0.611 2.375 1.00 . A A . 13 LEU N 1 1 11 2472 1 1 13 LEU O O 10.385 1.011 5.545 1.00 . A A . 13 LEU O 1 1 11 2473 1 1 14 NH2 HN1 H 12.997 0.379 3.968 1.00 . A A . 14 NH2 HN1 1 1 11 2474 1 1 14 NH2 HN2 H 12.682 -0.049 5.591 1.00 . A A . 14 NH2 HN2 1 1 11 2475 1 1 14 NH2 N N 12.390 0.384 4.737 1.00 . A A . 14 NH2 N 1 1 12 2476 1 1 1 ILE C C -6.049 0.544 -3.876 1.00 . A A . 1 ILE C 1 1 12 2477 1 1 1 ILE CA C -6.774 -0.201 -4.992 1.00 . A A . 1 ILE CA 1 1 12 2478 1 1 1 ILE CB C -6.939 0.741 -6.199 1.00 . A A . 1 ILE CB 1 1 12 2479 1 1 1 ILE CD1 C -8.223 2.767 -7.048 1.00 . A A . 1 ILE CD1 1 1 12 2480 1 1 1 ILE CG1 C -8.025 1.781 -5.919 1.00 . A A . 1 ILE CG1 1 1 12 2481 1 1 1 ILE CG2 C -7.272 -0.058 -7.451 1.00 . A A . 1 ILE CG2 1 1 12 2482 1 1 1 ILE H1 H -8.733 -0.080 -4.200 1.00 . A A . 1 ILE H1 1 1 12 2483 1 1 1 ILE HA H -6.172 -1.045 -5.297 1.00 . A A . 1 ILE HA 1 1 12 2484 1 1 1 ILE HB H -6.000 1.246 -6.364 1.00 . A A . 1 ILE HB 1 1 12 2485 1 1 1 ILE HD11 H -7.451 2.625 -7.791 1.00 . A A . 1 ILE HD11 1 1 12 2486 1 1 1 ILE HD12 H -9.191 2.607 -7.501 1.00 . A A . 1 ILE HD12 1 1 12 2487 1 1 1 ILE HD13 H -8.168 3.774 -6.662 1.00 . A A . 1 ILE HD13 1 1 12 2488 1 1 1 ILE HG12 H -8.963 1.277 -5.751 1.00 . A A . 1 ILE HG12 1 1 12 2489 1 1 1 ILE HG13 H -7.757 2.340 -5.033 1.00 . A A . 1 ILE HG13 1 1 12 2490 1 1 1 ILE HG21 H -6.541 -0.841 -7.586 1.00 . A A . 1 ILE HG21 1 1 12 2491 1 1 1 ILE HG22 H -8.254 -0.496 -7.347 1.00 . A A . 1 ILE HG22 1 1 12 2492 1 1 1 ILE HG23 H -7.261 0.598 -8.310 1.00 . A A . 1 ILE HG23 1 1 12 2493 1 1 1 ILE N N -8.062 -0.711 -4.535 1.00 . A A . 1 ILE N 1 1 12 2494 1 1 1 ILE O O -4.824 0.483 -3.768 1.00 . A A . 1 ILE O 1 1 12 2495 1 1 2 PHE C C -5.531 1.077 -0.958 1.00 . A A . 2 PHE C 1 1 12 2496 1 1 2 PHE CA C -6.246 2.002 -1.937 1.00 . A A . 2 PHE CA 1 1 12 2497 1 1 2 PHE CB C -7.342 2.784 -1.209 1.00 . A A . 2 PHE CB 1 1 12 2498 1 1 2 PHE CD1 C -8.597 4.181 -2.875 1.00 . A A . 2 PHE CD1 1 1 12 2499 1 1 2 PHE CD2 C -7.036 5.264 -1.434 1.00 . A A . 2 PHE CD2 1 1 12 2500 1 1 2 PHE CE1 C -8.897 5.392 -3.467 1.00 . A A . 2 PHE CE1 1 1 12 2501 1 1 2 PHE CE2 C -7.333 6.479 -2.023 1.00 . A A . 2 PHE CE2 1 1 12 2502 1 1 2 PHE CG C -7.665 4.103 -1.852 1.00 . A A . 2 PHE CG 1 1 12 2503 1 1 2 PHE CZ C -8.262 6.543 -3.042 1.00 . A A . 2 PHE CZ 1 1 12 2504 1 1 2 PHE H H -7.785 1.255 -3.184 1.00 . A A . 2 PHE H 1 1 12 2505 1 1 2 PHE HA H -5.529 2.699 -2.345 1.00 . A A . 2 PHE HA 1 1 12 2506 1 1 2 PHE HB2 H -8.245 2.193 -1.194 1.00 . A A . 2 PHE HB2 1 1 12 2507 1 1 2 PHE HB3 H -7.025 2.976 -0.195 1.00 . A A . 2 PHE HB3 1 1 12 2508 1 1 2 PHE HD1 H -9.094 3.281 -3.208 1.00 . A A . 2 PHE HD1 1 1 12 2509 1 1 2 PHE HD2 H -6.308 5.216 -0.639 1.00 . A A . 2 PHE HD2 1 1 12 2510 1 1 2 PHE HE1 H -9.626 5.438 -4.264 1.00 . A A . 2 PHE HE1 1 1 12 2511 1 1 2 PHE HE2 H -6.835 7.376 -1.689 1.00 . A A . 2 PHE HE2 1 1 12 2512 1 1 2 PHE HZ H -8.497 7.491 -3.503 1.00 . A A . 2 PHE HZ 1 1 12 2513 1 1 2 PHE N N -6.814 1.246 -3.046 1.00 . A A . 2 PHE N 1 1 12 2514 1 1 2 PHE O O -4.354 1.272 -0.649 1.00 . A A . 2 PHE O 1 1 12 2515 1 1 3 TRP C C -4.439 -1.549 -0.103 1.00 . A A . 3 TRP C 1 1 12 2516 1 1 3 TRP CA C -5.683 -0.885 0.474 1.00 . A A . 3 TRP CA 1 1 12 2517 1 1 3 TRP CB C -6.721 -1.948 0.839 1.00 . A A . 3 TRP CB 1 1 12 2518 1 1 3 TRP CD1 C -8.232 -2.319 -1.198 1.00 . A A . 3 TRP CD1 1 1 12 2519 1 1 3 TRP CD2 C -6.782 -3.982 -0.811 1.00 . A A . 3 TRP CD2 1 1 12 2520 1 1 3 TRP CE2 C -7.548 -4.309 -1.948 1.00 . A A . 3 TRP CE2 1 1 12 2521 1 1 3 TRP CE3 C -5.805 -4.881 -0.377 1.00 . A A . 3 TRP CE3 1 1 12 2522 1 1 3 TRP CG C -7.236 -2.706 -0.347 1.00 . A A . 3 TRP CG 1 1 12 2523 1 1 3 TRP CH2 C -6.399 -6.357 -2.207 1.00 . A A . 3 TRP CH2 1 1 12 2524 1 1 3 TRP CZ2 C -7.363 -5.494 -2.654 1.00 . A A . 3 TRP CZ2 1 1 12 2525 1 1 3 TRP CZ3 C -5.624 -6.059 -1.078 1.00 . A A . 3 TRP CZ3 1 1 12 2526 1 1 3 TRP H H -7.182 -0.031 -0.756 1.00 . A A . 3 TRP H 1 1 12 2527 1 1 3 TRP HA H -5.406 -0.344 1.366 1.00 . A A . 3 TRP HA 1 1 12 2528 1 1 3 TRP HB2 H -6.277 -2.657 1.520 1.00 . A A . 3 TRP HB2 1 1 12 2529 1 1 3 TRP HB3 H -7.561 -1.469 1.321 1.00 . A A . 3 TRP HB3 1 1 12 2530 1 1 3 TRP HD1 H -8.780 -1.393 -1.113 1.00 . A A . 3 TRP HD1 1 1 12 2531 1 1 3 TRP HE1 H -9.083 -3.231 -2.889 1.00 . A A . 3 TRP HE1 1 1 12 2532 1 1 3 TRP HE3 H -5.196 -4.670 0.491 1.00 . A A . 3 TRP HE3 1 1 12 2533 1 1 3 TRP HH2 H -6.222 -7.287 -2.723 1.00 . A A . 3 TRP HH2 1 1 12 2534 1 1 3 TRP HZ2 H -7.952 -5.739 -3.525 1.00 . A A . 3 TRP HZ2 1 1 12 2535 1 1 3 TRP HZ3 H -4.872 -6.766 -0.758 1.00 . A A . 3 TRP HZ3 1 1 12 2536 1 1 3 TRP N N -6.248 0.070 -0.472 1.00 . A A . 3 TRP N 1 1 12 2537 1 1 3 TRP NE1 N -8.425 -3.279 -2.163 1.00 . A A . 3 TRP NE1 1 1 12 2538 1 1 3 TRP O O -3.463 -1.789 0.610 1.00 . A A . 3 TRP O 1 1 12 2539 1 1 4 LEU C C -2.138 -1.559 -2.096 1.00 . A A . 4 LEU C 1 1 12 2540 1 1 4 LEU CA C -3.351 -2.483 -2.070 1.00 . A A . 4 LEU CA 1 1 12 2541 1 1 4 LEU CB C -3.738 -2.873 -3.499 1.00 . A A . 4 LEU CB 1 1 12 2542 1 1 4 LEU CD1 C -1.822 -4.434 -3.917 1.00 . A A . 4 LEU CD1 1 1 12 2543 1 1 4 LEU CD2 C -3.097 -3.479 -5.846 1.00 . A A . 4 LEU CD2 1 1 12 2544 1 1 4 LEU CG C -2.582 -3.223 -4.436 1.00 . A A . 4 LEU CG 1 1 12 2545 1 1 4 LEU H H -5.281 -1.630 -1.914 1.00 . A A . 4 LEU H 1 1 12 2546 1 1 4 LEU HA H -3.097 -3.376 -1.519 1.00 . A A . 4 LEU HA 1 1 12 2547 1 1 4 LEU HB2 H -4.390 -3.731 -3.441 1.00 . A A . 4 LEU HB2 1 1 12 2548 1 1 4 LEU HB3 H -4.277 -2.042 -3.932 1.00 . A A . 4 LEU HB3 1 1 12 2549 1 1 4 LEU HD11 H -1.107 -4.755 -4.660 1.00 . A A . 4 LEU HD11 1 1 12 2550 1 1 4 LEU HD12 H -1.302 -4.169 -3.008 1.00 . A A . 4 LEU HD12 1 1 12 2551 1 1 4 LEU HD13 H -2.516 -5.235 -3.714 1.00 . A A . 4 LEU HD13 1 1 12 2552 1 1 4 LEU HD21 H -2.263 -3.549 -6.527 1.00 . A A . 4 LEU HD21 1 1 12 2553 1 1 4 LEU HD22 H -3.654 -4.405 -5.862 1.00 . A A . 4 LEU HD22 1 1 12 2554 1 1 4 LEU HD23 H -3.741 -2.667 -6.146 1.00 . A A . 4 LEU HD23 1 1 12 2555 1 1 4 LEU HG H -1.895 -2.389 -4.477 1.00 . A A . 4 LEU HG 1 1 12 2556 1 1 4 LEU N N -4.477 -1.846 -1.397 1.00 . A A . 4 LEU N 1 1 12 2557 1 1 4 LEU O O -1.028 -1.965 -1.748 1.00 . A A . 4 LEU O 1 1 12 2558 1 1 5 PHE C C -0.627 0.858 -1.211 1.00 . A A . 5 PHE C 1 1 12 2559 1 1 5 PHE CA C -1.281 0.668 -2.577 1.00 . A A . 5 PHE CA 1 1 12 2560 1 1 5 PHE CB C -1.817 2.006 -3.089 1.00 . A A . 5 PHE CB 1 1 12 2561 1 1 5 PHE CD1 C 0.363 2.934 -3.916 1.00 . A A . 5 PHE CD1 1 1 12 2562 1 1 5 PHE CD2 C -0.936 4.259 -2.417 1.00 . A A . 5 PHE CD2 1 1 12 2563 1 1 5 PHE CE1 C 1.323 3.928 -3.966 1.00 . A A . 5 PHE CE1 1 1 12 2564 1 1 5 PHE CE2 C 0.019 5.256 -2.465 1.00 . A A . 5 PHE CE2 1 1 12 2565 1 1 5 PHE CG C -0.776 3.088 -3.142 1.00 . A A . 5 PHE CG 1 1 12 2566 1 1 5 PHE CZ C 1.151 5.090 -3.239 1.00 . A A . 5 PHE CZ 1 1 12 2567 1 1 5 PHE H H -3.263 -0.051 -2.773 1.00 . A A . 5 PHE H 1 1 12 2568 1 1 5 PHE HA H -0.540 0.299 -3.269 1.00 . A A . 5 PHE HA 1 1 12 2569 1 1 5 PHE HB2 H -2.205 1.873 -4.088 1.00 . A A . 5 PHE HB2 1 1 12 2570 1 1 5 PHE HB3 H -2.612 2.340 -2.438 1.00 . A A . 5 PHE HB3 1 1 12 2571 1 1 5 PHE HD1 H 0.499 2.026 -4.486 1.00 . A A . 5 PHE HD1 1 1 12 2572 1 1 5 PHE HD2 H -1.820 4.388 -1.810 1.00 . A A . 5 PHE HD2 1 1 12 2573 1 1 5 PHE HE1 H 2.206 3.795 -4.573 1.00 . A A . 5 PHE HE1 1 1 12 2574 1 1 5 PHE HE2 H -0.117 6.163 -1.895 1.00 . A A . 5 PHE HE2 1 1 12 2575 1 1 5 PHE HZ H 1.899 5.868 -3.278 1.00 . A A . 5 PHE HZ 1 1 12 2576 1 1 5 PHE N N -2.356 -0.315 -2.509 1.00 . A A . 5 PHE N 1 1 12 2577 1 1 5 PHE O O 0.597 0.830 -1.087 1.00 . A A . 5 PHE O 1 1 12 2578 1 1 6 ARG C C -0.223 0.005 1.662 1.00 . A A . 6 ARG C 1 1 12 2579 1 1 6 ARG CA C -0.961 1.247 1.168 1.00 . A A . 6 ARG CA 1 1 12 2580 1 1 6 ARG CB C -2.117 1.575 2.114 1.00 . A A . 6 ARG CB 1 1 12 2581 1 1 6 ARG CD C -1.022 3.360 3.503 1.00 . A A . 6 ARG CD 1 1 12 2582 1 1 6 ARG CG C -1.667 1.983 3.507 1.00 . A A . 6 ARG CG 1 1 12 2583 1 1 6 ARG CZ C -2.983 4.842 3.549 1.00 . A A . 6 ARG CZ 1 1 12 2584 1 1 6 ARG H H -2.422 1.063 -0.351 1.00 . A A . 6 ARG H 1 1 12 2585 1 1 6 ARG HA H -0.272 2.078 1.153 1.00 . A A . 6 ARG HA 1 1 12 2586 1 1 6 ARG HB2 H -2.691 2.388 1.692 1.00 . A A . 6 ARG HB2 1 1 12 2587 1 1 6 ARG HB3 H -2.750 0.706 2.203 1.00 . A A . 6 ARG HB3 1 1 12 2588 1 1 6 ARG HD2 H -0.784 3.635 4.521 1.00 . A A . 6 ARG HD2 1 1 12 2589 1 1 6 ARG HD3 H -0.113 3.316 2.921 1.00 . A A . 6 ARG HD3 1 1 12 2590 1 1 6 ARG HE H -1.676 4.727 2.046 1.00 . A A . 6 ARG HE 1 1 12 2591 1 1 6 ARG HG2 H -2.526 2.002 4.161 1.00 . A A . 6 ARG HG2 1 1 12 2592 1 1 6 ARG HG3 H -0.952 1.261 3.870 1.00 . A A . 6 ARG HG3 1 1 12 2593 1 1 6 ARG HH11 H -2.749 3.691 5.192 1.00 . A A . 6 ARG HH11 1 1 12 2594 1 1 6 ARG HH12 H -4.129 4.740 5.210 1.00 . A A . 6 ARG HH12 1 1 12 2595 1 1 6 ARG HH21 H -3.488 6.113 2.060 1.00 . A A . 6 ARG HH21 1 1 12 2596 1 1 6 ARG HH22 H -4.548 6.117 3.429 1.00 . A A . 6 ARG HH22 1 1 12 2597 1 1 6 ARG N N -1.455 1.051 -0.188 1.00 . A A . 6 ARG N 1 1 12 2598 1 1 6 ARG NE N -1.904 4.377 2.933 1.00 . A A . 6 ARG NE 1 1 12 2599 1 1 6 ARG NH1 N -3.314 4.386 4.748 1.00 . A A . 6 ARG NH1 1 1 12 2600 1 1 6 ARG NH2 N -3.736 5.767 2.964 1.00 . A A . 6 ARG NH2 1 1 12 2601 1 1 6 ARG O O 0.827 0.106 2.297 1.00 . A A . 6 ARG O 1 1 12 2602 1 1 7 GLY C C 1.268 -2.539 1.306 1.00 . A A . 7 GLY C 1 1 12 2603 1 1 7 GLY CA C -0.162 -2.408 1.788 1.00 . A A . 7 GLY CA 1 1 12 2604 1 1 7 GLY H H -1.618 -1.185 0.858 1.00 . A A . 7 GLY H 1 1 12 2605 1 1 7 GLY HA2 H -0.173 -2.455 2.869 1.00 . A A . 7 GLY HA2 1 1 12 2606 1 1 7 GLY HA3 H -0.738 -3.234 1.397 1.00 . A A . 7 GLY HA3 1 1 12 2607 1 1 7 GLY N N -0.780 -1.165 1.367 1.00 . A A . 7 GLY N 1 1 12 2608 1 1 7 GLY O O 2.192 -2.677 2.108 1.00 . A A . 7 GLY O 1 1 12 2609 1 1 8 LYS C C 3.667 -1.440 -0.178 1.00 . A A . 8 LYS C 1 1 12 2610 1 1 8 LYS CA C 2.782 -2.608 -0.600 1.00 . A A . 8 LYS CA 1 1 12 2611 1 1 8 LYS CB C 2.682 -2.662 -2.126 1.00 . A A . 8 LYS CB 1 1 12 2612 1 1 8 LYS CD C 1.720 -1.614 -4.195 1.00 . A A . 8 LYS CD 1 1 12 2613 1 1 8 LYS CE C 2.911 -1.425 -5.124 1.00 . A A . 8 LYS CE 1 1 12 2614 1 1 8 LYS CG C 2.110 -1.398 -2.742 1.00 . A A . 8 LYS CG 1 1 12 2615 1 1 8 LYS H H 0.677 -2.382 -0.598 1.00 . A A . 8 LYS H 1 1 12 2616 1 1 8 LYS HA H 3.226 -3.527 -0.244 1.00 . A A . 8 LYS HA 1 1 12 2617 1 1 8 LYS HB2 H 3.669 -2.824 -2.534 1.00 . A A . 8 LYS HB2 1 1 12 2618 1 1 8 LYS HB3 H 2.048 -3.492 -2.404 1.00 . A A . 8 LYS HB3 1 1 12 2619 1 1 8 LYS HD2 H 1.341 -2.618 -4.313 1.00 . A A . 8 LYS HD2 1 1 12 2620 1 1 8 LYS HD3 H 0.951 -0.902 -4.463 1.00 . A A . 8 LYS HD3 1 1 12 2621 1 1 8 LYS HE2 H 3.540 -0.644 -4.727 1.00 . A A . 8 LYS HE2 1 1 12 2622 1 1 8 LYS HE3 H 3.468 -2.349 -5.166 1.00 . A A . 8 LYS HE3 1 1 12 2623 1 1 8 LYS HG2 H 1.232 -1.102 -2.187 1.00 . A A . 8 LYS HG2 1 1 12 2624 1 1 8 LYS HG3 H 2.852 -0.615 -2.690 1.00 . A A . 8 LYS HG3 1 1 12 2625 1 1 8 LYS HZ1 H 2.958 -1.663 -7.199 1.00 . A A . 8 LYS HZ1 1 1 12 2626 1 1 8 LYS HZ2 H 1.456 -1.164 -6.600 1.00 . A A . 8 LYS HZ2 1 1 12 2627 1 1 8 LYS HZ3 H 2.737 -0.062 -6.698 1.00 . A A . 8 LYS HZ3 1 1 12 2628 1 1 8 LYS N N 1.455 -2.495 -0.009 1.00 . A A . 8 LYS N 1 1 12 2629 1 1 8 LYS NZ N 2.485 -1.052 -6.501 1.00 . A A . 8 LYS NZ 1 1 12 2630 1 1 8 LYS O O 4.866 -1.606 0.045 1.00 . A A . 8 LYS O 1 1 12 2631 1 1 9 ALA C C 4.419 0.766 1.710 1.00 . A A . 9 ALA C 1 1 12 2632 1 1 9 ALA CA C 3.801 0.936 0.327 1.00 . A A . 9 ALA CA 1 1 12 2633 1 1 9 ALA CB C 2.883 2.150 0.304 1.00 . A A . 9 ALA CB 1 1 12 2634 1 1 9 ALA H H 2.109 -0.190 -0.261 1.00 . A A . 9 ALA H 1 1 12 2635 1 1 9 ALA HA H 4.590 1.099 -0.392 1.00 . A A . 9 ALA HA 1 1 12 2636 1 1 9 ALA HB1 H 2.604 2.371 -0.716 1.00 . A A . 9 ALA HB1 1 1 12 2637 1 1 9 ALA HB2 H 1.996 1.942 0.883 1.00 . A A . 9 ALA HB2 1 1 12 2638 1 1 9 ALA HB3 H 3.399 3.000 0.727 1.00 . A A . 9 ALA HB3 1 1 12 2639 1 1 9 ALA N N 3.067 -0.260 -0.070 1.00 . A A . 9 ALA N 1 1 12 2640 1 1 9 ALA O O 5.566 1.151 1.939 1.00 . A A . 9 ALA O 1 1 12 2641 1 1 10 ASP C C 5.446 -0.800 3.988 1.00 . A A . 10 ASP C 1 1 12 2642 1 1 10 ASP CA C 4.127 -0.035 3.990 1.00 . A A . 10 ASP CA 1 1 12 2643 1 1 10 ASP CB C 3.080 -0.802 4.799 1.00 . A A . 10 ASP CB 1 1 12 2644 1 1 10 ASP CG C 3.655 -1.409 6.063 1.00 . A A . 10 ASP CG 1 1 12 2645 1 1 10 ASP H H 2.747 -0.098 2.386 1.00 . A A . 10 ASP H 1 1 12 2646 1 1 10 ASP HA H 4.286 0.930 4.448 1.00 . A A . 10 ASP HA 1 1 12 2647 1 1 10 ASP HB2 H 2.284 -0.126 5.077 1.00 . A A . 10 ASP HB2 1 1 12 2648 1 1 10 ASP HB3 H 2.676 -1.597 4.190 1.00 . A A . 10 ASP HB3 1 1 12 2649 1 1 10 ASP N N 3.653 0.187 2.628 1.00 . A A . 10 ASP N 1 1 12 2650 1 1 10 ASP O O 6.339 -0.521 4.789 1.00 . A A . 10 ASP O 1 1 12 2651 1 1 10 ASP OD1 O 3.614 -0.737 7.115 1.00 . A A . 10 ASP OD1 1 1 12 2652 1 1 10 ASP OD2 O 4.145 -2.556 6.000 1.00 . A A . 10 ASP OD2 1 1 12 2653 1 1 11 VAL C C 8.011 -1.691 2.838 1.00 . A A . 11 VAL C 1 1 12 2654 1 1 11 VAL CA C 6.775 -2.572 2.977 1.00 . A A . 11 VAL CA 1 1 12 2655 1 1 11 VAL CB C 6.705 -3.533 1.776 1.00 . A A . 11 VAL CB 1 1 12 2656 1 1 11 VAL CG1 C 7.943 -4.415 1.725 1.00 . A A . 11 VAL CG1 1 1 12 2657 1 1 11 VAL CG2 C 5.441 -4.379 1.843 1.00 . A A . 11 VAL CG2 1 1 12 2658 1 1 11 VAL H H 4.818 -1.941 2.472 1.00 . A A . 11 VAL H 1 1 12 2659 1 1 11 VAL HA H 6.863 -3.161 3.879 1.00 . A A . 11 VAL HA 1 1 12 2660 1 1 11 VAL HB H 6.671 -2.946 0.871 1.00 . A A . 11 VAL HB 1 1 12 2661 1 1 11 VAL HG11 H 8.453 -4.266 0.784 1.00 . A A . 11 VAL HG11 1 1 12 2662 1 1 11 VAL HG12 H 8.604 -4.154 2.538 1.00 . A A . 11 VAL HG12 1 1 12 2663 1 1 11 VAL HG13 H 7.652 -5.450 1.816 1.00 . A A . 11 VAL HG13 1 1 12 2664 1 1 11 VAL HG21 H 5.667 -5.389 1.533 1.00 . A A . 11 VAL HG21 1 1 12 2665 1 1 11 VAL HG22 H 5.067 -4.387 2.856 1.00 . A A . 11 VAL HG22 1 1 12 2666 1 1 11 VAL HG23 H 4.693 -3.959 1.187 1.00 . A A . 11 VAL HG23 1 1 12 2667 1 1 11 VAL N N 5.563 -1.766 3.083 1.00 . A A . 11 VAL N 1 1 12 2668 1 1 11 VAL O O 8.971 -1.829 3.594 1.00 . A A . 11 VAL O 1 1 12 2669 1 1 12 ALA C C 9.292 1.069 2.808 1.00 . A A . 12 ALA C 1 1 12 2670 1 1 12 ALA CA C 9.095 0.123 1.629 1.00 . A A . 12 ALA CA 1 1 12 2671 1 1 12 ALA CB C 8.872 0.910 0.349 1.00 . A A . 12 ALA CB 1 1 12 2672 1 1 12 ALA H H 7.184 -0.723 1.296 1.00 . A A . 12 ALA H 1 1 12 2673 1 1 12 ALA HA H 9.988 -0.475 1.507 1.00 . A A . 12 ALA HA 1 1 12 2674 1 1 12 ALA HB1 H 9.817 1.059 -0.152 1.00 . A A . 12 ALA HB1 1 1 12 2675 1 1 12 ALA HB2 H 8.204 0.363 -0.300 1.00 . A A . 12 ALA HB2 1 1 12 2676 1 1 12 ALA HB3 H 8.437 1.869 0.587 1.00 . A A . 12 ALA HB3 1 1 12 2677 1 1 12 ALA N N 7.978 -0.786 1.867 1.00 . A A . 12 ALA N 1 1 12 2678 1 1 12 ALA O O 8.357 1.744 3.239 1.00 . A A . 12 ALA O 1 1 12 2679 1 1 13 LEU C C 11.103 3.406 3.992 1.00 . A A . 13 LEU C 1 1 12 2680 1 1 13 LEU CA C 10.836 1.978 4.458 1.00 . A A . 13 LEU CA 1 1 12 2681 1 1 13 LEU CB C 12.054 1.438 5.208 1.00 . A A . 13 LEU CB 1 1 12 2682 1 1 13 LEU CD1 C 13.279 -0.494 6.232 1.00 . A A . 13 LEU CD1 1 1 12 2683 1 1 13 LEU CD2 C 10.912 -0.030 6.889 1.00 . A A . 13 LEU CD2 1 1 12 2684 1 1 13 LEU CG C 11.928 0.016 5.758 1.00 . A A . 13 LEU CG 1 1 12 2685 1 1 13 LEU H H 11.220 0.552 2.942 1.00 . A A . 13 LEU H 1 1 12 2686 1 1 13 LEU HA H 9.986 1.982 5.122 1.00 . A A . 13 LEU HA 1 1 12 2687 1 1 13 LEU HB2 H 12.895 1.457 4.532 1.00 . A A . 13 LEU HB2 1 1 12 2688 1 1 13 LEU HB3 H 12.249 2.100 6.040 1.00 . A A . 13 LEU HB3 1 1 12 2689 1 1 13 LEU HD11 H 14.064 0.095 5.783 1.00 . A A . 13 LEU HD11 1 1 12 2690 1 1 13 LEU HD12 H 13.337 -0.413 7.307 1.00 . A A . 13 LEU HD12 1 1 12 2691 1 1 13 LEU HD13 H 13.395 -1.528 5.942 1.00 . A A . 13 LEU HD13 1 1 12 2692 1 1 13 LEU HD21 H 10.213 0.786 6.779 1.00 . A A . 13 LEU HD21 1 1 12 2693 1 1 13 LEU HD22 H 10.378 -0.968 6.857 1.00 . A A . 13 LEU HD22 1 1 12 2694 1 1 13 LEU HD23 H 11.423 0.060 7.836 1.00 . A A . 13 LEU HD23 1 1 12 2695 1 1 13 LEU HG H 11.583 -0.638 4.970 1.00 . A A . 13 LEU HG 1 1 12 2696 1 1 13 LEU N N 10.515 1.114 3.326 1.00 . A A . 13 LEU N 1 1 12 2697 1 1 13 LEU O O 11.904 3.635 3.085 1.00 . A A . 13 LEU O 1 1 12 2698 1 1 14 NH2 HN1 H 9.805 4.119 5.335 1.00 . A A . 14 NH2 HN1 1 1 12 2699 1 1 14 NH2 HN2 H 10.545 5.328 4.382 1.00 . A A . 14 NH2 HN2 1 1 12 2700 1 1 14 NH2 N N 10.429 4.363 4.621 1.00 . A A . 14 NH2 N 1 1 13 2701 1 1 1 ILE C C -6.079 0.464 -3.667 1.00 . A A . 1 ILE C 1 1 13 2702 1 1 1 ILE CA C -6.878 -0.188 -4.790 1.00 . A A . 1 ILE CA 1 1 13 2703 1 1 1 ILE CB C -7.292 0.895 -5.805 1.00 . A A . 1 ILE CB 1 1 13 2704 1 1 1 ILE CD1 C -9.706 0.419 -6.454 1.00 . A A . 1 ILE CD1 1 1 13 2705 1 1 1 ILE CG1 C -8.249 0.310 -6.846 1.00 . A A . 1 ILE CG1 1 1 13 2706 1 1 1 ILE CG2 C -6.063 1.485 -6.481 1.00 . A A . 1 ILE CG2 1 1 13 2707 1 1 1 ILE H1 H -8.748 -0.393 -3.824 1.00 . A A . 1 ILE H1 1 1 13 2708 1 1 1 ILE HA H -6.248 -0.905 -5.296 1.00 . A A . 1 ILE HA 1 1 13 2709 1 1 1 ILE HB H -7.793 1.686 -5.269 1.00 . A A . 1 ILE HB 1 1 13 2710 1 1 1 ILE HD11 H -9.884 1.380 -5.994 1.00 . A A . 1 ILE HD11 1 1 13 2711 1 1 1 ILE HD12 H -10.324 0.323 -7.335 1.00 . A A . 1 ILE HD12 1 1 13 2712 1 1 1 ILE HD13 H -9.952 -0.366 -5.755 1.00 . A A . 1 ILE HD13 1 1 13 2713 1 1 1 ILE HG12 H -8.117 0.831 -7.780 1.00 . A A . 1 ILE HG12 1 1 13 2714 1 1 1 ILE HG13 H -8.020 -0.737 -6.985 1.00 . A A . 1 ILE HG13 1 1 13 2715 1 1 1 ILE HG21 H -6.174 2.557 -6.558 1.00 . A A . 1 ILE HG21 1 1 13 2716 1 1 1 ILE HG22 H -5.186 1.256 -5.895 1.00 . A A . 1 ILE HG22 1 1 13 2717 1 1 1 ILE HG23 H -5.957 1.062 -7.468 1.00 . A A . 1 ILE HG23 1 1 13 2718 1 1 1 ILE N N -8.037 -0.899 -4.267 1.00 . A A . 1 ILE N 1 1 13 2719 1 1 1 ILE O O -4.897 0.173 -3.480 1.00 . A A . 1 ILE O 1 1 13 2720 1 1 2 PHE C C -5.408 1.046 -0.870 1.00 . A A . 2 PHE C 1 1 13 2721 1 1 2 PHE CA C -6.085 2.039 -1.810 1.00 . A A . 2 PHE CA 1 1 13 2722 1 1 2 PHE CB C -7.106 2.877 -1.038 1.00 . A A . 2 PHE CB 1 1 13 2723 1 1 2 PHE CD1 C -7.982 4.502 -2.735 1.00 . A A . 2 PHE CD1 1 1 13 2724 1 1 2 PHE CD2 C -6.700 5.349 -0.913 1.00 . A A . 2 PHE CD2 1 1 13 2725 1 1 2 PHE CE1 C -8.129 5.785 -3.230 1.00 . A A . 2 PHE CE1 1 1 13 2726 1 1 2 PHE CE2 C -6.844 6.634 -1.403 1.00 . A A . 2 PHE CE2 1 1 13 2727 1 1 2 PHE CG C -7.265 4.270 -1.573 1.00 . A A . 2 PHE CG 1 1 13 2728 1 1 2 PHE CZ C -7.561 6.851 -2.562 1.00 . A A . 2 PHE CZ 1 1 13 2729 1 1 2 PHE H H -7.675 1.535 -3.115 1.00 . A A . 2 PHE H 1 1 13 2730 1 1 2 PHE HA H -5.335 2.693 -2.224 1.00 . A A . 2 PHE HA 1 1 13 2731 1 1 2 PHE HB2 H -8.069 2.391 -1.085 1.00 . A A . 2 PHE HB2 1 1 13 2732 1 1 2 PHE HB3 H -6.795 2.948 -0.006 1.00 . A A . 2 PHE HB3 1 1 13 2733 1 1 2 PHE HD1 H -8.428 3.670 -3.260 1.00 . A A . 2 PHE HD1 1 1 13 2734 1 1 2 PHE HD2 H -6.138 5.179 -0.004 1.00 . A A . 2 PHE HD2 1 1 13 2735 1 1 2 PHE HE1 H -8.690 5.952 -4.138 1.00 . A A . 2 PHE HE1 1 1 13 2736 1 1 2 PHE HE2 H -6.397 7.465 -0.878 1.00 . A A . 2 PHE HE2 1 1 13 2737 1 1 2 PHE HZ H -7.674 7.854 -2.947 1.00 . A A . 2 PHE HZ 1 1 13 2738 1 1 2 PHE N N -6.734 1.346 -2.918 1.00 . A A . 2 PHE N 1 1 13 2739 1 1 2 PHE O O -4.214 1.155 -0.589 1.00 . A A . 2 PHE O 1 1 13 2740 1 1 3 TRP C C -4.406 -1.589 -0.051 1.00 . A A . 3 TRP C 1 1 13 2741 1 1 3 TRP CA C -5.656 -0.933 0.526 1.00 . A A . 3 TRP CA 1 1 13 2742 1 1 3 TRP CB C -6.719 -1.994 0.809 1.00 . A A . 3 TRP CB 1 1 13 2743 1 1 3 TRP CD1 C -5.943 -2.332 3.227 1.00 . A A . 3 TRP CD1 1 1 13 2744 1 1 3 TRP CD2 C -6.656 -4.201 2.219 1.00 . A A . 3 TRP CD2 1 1 13 2745 1 1 3 TRP CE2 C -6.260 -4.522 3.532 1.00 . A A . 3 TRP CE2 1 1 13 2746 1 1 3 TRP CE3 C -7.141 -5.219 1.394 1.00 . A A . 3 TRP CE3 1 1 13 2747 1 1 3 TRP CG C -6.444 -2.796 2.045 1.00 . A A . 3 TRP CG 1 1 13 2748 1 1 3 TRP CH2 C -6.815 -6.795 3.207 1.00 . A A . 3 TRP CH2 1 1 13 2749 1 1 3 TRP CZ2 C -6.336 -5.818 4.036 1.00 . A A . 3 TRP CZ2 1 1 13 2750 1 1 3 TRP CZ3 C -7.215 -6.504 1.896 1.00 . A A . 3 TRP CZ3 1 1 13 2751 1 1 3 TRP H H -7.124 0.046 -0.645 1.00 . A A . 3 TRP H 1 1 13 2752 1 1 3 TRP HA H -5.395 -0.441 1.451 1.00 . A A . 3 TRP HA 1 1 13 2753 1 1 3 TRP HB2 H -7.678 -1.511 0.931 1.00 . A A . 3 TRP HB2 1 1 13 2754 1 1 3 TRP HB3 H -6.769 -2.675 -0.028 1.00 . A A . 3 TRP HB3 1 1 13 2755 1 1 3 TRP HD1 H -5.678 -1.303 3.413 1.00 . A A . 3 TRP HD1 1 1 13 2756 1 1 3 TRP HE1 H -5.495 -3.286 5.045 1.00 . A A . 3 TRP HE1 1 1 13 2757 1 1 3 TRP HE3 H -7.455 -5.016 0.382 1.00 . A A . 3 TRP HE3 1 1 13 2758 1 1 3 TRP HH2 H -6.890 -7.812 3.557 1.00 . A A . 3 TRP HH2 1 1 13 2759 1 1 3 TRP HZ2 H -6.031 -6.057 5.045 1.00 . A A . 3 TRP HZ2 1 1 13 2760 1 1 3 TRP HZ3 H -7.588 -7.304 1.273 1.00 . A A . 3 TRP HZ3 1 1 13 2761 1 1 3 TRP N N -6.179 0.079 -0.385 1.00 . A A . 3 TRP N 1 1 13 2762 1 1 3 TRP NE1 N -5.829 -3.366 4.126 1.00 . A A . 3 TRP NE1 1 1 13 2763 1 1 3 TRP O O -3.444 -1.857 0.669 1.00 . A A . 3 TRP O 1 1 13 2764 1 1 4 LEU C C -2.090 -1.536 -2.053 1.00 . A A . 4 LEU C 1 1 13 2765 1 1 4 LEU CA C -3.294 -2.473 -2.030 1.00 . A A . 4 LEU CA 1 1 13 2766 1 1 4 LEU CB C -3.679 -2.864 -3.457 1.00 . A A . 4 LEU CB 1 1 13 2767 1 1 4 LEU CD1 C -5.279 -3.904 -5.081 1.00 . A A . 4 LEU CD1 1 1 13 2768 1 1 4 LEU CD2 C -4.957 -4.922 -2.819 1.00 . A A . 4 LEU CD2 1 1 13 2769 1 1 4 LEU CG C -4.994 -3.625 -3.613 1.00 . A A . 4 LEU CG 1 1 13 2770 1 1 4 LEU H H -5.221 -1.610 -1.876 1.00 . A A . 4 LEU H 1 1 13 2771 1 1 4 LEU HA H -3.033 -3.364 -1.478 1.00 . A A . 4 LEU HA 1 1 13 2772 1 1 4 LEU HB2 H -3.749 -1.958 -4.041 1.00 . A A . 4 LEU HB2 1 1 13 2773 1 1 4 LEU HB3 H -2.887 -3.483 -3.853 1.00 . A A . 4 LEU HB3 1 1 13 2774 1 1 4 LEU HD11 H -5.526 -2.980 -5.581 1.00 . A A . 4 LEU HD11 1 1 13 2775 1 1 4 LEU HD12 H -4.405 -4.340 -5.540 1.00 . A A . 4 LEU HD12 1 1 13 2776 1 1 4 LEU HD13 H -6.108 -4.591 -5.163 1.00 . A A . 4 LEU HD13 1 1 13 2777 1 1 4 LEU HD21 H -5.574 -5.662 -3.309 1.00 . A A . 4 LEU HD21 1 1 13 2778 1 1 4 LEU HD22 H -3.941 -5.282 -2.764 1.00 . A A . 4 LEU HD22 1 1 13 2779 1 1 4 LEU HD23 H -5.332 -4.745 -1.822 1.00 . A A . 4 LEU HD23 1 1 13 2780 1 1 4 LEU HG H -5.802 -3.018 -3.228 1.00 . A A . 4 LEU HG 1 1 13 2781 1 1 4 LEU N N -4.428 -1.846 -1.355 1.00 . A A . 4 LEU N 1 1 13 2782 1 1 4 LEU O O -0.984 -1.922 -1.670 1.00 . A A . 4 LEU O 1 1 13 2783 1 1 5 PHE C C -0.614 0.907 -1.201 1.00 . A A . 5 PHE C 1 1 13 2784 1 1 5 PHE CA C -1.245 0.686 -2.574 1.00 . A A . 5 PHE CA 1 1 13 2785 1 1 5 PHE CB C -1.786 2.009 -3.119 1.00 . A A . 5 PHE CB 1 1 13 2786 1 1 5 PHE CD1 C -0.683 2.841 -5.214 1.00 . A A . 5 PHE CD1 1 1 13 2787 1 1 5 PHE CD2 C 0.157 3.597 -3.114 1.00 . A A . 5 PHE CD2 1 1 13 2788 1 1 5 PHE CE1 C 0.269 3.597 -5.870 1.00 . A A . 5 PHE CE1 1 1 13 2789 1 1 5 PHE CE2 C 1.111 4.356 -3.766 1.00 . A A . 5 PHE CE2 1 1 13 2790 1 1 5 PHE CG C -0.750 2.833 -3.830 1.00 . A A . 5 PHE CG 1 1 13 2791 1 1 5 PHE CZ C 1.166 4.356 -5.146 1.00 . A A . 5 PHE CZ 1 1 13 2792 1 1 5 PHE H H -3.215 -0.059 -2.792 1.00 . A A . 5 PHE H 1 1 13 2793 1 1 5 PHE HA H -0.490 0.311 -3.246 1.00 . A A . 5 PHE HA 1 1 13 2794 1 1 5 PHE HB2 H -2.582 1.804 -3.818 1.00 . A A . 5 PHE HB2 1 1 13 2795 1 1 5 PHE HB3 H -2.172 2.596 -2.300 1.00 . A A . 5 PHE HB3 1 1 13 2796 1 1 5 PHE HD1 H -1.385 2.248 -5.782 1.00 . A A . 5 PHE HD1 1 1 13 2797 1 1 5 PHE HD2 H 0.114 3.598 -2.034 1.00 . A A . 5 PHE HD2 1 1 13 2798 1 1 5 PHE HE1 H 0.310 3.595 -6.950 1.00 . A A . 5 PHE HE1 1 1 13 2799 1 1 5 PHE HE2 H 1.812 4.949 -3.196 1.00 . A A . 5 PHE HE2 1 1 13 2800 1 1 5 PHE HZ H 1.912 4.947 -5.656 1.00 . A A . 5 PHE HZ 1 1 13 2801 1 1 5 PHE N N -2.311 -0.305 -2.502 1.00 . A A . 5 PHE N 1 1 13 2802 1 1 5 PHE O O 0.601 1.061 -1.082 1.00 . A A . 5 PHE O 1 1 13 2803 1 1 6 ARG C C -0.238 -0.104 1.704 1.00 . A A . 6 ARG C 1 1 13 2804 1 1 6 ARG CA C -0.977 1.129 1.195 1.00 . A A . 6 ARG CA 1 1 13 2805 1 1 6 ARG CB C -2.152 1.451 2.121 1.00 . A A . 6 ARG CB 1 1 13 2806 1 1 6 ARG CD C -2.938 1.940 4.459 1.00 . A A . 6 ARG CD 1 1 13 2807 1 1 6 ARG CG C -1.732 1.767 3.548 1.00 . A A . 6 ARG CG 1 1 13 2808 1 1 6 ARG CZ C -1.958 1.684 6.698 1.00 . A A . 6 ARG CZ 1 1 13 2809 1 1 6 ARG H H -2.410 0.796 -0.328 1.00 . A A . 6 ARG H 1 1 13 2810 1 1 6 ARG HA H -0.296 1.965 1.187 1.00 . A A . 6 ARG HA 1 1 13 2811 1 1 6 ARG HB2 H -2.681 2.307 1.728 1.00 . A A . 6 ARG HB2 1 1 13 2812 1 1 6 ARG HB3 H -2.820 0.604 2.145 1.00 . A A . 6 ARG HB3 1 1 13 2813 1 1 6 ARG HD2 H -3.617 2.644 4.003 1.00 . A A . 6 ARG HD2 1 1 13 2814 1 1 6 ARG HD3 H -3.429 0.984 4.567 1.00 . A A . 6 ARG HD3 1 1 13 2815 1 1 6 ARG HE H -2.766 3.367 5.992 1.00 . A A . 6 ARG HE 1 1 13 2816 1 1 6 ARG HG2 H -1.126 0.956 3.923 1.00 . A A . 6 ARG HG2 1 1 13 2817 1 1 6 ARG HG3 H -1.157 2.680 3.551 1.00 . A A . 6 ARG HG3 1 1 13 2818 1 1 6 ARG HH11 H -1.900 0.022 5.551 1.00 . A A . 6 ARG HH11 1 1 13 2819 1 1 6 ARG HH12 H -1.213 -0.143 7.133 1.00 . A A . 6 ARG HH12 1 1 13 2820 1 1 6 ARG HH21 H -1.864 3.160 8.078 1.00 . A A . 6 ARG HH21 1 1 13 2821 1 1 6 ARG HH22 H -1.193 1.641 8.569 1.00 . A A . 6 ARG HH22 1 1 13 2822 1 1 6 ARG N N -1.451 0.924 -0.169 1.00 . A A . 6 ARG N 1 1 13 2823 1 1 6 ARG NE N -2.559 2.432 5.780 1.00 . A A . 6 ARG NE 1 1 13 2824 1 1 6 ARG NH1 N -1.667 0.417 6.440 1.00 . A A . 6 ARG NH1 1 1 13 2825 1 1 6 ARG NH2 N -1.646 2.204 7.879 1.00 . A A . 6 ARG NH2 1 1 13 2826 1 1 6 ARG O O 0.739 0.007 2.444 1.00 . A A . 6 ARG O 1 1 13 2827 1 1 7 GLY C C 1.321 -2.673 1.182 1.00 . A A . 7 GLY C 1 1 13 2828 1 1 7 GLY CA C -0.084 -2.518 1.730 1.00 . A A . 7 GLY CA 1 1 13 2829 1 1 7 GLY H H -1.494 -1.309 0.714 1.00 . A A . 7 GLY H 1 1 13 2830 1 1 7 GLY HA2 H -0.044 -2.535 2.809 1.00 . A A . 7 GLY HA2 1 1 13 2831 1 1 7 GLY HA3 H -0.683 -3.348 1.389 1.00 . A A . 7 GLY HA3 1 1 13 2832 1 1 7 GLY N N -0.712 -1.281 1.305 1.00 . A A . 7 GLY N 1 1 13 2833 1 1 7 GLY O O 2.249 -3.010 1.919 1.00 . A A . 7 GLY O 1 1 13 2834 1 1 8 LYS C C 3.694 -1.388 -0.356 1.00 . A A . 8 LYS C 1 1 13 2835 1 1 8 LYS CA C 2.782 -2.543 -0.760 1.00 . A A . 8 LYS CA 1 1 13 2836 1 1 8 LYS CB C 2.618 -2.569 -2.282 1.00 . A A . 8 LYS CB 1 1 13 2837 1 1 8 LYS CD C 1.704 -1.444 -4.333 1.00 . A A . 8 LYS CD 1 1 13 2838 1 1 8 LYS CE C 2.980 -1.369 -5.157 1.00 . A A . 8 LYS CE 1 1 13 2839 1 1 8 LYS CG C 1.992 -1.306 -2.848 1.00 . A A . 8 LYS CG 1 1 13 2840 1 1 8 LYS H H 0.702 -2.163 -0.648 1.00 . A A . 8 LYS H 1 1 13 2841 1 1 8 LYS HA H 3.231 -3.470 -0.440 1.00 . A A . 8 LYS HA 1 1 13 2842 1 1 8 LYS HB2 H 3.590 -2.698 -2.735 1.00 . A A . 8 LYS HB2 1 1 13 2843 1 1 8 LYS HB3 H 1.992 -3.408 -2.550 1.00 . A A . 8 LYS HB3 1 1 13 2844 1 1 8 LYS HD2 H 1.229 -2.397 -4.512 1.00 . A A . 8 LYS HD2 1 1 13 2845 1 1 8 LYS HD3 H 1.041 -0.647 -4.638 1.00 . A A . 8 LYS HD3 1 1 13 2846 1 1 8 LYS HE2 H 3.376 -0.367 -5.094 1.00 . A A . 8 LYS HE2 1 1 13 2847 1 1 8 LYS HE3 H 3.698 -2.066 -4.750 1.00 . A A . 8 LYS HE3 1 1 13 2848 1 1 8 LYS HG2 H 1.066 -1.110 -2.328 1.00 . A A . 8 LYS HG2 1 1 13 2849 1 1 8 LYS HG3 H 2.672 -0.480 -2.697 1.00 . A A . 8 LYS HG3 1 1 13 2850 1 1 8 LYS HZ1 H 3.501 -1.321 -7.180 1.00 . A A . 8 LYS HZ1 1 1 13 2851 1 1 8 LYS HZ2 H 2.702 -2.737 -6.712 1.00 . A A . 8 LYS HZ2 1 1 13 2852 1 1 8 LYS HZ3 H 1.832 -1.299 -6.902 1.00 . A A . 8 LYS HZ3 1 1 13 2853 1 1 8 LYS N N 1.481 -2.429 -0.114 1.00 . A A . 8 LYS N 1 1 13 2854 1 1 8 LYS NZ N 2.737 -1.705 -6.588 1.00 . A A . 8 LYS NZ 1 1 13 2855 1 1 8 LYS O O 4.898 -1.570 -0.177 1.00 . A A . 8 LYS O 1 1 13 2856 1 1 9 ALA C C 4.386 0.859 1.603 1.00 . A A . 9 ALA C 1 1 13 2857 1 1 9 ALA CA C 3.870 0.980 0.173 1.00 . A A . 9 ALA CA 1 1 13 2858 1 1 9 ALA CB C 3.015 2.229 0.021 1.00 . A A . 9 ALA CB 1 1 13 2859 1 1 9 ALA H H 2.147 -0.121 -0.371 1.00 . A A . 9 ALA H 1 1 13 2860 1 1 9 ALA HA H 4.713 1.068 -0.498 1.00 . A A . 9 ALA HA 1 1 13 2861 1 1 9 ALA HB1 H 2.157 2.159 0.674 1.00 . A A . 9 ALA HB1 1 1 13 2862 1 1 9 ALA HB2 H 3.598 3.098 0.288 1.00 . A A . 9 ALA HB2 1 1 13 2863 1 1 9 ALA HB3 H 2.683 2.316 -1.002 1.00 . A A . 9 ALA HB3 1 1 13 2864 1 1 9 ALA N N 3.111 -0.202 -0.214 1.00 . A A . 9 ALA N 1 1 13 2865 1 1 9 ALA O O 5.499 1.286 1.910 1.00 . A A . 9 ALA O 1 1 13 2866 1 1 10 ASP C C 5.289 -0.608 3.989 1.00 . A A . 10 ASP C 1 1 13 2867 1 1 10 ASP CA C 3.942 0.098 3.873 1.00 . A A . 10 ASP CA 1 1 13 2868 1 1 10 ASP CB C 2.868 -0.701 4.612 1.00 . A A . 10 ASP CB 1 1 13 2869 1 1 10 ASP CG C 3.110 -0.749 6.107 1.00 . A A . 10 ASP CG 1 1 13 2870 1 1 10 ASP H H 2.694 -0.043 2.168 1.00 . A A . 10 ASP H 1 1 13 2871 1 1 10 ASP HA H 4.023 1.076 4.320 1.00 . A A . 10 ASP HA 1 1 13 2872 1 1 10 ASP HB2 H 1.905 -0.243 4.436 1.00 . A A . 10 ASP HB2 1 1 13 2873 1 1 10 ASP HB3 H 2.856 -1.711 4.233 1.00 . A A . 10 ASP HB3 1 1 13 2874 1 1 10 ASP N N 3.570 0.276 2.474 1.00 . A A . 10 ASP N 1 1 13 2875 1 1 10 ASP O O 6.222 -0.090 4.603 1.00 . A A . 10 ASP O 1 1 13 2876 1 1 10 ASP OD1 O 3.858 0.112 6.616 1.00 . A A . 10 ASP OD1 1 1 13 2877 1 1 10 ASP OD2 O 2.549 -1.648 6.769 1.00 . A A . 10 ASP OD2 1 1 13 2878 1 1 11 VAL C C 7.730 -1.875 2.661 1.00 . A A . 11 VAL C 1 1 13 2879 1 1 11 VAL CA C 6.616 -2.572 3.434 1.00 . A A . 11 VAL CA 1 1 13 2880 1 1 11 VAL CB C 6.408 -3.983 2.853 1.00 . A A . 11 VAL CB 1 1 13 2881 1 1 11 VAL CG1 C 7.656 -4.830 3.045 1.00 . A A . 11 VAL CG1 1 1 13 2882 1 1 11 VAL CG2 C 5.198 -4.649 3.491 1.00 . A A . 11 VAL CG2 1 1 13 2883 1 1 11 VAL H H 4.605 -2.154 2.923 1.00 . A A . 11 VAL H 1 1 13 2884 1 1 11 VAL HA H 6.915 -2.673 4.467 1.00 . A A . 11 VAL HA 1 1 13 2885 1 1 11 VAL HB H 6.223 -3.889 1.792 1.00 . A A . 11 VAL HB 1 1 13 2886 1 1 11 VAL HG11 H 8.530 -4.240 2.811 1.00 . A A . 11 VAL HG11 1 1 13 2887 1 1 11 VAL HG12 H 7.710 -5.164 4.070 1.00 . A A . 11 VAL HG12 1 1 13 2888 1 1 11 VAL HG13 H 7.615 -5.686 2.388 1.00 . A A . 11 VAL HG13 1 1 13 2889 1 1 11 VAL HG21 H 5.182 -5.696 3.227 1.00 . A A . 11 VAL HG21 1 1 13 2890 1 1 11 VAL HG22 H 5.258 -4.551 4.565 1.00 . A A . 11 VAL HG22 1 1 13 2891 1 1 11 VAL HG23 H 4.296 -4.173 3.138 1.00 . A A . 11 VAL HG23 1 1 13 2892 1 1 11 VAL N N 5.384 -1.794 3.397 1.00 . A A . 11 VAL N 1 1 13 2893 1 1 11 VAL O O 8.881 -1.850 3.097 1.00 . A A . 11 VAL O 1 1 13 2894 1 1 12 ALA C C 9.564 -1.483 0.397 1.00 . A A . 12 ALA C 1 1 13 2895 1 1 12 ALA CA C 8.348 -0.609 0.679 1.00 . A A . 12 ALA CA 1 1 13 2896 1 1 12 ALA CB C 8.774 0.692 1.342 1.00 . A A . 12 ALA CB 1 1 13 2897 1 1 12 ALA H H 6.446 -1.362 1.217 1.00 . A A . 12 ALA H 1 1 13 2898 1 1 12 ALA HA H 7.868 -0.365 -0.259 1.00 . A A . 12 ALA HA 1 1 13 2899 1 1 12 ALA HB1 H 9.109 0.489 2.350 1.00 . A A . 12 ALA HB1 1 1 13 2900 1 1 12 ALA HB2 H 9.580 1.139 0.778 1.00 . A A . 12 ALA HB2 1 1 13 2901 1 1 12 ALA HB3 H 7.935 1.372 1.373 1.00 . A A . 12 ALA HB3 1 1 13 2902 1 1 12 ALA N N 7.379 -1.309 1.512 1.00 . A A . 12 ALA N 1 1 13 2903 1 1 12 ALA O O 10.704 -1.072 0.622 1.00 . A A . 12 ALA O 1 1 13 2904 1 1 13 LEU C C 11.335 -3.045 -1.454 1.00 . A A . 13 LEU C 1 1 13 2905 1 1 13 LEU CA C 10.394 -3.627 -0.406 1.00 . A A . 13 LEU CA 1 1 13 2906 1 1 13 LEU CB C 9.816 -4.953 -0.904 1.00 . A A . 13 LEU CB 1 1 13 2907 1 1 13 LEU CD1 C 9.970 -7.442 -0.646 1.00 . A A . 13 LEU CD1 1 1 13 2908 1 1 13 LEU CD2 C 11.587 -6.238 -2.126 1.00 . A A . 13 LEU CD2 1 1 13 2909 1 1 13 LEU CG C 10.756 -6.157 -0.855 1.00 . A A . 13 LEU CG 1 1 13 2910 1 1 13 LEU H H 8.389 -2.964 -0.253 1.00 . A A . 13 LEU H 1 1 13 2911 1 1 13 LEU HA H 10.951 -3.805 0.502 1.00 . A A . 13 LEU HA 1 1 13 2912 1 1 13 LEU HB2 H 8.950 -5.185 -0.300 1.00 . A A . 13 LEU HB2 1 1 13 2913 1 1 13 LEU HB3 H 9.509 -4.815 -1.930 1.00 . A A . 13 LEU HB3 1 1 13 2914 1 1 13 LEU HD11 H 10.654 -8.258 -0.469 1.00 . A A . 13 LEU HD11 1 1 13 2915 1 1 13 LEU HD12 H 9.316 -7.330 0.208 1.00 . A A . 13 LEU HD12 1 1 13 2916 1 1 13 LEU HD13 H 9.381 -7.649 -1.526 1.00 . A A . 13 LEU HD13 1 1 13 2917 1 1 13 LEU HD21 H 10.940 -6.132 -2.986 1.00 . A A . 13 LEU HD21 1 1 13 2918 1 1 13 LEU HD22 H 12.321 -5.446 -2.128 1.00 . A A . 13 LEU HD22 1 1 13 2919 1 1 13 LEU HD23 H 12.089 -7.193 -2.169 1.00 . A A . 13 LEU HD23 1 1 13 2920 1 1 13 LEU HG H 11.433 -6.042 -0.018 1.00 . A A . 13 LEU HG 1 1 13 2921 1 1 13 LEU N N 9.317 -2.693 -0.094 1.00 . A A . 13 LEU N 1 1 13 2922 1 1 13 LEU O O 12.543 -2.955 -1.237 1.00 . A A . 13 LEU O 1 1 13 2923 1 1 14 NH2 HN1 H 9.804 -2.745 -2.706 1.00 . A A . 14 NH2 HN1 1 1 13 2924 1 1 14 NH2 HN2 H 11.314 -2.252 -3.332 1.00 . A A . 14 NH2 HN2 1 1 13 2925 1 1 14 NH2 N N 10.774 -2.648 -2.591 1.00 . A A . 14 NH2 N 1 1 14 2926 1 1 1 ILE C C -5.967 0.763 -3.964 1.00 . A A . 1 ILE C 1 1 14 2927 1 1 1 ILE CA C -6.832 0.220 -5.097 1.00 . A A . 1 ILE CA 1 1 14 2928 1 1 1 ILE CB C -6.703 1.149 -6.317 1.00 . A A . 1 ILE CB 1 1 14 2929 1 1 1 ILE CD1 C -7.369 3.431 -7.226 1.00 . A A . 1 ILE CD1 1 1 14 2930 1 1 1 ILE CG1 C -7.475 2.449 -6.081 1.00 . A A . 1 ILE CG1 1 1 14 2931 1 1 1 ILE CG2 C -7.205 0.449 -7.572 1.00 . A A . 1 ILE CG2 1 1 14 2932 1 1 1 ILE H1 H -8.694 0.865 -4.327 1.00 . A A . 1 ILE H1 1 1 14 2933 1 1 1 ILE HA H -6.469 -0.760 -5.374 1.00 . A A . 1 ILE HA 1 1 14 2934 1 1 1 ILE HB H -5.659 1.380 -6.457 1.00 . A A . 1 ILE HB 1 1 14 2935 1 1 1 ILE HD11 H -8.045 3.137 -8.016 1.00 . A A . 1 ILE HD11 1 1 14 2936 1 1 1 ILE HD12 H -7.630 4.419 -6.878 1.00 . A A . 1 ILE HD12 1 1 14 2937 1 1 1 ILE HD13 H -6.357 3.438 -7.603 1.00 . A A . 1 ILE HD13 1 1 14 2938 1 1 1 ILE HG12 H -8.519 2.218 -5.938 1.00 . A A . 1 ILE HG12 1 1 14 2939 1 1 1 ILE HG13 H -7.091 2.929 -5.193 1.00 . A A . 1 ILE HG13 1 1 14 2940 1 1 1 ILE HG21 H -8.256 0.223 -7.461 1.00 . A A . 1 ILE HG21 1 1 14 2941 1 1 1 ILE HG22 H -7.063 1.093 -8.426 1.00 . A A . 1 ILE HG22 1 1 14 2942 1 1 1 ILE HG23 H -6.652 -0.468 -7.717 1.00 . A A . 1 ILE HG23 1 1 14 2943 1 1 1 ILE N N -8.221 0.083 -4.676 1.00 . A A . 1 ILE N 1 1 14 2944 1 1 1 ILE O O -4.808 0.375 -3.815 1.00 . A A . 1 ILE O 1 1 14 2945 1 1 2 PHE C C -5.486 1.205 -0.994 1.00 . A A . 2 PHE C 1 1 14 2946 1 1 2 PHE CA C -5.819 2.256 -2.049 1.00 . A A . 2 PHE CA 1 1 14 2947 1 1 2 PHE CB C -6.649 3.379 -1.422 1.00 . A A . 2 PHE CB 1 1 14 2948 1 1 2 PHE CD1 C -7.954 4.918 -2.913 1.00 . A A . 2 PHE CD1 1 1 14 2949 1 1 2 PHE CD2 C -5.666 5.430 -2.480 1.00 . A A . 2 PHE CD2 1 1 14 2950 1 1 2 PHE CE1 C -8.057 6.041 -3.713 1.00 . A A . 2 PHE CE1 1 1 14 2951 1 1 2 PHE CE2 C -5.762 6.554 -3.279 1.00 . A A . 2 PHE CE2 1 1 14 2952 1 1 2 PHE CG C -6.758 4.600 -2.290 1.00 . A A . 2 PHE CG 1 1 14 2953 1 1 2 PHE CZ C -6.960 6.860 -3.894 1.00 . A A . 2 PHE CZ 1 1 14 2954 1 1 2 PHE H H -7.466 1.929 -3.339 1.00 . A A . 2 PHE H 1 1 14 2955 1 1 2 PHE HA H -4.899 2.671 -2.430 1.00 . A A . 2 PHE HA 1 1 14 2956 1 1 2 PHE HB2 H -7.648 3.016 -1.234 1.00 . A A . 2 PHE HB2 1 1 14 2957 1 1 2 PHE HB3 H -6.195 3.673 -0.488 1.00 . A A . 2 PHE HB3 1 1 14 2958 1 1 2 PHE HD1 H -8.813 4.280 -2.770 1.00 . A A . 2 PHE HD1 1 1 14 2959 1 1 2 PHE HD2 H -4.727 5.191 -2.000 1.00 . A A . 2 PHE HD2 1 1 14 2960 1 1 2 PHE HE1 H -8.994 6.279 -4.192 1.00 . A A . 2 PHE HE1 1 1 14 2961 1 1 2 PHE HE2 H -4.902 7.193 -3.420 1.00 . A A . 2 PHE HE2 1 1 14 2962 1 1 2 PHE HZ H -7.038 7.738 -4.519 1.00 . A A . 2 PHE HZ 1 1 14 2963 1 1 2 PHE N N -6.537 1.661 -3.168 1.00 . A A . 2 PHE N 1 1 14 2964 1 1 2 PHE O O -4.424 1.248 -0.374 1.00 . A A . 2 PHE O 1 1 14 2965 1 1 3 TRP C C -4.885 -1.524 -0.056 1.00 . A A . 3 TRP C 1 1 14 2966 1 1 3 TRP CA C -6.205 -0.800 0.181 1.00 . A A . 3 TRP CA 1 1 14 2967 1 1 3 TRP CB C -7.365 -1.795 0.124 1.00 . A A . 3 TRP CB 1 1 14 2968 1 1 3 TRP CD1 C -7.773 -2.683 2.492 1.00 . A A . 3 TRP CD1 1 1 14 2969 1 1 3 TRP CD2 C -6.789 -4.150 1.116 1.00 . A A . 3 TRP CD2 1 1 14 2970 1 1 3 TRP CE2 C -6.956 -4.758 2.375 1.00 . A A . 3 TRP CE2 1 1 14 2971 1 1 3 TRP CE3 C -6.191 -4.884 0.088 1.00 . A A . 3 TRP CE3 1 1 14 2972 1 1 3 TRP CG C -7.320 -2.824 1.212 1.00 . A A . 3 TRP CG 1 1 14 2973 1 1 3 TRP CH2 C -5.962 -6.758 1.608 1.00 . A A . 3 TRP CH2 1 1 14 2974 1 1 3 TRP CZ2 C -6.545 -6.064 2.632 1.00 . A A . 3 TRP CZ2 1 1 14 2975 1 1 3 TRP CZ3 C -5.783 -6.180 0.343 1.00 . A A . 3 TRP CZ3 1 1 14 2976 1 1 3 TRP H H -7.228 0.282 -1.323 1.00 . A A . 3 TRP H 1 1 14 2977 1 1 3 TRP HA H -6.182 -0.345 1.161 1.00 . A A . 3 TRP HA 1 1 14 2978 1 1 3 TRP HB2 H -8.298 -1.258 0.211 1.00 . A A . 3 TRP HB2 1 1 14 2979 1 1 3 TRP HB3 H -7.339 -2.310 -0.826 1.00 . A A . 3 TRP HB3 1 1 14 2980 1 1 3 TRP HD1 H -8.233 -1.787 2.880 1.00 . A A . 3 TRP HD1 1 1 14 2981 1 1 3 TRP HE1 H -7.798 -3.991 4.137 1.00 . A A . 3 TRP HE1 1 1 14 2982 1 1 3 TRP HE3 H -6.044 -4.455 -0.893 1.00 . A A . 3 TRP HE3 1 1 14 2983 1 1 3 TRP HH2 H -5.628 -7.773 1.763 1.00 . A A . 3 TRP HH2 1 1 14 2984 1 1 3 TRP HZ2 H -6.675 -6.524 3.600 1.00 . A A . 3 TRP HZ2 1 1 14 2985 1 1 3 TRP HZ3 H -5.318 -6.762 -0.438 1.00 . A A . 3 TRP HZ3 1 1 14 2986 1 1 3 TRP N N -6.401 0.264 -0.798 1.00 . A A . 3 TRP N 1 1 14 2987 1 1 3 TRP NE1 N -7.559 -3.843 3.198 1.00 . A A . 3 TRP NE1 1 1 14 2988 1 1 3 TRP O O -4.008 -1.536 0.808 1.00 . A A . 3 TRP O 1 1 14 2989 1 1 4 LEU C C -2.362 -1.894 -1.771 1.00 . A A . 4 LEU C 1 1 14 2990 1 1 4 LEU CA C -3.534 -2.853 -1.586 1.00 . A A . 4 LEU CA 1 1 14 2991 1 1 4 LEU CB C -3.754 -3.662 -2.864 1.00 . A A . 4 LEU CB 1 1 14 2992 1 1 4 LEU CD1 C -2.816 -2.457 -4.851 1.00 . A A . 4 LEU CD1 1 1 14 2993 1 1 4 LEU CD2 C -5.003 -3.653 -5.038 1.00 . A A . 4 LEU CD2 1 1 14 2994 1 1 4 LEU CG C -4.087 -2.857 -4.121 1.00 . A A . 4 LEU CG 1 1 14 2995 1 1 4 LEU H H -5.482 -2.080 -1.881 1.00 . A A . 4 LEU H 1 1 14 2996 1 1 4 LEU HA H -3.307 -3.528 -0.775 1.00 . A A . 4 LEU HA 1 1 14 2997 1 1 4 LEU HB2 H -2.852 -4.221 -3.060 1.00 . A A . 4 LEU HB2 1 1 14 2998 1 1 4 LEU HB3 H -4.570 -4.349 -2.684 1.00 . A A . 4 LEU HB3 1 1 14 2999 1 1 4 LEU HD11 H -2.896 -1.428 -5.175 1.00 . A A . 4 LEU HD11 1 1 14 3000 1 1 4 LEU HD12 H -1.971 -2.558 -4.187 1.00 . A A . 4 LEU HD12 1 1 14 3001 1 1 4 LEU HD13 H -2.678 -3.096 -5.710 1.00 . A A . 4 LEU HD13 1 1 14 3002 1 1 4 LEU HD21 H -5.824 -4.058 -4.465 1.00 . A A . 4 LEU HD21 1 1 14 3003 1 1 4 LEU HD22 H -5.389 -3.007 -5.811 1.00 . A A . 4 LEU HD22 1 1 14 3004 1 1 4 LEU HD23 H -4.446 -4.461 -5.488 1.00 . A A . 4 LEU HD23 1 1 14 3005 1 1 4 LEU HG H -4.606 -1.952 -3.833 1.00 . A A . 4 LEU HG 1 1 14 3006 1 1 4 LEU N N -4.749 -2.125 -1.233 1.00 . A A . 4 LEU N 1 1 14 3007 1 1 4 LEU O O -1.227 -2.209 -1.413 1.00 . A A . 4 LEU O 1 1 14 3008 1 1 5 PHE C C -0.885 0.622 -1.268 1.00 . A A . 5 PHE C 1 1 14 3009 1 1 5 PHE CA C -1.613 0.281 -2.565 1.00 . A A . 5 PHE CA 1 1 14 3010 1 1 5 PHE CB C -2.230 1.546 -3.165 1.00 . A A . 5 PHE CB 1 1 14 3011 1 1 5 PHE CD1 C 0.008 2.476 -3.813 1.00 . A A . 5 PHE CD1 1 1 14 3012 1 1 5 PHE CD2 C -1.613 3.963 -2.892 1.00 . A A . 5 PHE CD2 1 1 14 3013 1 1 5 PHE CE1 C 0.905 3.521 -3.931 1.00 . A A . 5 PHE CE1 1 1 14 3014 1 1 5 PHE CE2 C -0.720 5.014 -3.009 1.00 . A A . 5 PHE CE2 1 1 14 3015 1 1 5 PHE CG C -1.259 2.686 -3.293 1.00 . A A . 5 PHE CG 1 1 14 3016 1 1 5 PHE CZ C 0.539 4.793 -3.529 1.00 . A A . 5 PHE CZ 1 1 14 3017 1 1 5 PHE H H -3.569 -0.530 -2.597 1.00 . A A . 5 PHE H 1 1 14 3018 1 1 5 PHE HA H -0.904 -0.129 -3.266 1.00 . A A . 5 PHE HA 1 1 14 3019 1 1 5 PHE HB2 H -2.608 1.322 -4.150 1.00 . A A . 5 PHE HB2 1 1 14 3020 1 1 5 PHE HB3 H -3.046 1.873 -2.536 1.00 . A A . 5 PHE HB3 1 1 14 3021 1 1 5 PHE HD1 H 0.295 1.484 -4.128 1.00 . A A . 5 PHE HD1 1 1 14 3022 1 1 5 PHE HD2 H -2.599 4.138 -2.486 1.00 . A A . 5 PHE HD2 1 1 14 3023 1 1 5 PHE HE1 H 1.889 3.346 -4.337 1.00 . A A . 5 PHE HE1 1 1 14 3024 1 1 5 PHE HE2 H -1.010 6.005 -2.695 1.00 . A A . 5 PHE HE2 1 1 14 3025 1 1 5 PHE HZ H 1.238 5.610 -3.620 1.00 . A A . 5 PHE HZ 1 1 14 3026 1 1 5 PHE N N -2.644 -0.723 -2.332 1.00 . A A . 5 PHE N 1 1 14 3027 1 1 5 PHE O O 0.330 0.826 -1.262 1.00 . A A . 5 PHE O 1 1 14 3028 1 1 6 ARG C C -0.109 -0.101 1.588 1.00 . A A . 6 ARG C 1 1 14 3029 1 1 6 ARG CA C -1.061 1.001 1.129 1.00 . A A . 6 ARG CA 1 1 14 3030 1 1 6 ARG CB C -2.169 1.195 2.164 1.00 . A A . 6 ARG CB 1 1 14 3031 1 1 6 ARG CD C -2.806 1.865 4.503 1.00 . A A . 6 ARG CD 1 1 14 3032 1 1 6 ARG CG C -1.667 1.692 3.510 1.00 . A A . 6 ARG CG 1 1 14 3033 1 1 6 ARG CZ C -4.811 3.255 4.792 1.00 . A A . 6 ARG CZ 1 1 14 3034 1 1 6 ARG H H -2.597 0.510 -0.243 1.00 . A A . 6 ARG H 1 1 14 3035 1 1 6 ARG HA H -0.506 1.922 1.032 1.00 . A A . 6 ARG HA 1 1 14 3036 1 1 6 ARG HB2 H -2.880 1.914 1.783 1.00 . A A . 6 ARG HB2 1 1 14 3037 1 1 6 ARG HB3 H -2.671 0.252 2.318 1.00 . A A . 6 ARG HB3 1 1 14 3038 1 1 6 ARG HD2 H -3.338 0.928 4.585 1.00 . A A . 6 ARG HD2 1 1 14 3039 1 1 6 ARG HD3 H -2.390 2.127 5.464 1.00 . A A . 6 ARG HD3 1 1 14 3040 1 1 6 ARG HE H -3.560 3.367 3.242 1.00 . A A . 6 ARG HE 1 1 14 3041 1 1 6 ARG HG2 H -0.963 0.975 3.908 1.00 . A A . 6 ARG HG2 1 1 14 3042 1 1 6 ARG HG3 H -1.174 2.644 3.371 1.00 . A A . 6 ARG HG3 1 1 14 3043 1 1 6 ARG HH11 H -4.475 1.928 6.278 1.00 . A A . 6 ARG HH11 1 1 14 3044 1 1 6 ARG HH12 H -5.887 2.917 6.470 1.00 . A A . 6 ARG HH12 1 1 14 3045 1 1 6 ARG HH21 H -5.414 4.674 3.483 1.00 . A A . 6 ARG HH21 1 1 14 3046 1 1 6 ARG HH22 H -6.419 4.478 4.880 1.00 . A A . 6 ARG HH22 1 1 14 3047 1 1 6 ARG N N -1.634 0.684 -0.173 1.00 . A A . 6 ARG N 1 1 14 3048 1 1 6 ARG NE N -3.741 2.907 4.088 1.00 . A A . 6 ARG NE 1 1 14 3049 1 1 6 ARG NH1 N -5.080 2.650 5.940 1.00 . A A . 6 ARG NH1 1 1 14 3050 1 1 6 ARG NH2 N -5.614 4.214 4.349 1.00 . A A . 6 ARG NH2 1 1 14 3051 1 1 6 ARG O O 0.968 0.176 2.115 1.00 . A A . 6 ARG O 1 1 14 3052 1 1 7 GLY C C 1.670 -2.461 1.108 1.00 . A A . 7 GLY C 1 1 14 3053 1 1 7 GLY CA C 0.312 -2.473 1.781 1.00 . A A . 7 GLY CA 1 1 14 3054 1 1 7 GLY H H -1.384 -1.509 0.957 1.00 . A A . 7 GLY H 1 1 14 3055 1 1 7 GLY HA2 H 0.453 -2.442 2.851 1.00 . A A . 7 GLY HA2 1 1 14 3056 1 1 7 GLY HA3 H -0.197 -3.390 1.522 1.00 . A A . 7 GLY HA3 1 1 14 3057 1 1 7 GLY N N -0.515 -1.350 1.382 1.00 . A A . 7 GLY N 1 1 14 3058 1 1 7 GLY O O 2.680 -2.800 1.724 1.00 . A A . 7 GLY O 1 1 14 3059 1 1 8 LYS C C 3.861 -0.932 -0.377 1.00 . A A . 8 LYS C 1 1 14 3060 1 1 8 LYS CA C 2.939 -2.017 -0.922 1.00 . A A . 8 LYS CA 1 1 14 3061 1 1 8 LYS CB C 2.646 -1.756 -2.401 1.00 . A A . 8 LYS CB 1 1 14 3062 1 1 8 LYS CD C 3.720 -3.560 -3.782 1.00 . A A . 8 LYS CD 1 1 14 3063 1 1 8 LYS CE C 2.647 -3.750 -4.843 1.00 . A A . 8 LYS CE 1 1 14 3064 1 1 8 LYS CG C 3.800 -2.114 -3.321 1.00 . A A . 8 LYS CG 1 1 14 3065 1 1 8 LYS H H 0.856 -1.813 -0.600 1.00 . A A . 8 LYS H 1 1 14 3066 1 1 8 LYS HA H 3.430 -2.974 -0.823 1.00 . A A . 8 LYS HA 1 1 14 3067 1 1 8 LYS HB2 H 1.785 -2.340 -2.693 1.00 . A A . 8 LYS HB2 1 1 14 3068 1 1 8 LYS HB3 H 2.421 -0.708 -2.532 1.00 . A A . 8 LYS HB3 1 1 14 3069 1 1 8 LYS HD2 H 4.673 -3.852 -4.194 1.00 . A A . 8 LYS HD2 1 1 14 3070 1 1 8 LYS HD3 H 3.485 -4.187 -2.931 1.00 . A A . 8 LYS HD3 1 1 14 3071 1 1 8 LYS HE2 H 1.688 -3.840 -4.356 1.00 . A A . 8 LYS HE2 1 1 14 3072 1 1 8 LYS HE3 H 2.642 -2.884 -5.489 1.00 . A A . 8 LYS HE3 1 1 14 3073 1 1 8 LYS HG2 H 3.769 -1.470 -4.188 1.00 . A A . 8 LYS HG2 1 1 14 3074 1 1 8 LYS HG3 H 4.730 -1.965 -2.792 1.00 . A A . 8 LYS HG3 1 1 14 3075 1 1 8 LYS HZ1 H 2.894 -5.813 -5.059 1.00 . A A . 8 LYS HZ1 1 1 14 3076 1 1 8 LYS HZ2 H 2.140 -5.071 -6.381 1.00 . A A . 8 LYS HZ2 1 1 14 3077 1 1 8 LYS HZ3 H 3.808 -4.894 -6.149 1.00 . A A . 8 LYS HZ3 1 1 14 3078 1 1 8 LYS N N 1.695 -2.072 -0.163 1.00 . A A . 8 LYS N 1 1 14 3079 1 1 8 LYS NZ N 2.889 -4.967 -5.666 1.00 . A A . 8 LYS NZ 1 1 14 3080 1 1 8 LYS O O 5.070 -1.133 -0.261 1.00 . A A . 8 LYS O 1 1 14 3081 1 1 9 ALA C C 4.612 1.001 1.874 1.00 . A A . 9 ALA C 1 1 14 3082 1 1 9 ALA CA C 4.056 1.332 0.493 1.00 . A A . 9 ALA CA 1 1 14 3083 1 1 9 ALA CB C 3.195 2.586 0.555 1.00 . A A . 9 ALA CB 1 1 14 3084 1 1 9 ALA H H 2.317 0.317 -0.159 1.00 . A A . 9 ALA H 1 1 14 3085 1 1 9 ALA HA H 4.878 1.523 -0.180 1.00 . A A . 9 ALA HA 1 1 14 3086 1 1 9 ALA HB1 H 3.005 2.943 -0.447 1.00 . A A . 9 ALA HB1 1 1 14 3087 1 1 9 ALA HB2 H 2.257 2.357 1.040 1.00 . A A . 9 ALA HB2 1 1 14 3088 1 1 9 ALA HB3 H 3.713 3.351 1.117 1.00 . A A . 9 ALA HB3 1 1 14 3089 1 1 9 ALA N N 3.283 0.217 -0.044 1.00 . A A . 9 ALA N 1 1 14 3090 1 1 9 ALA O O 5.757 1.325 2.185 1.00 . A A . 9 ALA O 1 1 14 3091 1 1 10 ASP C C 5.485 -0.849 4.011 1.00 . A A . 10 ASP C 1 1 14 3092 1 1 10 ASP CA C 4.205 -0.020 4.044 1.00 . A A . 10 ASP CA 1 1 14 3093 1 1 10 ASP CB C 3.092 -0.804 4.741 1.00 . A A . 10 ASP CB 1 1 14 3094 1 1 10 ASP CG C 3.490 -1.268 6.129 1.00 . A A . 10 ASP CG 1 1 14 3095 1 1 10 ASP H H 2.892 0.124 2.391 1.00 . A A . 10 ASP H 1 1 14 3096 1 1 10 ASP HA H 4.393 0.887 4.599 1.00 . A A . 10 ASP HA 1 1 14 3097 1 1 10 ASP HB2 H 2.217 -0.176 4.828 1.00 . A A . 10 ASP HB2 1 1 14 3098 1 1 10 ASP HB3 H 2.848 -1.674 4.147 1.00 . A A . 10 ASP HB3 1 1 14 3099 1 1 10 ASP N N 3.793 0.355 2.697 1.00 . A A . 10 ASP N 1 1 14 3100 1 1 10 ASP O O 6.497 -0.473 4.601 1.00 . A A . 10 ASP O 1 1 14 3101 1 1 10 ASP OD1 O 3.087 -0.610 7.111 1.00 . A A . 10 ASP OD1 1 1 14 3102 1 1 10 ASP OD2 O 4.205 -2.286 6.232 1.00 . A A . 10 ASP OD2 1 1 14 3103 1 1 11 VAL C C 7.772 -2.144 2.572 1.00 . A A . 11 VAL C 1 1 14 3104 1 1 11 VAL CA C 6.587 -2.865 3.205 1.00 . A A . 11 VAL CA 1 1 14 3105 1 1 11 VAL CB C 6.257 -4.118 2.372 1.00 . A A . 11 VAL CB 1 1 14 3106 1 1 11 VAL CG1 C 7.475 -5.023 2.263 1.00 . A A . 11 VAL CG1 1 1 14 3107 1 1 11 VAL CG2 C 5.080 -4.866 2.979 1.00 . A A . 11 VAL CG2 1 1 14 3108 1 1 11 VAL H H 4.597 -2.228 2.867 1.00 . A A . 11 VAL H 1 1 14 3109 1 1 11 VAL HA H 6.861 -3.182 4.200 1.00 . A A . 11 VAL HA 1 1 14 3110 1 1 11 VAL HB H 5.982 -3.801 1.378 1.00 . A A . 11 VAL HB 1 1 14 3111 1 1 11 VAL HG11 H 8.279 -4.487 1.781 1.00 . A A . 11 VAL HG11 1 1 14 3112 1 1 11 VAL HG12 H 7.787 -5.327 3.253 1.00 . A A . 11 VAL HG12 1 1 14 3113 1 1 11 VAL HG13 H 7.224 -5.896 1.680 1.00 . A A . 11 VAL HG13 1 1 14 3114 1 1 11 VAL HG21 H 4.219 -4.765 2.335 1.00 . A A . 11 VAL HG21 1 1 14 3115 1 1 11 VAL HG22 H 5.331 -5.911 3.082 1.00 . A A . 11 VAL HG22 1 1 14 3116 1 1 11 VAL HG23 H 4.853 -4.453 3.951 1.00 . A A . 11 VAL HG23 1 1 14 3117 1 1 11 VAL N N 5.432 -1.982 3.317 1.00 . A A . 11 VAL N 1 1 14 3118 1 1 11 VAL O O 8.915 -2.324 2.989 1.00 . A A . 11 VAL O 1 1 14 3119 1 1 12 ALA C C 8.157 0.898 0.751 1.00 . A A . 12 ALA C 1 1 14 3120 1 1 12 ALA CA C 8.531 -0.576 0.873 1.00 . A A . 12 ALA CA 1 1 14 3121 1 1 12 ALA CB C 8.788 -1.172 -0.503 1.00 . A A . 12 ALA CB 1 1 14 3122 1 1 12 ALA H H 6.558 -1.225 1.276 1.00 . A A . 12 ALA H 1 1 14 3123 1 1 12 ALA HA H 9.440 -0.660 1.451 1.00 . A A . 12 ALA HA 1 1 14 3124 1 1 12 ALA HB1 H 8.698 -0.400 -1.253 1.00 . A A . 12 ALA HB1 1 1 14 3125 1 1 12 ALA HB2 H 9.782 -1.592 -0.533 1.00 . A A . 12 ALA HB2 1 1 14 3126 1 1 12 ALA HB3 H 8.063 -1.949 -0.700 1.00 . A A . 12 ALA HB3 1 1 14 3127 1 1 12 ALA N N 7.489 -1.327 1.563 1.00 . A A . 12 ALA N 1 1 14 3128 1 1 12 ALA O O 7.274 1.263 -0.025 1.00 . A A . 12 ALA O 1 1 14 3129 1 1 13 LEU C C 8.665 3.725 0.085 1.00 . A A . 13 LEU C 1 1 14 3130 1 1 13 LEU CA C 8.572 3.175 1.505 1.00 . A A . 13 LEU CA 1 1 14 3131 1 1 13 LEU CB C 9.561 3.906 2.414 1.00 . A A . 13 LEU CB 1 1 14 3132 1 1 13 LEU CD1 C 7.865 4.786 4.037 1.00 . A A . 13 LEU CD1 1 1 14 3133 1 1 13 LEU CD2 C 9.042 2.627 4.506 1.00 . A A . 13 LEU CD2 1 1 14 3134 1 1 13 LEU CG C 9.167 4.012 3.887 1.00 . A A . 13 LEU CG 1 1 14 3135 1 1 13 LEU H H 9.526 1.390 2.123 1.00 . A A . 13 LEU H 1 1 14 3136 1 1 13 LEU HA H 7.570 3.334 1.874 1.00 . A A . 13 LEU HA 1 1 14 3137 1 1 13 LEU HB2 H 10.505 3.386 2.360 1.00 . A A . 13 LEU HB2 1 1 14 3138 1 1 13 LEU HB3 H 9.683 4.909 2.028 1.00 . A A . 13 LEU HB3 1 1 14 3139 1 1 13 LEU HD11 H 7.676 4.971 5.083 1.00 . A A . 13 LEU HD11 1 1 14 3140 1 1 13 LEU HD12 H 7.943 5.725 3.512 1.00 . A A . 13 LEU HD12 1 1 14 3141 1 1 13 LEU HD13 H 7.054 4.207 3.622 1.00 . A A . 13 LEU HD13 1 1 14 3142 1 1 13 LEU HD21 H 9.820 1.988 4.118 1.00 . A A . 13 LEU HD21 1 1 14 3143 1 1 13 LEU HD22 H 9.138 2.704 5.579 1.00 . A A . 13 LEU HD22 1 1 14 3144 1 1 13 LEU HD23 H 8.076 2.209 4.260 1.00 . A A . 13 LEU HD23 1 1 14 3145 1 1 13 LEU HG H 9.938 4.550 4.421 1.00 . A A . 13 LEU HG 1 1 14 3146 1 1 13 LEU N N 8.834 1.740 1.525 1.00 . A A . 13 LEU N 1 1 14 3147 1 1 13 LEU O O 7.902 4.611 -0.300 1.00 . A A . 13 LEU O 1 1 14 3148 1 1 14 NH2 HN1 H 10.184 2.491 -0.327 1.00 . A A . 14 NH2 HN1 1 1 14 3149 1 1 14 NH2 HN2 H 9.736 3.492 -1.637 1.00 . A A . 14 NH2 HN2 1 1 14 3150 1 1 14 NH2 N N 9.605 3.194 -0.690 1.00 . A A . 14 NH2 N 1 1 15 3151 1 1 1 ILE C C -6.200 0.375 -3.904 1.00 . A A . 1 ILE C 1 1 15 3152 1 1 1 ILE CA C -7.115 -0.199 -4.981 1.00 . A A . 1 ILE CA 1 1 15 3153 1 1 1 ILE CB C -8.152 -1.124 -4.318 1.00 . A A . 1 ILE CB 1 1 15 3154 1 1 1 ILE CD1 C -10.475 -0.902 -3.299 1.00 . A A . 1 ILE CD1 1 1 15 3155 1 1 1 ILE CG1 C -9.085 -0.314 -3.415 1.00 . A A . 1 ILE CG1 1 1 15 3156 1 1 1 ILE CG2 C -7.456 -2.219 -3.524 1.00 . A A . 1 ILE CG2 1 1 15 3157 1 1 1 ILE H1 H -5.991 -1.794 -5.801 1.00 . A A . 1 ILE H1 1 1 15 3158 1 1 1 ILE HA H -7.641 0.614 -5.462 1.00 . A A . 1 ILE HA 1 1 15 3159 1 1 1 ILE HB H -8.735 -1.592 -5.097 1.00 . A A . 1 ILE HB 1 1 15 3160 1 1 1 ILE HD11 H -10.504 -1.857 -3.801 1.00 . A A . 1 ILE HD11 1 1 15 3161 1 1 1 ILE HD12 H -10.724 -1.035 -2.257 1.00 . A A . 1 ILE HD12 1 1 15 3162 1 1 1 ILE HD13 H -11.188 -0.232 -3.758 1.00 . A A . 1 ILE HD13 1 1 15 3163 1 1 1 ILE HG12 H -8.664 -0.265 -2.423 1.00 . A A . 1 ILE HG12 1 1 15 3164 1 1 1 ILE HG13 H -9.180 0.687 -3.810 1.00 . A A . 1 ILE HG13 1 1 15 3165 1 1 1 ILE HG21 H -6.446 -2.339 -3.888 1.00 . A A . 1 ILE HG21 1 1 15 3166 1 1 1 ILE HG22 H -7.433 -1.946 -2.479 1.00 . A A . 1 ILE HG22 1 1 15 3167 1 1 1 ILE HG23 H -7.995 -3.147 -3.642 1.00 . A A . 1 ILE HG23 1 1 15 3168 1 1 1 ILE N N -6.348 -0.903 -6.001 1.00 . A A . 1 ILE N 1 1 15 3169 1 1 1 ILE O O -5.141 -0.181 -3.613 1.00 . A A . 1 ILE O 1 1 15 3170 1 1 2 PHE C C -5.473 1.148 -1.165 1.00 . A A . 2 PHE C 1 1 15 3171 1 1 2 PHE CA C -5.836 2.139 -2.267 1.00 . A A . 2 PHE CA 1 1 15 3172 1 1 2 PHE CB C -6.616 3.315 -1.675 1.00 . A A . 2 PHE CB 1 1 15 3173 1 1 2 PHE CD1 C -4.530 4.611 -1.156 1.00 . A A . 2 PHE CD1 1 1 15 3174 1 1 2 PHE CD2 C -6.277 4.580 0.465 1.00 . A A . 2 PHE CD2 1 1 15 3175 1 1 2 PHE CE1 C -3.768 5.412 -0.327 1.00 . A A . 2 PHE CE1 1 1 15 3176 1 1 2 PHE CE2 C -5.521 5.383 1.299 1.00 . A A . 2 PHE CE2 1 1 15 3177 1 1 2 PHE CG C -5.792 4.187 -0.771 1.00 . A A . 2 PHE CG 1 1 15 3178 1 1 2 PHE CZ C -4.265 5.799 0.903 1.00 . A A . 2 PHE CZ 1 1 15 3179 1 1 2 PHE H H -7.471 1.886 -3.589 1.00 . A A . 2 PHE H 1 1 15 3180 1 1 2 PHE HA H -4.927 2.510 -2.715 1.00 . A A . 2 PHE HA 1 1 15 3181 1 1 2 PHE HB2 H -6.988 3.933 -2.479 1.00 . A A . 2 PHE HB2 1 1 15 3182 1 1 2 PHE HB3 H -7.448 2.935 -1.104 1.00 . A A . 2 PHE HB3 1 1 15 3183 1 1 2 PHE HD1 H -4.140 4.310 -2.120 1.00 . A A . 2 PHE HD1 1 1 15 3184 1 1 2 PHE HD2 H -7.259 4.256 0.778 1.00 . A A . 2 PHE HD2 1 1 15 3185 1 1 2 PHE HE1 H -2.786 5.735 -0.640 1.00 . A A . 2 PHE HE1 1 1 15 3186 1 1 2 PHE HE2 H -5.910 5.682 2.260 1.00 . A A . 2 PHE HE2 1 1 15 3187 1 1 2 PHE HZ H -3.671 6.425 1.552 1.00 . A A . 2 PHE HZ 1 1 15 3188 1 1 2 PHE N N -6.618 1.491 -3.313 1.00 . A A . 2 PHE N 1 1 15 3189 1 1 2 PHE O O -4.335 1.113 -0.698 1.00 . A A . 2 PHE O 1 1 15 3190 1 1 3 TRP C C -5.027 -1.520 -0.026 1.00 . A A . 3 TRP C 1 1 15 3191 1 1 3 TRP CA C -6.234 -0.645 0.293 1.00 . A A . 3 TRP CA 1 1 15 3192 1 1 3 TRP CB C -7.479 -1.517 0.463 1.00 . A A . 3 TRP CB 1 1 15 3193 1 1 3 TRP CD1 C -8.106 -1.519 2.947 1.00 . A A . 3 TRP CD1 1 1 15 3194 1 1 3 TRP CD2 C -7.210 -3.438 2.222 1.00 . A A . 3 TRP CD2 1 1 15 3195 1 1 3 TRP CE2 C -7.506 -3.571 3.593 1.00 . A A . 3 TRP CE2 1 1 15 3196 1 1 3 TRP CE3 C -6.640 -4.523 1.549 1.00 . A A . 3 TRP CE3 1 1 15 3197 1 1 3 TRP CG C -7.602 -2.119 1.829 1.00 . A A . 3 TRP CG 1 1 15 3198 1 1 3 TRP CH2 C -6.692 -5.787 3.617 1.00 . A A . 3 TRP CH2 1 1 15 3199 1 1 3 TRP CZ2 C -7.251 -4.742 4.300 1.00 . A A . 3 TRP CZ2 1 1 15 3200 1 1 3 TRP CZ3 C -6.385 -5.685 2.253 1.00 . A A . 3 TRP CZ3 1 1 15 3201 1 1 3 TRP H H -7.336 0.422 -1.167 1.00 . A A . 3 TRP H 1 1 15 3202 1 1 3 TRP HA H -6.049 -0.115 1.215 1.00 . A A . 3 TRP HA 1 1 15 3203 1 1 3 TRP HB2 H -8.358 -0.916 0.284 1.00 . A A . 3 TRP HB2 1 1 15 3204 1 1 3 TRP HB3 H -7.446 -2.323 -0.257 1.00 . A A . 3 TRP HB3 1 1 15 3205 1 1 3 TRP HD1 H -8.486 -0.509 2.976 1.00 . A A . 3 TRP HD1 1 1 15 3206 1 1 3 TRP HE1 H -8.355 -2.188 4.922 1.00 . A A . 3 TRP HE1 1 1 15 3207 1 1 3 TRP HE3 H -6.397 -4.463 0.498 1.00 . A A . 3 TRP HE3 1 1 15 3208 1 1 3 TRP HH2 H -6.476 -6.715 4.127 1.00 . A A . 3 TRP HH2 1 1 15 3209 1 1 3 TRP HZ2 H -7.480 -4.838 5.352 1.00 . A A . 3 TRP HZ2 1 1 15 3210 1 1 3 TRP HZ3 H -5.945 -6.532 1.749 1.00 . A A . 3 TRP HZ3 1 1 15 3211 1 1 3 TRP N N -6.449 0.347 -0.756 1.00 . A A . 3 TRP N 1 1 15 3212 1 1 3 TRP NE1 N -8.051 -2.385 4.012 1.00 . A A . 3 TRP NE1 1 1 15 3213 1 1 3 TRP O O -4.273 -1.904 0.871 1.00 . A A . 3 TRP O 1 1 15 3214 1 1 4 LEU C C -2.440 -1.843 -1.813 1.00 . A A . 4 LEU C 1 1 15 3215 1 1 4 LEU CA C -3.728 -2.659 -1.740 1.00 . A A . 4 LEU CA 1 1 15 3216 1 1 4 LEU CB C -4.029 -3.280 -3.104 1.00 . A A . 4 LEU CB 1 1 15 3217 1 1 4 LEU CD1 C -2.370 -5.156 -3.010 1.00 . A A . 4 LEU CD1 1 1 15 3218 1 1 4 LEU CD2 C -3.244 -4.374 -5.219 1.00 . A A . 4 LEU CD2 1 1 15 3219 1 1 4 LEU CG C -2.853 -3.956 -3.809 1.00 . A A . 4 LEU CG 1 1 15 3220 1 1 4 LEU H H -5.479 -1.494 -1.971 1.00 . A A . 4 LEU H 1 1 15 3221 1 1 4 LEU HA H -3.598 -3.449 -1.014 1.00 . A A . 4 LEU HA 1 1 15 3222 1 1 4 LEU HB2 H -4.801 -4.021 -2.966 1.00 . A A . 4 LEU HB2 1 1 15 3223 1 1 4 LEU HB3 H -4.397 -2.495 -3.750 1.00 . A A . 4 LEU HB3 1 1 15 3224 1 1 4 LEU HD11 H -1.946 -5.889 -3.682 1.00 . A A . 4 LEU HD11 1 1 15 3225 1 1 4 LEU HD12 H -1.617 -4.838 -2.303 1.00 . A A . 4 LEU HD12 1 1 15 3226 1 1 4 LEU HD13 H -3.201 -5.594 -2.479 1.00 . A A . 4 LEU HD13 1 1 15 3227 1 1 4 LEU HD21 H -4.230 -4.813 -5.203 1.00 . A A . 4 LEU HD21 1 1 15 3228 1 1 4 LEU HD22 H -3.245 -3.508 -5.865 1.00 . A A . 4 LEU HD22 1 1 15 3229 1 1 4 LEU HD23 H -2.534 -5.099 -5.589 1.00 . A A . 4 LEU HD23 1 1 15 3230 1 1 4 LEU HG H -2.034 -3.254 -3.883 1.00 . A A . 4 LEU HG 1 1 15 3231 1 1 4 LEU N N -4.845 -1.829 -1.303 1.00 . A A . 4 LEU N 1 1 15 3232 1 1 4 LEU O O -1.373 -2.311 -1.418 1.00 . A A . 4 LEU O 1 1 15 3233 1 1 5 PHE C C -0.746 0.504 -1.084 1.00 . A A . 5 PHE C 1 1 15 3234 1 1 5 PHE CA C -1.395 0.262 -2.444 1.00 . A A . 5 PHE CA 1 1 15 3235 1 1 5 PHE CB C -1.811 1.596 -3.068 1.00 . A A . 5 PHE CB 1 1 15 3236 1 1 5 PHE CD1 C 0.064 1.654 -4.735 1.00 . A A . 5 PHE CD1 1 1 15 3237 1 1 5 PHE CD2 C -0.385 3.622 -3.465 1.00 . A A . 5 PHE CD2 1 1 15 3238 1 1 5 PHE CE1 C 1.098 2.303 -5.381 1.00 . A A . 5 PHE CE1 1 1 15 3239 1 1 5 PHE CE2 C 0.648 4.278 -4.109 1.00 . A A . 5 PHE CE2 1 1 15 3240 1 1 5 PHE CG C -0.688 2.305 -3.770 1.00 . A A . 5 PHE CG 1 1 15 3241 1 1 5 PHE CZ C 1.390 3.617 -5.070 1.00 . A A . 5 PHE CZ 1 1 15 3242 1 1 5 PHE H H -3.429 -0.302 -2.619 1.00 . A A . 5 PHE H 1 1 15 3243 1 1 5 PHE HA H -0.680 -0.220 -3.090 1.00 . A A . 5 PHE HA 1 1 15 3244 1 1 5 PHE HB2 H -2.594 1.420 -3.789 1.00 . A A . 5 PHE HB2 1 1 15 3245 1 1 5 PHE HB3 H -2.181 2.247 -2.291 1.00 . A A . 5 PHE HB3 1 1 15 3246 1 1 5 PHE HD1 H -0.164 0.627 -4.980 1.00 . A A . 5 PHE HD1 1 1 15 3247 1 1 5 PHE HD2 H -0.965 4.141 -2.715 1.00 . A A . 5 PHE HD2 1 1 15 3248 1 1 5 PHE HE1 H 1.676 1.786 -6.132 1.00 . A A . 5 PHE HE1 1 1 15 3249 1 1 5 PHE HE2 H 0.873 5.305 -3.864 1.00 . A A . 5 PHE HE2 1 1 15 3250 1 1 5 PHE HZ H 2.197 4.127 -5.574 1.00 . A A . 5 PHE HZ 1 1 15 3251 1 1 5 PHE N N -2.550 -0.620 -2.319 1.00 . A A . 5 PHE N 1 1 15 3252 1 1 5 PHE O O 0.478 0.557 -0.968 1.00 . A A . 5 PHE O 1 1 15 3253 1 1 6 ARG C C -0.097 -0.198 1.713 1.00 . A A . 6 ARG C 1 1 15 3254 1 1 6 ARG CA C -1.085 0.886 1.296 1.00 . A A . 6 ARG CA 1 1 15 3255 1 1 6 ARG CB C -2.252 0.936 2.284 1.00 . A A . 6 ARG CB 1 1 15 3256 1 1 6 ARG CD C -2.037 3.268 3.194 1.00 . A A . 6 ARG CD 1 1 15 3257 1 1 6 ARG CG C -2.900 2.307 2.394 1.00 . A A . 6 ARG CG 1 1 15 3258 1 1 6 ARG CZ C -2.782 3.023 5.525 1.00 . A A . 6 ARG CZ 1 1 15 3259 1 1 6 ARG H H -2.544 0.597 -0.211 1.00 . A A . 6 ARG H 1 1 15 3260 1 1 6 ARG HA H -0.580 1.842 1.302 1.00 . A A . 6 ARG HA 1 1 15 3261 1 1 6 ARG HB2 H -3.007 0.230 1.968 1.00 . A A . 6 ARG HB2 1 1 15 3262 1 1 6 ARG HB3 H -1.893 0.653 3.261 1.00 . A A . 6 ARG HB3 1 1 15 3263 1 1 6 ARG HD2 H -1.064 3.333 2.728 1.00 . A A . 6 ARG HD2 1 1 15 3264 1 1 6 ARG HD3 H -2.504 4.242 3.188 1.00 . A A . 6 ARG HD3 1 1 15 3265 1 1 6 ARG HE H -1.035 2.374 4.812 1.00 . A A . 6 ARG HE 1 1 15 3266 1 1 6 ARG HG2 H -3.042 2.708 1.401 1.00 . A A . 6 ARG HG2 1 1 15 3267 1 1 6 ARG HG3 H -3.858 2.204 2.883 1.00 . A A . 6 ARG HG3 1 1 15 3268 1 1 6 ARG HH11 H -4.093 3.962 4.307 1.00 . A A . 6 ARG HH11 1 1 15 3269 1 1 6 ARG HH12 H -4.606 3.781 5.952 1.00 . A A . 6 ARG HH12 1 1 15 3270 1 1 6 ARG HH21 H -1.700 2.131 6.981 1.00 . A A . 6 ARG HH21 1 1 15 3271 1 1 6 ARG HH22 H -3.244 2.741 7.473 1.00 . A A . 6 ARG HH22 1 1 15 3272 1 1 6 ARG N N -1.578 0.650 -0.057 1.00 . A A . 6 ARG N 1 1 15 3273 1 1 6 ARG NE N -1.869 2.832 4.578 1.00 . A A . 6 ARG NE 1 1 15 3274 1 1 6 ARG NH1 N -3.920 3.639 5.238 1.00 . A A . 6 ARG NH1 1 1 15 3275 1 1 6 ARG NH2 N -2.556 2.597 6.761 1.00 . A A . 6 ARG NH2 1 1 15 3276 1 1 6 ARG O O 0.983 0.097 2.225 1.00 . A A . 6 ARG O 1 1 15 3277 1 1 7 GLY C C 1.701 -2.545 1.090 1.00 . A A . 7 GLY C 1 1 15 3278 1 1 7 GLY CA C 0.390 -2.561 1.849 1.00 . A A . 7 GLY CA 1 1 15 3279 1 1 7 GLY H H -1.346 -1.627 1.078 1.00 . A A . 7 GLY H 1 1 15 3280 1 1 7 GLY HA2 H 0.599 -2.513 2.908 1.00 . A A . 7 GLY HA2 1 1 15 3281 1 1 7 GLY HA3 H -0.124 -3.487 1.636 1.00 . A A . 7 GLY HA3 1 1 15 3282 1 1 7 GLY N N -0.474 -1.452 1.490 1.00 . A A . 7 GLY N 1 1 15 3283 1 1 7 GLY O O 2.742 -2.931 1.622 1.00 . A A . 7 GLY O 1 1 15 3284 1 1 8 LYS C C 3.796 -0.946 -0.506 1.00 . A A . 8 LYS C 1 1 15 3285 1 1 8 LYS CA C 2.845 -2.032 -0.998 1.00 . A A . 8 LYS CA 1 1 15 3286 1 1 8 LYS CB C 2.458 -1.766 -2.453 1.00 . A A . 8 LYS CB 1 1 15 3287 1 1 8 LYS CD C 2.540 -4.056 -3.482 1.00 . A A . 8 LYS CD 1 1 15 3288 1 1 8 LYS CE C 3.364 -3.734 -4.719 1.00 . A A . 8 LYS CE 1 1 15 3289 1 1 8 LYS CG C 1.652 -2.888 -3.084 1.00 . A A . 8 LYS CG 1 1 15 3290 1 1 8 LYS H H 0.793 -1.804 -0.531 1.00 . A A . 8 LYS H 1 1 15 3291 1 1 8 LYS HA H 3.347 -2.987 -0.935 1.00 . A A . 8 LYS HA 1 1 15 3292 1 1 8 LYS HB2 H 1.870 -0.860 -2.497 1.00 . A A . 8 LYS HB2 1 1 15 3293 1 1 8 LYS HB3 H 3.359 -1.628 -3.034 1.00 . A A . 8 LYS HB3 1 1 15 3294 1 1 8 LYS HD2 H 3.209 -4.282 -2.666 1.00 . A A . 8 LYS HD2 1 1 15 3295 1 1 8 LYS HD3 H 1.917 -4.915 -3.688 1.00 . A A . 8 LYS HD3 1 1 15 3296 1 1 8 LYS HE2 H 3.928 -2.833 -4.536 1.00 . A A . 8 LYS HE2 1 1 15 3297 1 1 8 LYS HE3 H 4.043 -4.553 -4.907 1.00 . A A . 8 LYS HE3 1 1 15 3298 1 1 8 LYS HG2 H 0.917 -3.235 -2.372 1.00 . A A . 8 LYS HG2 1 1 15 3299 1 1 8 LYS HG3 H 1.153 -2.510 -3.965 1.00 . A A . 8 LYS HG3 1 1 15 3300 1 1 8 LYS HZ1 H 2.312 -2.517 -6.053 1.00 . A A . 8 LYS HZ1 1 1 15 3301 1 1 8 LYS HZ2 H 2.985 -3.895 -6.767 1.00 . A A . 8 LYS HZ2 1 1 15 3302 1 1 8 LYS HZ3 H 1.602 -4.033 -5.802 1.00 . A A . 8 LYS HZ3 1 1 15 3303 1 1 8 LYS N N 1.653 -2.098 -0.161 1.00 . A A . 8 LYS N 1 1 15 3304 1 1 8 LYS NZ N 2.505 -3.530 -5.919 1.00 . A A . 8 LYS NZ 1 1 15 3305 1 1 8 LYS O O 5.015 -1.104 -0.556 1.00 . A A . 8 LYS O 1 1 15 3306 1 1 9 ALA C C 4.584 0.960 1.862 1.00 . A A . 9 ALA C 1 1 15 3307 1 1 9 ALA CA C 4.026 1.269 0.477 1.00 . A A . 9 ALA CA 1 1 15 3308 1 1 9 ALA CB C 3.193 2.541 0.514 1.00 . A A . 9 ALA CB 1 1 15 3309 1 1 9 ALA H H 2.252 0.224 -0.012 1.00 . A A . 9 ALA H 1 1 15 3310 1 1 9 ALA HA H 4.849 1.426 -0.205 1.00 . A A . 9 ALA HA 1 1 15 3311 1 1 9 ALA HB1 H 2.280 2.359 1.061 1.00 . A A . 9 ALA HB1 1 1 15 3312 1 1 9 ALA HB2 H 3.754 3.325 1.002 1.00 . A A . 9 ALA HB2 1 1 15 3313 1 1 9 ALA HB3 H 2.955 2.845 -0.495 1.00 . A A . 9 ALA HB3 1 1 15 3314 1 1 9 ALA N N 3.229 0.158 -0.028 1.00 . A A . 9 ALA N 1 1 15 3315 1 1 9 ALA O O 5.726 1.304 2.172 1.00 . A A . 9 ALA O 1 1 15 3316 1 1 10 ASP C C 5.510 -0.806 4.024 1.00 . A A . 10 ASP C 1 1 15 3317 1 1 10 ASP CA C 4.188 -0.045 4.043 1.00 . A A . 10 ASP CA 1 1 15 3318 1 1 10 ASP CB C 3.108 -0.888 4.724 1.00 . A A . 10 ASP CB 1 1 15 3319 1 1 10 ASP CG C 3.255 -0.904 6.233 1.00 . A A . 10 ASP CG 1 1 15 3320 1 1 10 ASP H H 2.876 0.064 2.384 1.00 . A A . 10 ASP H 1 1 15 3321 1 1 10 ASP HA H 4.322 0.870 4.599 1.00 . A A . 10 ASP HA 1 1 15 3322 1 1 10 ASP HB2 H 2.138 -0.483 4.479 1.00 . A A . 10 ASP HB2 1 1 15 3323 1 1 10 ASP HB3 H 3.173 -1.903 4.363 1.00 . A A . 10 ASP HB3 1 1 15 3324 1 1 10 ASP N N 3.774 0.311 2.690 1.00 . A A . 10 ASP N 1 1 15 3325 1 1 10 ASP O O 6.485 -0.393 4.652 1.00 . A A . 10 ASP O 1 1 15 3326 1 1 10 ASP OD1 O 3.349 0.187 6.832 1.00 . A A . 10 ASP OD1 1 1 15 3327 1 1 10 ASP OD2 O 3.271 -2.009 6.814 1.00 . A A . 10 ASP OD2 1 1 15 3328 1 1 11 VAL C C 7.872 -1.970 2.536 1.00 . A A . 11 VAL C 1 1 15 3329 1 1 11 VAL CA C 6.736 -2.740 3.200 1.00 . A A . 11 VAL CA 1 1 15 3330 1 1 11 VAL CB C 6.471 -4.031 2.401 1.00 . A A . 11 VAL CB 1 1 15 3331 1 1 11 VAL CG1 C 5.961 -3.701 1.007 1.00 . A A . 11 VAL CG1 1 1 15 3332 1 1 11 VAL CG2 C 7.730 -4.881 2.331 1.00 . A A . 11 VAL CG2 1 1 15 3333 1 1 11 VAL H H 4.727 -2.198 2.822 1.00 . A A . 11 VAL H 1 1 15 3334 1 1 11 VAL HA H 7.037 -3.016 4.199 1.00 . A A . 11 VAL HA 1 1 15 3335 1 1 11 VAL HB H 5.708 -4.597 2.915 1.00 . A A . 11 VAL HB 1 1 15 3336 1 1 11 VAL HG11 H 5.239 -2.901 1.067 1.00 . A A . 11 VAL HG11 1 1 15 3337 1 1 11 VAL HG12 H 6.788 -3.392 0.384 1.00 . A A . 11 VAL HG12 1 1 15 3338 1 1 11 VAL HG13 H 5.494 -4.575 0.578 1.00 . A A . 11 VAL HG13 1 1 15 3339 1 1 11 VAL HG21 H 8.376 -4.503 1.552 1.00 . A A . 11 VAL HG21 1 1 15 3340 1 1 11 VAL HG22 H 8.246 -4.840 3.278 1.00 . A A . 11 VAL HG22 1 1 15 3341 1 1 11 VAL HG23 H 7.461 -5.904 2.112 1.00 . A A . 11 VAL HG23 1 1 15 3342 1 1 11 VAL N N 5.534 -1.921 3.300 1.00 . A A . 11 VAL N 1 1 15 3343 1 1 11 VAL O O 9.037 -2.127 2.899 1.00 . A A . 11 VAL O 1 1 15 3344 1 1 12 ALA C C 9.203 0.648 1.784 1.00 . A A . 12 ALA C 1 1 15 3345 1 1 12 ALA CA C 8.515 -0.339 0.847 1.00 . A A . 12 ALA CA 1 1 15 3346 1 1 12 ALA CB C 7.864 0.397 -0.313 1.00 . A A . 12 ALA CB 1 1 15 3347 1 1 12 ALA H H 6.580 -1.054 1.316 1.00 . A A . 12 ALA H 1 1 15 3348 1 1 12 ALA HA H 9.256 -1.014 0.442 1.00 . A A . 12 ALA HA 1 1 15 3349 1 1 12 ALA HB1 H 6.813 0.536 -0.106 1.00 . A A . 12 ALA HB1 1 1 15 3350 1 1 12 ALA HB2 H 8.336 1.361 -0.438 1.00 . A A . 12 ALA HB2 1 1 15 3351 1 1 12 ALA HB3 H 7.980 -0.181 -1.217 1.00 . A A . 12 ALA HB3 1 1 15 3352 1 1 12 ALA N N 7.526 -1.137 1.560 1.00 . A A . 12 ALA N 1 1 15 3353 1 1 12 ALA O O 8.604 1.124 2.749 1.00 . A A . 12 ALA O 1 1 15 3354 1 1 13 LEU C C 11.538 3.161 1.541 1.00 . A A . 13 LEU C 1 1 15 3355 1 1 13 LEU CA C 11.235 1.879 2.312 1.00 . A A . 13 LEU CA 1 1 15 3356 1 1 13 LEU CB C 12.541 1.226 2.769 1.00 . A A . 13 LEU CB 1 1 15 3357 1 1 13 LEU CD1 C 13.137 2.044 5.064 1.00 . A A . 13 LEU CD1 1 1 15 3358 1 1 13 LEU CD2 C 14.931 1.701 3.357 1.00 . A A . 13 LEU CD2 1 1 15 3359 1 1 13 LEU CG C 13.484 2.112 3.585 1.00 . A A . 13 LEU CG 1 1 15 3360 1 1 13 LEU H H 10.888 0.537 0.713 1.00 . A A . 13 LEU H 1 1 15 3361 1 1 13 LEU HA H 10.642 2.127 3.180 1.00 . A A . 13 LEU HA 1 1 15 3362 1 1 13 LEU HB2 H 12.287 0.370 3.376 1.00 . A A . 13 LEU HB2 1 1 15 3363 1 1 13 LEU HB3 H 13.072 0.898 1.889 1.00 . A A . 13 LEU HB3 1 1 15 3364 1 1 13 LEU HD11 H 13.006 1.013 5.356 1.00 . A A . 13 LEU HD11 1 1 15 3365 1 1 13 LEU HD12 H 13.936 2.485 5.642 1.00 . A A . 13 LEU HD12 1 1 15 3366 1 1 13 LEU HD13 H 12.221 2.589 5.243 1.00 . A A . 13 LEU HD13 1 1 15 3367 1 1 13 LEU HD21 H 15.191 0.903 4.036 1.00 . A A . 13 LEU HD21 1 1 15 3368 1 1 13 LEU HD22 H 15.052 1.358 2.339 1.00 . A A . 13 LEU HD22 1 1 15 3369 1 1 13 LEU HD23 H 15.579 2.548 3.531 1.00 . A A . 13 LEU HD23 1 1 15 3370 1 1 13 LEU HG H 13.372 3.138 3.263 1.00 . A A . 13 LEU HG 1 1 15 3371 1 1 13 LEU N N 10.464 0.949 1.495 1.00 . A A . 13 LEU N 1 1 15 3372 1 1 13 LEU O O 12.580 3.279 0.899 1.00 . A A . 13 LEU O 1 1 15 3373 1 1 14 NH2 HN1 H 9.805 3.965 2.137 1.00 . A A . 14 NH2 HN1 1 1 15 3374 1 1 14 NH2 HN2 H 10.734 4.992 1.138 1.00 . A A . 14 NH2 HN2 1 1 15 3375 1 1 14 NH2 N N 10.617 4.118 1.611 1.00 . A A . 14 NH2 N 1 1 16 3376 1 1 1 ILE C C -6.392 0.091 -3.481 1.00 . A A . 1 ILE C 1 1 16 3377 1 1 1 ILE CA C -7.313 -0.605 -4.477 1.00 . A A . 1 ILE CA 1 1 16 3378 1 1 1 ILE CB C -7.570 0.339 -5.667 1.00 . A A . 1 ILE CB 1 1 16 3379 1 1 1 ILE CD1 C -9.013 0.636 -7.743 1.00 . A A . 1 ILE CD1 1 1 16 3380 1 1 1 ILE CG1 C -8.542 -0.306 -6.657 1.00 . A A . 1 ILE CG1 1 1 16 3381 1 1 1 ILE CG2 C -6.260 0.689 -6.356 1.00 . A A . 1 ILE CG2 1 1 16 3382 1 1 1 ILE H1 H -9.090 -0.348 -3.355 1.00 . A A . 1 ILE H1 1 1 16 3383 1 1 1 ILE HA H -6.822 -1.492 -4.846 1.00 . A A . 1 ILE HA 1 1 16 3384 1 1 1 ILE HB H -8.005 1.251 -5.287 1.00 . A A . 1 ILE HB 1 1 16 3385 1 1 1 ILE HD11 H -9.878 0.216 -8.234 1.00 . A A . 1 ILE HD11 1 1 16 3386 1 1 1 ILE HD12 H -9.273 1.589 -7.305 1.00 . A A . 1 ILE HD12 1 1 16 3387 1 1 1 ILE HD13 H -8.221 0.776 -8.465 1.00 . A A . 1 ILE HD13 1 1 16 3388 1 1 1 ILE HG12 H -8.059 -1.145 -7.133 1.00 . A A . 1 ILE HG12 1 1 16 3389 1 1 1 ILE HG13 H -9.413 -0.655 -6.120 1.00 . A A . 1 ILE HG13 1 1 16 3390 1 1 1 ILE HG21 H -6.415 0.733 -7.425 1.00 . A A . 1 ILE HG21 1 1 16 3391 1 1 1 ILE HG22 H -5.914 1.649 -6.003 1.00 . A A . 1 ILE HG22 1 1 16 3392 1 1 1 ILE HG23 H -5.521 -0.065 -6.131 1.00 . A A . 1 ILE HG23 1 1 16 3393 1 1 1 ILE N N -8.561 -1.012 -3.843 1.00 . A A . 1 ILE N 1 1 16 3394 1 1 1 ILE O O -5.232 -0.288 -3.324 1.00 . A A . 1 ILE O 1 1 16 3395 1 1 2 PHE C C -5.527 0.921 -0.791 1.00 . A A . 2 PHE C 1 1 16 3396 1 1 2 PHE CA C -6.143 1.858 -1.826 1.00 . A A . 2 PHE CA 1 1 16 3397 1 1 2 PHE CB C -7.026 2.895 -1.130 1.00 . A A . 2 PHE CB 1 1 16 3398 1 1 2 PHE CD1 C -7.968 2.075 1.047 1.00 . A A . 2 PHE CD1 1 1 16 3399 1 1 2 PHE CD2 C -9.333 1.933 -0.902 1.00 . A A . 2 PHE CD2 1 1 16 3400 1 1 2 PHE CE1 C -8.982 1.517 1.803 1.00 . A A . 2 PHE CE1 1 1 16 3401 1 1 2 PHE CE2 C -10.352 1.376 -0.152 1.00 . A A . 2 PHE CE2 1 1 16 3402 1 1 2 PHE CG C -8.132 2.289 -0.313 1.00 . A A . 2 PHE CG 1 1 16 3403 1 1 2 PHE CZ C -10.175 1.167 1.202 1.00 . A A . 2 PHE CZ 1 1 16 3404 1 1 2 PHE H H -7.849 1.364 -2.978 1.00 . A A . 2 PHE H 1 1 16 3405 1 1 2 PHE HA H -5.349 2.368 -2.350 1.00 . A A . 2 PHE HA 1 1 16 3406 1 1 2 PHE HB2 H -6.417 3.493 -0.470 1.00 . A A . 2 PHE HB2 1 1 16 3407 1 1 2 PHE HB3 H -7.477 3.533 -1.876 1.00 . A A . 2 PHE HB3 1 1 16 3408 1 1 2 PHE HD1 H -7.035 2.348 1.518 1.00 . A A . 2 PHE HD1 1 1 16 3409 1 1 2 PHE HD2 H -9.473 2.095 -1.961 1.00 . A A . 2 PHE HD2 1 1 16 3410 1 1 2 PHE HE1 H -8.841 1.357 2.861 1.00 . A A . 2 PHE HE1 1 1 16 3411 1 1 2 PHE HE2 H -11.284 1.102 -0.624 1.00 . A A . 2 PHE HE2 1 1 16 3412 1 1 2 PHE HZ H -10.969 0.733 1.790 1.00 . A A . 2 PHE HZ 1 1 16 3413 1 1 2 PHE N N -6.917 1.109 -2.808 1.00 . A A . 2 PHE N 1 1 16 3414 1 1 2 PHE O O -4.408 1.140 -0.327 1.00 . A A . 2 PHE O 1 1 16 3415 1 1 3 TRP C C -4.532 -1.793 0.058 1.00 . A A . 3 TRP C 1 1 16 3416 1 1 3 TRP CA C -5.795 -1.093 0.548 1.00 . A A . 3 TRP CA 1 1 16 3417 1 1 3 TRP CB C -6.885 -2.125 0.840 1.00 . A A . 3 TRP CB 1 1 16 3418 1 1 3 TRP CD1 C -5.807 -4.003 2.211 1.00 . A A . 3 TRP CD1 1 1 16 3419 1 1 3 TRP CD2 C -7.208 -2.700 3.376 1.00 . A A . 3 TRP CD2 1 1 16 3420 1 1 3 TRP CE2 C -6.687 -3.683 4.240 1.00 . A A . 3 TRP CE2 1 1 16 3421 1 1 3 TRP CE3 C -8.110 -1.764 3.887 1.00 . A A . 3 TRP CE3 1 1 16 3422 1 1 3 TRP CG C -6.631 -2.922 2.084 1.00 . A A . 3 TRP CG 1 1 16 3423 1 1 3 TRP CH2 C -7.928 -2.829 6.059 1.00 . A A . 3 TRP CH2 1 1 16 3424 1 1 3 TRP CZ2 C -7.042 -3.757 5.584 1.00 . A A . 3 TRP CZ2 1 1 16 3425 1 1 3 TRP CZ3 C -8.463 -1.838 5.223 1.00 . A A . 3 TRP CZ3 1 1 16 3426 1 1 3 TRP H H -7.151 -0.244 -0.838 1.00 . A A . 3 TRP H 1 1 16 3427 1 1 3 TRP HA H -5.565 -0.557 1.458 1.00 . A A . 3 TRP HA 1 1 16 3428 1 1 3 TRP HB2 H -7.830 -1.618 0.956 1.00 . A A . 3 TRP HB2 1 1 16 3429 1 1 3 TRP HB3 H -6.948 -2.814 0.011 1.00 . A A . 3 TRP HB3 1 1 16 3430 1 1 3 TRP HD1 H -5.224 -4.423 1.405 1.00 . A A . 3 TRP HD1 1 1 16 3431 1 1 3 TRP HE1 H -5.328 -5.232 3.846 1.00 . A A . 3 TRP HE1 1 1 16 3432 1 1 3 TRP HE3 H -8.533 -0.994 3.260 1.00 . A A . 3 TRP HE3 1 1 16 3433 1 1 3 TRP HH2 H -8.232 -2.849 7.094 1.00 . A A . 3 TRP HH2 1 1 16 3434 1 1 3 TRP HZ2 H -6.639 -4.514 6.241 1.00 . A A . 3 TRP HZ2 1 1 16 3435 1 1 3 TRP HZ3 H -9.160 -1.125 5.636 1.00 . A A . 3 TRP HZ3 1 1 16 3436 1 1 3 TRP N N -6.267 -0.122 -0.433 1.00 . A A . 3 TRP N 1 1 16 3437 1 1 3 TRP NE1 N -5.836 -4.466 3.505 1.00 . A A . 3 TRP NE1 1 1 16 3438 1 1 3 TRP O O -3.612 -2.052 0.835 1.00 . A A . 3 TRP O 1 1 16 3439 1 1 4 LEU C C -2.199 -1.784 -2.060 1.00 . A A . 4 LEU C 1 1 16 3440 1 1 4 LEU CA C -3.342 -2.767 -1.829 1.00 . A A . 4 LEU CA 1 1 16 3441 1 1 4 LEU CB C -3.738 -3.426 -3.151 1.00 . A A . 4 LEU CB 1 1 16 3442 1 1 4 LEU CD1 C -1.725 -4.917 -3.250 1.00 . A A . 4 LEU CD1 1 1 16 3443 1 1 4 LEU CD2 C -3.119 -4.567 -5.296 1.00 . A A . 4 LEU CD2 1 1 16 3444 1 1 4 LEU CG C -2.585 -3.929 -4.022 1.00 . A A . 4 LEU CG 1 1 16 3445 1 1 4 LEU H H -5.257 -1.865 -1.804 1.00 . A A . 4 LEU H 1 1 16 3446 1 1 4 LEU HA H -3.011 -3.531 -1.140 1.00 . A A . 4 LEU HA 1 1 16 3447 1 1 4 LEU HB2 H -4.372 -4.269 -2.923 1.00 . A A . 4 LEU HB2 1 1 16 3448 1 1 4 LEU HB3 H -4.297 -2.701 -3.727 1.00 . A A . 4 LEU HB3 1 1 16 3449 1 1 4 LEU HD11 H -1.201 -4.396 -2.461 1.00 . A A . 4 LEU HD11 1 1 16 3450 1 1 4 LEU HD12 H -2.353 -5.683 -2.820 1.00 . A A . 4 LEU HD12 1 1 16 3451 1 1 4 LEU HD13 H -1.009 -5.370 -3.919 1.00 . A A . 4 LEU HD13 1 1 16 3452 1 1 4 LEU HD21 H -3.586 -5.512 -5.058 1.00 . A A . 4 LEU HD21 1 1 16 3453 1 1 4 LEU HD22 H -3.846 -3.910 -5.751 1.00 . A A . 4 LEU HD22 1 1 16 3454 1 1 4 LEU HD23 H -2.304 -4.733 -5.985 1.00 . A A . 4 LEU HD23 1 1 16 3455 1 1 4 LEU HG H -1.963 -3.091 -4.302 1.00 . A A . 4 LEU HG 1 1 16 3456 1 1 4 LEU N N -4.493 -2.097 -1.235 1.00 . A A . 4 LEU N 1 1 16 3457 1 1 4 LEU O O -1.031 -2.112 -1.847 1.00 . A A . 4 LEU O 1 1 16 3458 1 1 5 PHE C C -0.781 0.805 -1.480 1.00 . A A . 5 PHE C 1 1 16 3459 1 1 5 PHE CA C -1.546 0.455 -2.754 1.00 . A A . 5 PHE CA 1 1 16 3460 1 1 5 PHE CB C -2.213 1.710 -3.320 1.00 . A A . 5 PHE CB 1 1 16 3461 1 1 5 PHE CD1 C -1.268 2.283 -5.574 1.00 . A A . 5 PHE CD1 1 1 16 3462 1 1 5 PHE CD2 C -0.508 3.516 -3.679 1.00 . A A . 5 PHE CD2 1 1 16 3463 1 1 5 PHE CE1 C -0.440 3.026 -6.394 1.00 . A A . 5 PHE CE1 1 1 16 3464 1 1 5 PHE CE2 C 0.321 4.262 -4.495 1.00 . A A . 5 PHE CE2 1 1 16 3465 1 1 5 PHE CG C -1.312 2.519 -4.209 1.00 . A A . 5 PHE CG 1 1 16 3466 1 1 5 PHE CZ C 0.357 4.017 -5.854 1.00 . A A . 5 PHE CZ 1 1 16 3467 1 1 5 PHE H H -3.490 -0.375 -2.646 1.00 . A A . 5 PHE H 1 1 16 3468 1 1 5 PHE HA H -0.849 0.068 -3.481 1.00 . A A . 5 PHE HA 1 1 16 3469 1 1 5 PHE HB2 H -3.076 1.417 -3.901 1.00 . A A . 5 PHE HB2 1 1 16 3470 1 1 5 PHE HB3 H -2.531 2.341 -2.504 1.00 . A A . 5 PHE HB3 1 1 16 3471 1 1 5 PHE HD1 H -1.890 1.508 -5.998 1.00 . A A . 5 PHE HD1 1 1 16 3472 1 1 5 PHE HD2 H -0.534 3.709 -2.617 1.00 . A A . 5 PHE HD2 1 1 16 3473 1 1 5 PHE HE1 H -0.416 2.831 -7.456 1.00 . A A . 5 PHE HE1 1 1 16 3474 1 1 5 PHE HE2 H 0.943 5.036 -4.069 1.00 . A A . 5 PHE HE2 1 1 16 3475 1 1 5 PHE HZ H 1.003 4.599 -6.493 1.00 . A A . 5 PHE HZ 1 1 16 3476 1 1 5 PHE N N -2.542 -0.576 -2.495 1.00 . A A . 5 PHE N 1 1 16 3477 1 1 5 PHE O O 0.445 0.722 -1.436 1.00 . A A . 5 PHE O 1 1 16 3478 1 1 6 ARG C C -0.029 0.433 1.355 1.00 . A A . 6 ARG C 1 1 16 3479 1 1 6 ARG CA C -0.910 1.562 0.830 1.00 . A A . 6 ARG CA 1 1 16 3480 1 1 6 ARG CB C -1.992 1.899 1.857 1.00 . A A . 6 ARG CB 1 1 16 3481 1 1 6 ARG CD C -3.648 3.577 2.726 1.00 . A A . 6 ARG CD 1 1 16 3482 1 1 6 ARG CG C -2.667 3.238 1.614 1.00 . A A . 6 ARG CG 1 1 16 3483 1 1 6 ARG CZ C -3.550 4.577 4.970 1.00 . A A . 6 ARG CZ 1 1 16 3484 1 1 6 ARG H H -2.491 1.245 -0.540 1.00 . A A . 6 ARG H 1 1 16 3485 1 1 6 ARG HA H -0.296 2.436 0.668 1.00 . A A . 6 ARG HA 1 1 16 3486 1 1 6 ARG HB2 H -2.750 1.129 1.830 1.00 . A A . 6 ARG HB2 1 1 16 3487 1 1 6 ARG HB3 H -1.545 1.918 2.840 1.00 . A A . 6 ARG HB3 1 1 16 3488 1 1 6 ARG HD2 H -4.254 4.413 2.412 1.00 . A A . 6 ARG HD2 1 1 16 3489 1 1 6 ARG HD3 H -4.279 2.721 2.905 1.00 . A A . 6 ARG HD3 1 1 16 3490 1 1 6 ARG HE H -2.024 3.673 4.059 1.00 . A A . 6 ARG HE 1 1 16 3491 1 1 6 ARG HG2 H -1.912 4.009 1.569 1.00 . A A . 6 ARG HG2 1 1 16 3492 1 1 6 ARG HG3 H -3.201 3.197 0.676 1.00 . A A . 6 ARG HG3 1 1 16 3493 1 1 6 ARG HH11 H -5.342 4.726 4.051 1.00 . A A . 6 ARG HH11 1 1 16 3494 1 1 6 ARG HH12 H -5.261 5.426 5.633 1.00 . A A . 6 ARG HH12 1 1 16 3495 1 1 6 ARG HH21 H -1.903 4.591 6.143 1.00 . A A . 6 ARG HH21 1 1 16 3496 1 1 6 ARG HH22 H -3.303 5.350 6.823 1.00 . A A . 6 ARG HH22 1 1 16 3497 1 1 6 ARG N N -1.516 1.197 -0.444 1.00 . A A . 6 ARG N 1 1 16 3498 1 1 6 ARG NE N -2.966 3.930 3.969 1.00 . A A . 6 ARG NE 1 1 16 3499 1 1 6 ARG NH1 N -4.822 4.940 4.877 1.00 . A A . 6 ARG NH1 1 1 16 3500 1 1 6 ARG NH2 N -2.862 4.862 6.070 1.00 . A A . 6 ARG NH2 1 1 16 3501 1 1 6 ARG O O 1.100 0.661 1.788 1.00 . A A . 6 ARG O 1 1 16 3502 1 1 7 GLY C C 1.552 -2.060 1.119 1.00 . A A . 7 GLY C 1 1 16 3503 1 1 7 GLY CA C 0.199 -1.936 1.789 1.00 . A A . 7 GLY CA 1 1 16 3504 1 1 7 GLY H H -1.459 -0.912 0.958 1.00 . A A . 7 GLY H 1 1 16 3505 1 1 7 GLY HA2 H 0.343 -1.841 2.855 1.00 . A A . 7 GLY HA2 1 1 16 3506 1 1 7 GLY HA3 H -0.372 -2.832 1.591 1.00 . A A . 7 GLY HA3 1 1 16 3507 1 1 7 GLY N N -0.554 -0.789 1.314 1.00 . A A . 7 GLY N 1 1 16 3508 1 1 7 GLY O O 2.569 -2.247 1.786 1.00 . A A . 7 GLY O 1 1 16 3509 1 1 8 LYS C C 3.849 -1.078 -0.445 1.00 . A A . 8 LYS C 1 1 16 3510 1 1 8 LYS CA C 2.805 -2.059 -0.968 1.00 . A A . 8 LYS CA 1 1 16 3511 1 1 8 LYS CB C 2.537 -1.790 -2.452 1.00 . A A . 8 LYS CB 1 1 16 3512 1 1 8 LYS CD C 4.739 -1.614 -3.649 1.00 . A A . 8 LYS CD 1 1 16 3513 1 1 8 LYS CE C 4.481 -0.623 -4.773 1.00 . A A . 8 LYS CE 1 1 16 3514 1 1 8 LYS CG C 3.520 -2.481 -3.381 1.00 . A A . 8 LYS CG 1 1 16 3515 1 1 8 LYS H H 0.722 -1.807 -0.682 1.00 . A A . 8 LYS H 1 1 16 3516 1 1 8 LYS HA H 3.183 -3.062 -0.855 1.00 . A A . 8 LYS HA 1 1 16 3517 1 1 8 LYS HB2 H 1.543 -2.134 -2.694 1.00 . A A . 8 LYS HB2 1 1 16 3518 1 1 8 LYS HB3 H 2.594 -0.727 -2.629 1.00 . A A . 8 LYS HB3 1 1 16 3519 1 1 8 LYS HD2 H 4.985 -1.066 -2.751 1.00 . A A . 8 LYS HD2 1 1 16 3520 1 1 8 LYS HD3 H 5.570 -2.250 -3.923 1.00 . A A . 8 LYS HD3 1 1 16 3521 1 1 8 LYS HE2 H 3.565 -0.092 -4.565 1.00 . A A . 8 LYS HE2 1 1 16 3522 1 1 8 LYS HE3 H 5.302 0.077 -4.813 1.00 . A A . 8 LYS HE3 1 1 16 3523 1 1 8 LYS HG2 H 3.845 -3.405 -2.925 1.00 . A A . 8 LYS HG2 1 1 16 3524 1 1 8 LYS HG3 H 3.028 -2.694 -4.318 1.00 . A A . 8 LYS HG3 1 1 16 3525 1 1 8 LYS HZ1 H 4.544 -2.320 -5.990 1.00 . A A . 8 LYS HZ1 1 1 16 3526 1 1 8 LYS HZ2 H 3.398 -1.172 -6.474 1.00 . A A . 8 LYS HZ2 1 1 16 3527 1 1 8 LYS HZ3 H 5.042 -0.902 -6.766 1.00 . A A . 8 LYS HZ3 1 1 16 3528 1 1 8 LYS N N 1.566 -1.957 -0.206 1.00 . A A . 8 LYS N 1 1 16 3529 1 1 8 LYS NZ N 4.358 -1.302 -6.093 1.00 . A A . 8 LYS NZ 1 1 16 3530 1 1 8 LYS O O 5.035 -1.397 -0.378 1.00 . A A . 8 LYS O 1 1 16 3531 1 1 9 ALA C C 4.716 0.825 1.882 1.00 . A A . 9 ALA C 1 1 16 3532 1 1 9 ALA CA C 4.293 1.141 0.451 1.00 . A A . 9 ALA CA 1 1 16 3533 1 1 9 ALA CB C 3.627 2.507 0.386 1.00 . A A . 9 ALA CB 1 1 16 3534 1 1 9 ALA H H 2.442 0.311 -0.147 1.00 . A A . 9 ALA H 1 1 16 3535 1 1 9 ALA HA H 5.174 1.166 -0.176 1.00 . A A . 9 ALA HA 1 1 16 3536 1 1 9 ALA HB1 H 3.439 2.766 -0.646 1.00 . A A . 9 ALA HB1 1 1 16 3537 1 1 9 ALA HB2 H 2.693 2.478 0.924 1.00 . A A . 9 ALA HB2 1 1 16 3538 1 1 9 ALA HB3 H 4.276 3.247 0.829 1.00 . A A . 9 ALA HB3 1 1 16 3539 1 1 9 ALA N N 3.399 0.115 -0.071 1.00 . A A . 9 ALA N 1 1 16 3540 1 1 9 ALA O O 5.860 1.062 2.269 1.00 . A A . 9 ALA O 1 1 16 3541 1 1 10 ASP C C 5.251 -1.008 4.149 1.00 . A A . 10 ASP C 1 1 16 3542 1 1 10 ASP CA C 4.059 -0.061 4.053 1.00 . A A . 10 ASP CA 1 1 16 3543 1 1 10 ASP CB C 2.828 -0.703 4.692 1.00 . A A . 10 ASP CB 1 1 16 3544 1 1 10 ASP CG C 2.924 -0.759 6.205 1.00 . A A . 10 ASP CG 1 1 16 3545 1 1 10 ASP H H 2.890 0.123 2.296 1.00 . A A . 10 ASP H 1 1 16 3546 1 1 10 ASP HA H 4.296 0.850 4.583 1.00 . A A . 10 ASP HA 1 1 16 3547 1 1 10 ASP HB2 H 1.952 -0.129 4.427 1.00 . A A . 10 ASP HB2 1 1 16 3548 1 1 10 ASP HB3 H 2.720 -1.710 4.318 1.00 . A A . 10 ASP HB3 1 1 16 3549 1 1 10 ASP N N 3.784 0.289 2.663 1.00 . A A . 10 ASP N 1 1 16 3550 1 1 10 ASP O O 6.217 -0.738 4.862 1.00 . A A . 10 ASP O 1 1 16 3551 1 1 10 ASP OD1 O 2.943 0.318 6.837 1.00 . A A . 10 ASP OD1 1 1 16 3552 1 1 10 ASP OD2 O 2.981 -1.878 6.754 1.00 . A A . 10 ASP OD2 1 1 16 3553 1 1 11 VAL C C 7.462 -2.605 2.660 1.00 . A A . 11 VAL C 1 1 16 3554 1 1 11 VAL CA C 6.246 -3.110 3.430 1.00 . A A . 11 VAL CA 1 1 16 3555 1 1 11 VAL CB C 5.781 -4.445 2.817 1.00 . A A . 11 VAL CB 1 1 16 3556 1 1 11 VAL CG1 C 4.677 -5.064 3.660 1.00 . A A . 11 VAL CG1 1 1 16 3557 1 1 11 VAL CG2 C 5.316 -4.238 1.383 1.00 . A A . 11 VAL CG2 1 1 16 3558 1 1 11 VAL H H 4.379 -2.282 2.877 1.00 . A A . 11 VAL H 1 1 16 3559 1 1 11 VAL HA H 6.531 -3.290 4.456 1.00 . A A . 11 VAL HA 1 1 16 3560 1 1 11 VAL HB H 6.620 -5.124 2.807 1.00 . A A . 11 VAL HB 1 1 16 3561 1 1 11 VAL HG11 H 5.103 -5.792 4.333 1.00 . A A . 11 VAL HG11 1 1 16 3562 1 1 11 VAL HG12 H 4.185 -4.291 4.232 1.00 . A A . 11 VAL HG12 1 1 16 3563 1 1 11 VAL HG13 H 3.959 -5.547 3.014 1.00 . A A . 11 VAL HG13 1 1 16 3564 1 1 11 VAL HG21 H 6.105 -4.528 0.704 1.00 . A A . 11 VAL HG21 1 1 16 3565 1 1 11 VAL HG22 H 4.441 -4.843 1.198 1.00 . A A . 11 VAL HG22 1 1 16 3566 1 1 11 VAL HG23 H 5.074 -3.197 1.229 1.00 . A A . 11 VAL HG23 1 1 16 3567 1 1 11 VAL N N 5.175 -2.121 3.426 1.00 . A A . 11 VAL N 1 1 16 3568 1 1 11 VAL O O 8.602 -2.888 3.026 1.00 . A A . 11 VAL O 1 1 16 3569 1 1 12 ALA C C 8.104 0.188 0.560 1.00 . A A . 12 ALA C 1 1 16 3570 1 1 12 ALA CA C 8.283 -1.312 0.769 1.00 . A A . 12 ALA CA 1 1 16 3571 1 1 12 ALA CB C 8.340 -2.031 -0.570 1.00 . A A . 12 ALA CB 1 1 16 3572 1 1 12 ALA H H 6.279 -1.669 1.349 1.00 . A A . 12 ALA H 1 1 16 3573 1 1 12 ALA HA H 9.217 -1.486 1.283 1.00 . A A . 12 ALA HA 1 1 16 3574 1 1 12 ALA HB1 H 7.564 -1.649 -1.218 1.00 . A A . 12 ALA HB1 1 1 16 3575 1 1 12 ALA HB2 H 9.304 -1.863 -1.027 1.00 . A A . 12 ALA HB2 1 1 16 3576 1 1 12 ALA HB3 H 8.193 -3.090 -0.418 1.00 . A A . 12 ALA HB3 1 1 16 3577 1 1 12 ALA N N 7.209 -1.858 1.590 1.00 . A A . 12 ALA N 1 1 16 3578 1 1 12 ALA O O 7.518 0.621 -0.432 1.00 . A A . 12 ALA O 1 1 16 3579 1 1 13 LEU C C 9.070 2.941 0.095 1.00 . A A . 13 LEU C 1 1 16 3580 1 1 13 LEU CA C 8.511 2.428 1.420 1.00 . A A . 13 LEU CA 1 1 16 3581 1 1 13 LEU CB C 9.257 3.078 2.587 1.00 . A A . 13 LEU CB 1 1 16 3582 1 1 13 LEU CD1 C 9.569 3.079 5.074 1.00 . A A . 13 LEU CD1 1 1 16 3583 1 1 13 LEU CD2 C 7.558 4.175 4.068 1.00 . A A . 13 LEU CD2 1 1 16 3584 1 1 13 LEU CG C 8.553 3.030 3.943 1.00 . A A . 13 LEU CG 1 1 16 3585 1 1 13 LEU H H 9.070 0.573 2.267 1.00 . A A . 13 LEU H 1 1 16 3586 1 1 13 LEU HA H 7.466 2.691 1.481 1.00 . A A . 13 LEU HA 1 1 16 3587 1 1 13 LEU HB2 H 10.208 2.578 2.690 1.00 . A A . 13 LEU HB2 1 1 16 3588 1 1 13 LEU HB3 H 9.424 4.116 2.335 1.00 . A A . 13 LEU HB3 1 1 16 3589 1 1 13 LEU HD11 H 10.261 3.889 4.901 1.00 . A A . 13 LEU HD11 1 1 16 3590 1 1 13 LEU HD12 H 9.056 3.235 6.011 1.00 . A A . 13 LEU HD12 1 1 16 3591 1 1 13 LEU HD13 H 10.110 2.145 5.111 1.00 . A A . 13 LEU HD13 1 1 16 3592 1 1 13 LEU HD21 H 6.572 3.777 4.251 1.00 . A A . 13 LEU HD21 1 1 16 3593 1 1 13 LEU HD22 H 7.847 4.814 4.891 1.00 . A A . 13 LEU HD22 1 1 16 3594 1 1 13 LEU HD23 H 7.551 4.747 3.152 1.00 . A A . 13 LEU HD23 1 1 16 3595 1 1 13 LEU HG H 8.007 2.101 4.025 1.00 . A A . 13 LEU HG 1 1 16 3596 1 1 13 LEU N N 8.615 0.976 1.500 1.00 . A A . 13 LEU N 1 1 16 3597 1 1 13 LEU O O 10.194 2.613 -0.284 1.00 . A A . 13 LEU O 1 1 16 3598 1 1 14 NH2 HN1 H 7.392 3.974 -0.246 1.00 . A A . 14 NH2 HN1 1 1 16 3599 1 1 14 NH2 HN2 H 8.563 4.134 -1.480 1.00 . A A . 14 NH2 HN2 1 1 16 3600 1 1 14 NH2 N N 8.278 3.749 -0.601 1.00 . A A . 14 NH2 N 1 1 17 3601 1 1 1 ILE C C -6.274 0.049 -3.558 1.00 . A A . 1 ILE C 1 1 17 3602 1 1 1 ILE CA C -7.031 -0.820 -4.557 1.00 . A A . 1 ILE CA 1 1 17 3603 1 1 1 ILE CB C -7.357 0.020 -5.806 1.00 . A A . 1 ILE CB 1 1 17 3604 1 1 1 ILE CD1 C -5.131 -0.537 -6.906 1.00 . A A . 1 ILE CD1 1 1 17 3605 1 1 1 ILE CG1 C -6.071 0.552 -6.440 1.00 . A A . 1 ILE CG1 1 1 17 3606 1 1 1 ILE CG2 C -8.290 1.166 -5.445 1.00 . A A . 1 ILE CG2 1 1 17 3607 1 1 1 ILE H1 H -9.032 -1.509 -4.517 1.00 . A A . 1 ILE H1 1 1 17 3608 1 1 1 ILE HA H -6.397 -1.643 -4.855 1.00 . A A . 1 ILE HA 1 1 17 3609 1 1 1 ILE HB H -7.864 -0.616 -6.516 1.00 . A A . 1 ILE HB 1 1 17 3610 1 1 1 ILE HD11 H -4.468 -0.811 -6.099 1.00 . A A . 1 ILE HD11 1 1 17 3611 1 1 1 ILE HD12 H -5.704 -1.401 -7.210 1.00 . A A . 1 ILE HD12 1 1 17 3612 1 1 1 ILE HD13 H -4.550 -0.178 -7.742 1.00 . A A . 1 ILE HD13 1 1 17 3613 1 1 1 ILE HG12 H -6.322 1.160 -7.294 1.00 . A A . 1 ILE HG12 1 1 17 3614 1 1 1 ILE HG13 H -5.545 1.158 -5.715 1.00 . A A . 1 ILE HG13 1 1 17 3615 1 1 1 ILE HG21 H -9.020 1.296 -6.231 1.00 . A A . 1 ILE HG21 1 1 17 3616 1 1 1 ILE HG22 H -8.796 0.940 -4.517 1.00 . A A . 1 ILE HG22 1 1 17 3617 1 1 1 ILE HG23 H -7.718 2.073 -5.332 1.00 . A A . 1 ILE HG23 1 1 17 3618 1 1 1 ILE N N -8.238 -1.377 -3.958 1.00 . A A . 1 ILE N 1 1 17 3619 1 1 1 ILE O O -5.042 0.081 -3.556 1.00 . A A . 1 ILE O 1 1 17 3620 1 1 2 PHE C C -5.573 0.813 -0.721 1.00 . A A . 2 PHE C 1 1 17 3621 1 1 2 PHE CA C -6.415 1.620 -1.704 1.00 . A A . 2 PHE CA 1 1 17 3622 1 1 2 PHE CB C -7.501 2.391 -0.951 1.00 . A A . 2 PHE CB 1 1 17 3623 1 1 2 PHE CD1 C -9.568 2.813 -2.310 1.00 . A A . 2 PHE CD1 1 1 17 3624 1 1 2 PHE CD2 C -7.912 4.526 -2.205 1.00 . A A . 2 PHE CD2 1 1 17 3625 1 1 2 PHE CE1 C -10.346 3.610 -3.126 1.00 . A A . 2 PHE CE1 1 1 17 3626 1 1 2 PHE CE2 C -8.686 5.328 -3.021 1.00 . A A . 2 PHE CE2 1 1 17 3627 1 1 2 PHE CG C -8.344 3.261 -1.839 1.00 . A A . 2 PHE CG 1 1 17 3628 1 1 2 PHE CZ C -9.904 4.870 -3.484 1.00 . A A . 2 PHE CZ 1 1 17 3629 1 1 2 PHE H H -7.993 0.683 -2.760 1.00 . A A . 2 PHE H 1 1 17 3630 1 1 2 PHE HA H -5.775 2.322 -2.215 1.00 . A A . 2 PHE HA 1 1 17 3631 1 1 2 PHE HB2 H -8.155 1.689 -0.458 1.00 . A A . 2 PHE HB2 1 1 17 3632 1 1 2 PHE HB3 H -7.034 3.024 -0.211 1.00 . A A . 2 PHE HB3 1 1 17 3633 1 1 2 PHE HD1 H -9.914 1.827 -2.030 1.00 . A A . 2 PHE HD1 1 1 17 3634 1 1 2 PHE HD2 H -6.959 4.885 -1.845 1.00 . A A . 2 PHE HD2 1 1 17 3635 1 1 2 PHE HE1 H -11.298 3.250 -3.485 1.00 . A A . 2 PHE HE1 1 1 17 3636 1 1 2 PHE HE2 H -8.339 6.311 -3.299 1.00 . A A . 2 PHE HE2 1 1 17 3637 1 1 2 PHE HZ H -10.511 5.494 -4.122 1.00 . A A . 2 PHE HZ 1 1 17 3638 1 1 2 PHE N N -7.016 0.750 -2.709 1.00 . A A . 2 PHE N 1 1 17 3639 1 1 2 PHE O O -4.442 1.182 -0.406 1.00 . A A . 2 PHE O 1 1 17 3640 1 1 3 TRP C C -4.147 -1.695 0.106 1.00 . A A . 3 TRP C 1 1 17 3641 1 1 3 TRP CA C -5.437 -1.151 0.710 1.00 . A A . 3 TRP CA 1 1 17 3642 1 1 3 TRP CB C -6.340 -2.308 1.142 1.00 . A A . 3 TRP CB 1 1 17 3643 1 1 3 TRP CD1 C -5.603 -4.614 1.980 1.00 . A A . 3 TRP CD1 1 1 17 3644 1 1 3 TRP CD2 C -4.994 -2.916 3.306 1.00 . A A . 3 TRP CD2 1 1 17 3645 1 1 3 TRP CE2 C -4.532 -4.119 3.876 1.00 . A A . 3 TRP CE2 1 1 17 3646 1 1 3 TRP CE3 C -4.727 -1.713 3.965 1.00 . A A . 3 TRP CE3 1 1 17 3647 1 1 3 TRP CG C -5.677 -3.256 2.095 1.00 . A A . 3 TRP CG 1 1 17 3648 1 1 3 TRP CH2 C -3.573 -2.957 5.695 1.00 . A A . 3 TRP CH2 1 1 17 3649 1 1 3 TRP CZ2 C -3.820 -4.151 5.072 1.00 . A A . 3 TRP CZ2 1 1 17 3650 1 1 3 TRP CZ3 C -4.021 -1.746 5.152 1.00 . A A . 3 TRP CZ3 1 1 17 3651 1 1 3 TRP H H -7.039 -0.533 -0.528 1.00 . A A . 3 TRP H 1 1 17 3652 1 1 3 TRP HA H -5.191 -0.555 1.578 1.00 . A A . 3 TRP HA 1 1 17 3653 1 1 3 TRP HB2 H -7.218 -1.909 1.627 1.00 . A A . 3 TRP HB2 1 1 17 3654 1 1 3 TRP HB3 H -6.639 -2.866 0.267 1.00 . A A . 3 TRP HB3 1 1 17 3655 1 1 3 TRP HD1 H -6.029 -5.180 1.165 1.00 . A A . 3 TRP HD1 1 1 17 3656 1 1 3 TRP HE1 H -4.733 -6.093 3.193 1.00 . A A . 3 TRP HE1 1 1 17 3657 1 1 3 TRP HE3 H -5.064 -0.769 3.562 1.00 . A A . 3 TRP HE3 1 1 17 3658 1 1 3 TRP HH2 H -3.026 -2.936 6.624 1.00 . A A . 3 TRP HH2 1 1 17 3659 1 1 3 TRP HZ2 H -3.468 -5.076 5.503 1.00 . A A . 3 TRP HZ2 1 1 17 3660 1 1 3 TRP HZ3 H -3.806 -0.826 5.677 1.00 . A A . 3 TRP HZ3 1 1 17 3661 1 1 3 TRP N N -6.133 -0.290 -0.238 1.00 . A A . 3 TRP N 1 1 17 3662 1 1 3 TRP NE1 N -4.918 -5.140 3.048 1.00 . A A . 3 TRP NE1 1 1 17 3663 1 1 3 TRP O O -3.116 -1.764 0.776 1.00 . A A . 3 TRP O 1 1 17 3664 1 1 4 LEU C C -2.004 -1.531 -2.097 1.00 . A A . 4 LEU C 1 1 17 3665 1 1 4 LEU CA C -3.047 -2.618 -1.860 1.00 . A A . 4 LEU CA 1 1 17 3666 1 1 4 LEU CB C -3.467 -3.239 -3.193 1.00 . A A . 4 LEU CB 1 1 17 3667 1 1 4 LEU CD1 C -1.247 -4.355 -3.524 1.00 . A A . 4 LEU CD1 1 1 17 3668 1 1 4 LEU CD2 C -2.880 -4.239 -5.416 1.00 . A A . 4 LEU CD2 1 1 17 3669 1 1 4 LEU CG C -2.339 -3.526 -4.185 1.00 . A A . 4 LEU CG 1 1 17 3670 1 1 4 LEU H H -5.060 -2.000 -1.646 1.00 . A A . 4 LEU H 1 1 17 3671 1 1 4 LEU HA H -2.613 -3.386 -1.236 1.00 . A A . 4 LEU HA 1 1 17 3672 1 1 4 LEU HB2 H -3.967 -4.170 -2.982 1.00 . A A . 4 LEU HB2 1 1 17 3673 1 1 4 LEU HB3 H -4.162 -2.559 -3.668 1.00 . A A . 4 LEU HB3 1 1 17 3674 1 1 4 LEU HD11 H -1.014 -5.205 -4.148 1.00 . A A . 4 LEU HD11 1 1 17 3675 1 1 4 LEU HD12 H -0.362 -3.747 -3.398 1.00 . A A . 4 LEU HD12 1 1 17 3676 1 1 4 LEU HD13 H -1.589 -4.696 -2.559 1.00 . A A . 4 LEU HD13 1 1 17 3677 1 1 4 LEU HD21 H -2.104 -4.303 -6.166 1.00 . A A . 4 LEU HD21 1 1 17 3678 1 1 4 LEU HD22 H -3.199 -5.234 -5.144 1.00 . A A . 4 LEU HD22 1 1 17 3679 1 1 4 LEU HD23 H -3.719 -3.687 -5.811 1.00 . A A . 4 LEU HD23 1 1 17 3680 1 1 4 LEU HG H -1.900 -2.591 -4.504 1.00 . A A . 4 LEU HG 1 1 17 3681 1 1 4 LEU N N -4.211 -2.080 -1.165 1.00 . A A . 4 LEU N 1 1 17 3682 1 1 4 LEU O O -0.830 -1.701 -1.770 1.00 . A A . 4 LEU O 1 1 17 3683 1 1 5 PHE C C -0.815 1.145 -1.685 1.00 . A A . 5 PHE C 1 1 17 3684 1 1 5 PHE CA C -1.546 0.703 -2.948 1.00 . A A . 5 PHE CA 1 1 17 3685 1 1 5 PHE CB C -2.329 1.878 -3.537 1.00 . A A . 5 PHE CB 1 1 17 3686 1 1 5 PHE CD1 C -0.289 3.105 -4.326 1.00 . A A . 5 PHE CD1 1 1 17 3687 1 1 5 PHE CD2 C -1.971 4.334 -3.168 1.00 . A A . 5 PHE CD2 1 1 17 3688 1 1 5 PHE CE1 C 0.465 4.256 -4.461 1.00 . A A . 5 PHE CE1 1 1 17 3689 1 1 5 PHE CE2 C -1.223 5.488 -3.300 1.00 . A A . 5 PHE CE2 1 1 17 3690 1 1 5 PHE CG C -1.513 3.131 -3.681 1.00 . A A . 5 PHE CG 1 1 17 3691 1 1 5 PHE CZ C -0.003 5.449 -3.945 1.00 . A A . 5 PHE CZ 1 1 17 3692 1 1 5 PHE H H -3.389 -0.337 -2.907 1.00 . A A . 5 PHE H 1 1 17 3693 1 1 5 PHE HA H -0.817 0.368 -3.672 1.00 . A A . 5 PHE HA 1 1 17 3694 1 1 5 PHE HB2 H -2.691 1.605 -4.516 1.00 . A A . 5 PHE HB2 1 1 17 3695 1 1 5 PHE HB3 H -3.168 2.098 -2.895 1.00 . A A . 5 PHE HB3 1 1 17 3696 1 1 5 PHE HD1 H 0.078 2.172 -4.730 1.00 . A A . 5 PHE HD1 1 1 17 3697 1 1 5 PHE HD2 H -2.925 4.366 -2.661 1.00 . A A . 5 PHE HD2 1 1 17 3698 1 1 5 PHE HE1 H 1.418 4.223 -4.967 1.00 . A A . 5 PHE HE1 1 1 17 3699 1 1 5 PHE HE2 H -1.591 6.420 -2.895 1.00 . A A . 5 PHE HE2 1 1 17 3700 1 1 5 PHE HZ H 0.584 6.350 -4.049 1.00 . A A . 5 PHE HZ 1 1 17 3701 1 1 5 PHE N N -2.442 -0.413 -2.668 1.00 . A A . 5 PHE N 1 1 17 3702 1 1 5 PHE O O 0.374 1.461 -1.720 1.00 . A A . 5 PHE O 1 1 17 3703 1 1 6 ARG C C -0.052 0.482 1.265 1.00 . A A . 6 ARG C 1 1 17 3704 1 1 6 ARG CA C -0.960 1.573 0.707 1.00 . A A . 6 ARG CA 1 1 17 3705 1 1 6 ARG CB C -2.067 1.893 1.714 1.00 . A A . 6 ARG CB 1 1 17 3706 1 1 6 ARG CD C -2.681 2.941 3.914 1.00 . A A . 6 ARG CD 1 1 17 3707 1 1 6 ARG CG C -1.628 2.837 2.821 1.00 . A A . 6 ARG CG 1 1 17 3708 1 1 6 ARG CZ C -1.329 3.405 5.913 1.00 . A A . 6 ARG CZ 1 1 17 3709 1 1 6 ARG H H -2.481 0.905 -0.604 1.00 . A A . 6 ARG H 1 1 17 3710 1 1 6 ARG HA H -0.371 2.462 0.537 1.00 . A A . 6 ARG HA 1 1 17 3711 1 1 6 ARG HB2 H -2.893 2.351 1.189 1.00 . A A . 6 ARG HB2 1 1 17 3712 1 1 6 ARG HB3 H -2.402 0.973 2.166 1.00 . A A . 6 ARG HB3 1 1 17 3713 1 1 6 ARG HD2 H -3.579 3.366 3.489 1.00 . A A . 6 ARG HD2 1 1 17 3714 1 1 6 ARG HD3 H -2.893 1.951 4.287 1.00 . A A . 6 ARG HD3 1 1 17 3715 1 1 6 ARG HE H -2.639 4.672 5.106 1.00 . A A . 6 ARG HE 1 1 17 3716 1 1 6 ARG HG2 H -0.711 2.466 3.256 1.00 . A A . 6 ARG HG2 1 1 17 3717 1 1 6 ARG HG3 H -1.459 3.817 2.402 1.00 . A A . 6 ARG HG3 1 1 17 3718 1 1 6 ARG HH11 H -1.030 1.585 5.088 1.00 . A A . 6 ARG HH11 1 1 17 3719 1 1 6 ARG HH12 H -0.083 1.925 6.498 1.00 . A A . 6 ARG HH12 1 1 17 3720 1 1 6 ARG HH21 H -1.398 5.131 6.963 1.00 . A A . 6 ARG HH21 1 1 17 3721 1 1 6 ARG HH22 H -0.294 3.941 7.565 1.00 . A A . 6 ARG HH22 1 1 17 3722 1 1 6 ARG N N -1.537 1.166 -0.568 1.00 . A A . 6 ARG N 1 1 17 3723 1 1 6 ARG NE N -2.239 3.783 5.022 1.00 . A A . 6 ARG NE 1 1 17 3724 1 1 6 ARG NH1 N -0.769 2.206 5.827 1.00 . A A . 6 ARG NH1 1 1 17 3725 1 1 6 ARG NH2 N -0.977 4.227 6.894 1.00 . A A . 6 ARG NH2 1 1 17 3726 1 1 6 ARG O O 1.115 0.725 1.569 1.00 . A A . 6 ARG O 1 1 17 3727 1 1 7 GLY C C 1.486 -2.028 1.180 1.00 . A A . 7 GLY C 1 1 17 3728 1 1 7 GLY CA C 0.177 -1.835 1.920 1.00 . A A . 7 GLY CA 1 1 17 3729 1 1 7 GLY H H -1.533 -0.860 1.140 1.00 . A A . 7 GLY H 1 1 17 3730 1 1 7 GLY HA2 H 0.389 -1.655 2.964 1.00 . A A . 7 GLY HA2 1 1 17 3731 1 1 7 GLY HA3 H -0.407 -2.740 1.833 1.00 . A A . 7 GLY HA3 1 1 17 3732 1 1 7 GLY N N -0.597 -0.724 1.398 1.00 . A A . 7 GLY N 1 1 17 3733 1 1 7 GLY O O 2.525 -2.276 1.793 1.00 . A A . 7 GLY O 1 1 17 3734 1 1 8 LYS C C 3.741 -1.143 -0.512 1.00 . A A . 8 LYS C 1 1 17 3735 1 1 8 LYS CA C 2.628 -2.079 -0.970 1.00 . A A . 8 LYS CA 1 1 17 3736 1 1 8 LYS CB C 2.295 -1.813 -2.439 1.00 . A A . 8 LYS CB 1 1 17 3737 1 1 8 LYS CD C 3.167 -1.679 -4.791 1.00 . A A . 8 LYS CD 1 1 17 3738 1 1 8 LYS CE C 1.974 -2.325 -5.477 1.00 . A A . 8 LYS CE 1 1 17 3739 1 1 8 LYS CG C 3.386 -2.250 -3.399 1.00 . A A . 8 LYS CG 1 1 17 3740 1 1 8 LYS H H 0.580 -1.718 -0.576 1.00 . A A . 8 LYS H 1 1 17 3741 1 1 8 LYS HA H 2.967 -3.099 -0.866 1.00 . A A . 8 LYS HA 1 1 17 3742 1 1 8 LYS HB2 H 1.388 -2.343 -2.693 1.00 . A A . 8 LYS HB2 1 1 17 3743 1 1 8 LYS HB3 H 2.131 -0.753 -2.573 1.00 . A A . 8 LYS HB3 1 1 17 3744 1 1 8 LYS HD2 H 2.991 -0.617 -4.710 1.00 . A A . 8 LYS HD2 1 1 17 3745 1 1 8 LYS HD3 H 4.052 -1.854 -5.386 1.00 . A A . 8 LYS HD3 1 1 17 3746 1 1 8 LYS HE2 H 2.163 -3.382 -5.579 1.00 . A A . 8 LYS HE2 1 1 17 3747 1 1 8 LYS HE3 H 1.098 -2.173 -4.865 1.00 . A A . 8 LYS HE3 1 1 17 3748 1 1 8 LYS HG2 H 4.339 -1.907 -3.028 1.00 . A A . 8 LYS HG2 1 1 17 3749 1 1 8 LYS HG3 H 3.389 -3.330 -3.460 1.00 . A A . 8 LYS HG3 1 1 17 3750 1 1 8 LYS HZ1 H 2.614 -1.360 -7.217 1.00 . A A . 8 LYS HZ1 1 1 17 3751 1 1 8 LYS HZ2 H 1.370 -2.477 -7.471 1.00 . A A . 8 LYS HZ2 1 1 17 3752 1 1 8 LYS HZ3 H 1.029 -0.978 -6.765 1.00 . A A . 8 LYS HZ3 1 1 17 3753 1 1 8 LYS N N 1.438 -1.916 -0.143 1.00 . A A . 8 LYS N 1 1 17 3754 1 1 8 LYS NZ N 1.730 -1.745 -6.827 1.00 . A A . 8 LYS NZ 1 1 17 3755 1 1 8 LYS O O 4.916 -1.506 -0.525 1.00 . A A . 8 LYS O 1 1 17 3756 1 1 9 ALA C C 4.769 0.761 1.785 1.00 . A A . 9 ALA C 1 1 17 3757 1 1 9 ALA CA C 4.328 1.055 0.356 1.00 . A A . 9 ALA CA 1 1 17 3758 1 1 9 ALA CB C 3.739 2.454 0.259 1.00 . A A . 9 ALA CB 1 1 17 3759 1 1 9 ALA H H 2.410 0.299 -0.123 1.00 . A A . 9 ALA H 1 1 17 3760 1 1 9 ALA HA H 5.191 1.008 -0.293 1.00 . A A . 9 ALA HA 1 1 17 3761 1 1 9 ALA HB1 H 3.279 2.586 -0.707 1.00 . A A . 9 ALA HB1 1 1 17 3762 1 1 9 ALA HB2 H 2.995 2.586 1.033 1.00 . A A . 9 ALA HB2 1 1 17 3763 1 1 9 ALA HB3 H 4.525 3.184 0.387 1.00 . A A . 9 ALA HB3 1 1 17 3764 1 1 9 ALA N N 3.362 0.067 -0.108 1.00 . A A . 9 ALA N 1 1 17 3765 1 1 9 ALA O O 5.944 0.899 2.123 1.00 . A A . 9 ALA O 1 1 17 3766 1 1 10 ASP C C 5.215 -1.006 4.117 1.00 . A A . 10 ASP C 1 1 17 3767 1 1 10 ASP CA C 4.110 0.041 4.016 1.00 . A A . 10 ASP CA 1 1 17 3768 1 1 10 ASP CB C 2.850 -0.459 4.722 1.00 . A A . 10 ASP CB 1 1 17 3769 1 1 10 ASP CG C 2.896 -0.229 6.219 1.00 . A A . 10 ASP CG 1 1 17 3770 1 1 10 ASP H H 2.901 0.264 2.292 1.00 . A A . 10 ASP H 1 1 17 3771 1 1 10 ASP HA H 4.446 0.947 4.497 1.00 . A A . 10 ASP HA 1 1 17 3772 1 1 10 ASP HB2 H 1.991 0.061 4.323 1.00 . A A . 10 ASP HB2 1 1 17 3773 1 1 10 ASP HB3 H 2.740 -1.518 4.541 1.00 . A A . 10 ASP HB3 1 1 17 3774 1 1 10 ASP N N 3.820 0.355 2.621 1.00 . A A . 10 ASP N 1 1 17 3775 1 1 10 ASP O O 6.260 -0.765 4.722 1.00 . A A . 10 ASP O 1 1 17 3776 1 1 10 ASP OD1 O 2.256 0.734 6.693 1.00 . A A . 10 ASP OD1 1 1 17 3777 1 1 10 ASP OD2 O 3.570 -1.014 6.919 1.00 . A A . 10 ASP OD2 1 1 17 3778 1 1 11 VAL C C 7.190 -2.899 2.732 1.00 . A A . 11 VAL C 1 1 17 3779 1 1 11 VAL CA C 5.950 -3.255 3.546 1.00 . A A . 11 VAL CA 1 1 17 3780 1 1 11 VAL CB C 5.348 -4.563 2.998 1.00 . A A . 11 VAL CB 1 1 17 3781 1 1 11 VAL CG1 C 4.869 -4.372 1.567 1.00 . A A . 11 VAL CG1 1 1 17 3782 1 1 11 VAL CG2 C 6.362 -5.693 3.083 1.00 . A A . 11 VAL CG2 1 1 17 3783 1 1 11 VAL H H 4.125 -2.302 3.056 1.00 . A A . 11 VAL H 1 1 17 3784 1 1 11 VAL HA H 6.242 -3.420 4.573 1.00 . A A . 11 VAL HA 1 1 17 3785 1 1 11 VAL HB H 4.496 -4.826 3.608 1.00 . A A . 11 VAL HB 1 1 17 3786 1 1 11 VAL HG11 H 3.937 -4.898 1.426 1.00 . A A . 11 VAL HG11 1 1 17 3787 1 1 11 VAL HG12 H 4.721 -3.319 1.374 1.00 . A A . 11 VAL HG12 1 1 17 3788 1 1 11 VAL HG13 H 5.609 -4.762 0.884 1.00 . A A . 11 VAL HG13 1 1 17 3789 1 1 11 VAL HG21 H 5.887 -6.624 2.814 1.00 . A A . 11 VAL HG21 1 1 17 3790 1 1 11 VAL HG22 H 7.179 -5.496 2.403 1.00 . A A . 11 VAL HG22 1 1 17 3791 1 1 11 VAL HG23 H 6.742 -5.761 4.092 1.00 . A A . 11 VAL HG23 1 1 17 3792 1 1 11 VAL N N 4.976 -2.171 3.523 1.00 . A A . 11 VAL N 1 1 17 3793 1 1 11 VAL O O 8.307 -3.271 3.089 1.00 . A A . 11 VAL O 1 1 17 3794 1 1 12 ALA C C 8.853 -2.977 0.254 1.00 . A A . 12 ALA C 1 1 17 3795 1 1 12 ALA CA C 8.084 -1.768 0.773 1.00 . A A . 12 ALA CA 1 1 17 3796 1 1 12 ALA CB C 9.017 -0.825 1.518 1.00 . A A . 12 ALA CB 1 1 17 3797 1 1 12 ALA H H 6.069 -1.911 1.404 1.00 . A A . 12 ALA H 1 1 17 3798 1 1 12 ALA HA H 7.667 -1.231 -0.068 1.00 . A A . 12 ALA HA 1 1 17 3799 1 1 12 ALA HB1 H 9.546 -1.373 2.284 1.00 . A A . 12 ALA HB1 1 1 17 3800 1 1 12 ALA HB2 H 9.728 -0.399 0.824 1.00 . A A . 12 ALA HB2 1 1 17 3801 1 1 12 ALA HB3 H 8.441 -0.033 1.974 1.00 . A A . 12 ALA HB3 1 1 17 3802 1 1 12 ALA N N 6.983 -2.176 1.636 1.00 . A A . 12 ALA N 1 1 17 3803 1 1 12 ALA O O 10.084 -3.003 0.284 1.00 . A A . 12 ALA O 1 1 17 3804 1 1 13 LEU C C 8.729 -5.191 -2.271 1.00 . A A . 13 LEU C 1 1 17 3805 1 1 13 LEU CA C 8.735 -5.194 -0.746 1.00 . A A . 13 LEU CA 1 1 17 3806 1 1 13 LEU CB C 7.997 -6.428 -0.224 1.00 . A A . 13 LEU CB 1 1 17 3807 1 1 13 LEU CD1 C 9.891 -8.067 -0.341 1.00 . A A . 13 LEU CD1 1 1 17 3808 1 1 13 LEU CD2 C 7.528 -8.888 -0.337 1.00 . A A . 13 LEU CD2 1 1 17 3809 1 1 13 LEU CG C 8.464 -7.774 -0.780 1.00 . A A . 13 LEU CG 1 1 17 3810 1 1 13 LEU H H 7.145 -3.901 -0.217 1.00 . A A . 13 LEU H 1 1 17 3811 1 1 13 LEU HA H 9.759 -5.223 -0.401 1.00 . A A . 13 LEU HA 1 1 17 3812 1 1 13 LEU HB2 H 8.115 -6.456 0.848 1.00 . A A . 13 LEU HB2 1 1 17 3813 1 1 13 LEU HB3 H 6.951 -6.315 -0.467 1.00 . A A . 13 LEU HB3 1 1 17 3814 1 1 13 LEU HD11 H 10.186 -9.040 -0.706 1.00 . A A . 13 LEU HD11 1 1 17 3815 1 1 13 LEU HD12 H 10.554 -7.315 -0.744 1.00 . A A . 13 LEU HD12 1 1 17 3816 1 1 13 LEU HD13 H 9.945 -8.055 0.738 1.00 . A A . 13 LEU HD13 1 1 17 3817 1 1 13 LEU HD21 H 6.800 -9.076 -1.112 1.00 . A A . 13 LEU HD21 1 1 17 3818 1 1 13 LEU HD22 H 8.099 -9.787 -0.154 1.00 . A A . 13 LEU HD22 1 1 17 3819 1 1 13 LEU HD23 H 7.020 -8.592 0.570 1.00 . A A . 13 LEU HD23 1 1 17 3820 1 1 13 LEU HG H 8.450 -7.733 -1.861 1.00 . A A . 13 LEU HG 1 1 17 3821 1 1 13 LEU N N 8.121 -3.980 -0.221 1.00 . A A . 13 LEU N 1 1 17 3822 1 1 13 LEU O O 7.675 -5.118 -2.898 1.00 . A A . 13 LEU O 1 1 17 3823 1 1 14 NH2 HN1 H 10.726 -5.329 -2.308 1.00 . A A . 14 NH2 HN1 1 1 17 3824 1 1 14 NH2 HN2 H 10.009 -5.280 -3.857 1.00 . A A . 14 NH2 HN2 1 1 17 3825 1 1 14 NH2 N N 9.918 -5.273 -2.862 1.00 . A A . 14 NH2 N 1 1 18 3826 1 1 1 ILE C C -6.682 -0.137 -3.281 1.00 . A A . 1 ILE C 1 1 18 3827 1 1 1 ILE CA C -7.685 -0.917 -4.126 1.00 . A A . 1 ILE CA 1 1 18 3828 1 1 1 ILE CB C -7.795 -0.255 -5.512 1.00 . A A . 1 ILE CB 1 1 18 3829 1 1 1 ILE CD1 C -7.287 2.238 -5.427 1.00 . A A . 1 ILE CD1 1 1 18 3830 1 1 1 ILE CG1 C -8.352 1.164 -5.382 1.00 . A A . 1 ILE CG1 1 1 18 3831 1 1 1 ILE CG2 C -8.672 -1.094 -6.431 1.00 . A A . 1 ILE CG2 1 1 18 3832 1 1 1 ILE H1 H -9.796 -0.969 -4.010 1.00 . A A . 1 ILE H1 1 1 18 3833 1 1 1 ILE HA H -7.319 -1.925 -4.258 1.00 . A A . 1 ILE HA 1 1 18 3834 1 1 1 ILE HB H -6.806 -0.209 -5.944 1.00 . A A . 1 ILE HB 1 1 18 3835 1 1 1 ILE HD11 H -6.313 1.782 -5.335 1.00 . A A . 1 ILE HD11 1 1 18 3836 1 1 1 ILE HD12 H -7.351 2.768 -6.365 1.00 . A A . 1 ILE HD12 1 1 18 3837 1 1 1 ILE HD13 H -7.441 2.929 -4.612 1.00 . A A . 1 ILE HD13 1 1 18 3838 1 1 1 ILE HG12 H -9.042 1.348 -6.190 1.00 . A A . 1 ILE HG12 1 1 18 3839 1 1 1 ILE HG13 H -8.875 1.251 -4.441 1.00 . A A . 1 ILE HG13 1 1 18 3840 1 1 1 ILE HG21 H -8.713 -2.107 -6.062 1.00 . A A . 1 ILE HG21 1 1 18 3841 1 1 1 ILE HG22 H -9.668 -0.678 -6.453 1.00 . A A . 1 ILE HG22 1 1 18 3842 1 1 1 ILE HG23 H -8.257 -1.089 -7.428 1.00 . A A . 1 ILE HG23 1 1 18 3843 1 1 1 ILE N N -8.981 -0.991 -3.467 1.00 . A A . 1 ILE N 1 1 18 3844 1 1 1 ILE O O -5.493 -0.455 -3.257 1.00 . A A . 1 ILE O 1 1 18 3845 1 1 2 PHE C C -5.592 0.859 -0.705 1.00 . A A . 2 PHE C 1 1 18 3846 1 1 2 PHE CA C -6.317 1.712 -1.740 1.00 . A A . 2 PHE CA 1 1 18 3847 1 1 2 PHE CB C -7.150 2.787 -1.038 1.00 . A A . 2 PHE CB 1 1 18 3848 1 1 2 PHE CD1 C -9.082 3.735 -2.328 1.00 . A A . 2 PHE CD1 1 1 18 3849 1 1 2 PHE CD2 C -6.961 4.806 -2.519 1.00 . A A . 2 PHE CD2 1 1 18 3850 1 1 2 PHE CE1 C -9.630 4.661 -3.195 1.00 . A A . 2 PHE CE1 1 1 18 3851 1 1 2 PHE CE2 C -7.502 5.735 -3.386 1.00 . A A . 2 PHE CE2 1 1 18 3852 1 1 2 PHE CG C -7.743 3.796 -1.980 1.00 . A A . 2 PHE CG 1 1 18 3853 1 1 2 PHE CZ C -8.841 5.663 -3.724 1.00 . A A . 2 PHE CZ 1 1 18 3854 1 1 2 PHE H H -8.127 1.090 -2.648 1.00 . A A . 2 PHE H 1 1 18 3855 1 1 2 PHE HA H -5.587 2.189 -2.374 1.00 . A A . 2 PHE HA 1 1 18 3856 1 1 2 PHE HB2 H -7.961 2.315 -0.505 1.00 . A A . 2 PHE HB2 1 1 18 3857 1 1 2 PHE HB3 H -6.522 3.316 -0.337 1.00 . A A . 2 PHE HB3 1 1 18 3858 1 1 2 PHE HD1 H -9.702 2.953 -1.914 1.00 . A A . 2 PHE HD1 1 1 18 3859 1 1 2 PHE HD2 H -5.913 4.863 -2.255 1.00 . A A . 2 PHE HD2 1 1 18 3860 1 1 2 PHE HE1 H -10.677 4.603 -3.458 1.00 . A A . 2 PHE HE1 1 1 18 3861 1 1 2 PHE HE2 H -6.882 6.517 -3.796 1.00 . A A . 2 PHE HE2 1 1 18 3862 1 1 2 PHE HZ H -9.266 6.388 -4.402 1.00 . A A . 2 PHE HZ 1 1 18 3863 1 1 2 PHE N N -7.170 0.886 -2.587 1.00 . A A . 2 PHE N 1 1 18 3864 1 1 2 PHE O O -4.433 1.118 -0.374 1.00 . A A . 2 PHE O 1 1 18 3865 1 1 3 TRP C C -4.423 -1.697 0.278 1.00 . A A . 3 TRP C 1 1 18 3866 1 1 3 TRP CA C -5.700 -1.048 0.802 1.00 . A A . 3 TRP CA 1 1 18 3867 1 1 3 TRP CB C -6.708 -2.127 1.200 1.00 . A A . 3 TRP CB 1 1 18 3868 1 1 3 TRP CD1 C -5.342 -3.713 2.679 1.00 . A A . 3 TRP CD1 1 1 18 3869 1 1 3 TRP CD2 C -7.029 -2.689 3.738 1.00 . A A . 3 TRP CD2 1 1 18 3870 1 1 3 TRP CE2 C -6.364 -3.527 4.656 1.00 . A A . 3 TRP CE2 1 1 18 3871 1 1 3 TRP CE3 C -8.124 -1.944 4.180 1.00 . A A . 3 TRP CE3 1 1 18 3872 1 1 3 TRP CG C -6.359 -2.824 2.480 1.00 . A A . 3 TRP CG 1 1 18 3873 1 1 3 TRP CH2 C -7.836 -2.894 6.391 1.00 . A A . 3 TRP CH2 1 1 18 3874 1 1 3 TRP CZ2 C -6.761 -3.636 5.986 1.00 . A A . 3 TRP CZ2 1 1 18 3875 1 1 3 TRP CZ3 C -8.518 -2.054 5.500 1.00 . A A . 3 TRP CZ3 1 1 18 3876 1 1 3 TRP H H -7.197 -0.312 -0.500 1.00 . A A . 3 TRP H 1 1 18 3877 1 1 3 TRP HA H -5.456 -0.457 1.673 1.00 . A A . 3 TRP HA 1 1 18 3878 1 1 3 TRP HB2 H -7.681 -1.674 1.321 1.00 . A A . 3 TRP HB2 1 1 18 3879 1 1 3 TRP HB3 H -6.755 -2.870 0.417 1.00 . A A . 3 TRP HB3 1 1 18 3880 1 1 3 TRP HD1 H -4.650 -4.026 1.911 1.00 . A A . 3 TRP HD1 1 1 18 3881 1 1 3 TRP HE1 H -4.704 -4.779 4.373 1.00 . A A . 3 TRP HE1 1 1 18 3882 1 1 3 TRP HE3 H -8.662 -1.291 3.508 1.00 . A A . 3 TRP HE3 1 1 18 3883 1 1 3 TRP HH2 H -8.177 -2.951 7.413 1.00 . A A . 3 TRP HH2 1 1 18 3884 1 1 3 TRP HZ2 H -6.245 -4.280 6.685 1.00 . A A . 3 TRP HZ2 1 1 18 3885 1 1 3 TRP HZ3 H -9.363 -1.485 5.860 1.00 . A A . 3 TRP HZ3 1 1 18 3886 1 1 3 TRP N N -6.279 -0.158 -0.197 1.00 . A A . 3 TRP N 1 1 18 3887 1 1 3 TRP NE1 N -5.339 -4.140 3.984 1.00 . A A . 3 TRP NE1 1 1 18 3888 1 1 3 TRP O O -3.433 -1.815 1.001 1.00 . A A . 3 TRP O 1 1 18 3889 1 1 4 LEU C C -2.237 -1.719 -1.974 1.00 . A A . 4 LEU C 1 1 18 3890 1 1 4 LEU CA C -3.296 -2.753 -1.603 1.00 . A A . 4 LEU CA 1 1 18 3891 1 1 4 LEU CB C -3.725 -3.529 -2.851 1.00 . A A . 4 LEU CB 1 1 18 3892 1 1 4 LEU CD1 C -5.568 -4.900 -3.855 1.00 . A A . 4 LEU CD1 1 1 18 3893 1 1 4 LEU CD2 C -3.962 -5.952 -2.252 1.00 . A A . 4 LEU CD2 1 1 18 3894 1 1 4 LEU CG C -4.707 -4.678 -2.620 1.00 . A A . 4 LEU CG 1 1 18 3895 1 1 4 LEU H H -5.269 -1.996 -1.508 1.00 . A A . 4 LEU H 1 1 18 3896 1 1 4 LEU HA H -2.873 -3.444 -0.888 1.00 . A A . 4 LEU HA 1 1 18 3897 1 1 4 LEU HB2 H -4.187 -2.832 -3.532 1.00 . A A . 4 LEU HB2 1 1 18 3898 1 1 4 LEU HB3 H -2.835 -3.940 -3.306 1.00 . A A . 4 LEU HB3 1 1 18 3899 1 1 4 LEU HD11 H -4.989 -5.411 -4.610 1.00 . A A . 4 LEU HD11 1 1 18 3900 1 1 4 LEU HD12 H -6.427 -5.499 -3.593 1.00 . A A . 4 LEU HD12 1 1 18 3901 1 1 4 LEU HD13 H -5.898 -3.946 -4.241 1.00 . A A . 4 LEU HD13 1 1 18 3902 1 1 4 LEU HD21 H -4.669 -6.705 -1.938 1.00 . A A . 4 LEU HD21 1 1 18 3903 1 1 4 LEU HD22 H -3.413 -6.310 -3.111 1.00 . A A . 4 LEU HD22 1 1 18 3904 1 1 4 LEU HD23 H -3.274 -5.746 -1.445 1.00 . A A . 4 LEU HD23 1 1 18 3905 1 1 4 LEU HG H -5.364 -4.423 -1.800 1.00 . A A . 4 LEU HG 1 1 18 3906 1 1 4 LEU N N -4.452 -2.116 -0.982 1.00 . A A . 4 LEU N 1 1 18 3907 1 1 4 LEU O O -1.047 -1.921 -1.736 1.00 . A A . 4 LEU O 1 1 18 3908 1 1 5 PHE C C -0.879 0.878 -1.794 1.00 . A A . 5 PHE C 1 1 18 3909 1 1 5 PHE CA C -1.772 0.458 -2.958 1.00 . A A . 5 PHE CA 1 1 18 3910 1 1 5 PHE CB C -2.562 1.663 -3.470 1.00 . A A . 5 PHE CB 1 1 18 3911 1 1 5 PHE CD1 C -1.030 2.696 -5.168 1.00 . A A . 5 PHE CD1 1 1 18 3912 1 1 5 PHE CD2 C -1.538 3.939 -3.198 1.00 . A A . 5 PHE CD2 1 1 18 3913 1 1 5 PHE CE1 C -0.228 3.730 -5.616 1.00 . A A . 5 PHE CE1 1 1 18 3914 1 1 5 PHE CE2 C -0.739 4.975 -3.641 1.00 . A A . 5 PHE CE2 1 1 18 3915 1 1 5 PHE CG C -1.693 2.789 -3.955 1.00 . A A . 5 PHE CG 1 1 18 3916 1 1 5 PHE CZ C -0.084 4.870 -4.852 1.00 . A A . 5 PHE CZ 1 1 18 3917 1 1 5 PHE H H -3.642 -0.506 -2.718 1.00 . A A . 5 PHE H 1 1 18 3918 1 1 5 PHE HA H -1.150 0.081 -3.754 1.00 . A A . 5 PHE HA 1 1 18 3919 1 1 5 PHE HB2 H -3.189 1.351 -4.292 1.00 . A A . 5 PHE HB2 1 1 18 3920 1 1 5 PHE HB3 H -3.184 2.043 -2.673 1.00 . A A . 5 PHE HB3 1 1 18 3921 1 1 5 PHE HD1 H -1.143 1.803 -5.767 1.00 . A A . 5 PHE HD1 1 1 18 3922 1 1 5 PHE HD2 H -2.051 4.022 -2.249 1.00 . A A . 5 PHE HD2 1 1 18 3923 1 1 5 PHE HE1 H 0.282 3.644 -6.563 1.00 . A A . 5 PHE HE1 1 1 18 3924 1 1 5 PHE HE2 H -0.628 5.867 -3.041 1.00 . A A . 5 PHE HE2 1 1 18 3925 1 1 5 PHE HZ H 0.542 5.679 -5.201 1.00 . A A . 5 PHE HZ 1 1 18 3926 1 1 5 PHE N N -2.681 -0.609 -2.556 1.00 . A A . 5 PHE N 1 1 18 3927 1 1 5 PHE O O 0.347 0.896 -1.913 1.00 . A A . 5 PHE O 1 1 18 3928 1 1 6 ARG C C 0.079 0.494 1.067 1.00 . A A . 6 ARG C 1 1 18 3929 1 1 6 ARG CA C -0.765 1.640 0.515 1.00 . A A . 6 ARG CA 1 1 18 3930 1 1 6 ARG CB C -1.729 2.142 1.589 1.00 . A A . 6 ARG CB 1 1 18 3931 1 1 6 ARG CD C -3.862 1.661 2.827 1.00 . A A . 6 ARG CD 1 1 18 3932 1 1 6 ARG CG C -2.648 1.061 2.136 1.00 . A A . 6 ARG CG 1 1 18 3933 1 1 6 ARG CZ C -5.303 1.116 4.743 1.00 . A A . 6 ARG CZ 1 1 18 3934 1 1 6 ARG H H -2.480 1.182 -0.637 1.00 . A A . 6 ARG H 1 1 18 3935 1 1 6 ARG HA H -0.107 2.447 0.226 1.00 . A A . 6 ARG HA 1 1 18 3936 1 1 6 ARG HB2 H -1.156 2.546 2.413 1.00 . A A . 6 ARG HB2 1 1 18 3937 1 1 6 ARG HB3 H -2.340 2.926 1.170 1.00 . A A . 6 ARG HB3 1 1 18 3938 1 1 6 ARG HD2 H -3.561 2.564 3.338 1.00 . A A . 6 ARG HD2 1 1 18 3939 1 1 6 ARG HD3 H -4.603 1.902 2.079 1.00 . A A . 6 ARG HD3 1 1 18 3940 1 1 6 ARG HE H -4.193 -0.203 3.741 1.00 . A A . 6 ARG HE 1 1 18 3941 1 1 6 ARG HG2 H -2.984 0.441 1.318 1.00 . A A . 6 ARG HG2 1 1 18 3942 1 1 6 ARG HG3 H -2.101 0.460 2.846 1.00 . A A . 6 ARG HG3 1 1 18 3943 1 1 6 ARG HH11 H -5.302 3.064 4.208 1.00 . A A . 6 ARG HH11 1 1 18 3944 1 1 6 ARG HH12 H -6.314 2.667 5.557 1.00 . A A . 6 ARG HH12 1 1 18 3945 1 1 6 ARG HH21 H -5.521 -0.738 5.516 1.00 . A A . 6 ARG HH21 1 1 18 3946 1 1 6 ARG HH22 H -6.437 0.504 6.300 1.00 . A A . 6 ARG HH22 1 1 18 3947 1 1 6 ARG N N -1.501 1.218 -0.669 1.00 . A A . 6 ARG N 1 1 18 3948 1 1 6 ARG NE N -4.449 0.740 3.799 1.00 . A A . 6 ARG NE 1 1 18 3949 1 1 6 ARG NH1 N -5.670 2.387 4.843 1.00 . A A . 6 ARG NH1 1 1 18 3950 1 1 6 ARG NH2 N -5.794 0.220 5.589 1.00 . A A . 6 ARG NH2 1 1 18 3951 1 1 6 ARG O O 1.188 0.706 1.556 1.00 . A A . 6 ARG O 1 1 18 3952 1 1 7 GLY C C 1.629 -2.032 0.850 1.00 . A A . 7 GLY C 1 1 18 3953 1 1 7 GLY CA C 0.260 -1.881 1.482 1.00 . A A . 7 GLY CA 1 1 18 3954 1 1 7 GLY H H -1.344 -0.829 0.585 1.00 . A A . 7 GLY H 1 1 18 3955 1 1 7 GLY HA2 H 0.378 -1.788 2.552 1.00 . A A . 7 GLY HA2 1 1 18 3956 1 1 7 GLY HA3 H -0.321 -2.767 1.271 1.00 . A A . 7 GLY HA3 1 1 18 3957 1 1 7 GLY N N -0.456 -0.721 0.986 1.00 . A A . 7 GLY N 1 1 18 3958 1 1 7 GLY O O 2.595 -2.399 1.520 1.00 . A A . 7 GLY O 1 1 18 3959 1 1 8 LYS C C 4.049 -0.986 -0.526 1.00 . A A . 8 LYS C 1 1 18 3960 1 1 8 LYS CA C 2.976 -1.857 -1.171 1.00 . A A . 8 LYS CA 1 1 18 3961 1 1 8 LYS CB C 2.784 -1.447 -2.632 1.00 . A A . 8 LYS CB 1 1 18 3962 1 1 8 LYS CD C 3.511 -3.568 -3.766 1.00 . A A . 8 LYS CD 1 1 18 3963 1 1 8 LYS CE C 4.548 -4.216 -4.670 1.00 . A A . 8 LYS CE 1 1 18 3964 1 1 8 LYS CG C 3.785 -2.084 -3.580 1.00 . A A . 8 LYS CG 1 1 18 3965 1 1 8 LYS H H 0.910 -1.463 -0.926 1.00 . A A . 8 LYS H 1 1 18 3966 1 1 8 LYS HA H 3.293 -2.888 -1.134 1.00 . A A . 8 LYS HA 1 1 18 3967 1 1 8 LYS HB2 H 1.790 -1.734 -2.947 1.00 . A A . 8 LYS HB2 1 1 18 3968 1 1 8 LYS HB3 H 2.879 -0.374 -2.710 1.00 . A A . 8 LYS HB3 1 1 18 3969 1 1 8 LYS HD2 H 3.537 -4.055 -2.802 1.00 . A A . 8 LYS HD2 1 1 18 3970 1 1 8 LYS HD3 H 2.534 -3.692 -4.209 1.00 . A A . 8 LYS HD3 1 1 18 3971 1 1 8 LYS HE2 H 4.862 -3.497 -5.411 1.00 . A A . 8 LYS HE2 1 1 18 3972 1 1 8 LYS HE3 H 5.399 -4.508 -4.070 1.00 . A A . 8 LYS HE3 1 1 18 3973 1 1 8 LYS HG2 H 3.721 -1.595 -4.540 1.00 . A A . 8 LYS HG2 1 1 18 3974 1 1 8 LYS HG3 H 4.779 -1.959 -3.175 1.00 . A A . 8 LYS HG3 1 1 18 3975 1 1 8 LYS HZ1 H 4.775 -5.934 -5.838 1.00 . A A . 8 LYS HZ1 1 1 18 3976 1 1 8 LYS HZ2 H 3.556 -6.054 -4.671 1.00 . A A . 8 LYS HZ2 1 1 18 3977 1 1 8 LYS HZ3 H 3.301 -5.137 -6.070 1.00 . A A . 8 LYS HZ3 1 1 18 3978 1 1 8 LYS N N 1.714 -1.750 -0.445 1.00 . A A . 8 LYS N 1 1 18 3979 1 1 8 LYS NZ N 4.008 -5.419 -5.361 1.00 . A A . 8 LYS NZ 1 1 18 3980 1 1 8 LYS O O 5.206 -1.391 -0.419 1.00 . A A . 8 LYS O 1 1 18 3981 1 1 9 ALA C C 4.841 0.742 1.993 1.00 . A A . 9 ALA C 1 1 18 3982 1 1 9 ALA CA C 4.585 1.134 0.541 1.00 . A A . 9 ALA CA 1 1 18 3983 1 1 9 ALA CB C 4.051 2.556 0.463 1.00 . A A . 9 ALA CB 1 1 18 3984 1 1 9 ALA H H 2.721 0.473 -0.209 1.00 . A A . 9 ALA H 1 1 18 3985 1 1 9 ALA HA H 5.519 1.096 -0.001 1.00 . A A . 9 ALA HA 1 1 18 3986 1 1 9 ALA HB1 H 4.860 3.254 0.612 1.00 . A A . 9 ALA HB1 1 1 18 3987 1 1 9 ALA HB2 H 3.608 2.721 -0.508 1.00 . A A . 9 ALA HB2 1 1 18 3988 1 1 9 ALA HB3 H 3.304 2.702 1.229 1.00 . A A . 9 ALA HB3 1 1 18 3989 1 1 9 ALA N N 3.657 0.209 -0.097 1.00 . A A . 9 ALA N 1 1 18 3990 1 1 9 ALA O O 5.964 0.848 2.486 1.00 . A A . 9 ALA O 1 1 18 3991 1 1 10 ASP C C 5.025 -1.137 4.249 1.00 . A A . 10 ASP C 1 1 18 3992 1 1 10 ASP CA C 3.903 -0.119 4.067 1.00 . A A . 10 ASP CA 1 1 18 3993 1 1 10 ASP CB C 2.580 -0.710 4.554 1.00 . A A . 10 ASP CB 1 1 18 3994 1 1 10 ASP CG C 2.705 -1.370 5.914 1.00 . A A . 10 ASP CG 1 1 18 3995 1 1 10 ASP H H 2.923 0.227 2.224 1.00 . A A . 10 ASP H 1 1 18 3996 1 1 10 ASP HA H 4.132 0.758 4.653 1.00 . A A . 10 ASP HA 1 1 18 3997 1 1 10 ASP HB2 H 1.844 0.079 4.625 1.00 . A A . 10 ASP HB2 1 1 18 3998 1 1 10 ASP HB3 H 2.240 -1.450 3.846 1.00 . A A . 10 ASP HB3 1 1 18 3999 1 1 10 ASP N N 3.792 0.289 2.672 1.00 . A A . 10 ASP N 1 1 18 4000 1 1 10 ASP O O 5.939 -0.933 5.050 1.00 . A A . 10 ASP O 1 1 18 4001 1 1 10 ASP OD1 O 2.649 -0.648 6.931 1.00 . A A . 10 ASP OD1 1 1 18 4002 1 1 10 ASP OD2 O 2.862 -2.608 5.960 1.00 . A A . 10 ASP OD2 1 1 18 4003 1 1 11 VAL C C 7.354 -2.724 3.310 1.00 . A A . 11 VAL C 1 1 18 4004 1 1 11 VAL CA C 5.961 -3.281 3.577 1.00 . A A . 11 VAL CA 1 1 18 4005 1 1 11 VAL CB C 5.673 -4.413 2.574 1.00 . A A . 11 VAL CB 1 1 18 4006 1 1 11 VAL CG1 C 4.408 -5.163 2.965 1.00 . A A . 11 VAL CG1 1 1 18 4007 1 1 11 VAL CG2 C 5.557 -3.858 1.162 1.00 . A A . 11 VAL CG2 1 1 18 4008 1 1 11 VAL H H 4.200 -2.337 2.880 1.00 . A A . 11 VAL H 1 1 18 4009 1 1 11 VAL HA H 5.935 -3.696 4.574 1.00 . A A . 11 VAL HA 1 1 18 4010 1 1 11 VAL HB H 6.498 -5.108 2.599 1.00 . A A . 11 VAL HB 1 1 18 4011 1 1 11 VAL HG11 H 4.616 -6.222 3.006 1.00 . A A . 11 VAL HG11 1 1 18 4012 1 1 11 VAL HG12 H 4.072 -4.823 3.934 1.00 . A A . 11 VAL HG12 1 1 18 4013 1 1 11 VAL HG13 H 3.638 -4.976 2.231 1.00 . A A . 11 VAL HG13 1 1 18 4014 1 1 11 VAL HG21 H 5.266 -4.648 0.487 1.00 . A A . 11 VAL HG21 1 1 18 4015 1 1 11 VAL HG22 H 4.813 -3.075 1.143 1.00 . A A . 11 VAL HG22 1 1 18 4016 1 1 11 VAL HG23 H 6.512 -3.455 0.856 1.00 . A A . 11 VAL HG23 1 1 18 4017 1 1 11 VAL N N 4.952 -2.231 3.500 1.00 . A A . 11 VAL N 1 1 18 4018 1 1 11 VAL O O 8.333 -3.152 3.921 1.00 . A A . 11 VAL O 1 1 18 4019 1 1 12 ALA C C 9.104 -0.088 3.073 1.00 . A A . 12 ALA C 1 1 18 4020 1 1 12 ALA CA C 8.710 -1.145 2.048 1.00 . A A . 12 ALA CA 1 1 18 4021 1 1 12 ALA CB C 8.637 -0.532 0.657 1.00 . A A . 12 ALA CB 1 1 18 4022 1 1 12 ALA H H 6.621 -1.464 1.943 1.00 . A A . 12 ALA H 1 1 18 4023 1 1 12 ALA HA H 9.464 -1.919 2.035 1.00 . A A . 12 ALA HA 1 1 18 4024 1 1 12 ALA HB1 H 9.367 0.261 0.574 1.00 . A A . 12 ALA HB1 1 1 18 4025 1 1 12 ALA HB2 H 8.847 -1.291 -0.083 1.00 . A A . 12 ALA HB2 1 1 18 4026 1 1 12 ALA HB3 H 7.649 -0.131 0.490 1.00 . A A . 12 ALA HB3 1 1 18 4027 1 1 12 ALA N N 7.436 -1.764 2.395 1.00 . A A . 12 ALA N 1 1 18 4028 1 1 12 ALA O O 9.188 1.100 2.756 1.00 . A A . 12 ALA O 1 1 18 4029 1 1 13 LEU C C 11.118 0.962 5.131 1.00 . A A . 13 LEU C 1 1 18 4030 1 1 13 LEU CA C 9.727 0.385 5.379 1.00 . A A . 13 LEU CA 1 1 18 4031 1 1 13 LEU CB C 9.697 -0.342 6.725 1.00 . A A . 13 LEU CB 1 1 18 4032 1 1 13 LEU CD1 C 8.940 -0.199 9.110 1.00 . A A . 13 LEU CD1 1 1 18 4033 1 1 13 LEU CD2 C 10.993 1.028 8.377 1.00 . A A . 13 LEU CD2 1 1 18 4034 1 1 13 LEU CG C 9.609 0.546 7.966 1.00 . A A . 13 LEU CG 1 1 18 4035 1 1 13 LEU H H 9.260 -1.482 4.497 1.00 . A A . 13 LEU H 1 1 18 4036 1 1 13 LEU HA H 9.013 1.193 5.400 1.00 . A A . 13 LEU HA 1 1 18 4037 1 1 13 LEU HB2 H 8.841 -0.998 6.726 1.00 . A A . 13 LEU HB2 1 1 18 4038 1 1 13 LEU HB3 H 10.600 -0.932 6.802 1.00 . A A . 13 LEU HB3 1 1 18 4039 1 1 13 LEU HD11 H 9.639 -0.901 9.540 1.00 . A A . 13 LEU HD11 1 1 18 4040 1 1 13 LEU HD12 H 8.627 0.507 9.865 1.00 . A A . 13 LEU HD12 1 1 18 4041 1 1 13 LEU HD13 H 8.078 -0.732 8.737 1.00 . A A . 13 LEU HD13 1 1 18 4042 1 1 13 LEU HD21 H 11.712 0.737 7.626 1.00 . A A . 13 LEU HD21 1 1 18 4043 1 1 13 LEU HD22 H 10.986 2.102 8.472 1.00 . A A . 13 LEU HD22 1 1 18 4044 1 1 13 LEU HD23 H 11.261 0.584 9.324 1.00 . A A . 13 LEU HD23 1 1 18 4045 1 1 13 LEU HG H 9.007 1.415 7.737 1.00 . A A . 13 LEU HG 1 1 18 4046 1 1 13 LEU N N 9.343 -0.525 4.305 1.00 . A A . 13 LEU N 1 1 18 4047 1 1 13 LEU O O 12.120 0.256 5.226 1.00 . A A . 13 LEU O 1 1 18 4048 1 1 14 NH2 HN1 H 10.335 2.764 4.755 1.00 . A A . 14 NH2 HN1 1 1 18 4049 1 1 14 NH2 HN2 H 12.039 2.714 4.639 1.00 . A A . 14 NH2 HN2 1 1 18 4050 1 1 14 NH2 N N 11.169 2.252 4.816 1.00 . A A . 14 NH2 N 1 1 19 4051 1 1 1 ILE C C -6.368 0.309 -3.730 1.00 . A A . 1 ILE C 1 1 19 4052 1 1 1 ILE CA C -7.303 -0.428 -4.683 1.00 . A A . 1 ILE CA 1 1 19 4053 1 1 1 ILE CB C -7.754 -1.744 -4.023 1.00 . A A . 1 ILE CB 1 1 19 4054 1 1 1 ILE CD1 C -8.951 -3.944 -4.483 1.00 . A A . 1 ILE CD1 1 1 19 4055 1 1 1 ILE CG1 C -8.599 -2.567 -5.000 1.00 . A A . 1 ILE CG1 1 1 19 4056 1 1 1 ILE CG2 C -8.537 -1.458 -2.751 1.00 . A A . 1 ILE CG2 1 1 19 4057 1 1 1 ILE H1 H -5.683 -0.653 -6.025 1.00 . A A . 1 ILE H1 1 1 19 4058 1 1 1 ILE HA H -8.177 0.182 -4.856 1.00 . A A . 1 ILE HA 1 1 19 4059 1 1 1 ILE HB H -6.874 -2.309 -3.757 1.00 . A A . 1 ILE HB 1 1 19 4060 1 1 1 ILE HD11 H -9.954 -3.934 -4.085 1.00 . A A . 1 ILE HD11 1 1 19 4061 1 1 1 ILE HD12 H -8.892 -4.656 -5.293 1.00 . A A . 1 ILE HD12 1 1 19 4062 1 1 1 ILE HD13 H -8.256 -4.224 -3.705 1.00 . A A . 1 ILE HD13 1 1 19 4063 1 1 1 ILE HG12 H -9.521 -2.042 -5.198 1.00 . A A . 1 ILE HG12 1 1 19 4064 1 1 1 ILE HG13 H -8.052 -2.687 -5.924 1.00 . A A . 1 ILE HG13 1 1 19 4065 1 1 1 ILE HG21 H -9.421 -2.079 -2.722 1.00 . A A . 1 ILE HG21 1 1 19 4066 1 1 1 ILE HG22 H -7.918 -1.676 -1.892 1.00 . A A . 1 ILE HG22 1 1 19 4067 1 1 1 ILE HG23 H -8.826 -0.417 -2.731 1.00 . A A . 1 ILE HG23 1 1 19 4068 1 1 1 ILE N N -6.661 -0.669 -5.969 1.00 . A A . 1 ILE N 1 1 19 4069 1 1 1 ILE O O -5.156 0.090 -3.739 1.00 . A A . 1 ILE O 1 1 19 4070 1 1 2 PHE C C -5.556 1.042 -0.879 1.00 . A A . 2 PHE C 1 1 19 4071 1 1 2 PHE CA C -6.156 1.952 -1.947 1.00 . A A . 2 PHE CA 1 1 19 4072 1 1 2 PHE CB C -7.027 3.023 -1.287 1.00 . A A . 2 PHE CB 1 1 19 4073 1 1 2 PHE CD1 C -8.608 4.001 -2.974 1.00 . A A . 2 PHE CD1 1 1 19 4074 1 1 2 PHE CD2 C -6.677 5.262 -2.367 1.00 . A A . 2 PHE CD2 1 1 19 4075 1 1 2 PHE CE1 C -8.994 5.006 -3.841 1.00 . A A . 2 PHE CE1 1 1 19 4076 1 1 2 PHE CE2 C -7.060 6.271 -3.232 1.00 . A A . 2 PHE CE2 1 1 19 4077 1 1 2 PHE CG C -7.445 4.117 -2.228 1.00 . A A . 2 PHE CG 1 1 19 4078 1 1 2 PHE CZ C -8.220 6.143 -3.968 1.00 . A A . 2 PHE CZ 1 1 19 4079 1 1 2 PHE H H -7.909 1.313 -2.947 1.00 . A A . 2 PHE H 1 1 19 4080 1 1 2 PHE HA H -5.352 2.434 -2.485 1.00 . A A . 2 PHE HA 1 1 19 4081 1 1 2 PHE HB2 H -7.921 2.560 -0.901 1.00 . A A . 2 PHE HB2 1 1 19 4082 1 1 2 PHE HB3 H -6.478 3.475 -0.476 1.00 . A A . 2 PHE HB3 1 1 19 4083 1 1 2 PHE HD1 H -9.215 3.114 -2.874 1.00 . A A . 2 PHE HD1 1 1 19 4084 1 1 2 PHE HD2 H -5.768 5.363 -1.790 1.00 . A A . 2 PHE HD2 1 1 19 4085 1 1 2 PHE HE1 H -9.903 4.904 -4.415 1.00 . A A . 2 PHE HE1 1 1 19 4086 1 1 2 PHE HE2 H -6.451 7.157 -3.329 1.00 . A A . 2 PHE HE2 1 1 19 4087 1 1 2 PHE HZ H -8.520 6.929 -4.646 1.00 . A A . 2 PHE HZ 1 1 19 4088 1 1 2 PHE N N -6.938 1.182 -2.907 1.00 . A A . 2 PHE N 1 1 19 4089 1 1 2 PHE O O -4.381 1.165 -0.531 1.00 . A A . 2 PHE O 1 1 19 4090 1 1 3 TRP C C -4.706 -1.591 0.192 1.00 . A A . 3 TRP C 1 1 19 4091 1 1 3 TRP CA C -5.922 -0.804 0.665 1.00 . A A . 3 TRP CA 1 1 19 4092 1 1 3 TRP CB C -7.052 -1.763 1.040 1.00 . A A . 3 TRP CB 1 1 19 4093 1 1 3 TRP CD1 C -8.757 -0.069 1.930 1.00 . A A . 3 TRP CD1 1 1 19 4094 1 1 3 TRP CD2 C -8.284 -1.732 3.354 1.00 . A A . 3 TRP CD2 1 1 19 4095 1 1 3 TRP CE2 C -9.226 -0.878 3.958 1.00 . A A . 3 TRP CE2 1 1 19 4096 1 1 3 TRP CE3 C -7.838 -2.851 4.062 1.00 . A A . 3 TRP CE3 1 1 19 4097 1 1 3 TRP CG C -7.998 -1.197 2.056 1.00 . A A . 3 TRP CG 1 1 19 4098 1 1 3 TRP CH2 C -9.273 -2.211 5.907 1.00 . A A . 3 TRP CH2 1 1 19 4099 1 1 3 TRP CZ2 C -9.727 -1.108 5.237 1.00 . A A . 3 TRP CZ2 1 1 19 4100 1 1 3 TRP CZ3 C -8.334 -3.078 5.330 1.00 . A A . 3 TRP CZ3 1 1 19 4101 1 1 3 TRP H H -7.297 0.079 -0.682 1.00 . A A . 3 TRP H 1 1 19 4102 1 1 3 TRP HA H -5.647 -0.227 1.535 1.00 . A A . 3 TRP HA 1 1 19 4103 1 1 3 TRP HB2 H -7.619 -2.006 0.156 1.00 . A A . 3 TRP HB2 1 1 19 4104 1 1 3 TRP HB3 H -6.624 -2.667 1.450 1.00 . A A . 3 TRP HB3 1 1 19 4105 1 1 3 TRP HD1 H -8.764 0.565 1.057 1.00 . A A . 3 TRP HD1 1 1 19 4106 1 1 3 TRP HE1 H -10.120 0.872 3.222 1.00 . A A . 3 TRP HE1 1 1 19 4107 1 1 3 TRP HE3 H -7.116 -3.531 3.634 1.00 . A A . 3 TRP HE3 1 1 19 4108 1 1 3 TRP HH2 H -9.633 -2.427 6.901 1.00 . A A . 3 TRP HH2 1 1 19 4109 1 1 3 TRP HZ2 H -10.450 -0.449 5.695 1.00 . A A . 3 TRP HZ2 1 1 19 4110 1 1 3 TRP HZ3 H -8.002 -3.938 5.893 1.00 . A A . 3 TRP HZ3 1 1 19 4111 1 1 3 TRP N N -6.371 0.128 -0.364 1.00 . A A . 3 TRP N 1 1 19 4112 1 1 3 TRP NE1 N -9.497 0.130 3.070 1.00 . A A . 3 TRP NE1 1 1 19 4113 1 1 3 TRP O O -3.790 -1.866 0.969 1.00 . A A . 3 TRP O 1 1 19 4114 1 1 4 LEU C C -2.396 -1.805 -1.930 1.00 . A A . 4 LEU C 1 1 19 4115 1 1 4 LEU CA C -3.595 -2.709 -1.663 1.00 . A A . 4 LEU CA 1 1 19 4116 1 1 4 LEU CB C -4.036 -3.386 -2.963 1.00 . A A . 4 LEU CB 1 1 19 4117 1 1 4 LEU CD1 C -5.564 -4.951 -4.188 1.00 . A A . 4 LEU CD1 1 1 19 4118 1 1 4 LEU CD2 C -4.514 -5.667 -2.034 1.00 . A A . 4 LEU CD2 1 1 19 4119 1 1 4 LEU CG C -5.082 -4.494 -2.819 1.00 . A A . 4 LEU CG 1 1 19 4120 1 1 4 LEU H H -5.458 -1.705 -1.657 1.00 . A A . 4 LEU H 1 1 19 4121 1 1 4 LEU HA H -3.306 -3.469 -0.952 1.00 . A A . 4 LEU HA 1 1 19 4122 1 1 4 LEU HB2 H -4.448 -2.626 -3.608 1.00 . A A . 4 LEU HB2 1 1 19 4123 1 1 4 LEU HB3 H -3.160 -3.815 -3.425 1.00 . A A . 4 LEU HB3 1 1 19 4124 1 1 4 LEU HD11 H -6.253 -5.776 -4.070 1.00 . A A . 4 LEU HD11 1 1 19 4125 1 1 4 LEU HD12 H -6.064 -4.132 -4.685 1.00 . A A . 4 LEU HD12 1 1 19 4126 1 1 4 LEU HD13 H -4.719 -5.270 -4.780 1.00 . A A . 4 LEU HD13 1 1 19 4127 1 1 4 LEU HD21 H -4.312 -6.486 -2.707 1.00 . A A . 4 LEU HD21 1 1 19 4128 1 1 4 LEU HD22 H -3.596 -5.364 -1.550 1.00 . A A . 4 LEU HD22 1 1 19 4129 1 1 4 LEU HD23 H -5.228 -5.980 -1.288 1.00 . A A . 4 LEU HD23 1 1 19 4130 1 1 4 LEU HG H -5.934 -4.108 -2.277 1.00 . A A . 4 LEU HG 1 1 19 4131 1 1 4 LEU N N -4.700 -1.953 -1.087 1.00 . A A . 4 LEU N 1 1 19 4132 1 1 4 LEU O O -1.259 -2.153 -1.611 1.00 . A A . 4 LEU O 1 1 19 4133 1 1 5 PHE C C -0.846 0.717 -1.563 1.00 . A A . 5 PHE C 1 1 19 4134 1 1 5 PHE CA C -1.602 0.315 -2.825 1.00 . A A . 5 PHE CA 1 1 19 4135 1 1 5 PHE CB C -2.190 1.556 -3.499 1.00 . A A . 5 PHE CB 1 1 19 4136 1 1 5 PHE CD1 C -0.528 1.916 -5.344 1.00 . A A . 5 PHE CD1 1 1 19 4137 1 1 5 PHE CD2 C -0.841 3.658 -3.748 1.00 . A A . 5 PHE CD2 1 1 19 4138 1 1 5 PHE CE1 C 0.415 2.684 -6.001 1.00 . A A . 5 PHE CE1 1 1 19 4139 1 1 5 PHE CE2 C 0.101 4.431 -4.400 1.00 . A A . 5 PHE CE2 1 1 19 4140 1 1 5 PHE CG C -1.166 2.394 -4.210 1.00 . A A . 5 PHE CG 1 1 19 4141 1 1 5 PHE CZ C 0.729 3.943 -5.529 1.00 . A A . 5 PHE CZ 1 1 19 4142 1 1 5 PHE H H -3.585 -0.420 -2.747 1.00 . A A . 5 PHE H 1 1 19 4143 1 1 5 PHE HA H -0.914 -0.161 -3.506 1.00 . A A . 5 PHE HA 1 1 19 4144 1 1 5 PHE HB2 H -2.928 1.249 -4.224 1.00 . A A . 5 PHE HB2 1 1 19 4145 1 1 5 PHE HB3 H -2.662 2.173 -2.749 1.00 . A A . 5 PHE HB3 1 1 19 4146 1 1 5 PHE HD1 H -0.774 0.932 -5.716 1.00 . A A . 5 PHE HD1 1 1 19 4147 1 1 5 PHE HD2 H -1.331 4.040 -2.864 1.00 . A A . 5 PHE HD2 1 1 19 4148 1 1 5 PHE HE1 H 0.904 2.299 -6.884 1.00 . A A . 5 PHE HE1 1 1 19 4149 1 1 5 PHE HE2 H 0.345 5.414 -4.027 1.00 . A A . 5 PHE HE2 1 1 19 4150 1 1 5 PHE HZ H 1.466 4.545 -6.040 1.00 . A A . 5 PHE HZ 1 1 19 4151 1 1 5 PHE N N -2.659 -0.641 -2.517 1.00 . A A . 5 PHE N 1 1 19 4152 1 1 5 PHE O O 0.373 0.892 -1.586 1.00 . A A . 5 PHE O 1 1 19 4153 1 1 6 ARG C C 0.005 0.178 1.290 1.00 . A A . 6 ARG C 1 1 19 4154 1 1 6 ARG CA C -0.977 1.242 0.809 1.00 . A A . 6 ARG CA 1 1 19 4155 1 1 6 ARG CB C -2.063 1.464 1.864 1.00 . A A . 6 ARG CB 1 1 19 4156 1 1 6 ARG CD C -0.938 1.608 4.107 1.00 . A A . 6 ARG CD 1 1 19 4157 1 1 6 ARG CG C -1.633 2.380 2.998 1.00 . A A . 6 ARG CG 1 1 19 4158 1 1 6 ARG CZ C -1.804 2.596 6.184 1.00 . A A . 6 ARG CZ 1 1 19 4159 1 1 6 ARG H H -2.545 0.707 -0.508 1.00 . A A . 6 ARG H 1 1 19 4160 1 1 6 ARG HA H -0.441 2.167 0.658 1.00 . A A . 6 ARG HA 1 1 19 4161 1 1 6 ARG HB2 H -2.929 1.898 1.387 1.00 . A A . 6 ARG HB2 1 1 19 4162 1 1 6 ARG HB3 H -2.336 0.508 2.287 1.00 . A A . 6 ARG HB3 1 1 19 4163 1 1 6 ARG HD2 H -1.512 0.720 4.324 1.00 . A A . 6 ARG HD2 1 1 19 4164 1 1 6 ARG HD3 H 0.047 1.325 3.767 1.00 . A A . 6 ARG HD3 1 1 19 4165 1 1 6 ARG HE H 0.063 2.804 5.515 1.00 . A A . 6 ARG HE 1 1 19 4166 1 1 6 ARG HG2 H -0.951 3.123 2.609 1.00 . A A . 6 ARG HG2 1 1 19 4167 1 1 6 ARG HG3 H -2.506 2.869 3.404 1.00 . A A . 6 ARG HG3 1 1 19 4168 1 1 6 ARG HH11 H -3.145 1.508 5.137 1.00 . A A . 6 ARG HH11 1 1 19 4169 1 1 6 ARG HH12 H -3.743 2.209 6.604 1.00 . A A . 6 ARG HH12 1 1 19 4170 1 1 6 ARG HH21 H -0.712 3.733 7.450 1.00 . A A . 6 ARG HH21 1 1 19 4171 1 1 6 ARG HH22 H -2.359 3.476 7.919 1.00 . A A . 6 ARG HH22 1 1 19 4172 1 1 6 ARG N N -1.577 0.861 -0.462 1.00 . A A . 6 ARG N 1 1 19 4173 1 1 6 ARG NE N -0.808 2.400 5.328 1.00 . A A . 6 ARG NE 1 1 19 4174 1 1 6 ARG NH1 N -2.995 2.061 5.956 1.00 . A A . 6 ARG NH1 1 1 19 4175 1 1 6 ARG NH2 N -1.609 3.328 7.275 1.00 . A A . 6 ARG NH2 1 1 19 4176 1 1 6 ARG O O 1.107 0.491 1.735 1.00 . A A . 6 ARG O 1 1 19 4177 1 1 7 GLY C C 1.792 -2.171 0.921 1.00 . A A . 7 GLY C 1 1 19 4178 1 1 7 GLY CA C 0.449 -2.176 1.624 1.00 . A A . 7 GLY CA 1 1 19 4179 1 1 7 GLY H H -1.296 -1.274 0.832 1.00 . A A . 7 GLY H 1 1 19 4180 1 1 7 GLY HA2 H 0.612 -2.094 2.689 1.00 . A A . 7 GLY HA2 1 1 19 4181 1 1 7 GLY HA3 H -0.050 -3.111 1.417 1.00 . A A . 7 GLY HA3 1 1 19 4182 1 1 7 GLY N N -0.406 -1.083 1.195 1.00 . A A . 7 GLY N 1 1 19 4183 1 1 7 GLY O O 2.831 -2.365 1.550 1.00 . A A . 7 GLY O 1 1 19 4184 1 1 8 LYS C C 4.008 -0.955 -0.582 1.00 . A A . 8 LYS C 1 1 19 4185 1 1 8 LYS CA C 2.995 -1.925 -1.181 1.00 . A A . 8 LYS CA 1 1 19 4186 1 1 8 LYS CB C 2.684 -1.527 -2.626 1.00 . A A . 8 LYS CB 1 1 19 4187 1 1 8 LYS CD C 3.353 -3.582 -3.906 1.00 . A A . 8 LYS CD 1 1 19 4188 1 1 8 LYS CE C 4.157 -2.964 -5.040 1.00 . A A . 8 LYS CE 1 1 19 4189 1 1 8 LYS CG C 2.202 -2.684 -3.485 1.00 . A A . 8 LYS CG 1 1 19 4190 1 1 8 LYS H H 0.910 -1.805 -0.836 1.00 . A A . 8 LYS H 1 1 19 4191 1 1 8 LYS HA H 3.418 -2.918 -1.173 1.00 . A A . 8 LYS HA 1 1 19 4192 1 1 8 LYS HB2 H 1.916 -0.766 -2.620 1.00 . A A . 8 LYS HB2 1 1 19 4193 1 1 8 LYS HB3 H 3.577 -1.121 -3.075 1.00 . A A . 8 LYS HB3 1 1 19 4194 1 1 8 LYS HD2 H 4.006 -3.737 -3.060 1.00 . A A . 8 LYS HD2 1 1 19 4195 1 1 8 LYS HD3 H 2.955 -4.533 -4.233 1.00 . A A . 8 LYS HD3 1 1 19 4196 1 1 8 LYS HE2 H 3.475 -2.641 -5.812 1.00 . A A . 8 LYS HE2 1 1 19 4197 1 1 8 LYS HE3 H 4.698 -2.112 -4.658 1.00 . A A . 8 LYS HE3 1 1 19 4198 1 1 8 LYS HG2 H 1.491 -3.268 -2.920 1.00 . A A . 8 LYS HG2 1 1 19 4199 1 1 8 LYS HG3 H 1.724 -2.288 -4.369 1.00 . A A . 8 LYS HG3 1 1 19 4200 1 1 8 LYS HZ1 H 4.907 -4.897 -5.301 1.00 . A A . 8 LYS HZ1 1 1 19 4201 1 1 8 LYS HZ2 H 5.076 -3.905 -6.663 1.00 . A A . 8 LYS HZ2 1 1 19 4202 1 1 8 LYS HZ3 H 6.093 -3.692 -5.327 1.00 . A A . 8 LYS HZ3 1 1 19 4203 1 1 8 LYS N N 1.770 -1.953 -0.389 1.00 . A A . 8 LYS N 1 1 19 4204 1 1 8 LYS NZ N 5.127 -3.932 -5.624 1.00 . A A . 8 LYS NZ 1 1 19 4205 1 1 8 LYS O O 5.211 -1.209 -0.603 1.00 . A A . 8 LYS O 1 1 19 4206 1 1 9 ALA C C 4.709 0.799 2.002 1.00 . A A . 9 ALA C 1 1 19 4207 1 1 9 ALA CA C 4.373 1.164 0.558 1.00 . A A . 9 ALA CA 1 1 19 4208 1 1 9 ALA CB C 3.712 2.531 0.497 1.00 . A A . 9 ALA CB 1 1 19 4209 1 1 9 ALA H H 2.543 0.303 -0.062 1.00 . A A . 9 ALA H 1 1 19 4210 1 1 9 ALA HA H 5.290 1.207 -0.012 1.00 . A A . 9 ALA HA 1 1 19 4211 1 1 9 ALA HB1 H 2.921 2.516 -0.238 1.00 . A A . 9 ALA HB1 1 1 19 4212 1 1 9 ALA HB2 H 3.299 2.776 1.465 1.00 . A A . 9 ALA HB2 1 1 19 4213 1 1 9 ALA HB3 H 4.446 3.274 0.222 1.00 . A A . 9 ALA HB3 1 1 19 4214 1 1 9 ALA N N 3.512 0.156 -0.049 1.00 . A A . 9 ALA N 1 1 19 4215 1 1 9 ALA O O 5.831 1.015 2.462 1.00 . A A . 9 ALA O 1 1 19 4216 1 1 10 ASP C C 5.146 -1.044 4.249 1.00 . A A . 10 ASP C 1 1 19 4217 1 1 10 ASP CA C 3.922 -0.144 4.103 1.00 . A A . 10 ASP CA 1 1 19 4218 1 1 10 ASP CB C 2.679 -0.866 4.626 1.00 . A A . 10 ASP CB 1 1 19 4219 1 1 10 ASP CG C 2.716 -1.064 6.129 1.00 . A A . 10 ASP CG 1 1 19 4220 1 1 10 ASP H H 2.858 0.102 2.288 1.00 . A A . 10 ASP H 1 1 19 4221 1 1 10 ASP HA H 4.080 0.752 4.682 1.00 . A A . 10 ASP HA 1 1 19 4222 1 1 10 ASP HB2 H 1.803 -0.283 4.381 1.00 . A A . 10 ASP HB2 1 1 19 4223 1 1 10 ASP HB3 H 2.607 -1.834 4.154 1.00 . A A . 10 ASP HB3 1 1 19 4224 1 1 10 ASP N N 3.731 0.249 2.710 1.00 . A A . 10 ASP N 1 1 19 4225 1 1 10 ASP O O 5.989 -0.825 5.118 1.00 . A A . 10 ASP O 1 1 19 4226 1 1 10 ASP OD1 O 3.653 -0.546 6.774 1.00 . A A . 10 ASP OD1 1 1 19 4227 1 1 10 ASP OD2 O 1.810 -1.738 6.660 1.00 . A A . 10 ASP OD2 1 1 19 4228 1 1 11 VAL C C 7.666 -2.287 3.091 1.00 . A A . 11 VAL C 1 1 19 4229 1 1 11 VAL CA C 6.356 -2.989 3.427 1.00 . A A . 11 VAL CA 1 1 19 4230 1 1 11 VAL CB C 6.145 -4.156 2.443 1.00 . A A . 11 VAL CB 1 1 19 4231 1 1 11 VAL CG1 C 4.961 -5.009 2.872 1.00 . A A . 11 VAL CG1 1 1 19 4232 1 1 11 VAL CG2 C 5.950 -3.631 1.028 1.00 . A A . 11 VAL CG2 1 1 19 4233 1 1 11 VAL H H 4.532 -2.179 2.721 1.00 . A A . 11 VAL H 1 1 19 4234 1 1 11 VAL HA H 6.421 -3.396 4.425 1.00 . A A . 11 VAL HA 1 1 19 4235 1 1 11 VAL HB H 7.029 -4.775 2.455 1.00 . A A . 11 VAL HB 1 1 19 4236 1 1 11 VAL HG11 H 5.106 -6.024 2.531 1.00 . A A . 11 VAL HG11 1 1 19 4237 1 1 11 VAL HG12 H 4.881 -4.999 3.949 1.00 . A A . 11 VAL HG12 1 1 19 4238 1 1 11 VAL HG13 H 4.055 -4.610 2.440 1.00 . A A . 11 VAL HG13 1 1 19 4239 1 1 11 VAL HG21 H 5.149 -2.907 1.021 1.00 . A A . 11 VAL HG21 1 1 19 4240 1 1 11 VAL HG22 H 6.862 -3.163 0.690 1.00 . A A . 11 VAL HG22 1 1 19 4241 1 1 11 VAL HG23 H 5.700 -4.451 0.372 1.00 . A A . 11 VAL HG23 1 1 19 4242 1 1 11 VAL N N 5.236 -2.057 3.392 1.00 . A A . 11 VAL N 1 1 19 4243 1 1 11 VAL O O 8.714 -2.605 3.651 1.00 . A A . 11 VAL O 1 1 19 4244 1 1 12 ALA C C 9.301 0.291 2.904 1.00 . A A . 12 ALA C 1 1 19 4245 1 1 12 ALA CA C 8.781 -0.579 1.763 1.00 . A A . 12 ALA CA 1 1 19 4246 1 1 12 ALA CB C 8.466 0.278 0.546 1.00 . A A . 12 ALA CB 1 1 19 4247 1 1 12 ALA H H 6.735 -1.120 1.761 1.00 . A A . 12 ALA H 1 1 19 4248 1 1 12 ALA HA H 9.547 -1.287 1.485 1.00 . A A . 12 ALA HA 1 1 19 4249 1 1 12 ALA HB1 H 9.120 1.137 0.532 1.00 . A A . 12 ALA HB1 1 1 19 4250 1 1 12 ALA HB2 H 8.616 -0.303 -0.351 1.00 . A A . 12 ALA HB2 1 1 19 4251 1 1 12 ALA HB3 H 7.439 0.609 0.594 1.00 . A A . 12 ALA HB3 1 1 19 4252 1 1 12 ALA N N 7.599 -1.329 2.173 1.00 . A A . 12 ALA N 1 1 19 4253 1 1 12 ALA O O 10.508 0.487 3.047 1.00 . A A . 12 ALA O 1 1 19 4254 1 1 13 LEU C C 9.103 0.816 6.063 1.00 . A A . 13 LEU C 1 1 19 4255 1 1 13 LEU CA C 8.750 1.658 4.841 1.00 . A A . 13 LEU CA 1 1 19 4256 1 1 13 LEU CB C 7.603 2.614 5.178 1.00 . A A . 13 LEU CB 1 1 19 4257 1 1 13 LEU CD1 C 9.056 4.255 6.395 1.00 . A A . 13 LEU CD1 1 1 19 4258 1 1 13 LEU CD2 C 6.572 4.349 6.663 1.00 . A A . 13 LEU CD2 1 1 19 4259 1 1 13 LEU CG C 7.773 3.440 6.453 1.00 . A A . 13 LEU CG 1 1 19 4260 1 1 13 LEU H H 7.437 0.616 3.549 1.00 . A A . 13 LEU H 1 1 19 4261 1 1 13 LEU HA H 9.616 2.234 4.554 1.00 . A A . 13 LEU HA 1 1 19 4262 1 1 13 LEU HB2 H 7.490 3.298 4.353 1.00 . A A . 13 LEU HB2 1 1 19 4263 1 1 13 LEU HB3 H 6.703 2.024 5.283 1.00 . A A . 13 LEU HB3 1 1 19 4264 1 1 13 LEU HD11 H 9.518 4.131 5.426 1.00 . A A . 13 LEU HD11 1 1 19 4265 1 1 13 LEU HD12 H 8.828 5.299 6.552 1.00 . A A . 13 LEU HD12 1 1 19 4266 1 1 13 LEU HD13 H 9.735 3.915 7.163 1.00 . A A . 13 LEU HD13 1 1 19 4267 1 1 13 LEU HD21 H 6.845 5.162 7.320 1.00 . A A . 13 LEU HD21 1 1 19 4268 1 1 13 LEU HD22 H 6.251 4.748 5.712 1.00 . A A . 13 LEU HD22 1 1 19 4269 1 1 13 LEU HD23 H 5.765 3.783 7.107 1.00 . A A . 13 LEU HD23 1 1 19 4270 1 1 13 LEU HG H 7.842 2.773 7.302 1.00 . A A . 13 LEU HG 1 1 19 4271 1 1 13 LEU N N 8.383 0.809 3.713 1.00 . A A . 13 LEU N 1 1 19 4272 1 1 13 LEU O O 8.228 0.225 6.695 1.00 . A A . 13 LEU O 1 1 19 4273 1 1 14 NH2 HN1 H 11.040 1.262 5.849 1.00 . A A . 14 NH2 HN1 1 1 19 4274 1 1 14 NH2 HN2 H 10.711 0.244 7.180 1.00 . A A . 14 NH2 HN2 1 1 19 4275 1 1 14 NH2 N N 10.390 0.770 6.391 1.00 . A A . 14 NH2 N 1 1 20 4276 1 1 1 ILE C C -6.323 0.200 -3.697 1.00 . A A . 1 ILE C 1 1 20 4277 1 1 1 ILE CA C -7.197 -0.522 -4.716 1.00 . A A . 1 ILE CA 1 1 20 4278 1 1 1 ILE CB C -7.705 -1.838 -4.098 1.00 . A A . 1 ILE CB 1 1 20 4279 1 1 1 ILE CD1 C -8.890 -4.022 -4.655 1.00 . A A . 1 ILE CD1 1 1 20 4280 1 1 1 ILE CG1 C -8.494 -2.643 -5.134 1.00 . A A . 1 ILE CG1 1 1 20 4281 1 1 1 ILE CG2 C -8.565 -1.552 -2.876 1.00 . A A . 1 ILE CG2 1 1 20 4282 1 1 1 ILE H1 H -5.521 -1.001 -5.916 1.00 . A A . 1 ILE H1 1 1 20 4283 1 1 1 ILE HA H -8.052 0.099 -4.945 1.00 . A A . 1 ILE HA 1 1 20 4284 1 1 1 ILE HB H -6.850 -2.414 -3.779 1.00 . A A . 1 ILE HB 1 1 20 4285 1 1 1 ILE HD11 H -8.978 -4.686 -5.502 1.00 . A A . 1 ILE HD11 1 1 20 4286 1 1 1 ILE HD12 H -8.136 -4.399 -3.979 1.00 . A A . 1 ILE HD12 1 1 20 4287 1 1 1 ILE HD13 H -9.838 -3.965 -4.141 1.00 . A A . 1 ILE HD13 1 1 20 4288 1 1 1 ILE HG12 H -9.395 -2.107 -5.386 1.00 . A A . 1 ILE HG12 1 1 20 4289 1 1 1 ILE HG13 H -7.889 -2.761 -6.022 1.00 . A A . 1 ILE HG13 1 1 20 4290 1 1 1 ILE HG21 H -7.981 -1.018 -2.141 1.00 . A A . 1 ILE HG21 1 1 20 4291 1 1 1 ILE HG22 H -9.415 -0.954 -3.166 1.00 . A A . 1 ILE HG22 1 1 20 4292 1 1 1 ILE HG23 H -8.910 -2.484 -2.452 1.00 . A A . 1 ILE HG23 1 1 20 4293 1 1 1 ILE N N -6.471 -0.762 -5.957 1.00 . A A . 1 ILE N 1 1 20 4294 1 1 1 ILE O O -5.136 -0.097 -3.560 1.00 . A A . 1 ILE O 1 1 20 4295 1 1 2 PHE C C -5.536 0.987 -0.956 1.00 . A A . 2 PHE C 1 1 20 4296 1 1 2 PHE CA C -6.193 1.915 -1.974 1.00 . A A . 2 PHE CA 1 1 20 4297 1 1 2 PHE CB C -7.139 2.884 -1.261 1.00 . A A . 2 PHE CB 1 1 20 4298 1 1 2 PHE CD1 C -8.954 4.178 -2.414 1.00 . A A . 2 PHE CD1 1 1 20 4299 1 1 2 PHE CD2 C -6.701 4.914 -2.668 1.00 . A A . 2 PHE CD2 1 1 20 4300 1 1 2 PHE CE1 C -9.388 5.218 -3.215 1.00 . A A . 2 PHE CE1 1 1 20 4301 1 1 2 PHE CE2 C -7.128 5.955 -3.469 1.00 . A A . 2 PHE CE2 1 1 20 4302 1 1 2 PHE CG C -7.607 4.014 -2.132 1.00 . A A . 2 PHE CG 1 1 20 4303 1 1 2 PHE CZ C -8.473 6.107 -3.744 1.00 . A A . 2 PHE CZ 1 1 20 4304 1 1 2 PHE H H -7.866 1.340 -3.137 1.00 . A A . 2 PHE H 1 1 20 4305 1 1 2 PHE HA H -5.425 2.480 -2.477 1.00 . A A . 2 PHE HA 1 1 20 4306 1 1 2 PHE HB2 H -8.010 2.342 -0.925 1.00 . A A . 2 PHE HB2 1 1 20 4307 1 1 2 PHE HB3 H -6.632 3.308 -0.408 1.00 . A A . 2 PHE HB3 1 1 20 4308 1 1 2 PHE HD1 H -9.670 3.482 -2.001 1.00 . A A . 2 PHE HD1 1 1 20 4309 1 1 2 PHE HD2 H -5.648 4.797 -2.456 1.00 . A A . 2 PHE HD2 1 1 20 4310 1 1 2 PHE HE1 H -10.440 5.333 -3.426 1.00 . A A . 2 PHE HE1 1 1 20 4311 1 1 2 PHE HE2 H -6.411 6.649 -3.882 1.00 . A A . 2 PHE HE2 1 1 20 4312 1 1 2 PHE HZ H -8.810 6.920 -4.370 1.00 . A A . 2 PHE HZ 1 1 20 4313 1 1 2 PHE N N -6.917 1.150 -2.982 1.00 . A A . 2 PHE N 1 1 20 4314 1 1 2 PHE O O -4.340 1.095 -0.686 1.00 . A A . 2 PHE O 1 1 20 4315 1 1 3 TRP C C -4.583 -1.591 0.071 1.00 . A A . 3 TRP C 1 1 20 4316 1 1 3 TRP CA C -5.820 -0.867 0.591 1.00 . A A . 3 TRP CA 1 1 20 4317 1 1 3 TRP CB C -6.904 -1.883 0.957 1.00 . A A . 3 TRP CB 1 1 20 4318 1 1 3 TRP CD1 C -6.528 -2.311 3.456 1.00 . A A . 3 TRP CD1 1 1 20 4319 1 1 3 TRP CD2 C -6.190 -4.102 2.154 1.00 . A A . 3 TRP CD2 1 1 20 4320 1 1 3 TRP CE2 C -5.953 -4.468 3.494 1.00 . A A . 3 TRP CE2 1 1 20 4321 1 1 3 TRP CE3 C -6.041 -5.067 1.156 1.00 . A A . 3 TRP CE3 1 1 20 4322 1 1 3 TRP CG C -6.558 -2.718 2.152 1.00 . A A . 3 TRP CG 1 1 20 4323 1 1 3 TRP CH2 C -5.434 -6.683 2.858 1.00 . A A . 3 TRP CH2 1 1 20 4324 1 1 3 TRP CZ2 C -5.573 -5.758 3.856 1.00 . A A . 3 TRP CZ2 1 1 20 4325 1 1 3 TRP CZ3 C -5.663 -6.347 1.517 1.00 . A A . 3 TRP CZ3 1 1 20 4326 1 1 3 TRP H H -7.271 0.042 -0.653 1.00 . A A . 3 TRP H 1 1 20 4327 1 1 3 TRP HA H -5.550 -0.310 1.477 1.00 . A A . 3 TRP HA 1 1 20 4328 1 1 3 TRP HB2 H -7.823 -1.358 1.172 1.00 . A A . 3 TRP HB2 1 1 20 4329 1 1 3 TRP HB3 H -7.061 -2.547 0.120 1.00 . A A . 3 TRP HB3 1 1 20 4330 1 1 3 TRP HD1 H -6.759 -1.309 3.785 1.00 . A A . 3 TRP HD1 1 1 20 4331 1 1 3 TRP HE1 H -6.074 -3.317 5.244 1.00 . A A . 3 TRP HE1 1 1 20 4332 1 1 3 TRP HE3 H -6.214 -4.828 0.117 1.00 . A A . 3 TRP HE3 1 1 20 4333 1 1 3 TRP HH2 H -5.141 -7.694 3.092 1.00 . A A . 3 TRP HH2 1 1 20 4334 1 1 3 TRP HZ2 H -5.393 -6.033 4.884 1.00 . A A . 3 TRP HZ2 1 1 20 4335 1 1 3 TRP HZ3 H -5.543 -7.106 0.758 1.00 . A A . 3 TRP HZ3 1 1 20 4336 1 1 3 TRP N N -6.326 0.078 -0.397 1.00 . A A . 3 TRP N 1 1 20 4337 1 1 3 TRP NE1 N -6.165 -3.358 4.267 1.00 . A A . 3 TRP NE1 1 1 20 4338 1 1 3 TRP O O -3.634 -1.834 0.816 1.00 . A A . 3 TRP O 1 1 20 4339 1 1 4 LEU C C -2.265 -1.714 -1.946 1.00 . A A . 4 LEU C 1 1 20 4340 1 1 4 LEU CA C -3.480 -2.628 -1.834 1.00 . A A . 4 LEU CA 1 1 20 4341 1 1 4 LEU CB C -3.875 -3.142 -3.219 1.00 . A A . 4 LEU CB 1 1 20 4342 1 1 4 LEU CD1 C -1.871 -4.635 -3.397 1.00 . A A . 4 LEU CD1 1 1 20 4343 1 1 4 LEU CD2 C -3.268 -4.177 -5.421 1.00 . A A . 4 LEU CD2 1 1 20 4344 1 1 4 LEU CG C -2.728 -3.606 -4.117 1.00 . A A . 4 LEU CG 1 1 20 4345 1 1 4 LEU H H -5.385 -1.713 -1.756 1.00 . A A . 4 LEU H 1 1 20 4346 1 1 4 LEU HA H -3.223 -3.471 -1.208 1.00 . A A . 4 LEU HA 1 1 20 4347 1 1 4 LEU HB2 H -4.547 -3.974 -3.084 1.00 . A A . 4 LEU HB2 1 1 20 4348 1 1 4 LEU HB3 H -4.393 -2.342 -3.731 1.00 . A A . 4 LEU HB3 1 1 20 4349 1 1 4 LEU HD11 H -2.507 -5.300 -2.829 1.00 . A A . 4 LEU HD11 1 1 20 4350 1 1 4 LEU HD12 H -1.310 -5.208 -4.122 1.00 . A A . 4 LEU HD12 1 1 20 4351 1 1 4 LEU HD13 H -1.188 -4.131 -2.729 1.00 . A A . 4 LEU HD13 1 1 20 4352 1 1 4 LEU HD21 H -2.472 -4.677 -5.952 1.00 . A A . 4 LEU HD21 1 1 20 4353 1 1 4 LEU HD22 H -4.057 -4.883 -5.205 1.00 . A A . 4 LEU HD22 1 1 20 4354 1 1 4 LEU HD23 H -3.660 -3.376 -6.029 1.00 . A A . 4 LEU HD23 1 1 20 4355 1 1 4 LEU HG H -2.101 -2.759 -4.356 1.00 . A A . 4 LEU HG 1 1 20 4356 1 1 4 LEU N N -4.601 -1.933 -1.212 1.00 . A A . 4 LEU N 1 1 20 4357 1 1 4 LEU O O -1.160 -2.079 -1.544 1.00 . A A . 4 LEU O 1 1 20 4358 1 1 5 PHE C C -0.760 0.782 -1.313 1.00 . A A . 5 PHE C 1 1 20 4359 1 1 5 PHE CA C -1.400 0.448 -2.656 1.00 . A A . 5 PHE CA 1 1 20 4360 1 1 5 PHE CB C -1.930 1.724 -3.314 1.00 . A A . 5 PHE CB 1 1 20 4361 1 1 5 PHE CD1 C 0.242 2.304 -4.429 1.00 . A A . 5 PHE CD1 1 1 20 4362 1 1 5 PHE CD2 C -0.928 4.024 -3.263 1.00 . A A . 5 PHE CD2 1 1 20 4363 1 1 5 PHE CE1 C 1.237 3.205 -4.762 1.00 . A A . 5 PHE CE1 1 1 20 4364 1 1 5 PHE CE2 C 0.064 4.929 -3.593 1.00 . A A . 5 PHE CE2 1 1 20 4365 1 1 5 PHE CG C -0.851 2.703 -3.675 1.00 . A A . 5 PHE CG 1 1 20 4366 1 1 5 PHE CZ C 1.147 4.518 -4.346 1.00 . A A . 5 PHE CZ 1 1 20 4367 1 1 5 PHE H H -3.381 -0.288 -2.793 1.00 . A A . 5 PHE H 1 1 20 4368 1 1 5 PHE HA H -0.653 0.007 -3.296 1.00 . A A . 5 PHE HA 1 1 20 4369 1 1 5 PHE HB2 H -2.457 1.463 -4.219 1.00 . A A . 5 PHE HB2 1 1 20 4370 1 1 5 PHE HB3 H -2.610 2.214 -2.634 1.00 . A A . 5 PHE HB3 1 1 20 4371 1 1 5 PHE HD1 H 0.314 1.278 -4.756 1.00 . A A . 5 PHE HD1 1 1 20 4372 1 1 5 PHE HD2 H -1.776 4.347 -2.675 1.00 . A A . 5 PHE HD2 1 1 20 4373 1 1 5 PHE HE1 H 2.083 2.880 -5.351 1.00 . A A . 5 PHE HE1 1 1 20 4374 1 1 5 PHE HE2 H -0.010 5.956 -3.267 1.00 . A A . 5 PHE HE2 1 1 20 4375 1 1 5 PHE HZ H 1.923 5.222 -4.605 1.00 . A A . 5 PHE HZ 1 1 20 4376 1 1 5 PHE N N -2.478 -0.521 -2.492 1.00 . A A . 5 PHE N 1 1 20 4377 1 1 5 PHE O O 0.456 0.950 -1.216 1.00 . A A . 5 PHE O 1 1 20 4378 1 1 6 ARG C C -0.098 0.152 1.536 1.00 . A A . 6 ARG C 1 1 20 4379 1 1 6 ARG CA C -1.105 1.196 1.061 1.00 . A A . 6 ARG CA 1 1 20 4380 1 1 6 ARG CB C -2.275 1.276 2.044 1.00 . A A . 6 ARG CB 1 1 20 4381 1 1 6 ARG CD C -2.799 1.491 4.492 1.00 . A A . 6 ARG CD 1 1 20 4382 1 1 6 ARG CG C -1.931 1.983 3.344 1.00 . A A . 6 ARG CG 1 1 20 4383 1 1 6 ARG CZ C -2.240 3.086 6.278 1.00 . A A . 6 ARG CZ 1 1 20 4384 1 1 6 ARG H H -2.548 0.736 -0.416 1.00 . A A . 6 ARG H 1 1 20 4385 1 1 6 ARG HA H -0.616 2.157 1.019 1.00 . A A . 6 ARG HA 1 1 20 4386 1 1 6 ARG HB2 H -3.089 1.809 1.574 1.00 . A A . 6 ARG HB2 1 1 20 4387 1 1 6 ARG HB3 H -2.600 0.273 2.280 1.00 . A A . 6 ARG HB3 1 1 20 4388 1 1 6 ARG HD2 H -3.780 1.934 4.399 1.00 . A A . 6 ARG HD2 1 1 20 4389 1 1 6 ARG HD3 H -2.881 0.417 4.429 1.00 . A A . 6 ARG HD3 1 1 20 4390 1 1 6 ARG HE H -1.846 1.132 6.330 1.00 . A A . 6 ARG HE 1 1 20 4391 1 1 6 ARG HG2 H -0.895 1.793 3.584 1.00 . A A . 6 ARG HG2 1 1 20 4392 1 1 6 ARG HG3 H -2.084 3.044 3.217 1.00 . A A . 6 ARG HG3 1 1 20 4393 1 1 6 ARG HH11 H -3.168 3.895 4.676 1.00 . A A . 6 ARG HH11 1 1 20 4394 1 1 6 ARG HH12 H -2.769 5.008 5.943 1.00 . A A . 6 ARG HH12 1 1 20 4395 1 1 6 ARG HH21 H -1.315 2.587 8.004 1.00 . A A . 6 ARG HH21 1 1 20 4396 1 1 6 ARG HH22 H -1.714 4.263 7.835 1.00 . A A . 6 ARG HH22 1 1 20 4397 1 1 6 ARG N N -1.589 0.879 -0.277 1.00 . A A . 6 ARG N 1 1 20 4398 1 1 6 ARG NE N -2.240 1.849 5.792 1.00 . A A . 6 ARG NE 1 1 20 4399 1 1 6 ARG NH1 N -2.769 4.078 5.574 1.00 . A A . 6 ARG NH1 1 1 20 4400 1 1 6 ARG NH2 N -1.712 3.332 7.471 1.00 . A A . 6 ARG NH2 1 1 20 4401 1 1 6 ARG O O 0.981 0.491 2.022 1.00 . A A . 6 ARG O 1 1 20 4402 1 1 7 GLY C C 1.716 -2.222 1.023 1.00 . A A . 7 GLY C 1 1 20 4403 1 1 7 GLY CA C 0.423 -2.193 1.814 1.00 . A A . 7 GLY CA 1 1 20 4404 1 1 7 GLY H H -1.332 -1.330 1.000 1.00 . A A . 7 GLY H 1 1 20 4405 1 1 7 GLY HA2 H 0.655 -2.064 2.860 1.00 . A A . 7 GLY HA2 1 1 20 4406 1 1 7 GLY HA3 H -0.088 -3.134 1.681 1.00 . A A . 7 GLY HA3 1 1 20 4407 1 1 7 GLY N N -0.459 -1.119 1.395 1.00 . A A . 7 GLY N 1 1 20 4408 1 1 7 GLY O O 2.792 -2.419 1.587 1.00 . A A . 7 GLY O 1 1 20 4409 1 1 8 LYS C C 3.835 -1.051 -0.657 1.00 . A A . 8 LYS C 1 1 20 4410 1 1 8 LYS CA C 2.782 -2.034 -1.158 1.00 . A A . 8 LYS CA 1 1 20 4411 1 1 8 LYS CB C 2.378 -1.681 -2.589 1.00 . A A . 8 LYS CB 1 1 20 4412 1 1 8 LYS CD C 1.762 -2.641 -4.828 1.00 . A A . 8 LYS CD 1 1 20 4413 1 1 8 LYS CE C 0.738 -3.507 -5.548 1.00 . A A . 8 LYS CE 1 1 20 4414 1 1 8 LYS CG C 1.674 -2.811 -3.321 1.00 . A A . 8 LYS CG 1 1 20 4415 1 1 8 LYS H H 0.726 -1.877 -0.679 1.00 . A A . 8 LYS H 1 1 20 4416 1 1 8 LYS HA H 3.199 -3.029 -1.145 1.00 . A A . 8 LYS HA 1 1 20 4417 1 1 8 LYS HB2 H 1.715 -0.828 -2.565 1.00 . A A . 8 LYS HB2 1 1 20 4418 1 1 8 LYS HB3 H 3.267 -1.418 -3.147 1.00 . A A . 8 LYS HB3 1 1 20 4419 1 1 8 LYS HD2 H 1.579 -1.606 -5.076 1.00 . A A . 8 LYS HD2 1 1 20 4420 1 1 8 LYS HD3 H 2.754 -2.922 -5.156 1.00 . A A . 8 LYS HD3 1 1 20 4421 1 1 8 LYS HE2 H 1.036 -4.541 -5.457 1.00 . A A . 8 LYS HE2 1 1 20 4422 1 1 8 LYS HE3 H -0.224 -3.366 -5.080 1.00 . A A . 8 LYS HE3 1 1 20 4423 1 1 8 LYS HG2 H 2.137 -3.747 -3.047 1.00 . A A . 8 LYS HG2 1 1 20 4424 1 1 8 LYS HG3 H 0.635 -2.824 -3.028 1.00 . A A . 8 LYS HG3 1 1 20 4425 1 1 8 LYS HZ1 H 0.658 -2.123 -7.110 1.00 . A A . 8 LYS HZ1 1 1 20 4426 1 1 8 LYS HZ2 H 1.424 -3.576 -7.519 1.00 . A A . 8 LYS HZ2 1 1 20 4427 1 1 8 LYS HZ3 H -0.261 -3.518 -7.380 1.00 . A A . 8 LYS HZ3 1 1 20 4428 1 1 8 LYS N N 1.611 -2.029 -0.287 1.00 . A A . 8 LYS N 1 1 20 4429 1 1 8 LYS NZ N 0.632 -3.157 -6.990 1.00 . A A . 8 LYS NZ 1 1 20 4430 1 1 8 LYS O O 5.033 -1.334 -0.706 1.00 . A A . 8 LYS O 1 1 20 4431 1 1 9 ALA C C 4.686 0.830 1.778 1.00 . A A . 9 ALA C 1 1 20 4432 1 1 9 ALA CA C 4.288 1.123 0.336 1.00 . A A . 9 ALA CA 1 1 20 4433 1 1 9 ALA CB C 3.644 2.498 0.233 1.00 . A A . 9 ALA CB 1 1 20 4434 1 1 9 ALA H H 2.418 0.267 -0.164 1.00 . A A . 9 ALA H 1 1 20 4435 1 1 9 ALA HA H 5.176 1.122 -0.280 1.00 . A A . 9 ALA HA 1 1 20 4436 1 1 9 ALA HB1 H 3.407 2.707 -0.801 1.00 . A A . 9 ALA HB1 1 1 20 4437 1 1 9 ALA HB2 H 2.739 2.516 0.820 1.00 . A A . 9 ALA HB2 1 1 20 4438 1 1 9 ALA HB3 H 4.331 3.245 0.604 1.00 . A A . 9 ALA HB3 1 1 20 4439 1 1 9 ALA N N 3.384 0.102 -0.176 1.00 . A A . 9 ALA N 1 1 20 4440 1 1 9 ALA O O 5.822 1.085 2.182 1.00 . A A . 9 ALA O 1 1 20 4441 1 1 10 ASP C C 5.238 -0.909 4.085 1.00 . A A . 10 ASP C 1 1 20 4442 1 1 10 ASP CA C 4.000 -0.030 3.949 1.00 . A A . 10 ASP CA 1 1 20 4443 1 1 10 ASP CB C 2.789 -0.736 4.557 1.00 . A A . 10 ASP CB 1 1 20 4444 1 1 10 ASP CG C 2.802 -0.709 6.074 1.00 . A A . 10 ASP CG 1 1 20 4445 1 1 10 ASP H H 2.861 0.119 2.171 1.00 . A A . 10 ASP H 1 1 20 4446 1 1 10 ASP HA H 4.170 0.894 4.480 1.00 . A A . 10 ASP HA 1 1 20 4447 1 1 10 ASP HB2 H 1.886 -0.250 4.215 1.00 . A A . 10 ASP HB2 1 1 20 4448 1 1 10 ASP HB3 H 2.781 -1.767 4.234 1.00 . A A . 10 ASP HB3 1 1 20 4449 1 1 10 ASP N N 3.747 0.297 2.551 1.00 . A A . 10 ASP N 1 1 20 4450 1 1 10 ASP O O 6.202 -0.543 4.758 1.00 . A A . 10 ASP O 1 1 20 4451 1 1 10 ASP OD1 O 3.064 0.371 6.644 1.00 . A A . 10 ASP OD1 1 1 20 4452 1 1 10 ASP OD2 O 2.550 -1.765 6.688 1.00 . A A . 10 ASP OD2 1 1 20 4453 1 1 11 VAL C C 7.627 -2.325 3.078 1.00 . A A . 11 VAL C 1 1 20 4454 1 1 11 VAL CA C 6.326 -3.005 3.491 1.00 . A A . 11 VAL CA 1 1 20 4455 1 1 11 VAL CB C 6.083 -4.222 2.580 1.00 . A A . 11 VAL CB 1 1 20 4456 1 1 11 VAL CG1 C 5.818 -3.774 1.151 1.00 . A A . 11 VAL CG1 1 1 20 4457 1 1 11 VAL CG2 C 7.268 -5.176 2.638 1.00 . A A . 11 VAL CG2 1 1 20 4458 1 1 11 VAL H H 4.410 -2.308 2.921 1.00 . A A . 11 VAL H 1 1 20 4459 1 1 11 VAL HA H 6.423 -3.357 4.508 1.00 . A A . 11 VAL HA 1 1 20 4460 1 1 11 VAL HB H 5.209 -4.746 2.937 1.00 . A A . 11 VAL HB 1 1 20 4461 1 1 11 VAL HG11 H 6.740 -3.429 0.705 1.00 . A A . 11 VAL HG11 1 1 20 4462 1 1 11 VAL HG12 H 5.431 -4.605 0.579 1.00 . A A . 11 VAL HG12 1 1 20 4463 1 1 11 VAL HG13 H 5.096 -2.971 1.153 1.00 . A A . 11 VAL HG13 1 1 20 4464 1 1 11 VAL HG21 H 7.591 -5.287 3.662 1.00 . A A . 11 VAL HG21 1 1 20 4465 1 1 11 VAL HG22 H 6.975 -6.138 2.245 1.00 . A A . 11 VAL HG22 1 1 20 4466 1 1 11 VAL HG23 H 8.079 -4.777 2.046 1.00 . A A . 11 VAL HG23 1 1 20 4467 1 1 11 VAL N N 5.206 -2.073 3.442 1.00 . A A . 11 VAL N 1 1 20 4468 1 1 11 VAL O O 8.689 -2.606 3.629 1.00 . A A . 11 VAL O 1 1 20 4469 1 1 12 ALA C C 9.233 0.256 2.673 1.00 . A A . 12 ALA C 1 1 20 4470 1 1 12 ALA CA C 8.703 -0.704 1.614 1.00 . A A . 12 ALA CA 1 1 20 4471 1 1 12 ALA CB C 8.362 0.050 0.338 1.00 . A A . 12 ALA CB 1 1 20 4472 1 1 12 ALA H H 6.658 -1.246 1.700 1.00 . A A . 12 ALA H 1 1 20 4473 1 1 12 ALA HA H 9.469 -1.429 1.382 1.00 . A A . 12 ALA HA 1 1 20 4474 1 1 12 ALA HB1 H 9.069 -0.212 -0.435 1.00 . A A . 12 ALA HB1 1 1 20 4475 1 1 12 ALA HB2 H 7.365 -0.215 0.018 1.00 . A A . 12 ALA HB2 1 1 20 4476 1 1 12 ALA HB3 H 8.409 1.113 0.524 1.00 . A A . 12 ALA HB3 1 1 20 4477 1 1 12 ALA N N 7.534 -1.427 2.102 1.00 . A A . 12 ALA N 1 1 20 4478 1 1 12 ALA O O 10.442 0.472 2.780 1.00 . A A . 12 ALA O 1 1 20 4479 1 1 13 LEU C C 9.449 2.966 3.923 1.00 . A A . 13 LEU C 1 1 20 4480 1 1 13 LEU CA C 8.703 1.770 4.503 1.00 . A A . 13 LEU CA 1 1 20 4481 1 1 13 LEU CB C 9.571 1.071 5.551 1.00 . A A . 13 LEU CB 1 1 20 4482 1 1 13 LEU CD1 C 9.650 0.517 7.994 1.00 . A A . 13 LEU CD1 1 1 20 4483 1 1 13 LEU CD2 C 10.548 2.705 7.182 1.00 . A A . 13 LEU CD2 1 1 20 4484 1 1 13 LEU CG C 9.491 1.630 6.972 1.00 . A A . 13 LEU CG 1 1 20 4485 1 1 13 LEU H H 7.378 0.620 3.321 1.00 . A A . 13 LEU H 1 1 20 4486 1 1 13 LEU HA H 7.797 2.121 4.976 1.00 . A A . 13 LEU HA 1 1 20 4487 1 1 13 LEU HB2 H 9.277 0.034 5.587 1.00 . A A . 13 LEU HB2 1 1 20 4488 1 1 13 LEU HB3 H 10.599 1.140 5.225 1.00 . A A . 13 LEU HB3 1 1 20 4489 1 1 13 LEU HD11 H 8.952 0.668 8.803 1.00 . A A . 13 LEU HD11 1 1 20 4490 1 1 13 LEU HD12 H 9.456 -0.435 7.522 1.00 . A A . 13 LEU HD12 1 1 20 4491 1 1 13 LEU HD13 H 10.658 0.526 8.382 1.00 . A A . 13 LEU HD13 1 1 20 4492 1 1 13 LEU HD21 H 10.679 2.879 8.240 1.00 . A A . 13 LEU HD21 1 1 20 4493 1 1 13 LEU HD22 H 11.483 2.380 6.751 1.00 . A A . 13 LEU HD22 1 1 20 4494 1 1 13 LEU HD23 H 10.230 3.621 6.705 1.00 . A A . 13 LEU HD23 1 1 20 4495 1 1 13 LEU HG H 8.520 2.082 7.119 1.00 . A A . 13 LEU HG 1 1 20 4496 1 1 13 LEU N N 8.325 0.831 3.453 1.00 . A A . 13 LEU N 1 1 20 4497 1 1 13 LEU O O 10.583 3.249 4.307 1.00 . A A . 13 LEU O 1 1 20 4498 1 1 14 NH2 HN1 H 7.902 3.391 2.729 1.00 . A A . 14 NH2 HN1 1 1 20 4499 1 1 14 NH2 HN2 H 9.217 4.467 2.561 1.00 . A A . 14 NH2 HN2 1 1 20 4500 1 1 14 NH2 N N 8.804 3.666 2.995 1.00 . A A . 14 NH2 N 1 1 stop_ save_
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