NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
628806 | 6cxr | 30449 | cing | 4-filtered-FRED | STAR | entry | full | 66 |
data_FRED_restraints_with_modified_coordinates_PDB_code_6cxr # This FRED archive file contains, for PDB entry <6cxr>: # # - 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_6cxr _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 6cxr _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 853.03 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 $Hexapeptide_HRFLRH A . 1 1 stop_ save_ save_Hexapeptide_HRFLRH _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Hexapeptide HRFLRH" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code HRFLRHX _Entity.Number_of_monomers 7 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 HIS . 1 1 2 ARG . 1 1 3 PHE . 1 1 4 LEU . 1 1 5 ARG . 1 1 6 HIS . 1 1 7 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 HIS 1 1 1 1 ARG 2 2 1 1 PHE 3 3 1 1 LEU 4 4 1 1 ARG 5 5 1 1 HIS 6 6 1 1 NH2 7 7 1 1 stop_ save_ save_NH2 _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID NH2 _Chem_comp.Type non-polymer save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 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 HIS HB2 . 1 . HB2 1 1 1 1 2 1 1 1 HIS HD2 . 1 . HD2 1 1 2 1 1 1 1 1 HIS HB3 . 1 . HB1 1 1 2 1 2 1 1 3 PHE H . 3 . HN 1 1 3 1 1 1 1 1 HIS HB3 . 1 . HB1 1 1 3 1 2 1 1 3 PHE HZ . 3 . HZ 1 1 4 1 1 1 1 2 ARG HA . 2 . HA 1 1 4 1 2 1 1 2 ARG QB . 2 . HB# 1 1 5 1 1 1 1 2 ARG HA . 2 . HA 1 1 5 1 2 1 1 2 ARG HD3 . 2 . HD1 1 1 6 1 1 1 1 2 ARG HA . 2 . HA 1 1 6 1 2 1 1 2 ARG HG2 . 2 . HG2 1 1 7 1 1 1 1 2 ARG HA . 2 . HA 1 1 7 1 2 1 1 3 PHE H . 3 . HN 1 1 8 1 1 1 1 2 ARG QB . 2 . HB# 1 1 8 1 2 1 1 2 ARG QD . 2 . HD# 1 1 9 1 1 1 1 2 ARG QB . 2 . HB# 1 1 9 1 2 1 1 2 ARG HE . 2 . HE 1 1 10 1 1 1 1 2 ARG QB . 2 . HB# 1 1 10 1 2 1 1 3 PHE H . 3 . HN 1 1 11 1 1 1 1 2 ARG QB . 2 . HB# 1 1 11 1 2 1 1 4 LEU H . 4 . HN 1 1 12 1 1 1 1 2 ARG QD . 2 . HD# 1 1 12 1 2 1 1 2 ARG HG2 . 2 . HG2 1 1 13 1 1 1 1 2 ARG QD . 2 . HD# 1 1 13 1 2 1 1 2 ARG HG3 . 2 . HG1 1 1 14 1 1 1 1 2 ARG HG3 . 2 . HG1 1 1 14 1 2 1 1 4 LEU MD1 . 4 . HD1# 1 1 15 1 1 1 1 3 PHE H . 3 . HN 1 1 15 1 2 1 1 3 PHE HB2 . 3 . HB2 1 1 16 1 1 1 1 3 PHE H . 3 . HN 1 1 16 1 2 1 1 3 PHE HB3 . 3 . HB1 1 1 17 1 1 1 1 3 PHE H . 3 . HN 1 1 17 1 2 1 1 3 PHE QD . 3 . HD# 1 1 18 1 1 1 1 3 PHE HA . 3 . HA 1 1 18 1 2 1 1 3 PHE HB2 . 3 . HB2 1 1 19 1 1 1 1 3 PHE HA . 3 . HA 1 1 19 1 2 1 1 3 PHE HB3 . 3 . HB1 1 1 20 1 1 1 1 3 PHE HA . 3 . HA 1 1 20 1 2 1 1 4 LEU H . 4 . HN 1 1 21 1 1 1 1 3 PHE HB2 . 3 . HB2 1 1 21 1 2 1 1 3 PHE QD . 3 . HD# 1 1 22 1 1 1 1 3 PHE HB2 . 3 . HB2 1 1 22 1 2 1 1 4 LEU H . 4 . HN 1 1 23 1 1 1 1 3 PHE HB3 . 3 . HB1 1 1 23 1 2 1 1 3 PHE QD . 3 . HD# 1 1 24 1 1 1 1 3 PHE HB3 . 3 . HB1 1 1 24 1 2 1 1 4 LEU H . 4 . HN 1 1 25 1 1 1 1 4 LEU H . 4 . HN 1 1 25 1 2 1 1 4 LEU HA . 4 . HA 1 1 26 1 1 1 1 4 LEU H . 4 . HN 1 1 26 1 2 1 1 4 LEU QB . 4 . HB# 1 1 27 1 1 1 1 4 LEU H . 4 . HN 1 1 27 1 2 1 1 4 LEU MD1 . 4 . HD1# 1 1 28 1 1 1 1 4 LEU H . 4 . HN 1 1 28 1 2 1 1 4 LEU MD2 . 4 . HD2# 1 1 29 1 1 1 1 4 LEU H . 4 . HN 1 1 29 1 2 1 1 4 LEU HG . 4 . HG 1 1 30 1 1 1 1 4 LEU H . 4 . HN 1 1 30 1 2 1 1 5 ARG QD . 5 . HD# 1 1 31 1 1 1 1 4 LEU HA . 4 . HA 1 1 31 1 2 1 1 4 LEU QB . 4 . HB# 1 1 32 1 1 1 1 4 LEU HA . 4 . HA 1 1 32 1 2 1 1 4 LEU MD1 . 4 . HD1# 1 1 33 1 1 1 1 4 LEU HA . 4 . HA 1 1 33 1 2 1 1 4 LEU HG . 4 . HG 1 1 34 1 1 1 1 4 LEU HA . 4 . HA 1 1 34 1 2 1 1 5 ARG H . 5 . HN 1 1 35 1 1 1 1 4 LEU HA . 4 . HA 1 1 35 1 2 1 1 5 ARG HA . 5 . HA 1 1 36 1 1 1 1 4 LEU HA . 4 . HA 1 1 36 1 2 1 1 5 ARG HD2 . 5 . HD2 1 1 37 1 1 1 1 4 LEU HA . 4 . HA 1 1 37 1 2 1 1 6 HIS HB3 . 6 . HB1 1 1 38 1 1 1 1 4 LEU QB . 4 . HB# 1 1 38 1 2 1 1 4 LEU MD1 . 4 . HD1# 1 1 39 1 1 1 1 4 LEU QB . 4 . HB# 1 1 39 1 2 1 1 4 LEU MD2 . 4 . HD2# 1 1 40 1 1 1 1 4 LEU QB . 4 . HB# 1 1 40 1 2 1 1 5 ARG H . 5 . HN 1 1 41 1 1 1 1 4 LEU QB . 4 . HB# 1 1 41 1 2 1 1 5 ARG HD2 . 5 . HD2 1 1 42 1 1 1 1 4 LEU QB . 4 . HB# 1 1 42 1 2 1 1 6 HIS HB3 . 6 . HB1 1 1 43 1 1 1 1 4 LEU HB2 . 4 . HB2 1 1 43 1 2 1 1 6 HIS HB2 . 6 . HB2 1 1 44 1 1 1 1 5 ARG H . 5 . HN 1 1 44 1 2 1 1 5 ARG HA . 5 . HA 1 1 45 1 1 1 1 5 ARG H . 5 . HN 1 1 45 1 2 1 1 5 ARG HB2 . 5 . HB2 1 1 46 1 1 1 1 5 ARG H . 5 . HN 1 1 46 1 2 1 1 5 ARG HB3 . 5 . HB1 1 1 47 1 1 1 1 5 ARG H . 5 . HN 1 1 47 1 2 1 1 5 ARG HG2 . 5 . HG2 1 1 48 1 1 1 1 5 ARG H . 5 . HN 1 1 48 1 2 1 1 5 ARG HG3 . 5 . HG1 1 1 49 1 1 1 1 5 ARG H . 5 . HN 1 1 49 1 2 1 1 6 HIS H . 6 . HN 1 1 50 1 1 1 1 5 ARG HA . 5 . HA 1 1 50 1 2 1 1 5 ARG HB3 . 5 . HB1 1 1 51 1 1 1 1 5 ARG HA . 5 . HA 1 1 51 1 2 1 1 5 ARG QD . 5 . HD# 1 1 52 1 1 1 1 5 ARG HA . 5 . HA 1 1 52 1 2 1 1 5 ARG HG2 . 5 . HG2 1 1 53 1 1 1 1 5 ARG HA . 5 . HA 1 1 53 1 2 1 1 5 ARG HG3 . 5 . HG1 1 1 54 1 1 1 1 5 ARG HA . 5 . HA 1 1 54 1 2 1 1 6 HIS H . 6 . HN 1 1 55 1 1 1 1 5 ARG HA . 5 . HA 1 1 55 1 2 1 1 6 HIS HB3 . 6 . HB1 1 1 56 1 1 1 1 5 ARG HB2 . 5 . HB2 1 1 56 1 2 1 1 5 ARG QD . 5 . HD# 1 1 57 1 1 1 1 5 ARG HB2 . 5 . HB2 1 1 57 1 2 1 1 5 ARG HE . 5 . HE 1 1 58 1 1 1 1 5 ARG HB2 . 5 . HB2 1 1 58 1 2 1 1 5 ARG HG3 . 5 . HG1 1 1 59 1 1 1 1 5 ARG HB2 . 5 . HB2 1 1 59 1 2 1 1 6 HIS H . 6 . HN 1 1 60 1 1 1 1 5 ARG HB3 . 5 . HB1 1 1 60 1 2 1 1 5 ARG HE . 5 . HE 1 1 61 1 1 1 1 5 ARG HB3 . 5 . HB1 1 1 61 1 2 1 1 6 HIS H . 6 . HN 1 1 62 1 1 1 1 5 ARG QD . 5 . HD# 1 1 62 1 2 1 1 5 ARG HE . 5 . HE 1 1 63 1 1 1 1 5 ARG QD . 5 . HD# 1 1 63 1 2 1 1 5 ARG HG3 . 5 . HG1 1 1 64 1 1 1 1 6 HIS H . 6 . HN 1 1 64 1 2 1 1 6 HIS HB3 . 6 . HB1 1 1 65 1 1 1 1 6 HIS HA . 6 . HA 1 1 65 1 2 1 1 6 HIS HD2 . 6 . HD2 1 1 66 1 1 1 1 6 HIS HB3 . 6 . HB1 1 1 66 1 2 1 1 6 HIS HD2 . 6 . HD2 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 2.8 1.8 2.8 1 1 2 1 . . . . . 5.0 1.8 5.0 1 1 3 1 . . . . . 5.0 1.8 5.0 1 1 4 1 . . . . . 2.8 1.8 2.8 1 1 5 1 . . . . . 5.0 1.8 5.0 1 1 6 1 . . . . . 3.4 1.8 3.4 1 1 7 1 . . . . . 2.8 1.8 2.8 1 1 8 1 . . . . . 2.8 1.8 2.8 1 1 9 1 . . . . . 5.0 1.8 5.0 1 1 10 1 . . . . . 5.0 1.8 5.0 1 1 11 1 . . . . . 5.0 1.8 5.0 1 1 12 1 . . . . . 2.8 1.8 2.8 1 1 13 1 . . . . . 2.8 1.8 2.8 1 1 14 1 . . . . . 2.8 1.8 2.8 1 1 15 1 . . . . . 3.4 1.8 3.4 1 1 16 1 . . . . . 2.8 1.8 2.8 1 1 17 1 . . . . . 5.0 1.8 5.0 1 1 18 1 . . . . . 2.8 1.8 2.8 1 1 19 1 . . . . . 2.8 1.8 2.8 1 1 20 1 . . . . . 2.8 1.8 2.8 1 1 21 1 . . . . . 2.8 1.8 2.8 1 1 22 1 . . . . . 5.0 1.8 5.0 1 1 23 1 . . . . . 2.8 1.8 2.8 1 1 24 1 . . . . . 5.0 1.8 5.0 1 1 25 1 . . . . . 2.8 1.8 2.8 1 1 26 1 . . . . . 3.4 1.8 3.4 1 1 27 1 . . . . . 5.0 1.8 5.0 1 1 28 1 . . . . . 5.0 1.8 5.0 1 1 29 1 . . . . . 2.8 1.8 2.8 1 1 30 1 . . . . . 5.0 1.8 5.0 1 1 31 1 . . . . . 2.8 1.8 2.8 1 1 32 1 . . . . . . 1.8 3.4 1 1 33 1 . . . . . 3.4 1.8 3.4 1 1 34 1 . . . . . 2.8 1.8 2.8 1 1 35 1 . . . . . 5.0 1.8 5.0 1 1 36 1 . . . . . 5.0 1.8 5.0 1 1 37 1 . . . . . 5.0 1.8 5.0 1 1 38 1 . . . . . 2.8 1.8 2.8 1 1 39 1 . . . . . 2.8 1.8 2.8 1 1 40 1 . . . . . 5.0 1.8 5.0 1 1 41 1 . . . . . 5.0 1.8 5.0 1 1 42 1 . . . . . 2.8 1.8 2.8 1 1 43 1 . . . . . 5.0 1.8 5.0 1 1 44 1 . . . . . 2.8 1.8 2.8 1 1 45 1 . . . . . 3.4 1.8 3.4 1 1 46 1 . . . . . 3.4 1.8 3.4 1 1 47 1 . . . . . 5.0 1.8 5.0 1 1 48 1 . . . . . 5.0 1.8 5.0 1 1 49 1 . . . . . 5.0 1.8 5.0 1 1 50 1 . . . . . 2.8 1.8 2.8 1 1 51 1 . . . . . 2.8 1.8 2.8 1 1 52 1 . . . . . 3.4 1.8 3.4 1 1 53 1 . . . . . 3.4 1.8 3.4 1 1 54 1 . . . . . 2.8 1.8 2.8 1 1 55 1 . . . . . 5.0 1.8 5.0 1 1 56 1 . . . . . . 1.8 2.8 1 1 57 1 . . . . . 5.0 1.8 5.0 1 1 58 1 . . . . . . 1.8 2.8 1 1 59 1 . . . . . 5.0 1.8 5.0 1 1 60 1 . . . . . 5.0 1.8 5.0 1 1 61 1 . . . . . 5.0 1.8 5.0 1 1 62 1 . . . . . 2.8 1.8 2.8 1 1 63 1 . . . . . 2.8 1.8 2.8 1 1 64 1 . . . . . 3.4 1.8 3.4 1 1 65 1 . . . . . 3.4 1.8 3.4 1 1 66 1 . . . . . 3.4 1.8 3.4 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 HIS C C 5.414 1.266 -3.017 1.00 . A A . 1 HIS C 1 1 1 2 1 1 1 HIS CA C 5.550 2.003 -4.345 1.00 . A A . 1 HIS CA 1 1 1 3 1 1 1 HIS CB C 4.726 1.301 -5.426 1.00 . A A . 1 HIS CB 1 1 1 4 1 1 1 HIS CD2 C 4.126 2.012 -7.847 1.00 . A A . 1 HIS CD2 1 1 1 5 1 1 1 HIS CE1 C 3.525 4.079 -7.434 1.00 . A A . 1 HIS CE1 1 1 1 6 1 1 1 HIS CG C 4.264 2.217 -6.516 1.00 . A A . 1 HIS CG 1 1 1 7 1 1 1 HIS H1 H 7.375 1.107 -4.657 1.00 . A A . 1 HIS H1 1 1 1 8 1 1 1 HIS H2 H 7.458 2.759 -4.201 1.00 . A A . 1 HIS H2 1 1 1 9 1 1 1 HIS H3 H 6.977 2.329 -5.791 1.00 . A A . 1 HIS H3 1 1 1 10 1 1 1 HIS HA H 5.191 3.014 -4.225 1.00 . A A . 1 HIS HA 1 1 1 11 1 1 1 HIS HB2 H 5.325 0.524 -5.877 1.00 . A A . 1 HIS HB2 1 1 1 12 1 1 1 HIS HB3 H 3.853 0.856 -4.971 1.00 . A A . 1 HIS HB3 1 1 1 13 1 1 1 HIS HD1 H 3.868 3.973 -5.420 1.00 . A A . 1 HIS HD1 1 1 1 14 1 1 1 HIS HD2 H 4.339 1.096 -8.380 1.00 . A A . 1 HIS HD2 1 1 1 15 1 1 1 HIS HE1 H 3.179 5.094 -7.562 1.00 . A A . 1 HIS HE1 1 1 1 16 1 1 1 HIS HE2 H 3.556 3.361 -9.352 1.00 . A A . 1 HIS HE2 1 1 1 17 1 1 1 HIS N N 6.968 2.054 -4.789 1.00 . A A . 1 HIS N 1 1 1 18 1 1 1 HIS ND1 N 3.880 3.522 -6.290 1.00 . A A . 1 HIS ND1 1 1 1 19 1 1 1 HIS NE2 N 3.666 3.184 -8.394 1.00 . A A . 1 HIS NE2 1 1 1 20 1 1 1 HIS O O 6.234 0.410 -2.684 1.00 . A A . 1 HIS O 1 1 1 21 1 1 2 ARG C C 2.759 1.360 -0.424 1.00 . A A . 2 ARG C 1 1 1 22 1 1 2 ARG CA C 4.131 0.973 -0.969 1.00 . A A . 2 ARG CA 1 1 1 23 1 1 2 ARG CB C 5.221 1.372 0.028 1.00 . A A . 2 ARG CB 1 1 1 24 1 1 2 ARG CD C 6.505 0.483 1.996 1.00 . A A . 2 ARG CD 1 1 1 25 1 1 2 ARG CG C 5.136 0.628 1.351 1.00 . A A . 2 ARG CG 1 1 1 26 1 1 2 ARG CZ C 6.603 2.292 3.667 1.00 . A A . 2 ARG CZ 1 1 1 27 1 1 2 ARG H H 3.755 2.293 -2.581 1.00 . A A . 2 ARG H 1 1 1 28 1 1 2 ARG HA H 4.160 -0.096 -1.112 1.00 . A A . 2 ARG HA 1 1 1 29 1 1 2 ARG HB2 H 6.186 1.170 -0.412 1.00 . A A . 2 ARG HB2 1 1 1 30 1 1 2 ARG HB3 H 5.140 2.430 0.228 1.00 . A A . 2 ARG HB3 1 1 1 31 1 1 2 ARG HD2 H 6.432 -0.224 2.809 1.00 . A A . 2 ARG HD2 1 1 1 32 1 1 2 ARG HD3 H 7.199 0.111 1.257 1.00 . A A . 2 ARG HD3 1 1 1 33 1 1 2 ARG HE H 7.669 2.233 1.980 1.00 . A A . 2 ARG HE 1 1 1 34 1 1 2 ARG HG2 H 4.490 1.180 2.022 1.00 . A A . 2 ARG HG2 1 1 1 35 1 1 2 ARG HG3 H 4.724 -0.358 1.172 1.00 . A A . 2 ARG HG3 1 1 1 36 1 1 2 ARG HH11 H 5.318 0.798 4.123 1.00 . A A . 2 ARG HH11 1 1 1 37 1 1 2 ARG HH12 H 5.406 2.081 5.282 1.00 . A A . 2 ARG HH12 1 1 1 38 1 1 2 ARG HH21 H 7.786 3.922 3.504 1.00 . A A . 2 ARG HH21 1 1 1 39 1 1 2 ARG HH22 H 6.806 3.855 4.931 1.00 . A A . 2 ARG HH22 1 1 1 40 1 1 2 ARG N N 4.374 1.604 -2.262 1.00 . A A . 2 ARG N 1 1 1 41 1 1 2 ARG NE N 7.002 1.754 2.516 1.00 . A A . 2 ARG NE 1 1 1 42 1 1 2 ARG NH1 N 5.701 1.672 4.419 1.00 . A A . 2 ARG NH1 1 1 1 43 1 1 2 ARG NH2 N 7.106 3.451 4.066 1.00 . A A . 2 ARG NH2 1 1 1 44 1 1 2 ARG O O 2.604 1.617 0.769 1.00 . A A . 2 ARG O 1 1 1 45 1 1 3 PHE C C -0.332 0.559 -0.359 1.00 . A A . 3 PHE C 1 1 1 46 1 1 3 PHE CA C 0.418 1.762 -0.928 1.00 . A A . 3 PHE CA 1 1 1 47 1 1 3 PHE CB C -0.320 2.326 -2.142 1.00 . A A . 3 PHE CB 1 1 1 48 1 1 3 PHE CD1 C -0.982 0.481 -3.719 1.00 . A A . 3 PHE CD1 1 1 1 49 1 1 3 PHE CD2 C 0.890 1.843 -4.291 1.00 . A A . 3 PHE CD2 1 1 1 50 1 1 3 PHE CE1 C -0.814 -0.244 -4.883 1.00 . A A . 3 PHE CE1 1 1 1 51 1 1 3 PHE CE2 C 1.063 1.120 -5.456 1.00 . A A . 3 PHE CE2 1 1 1 52 1 1 3 PHE CG C -0.133 1.532 -3.408 1.00 . A A . 3 PHE CG 1 1 1 53 1 1 3 PHE CZ C 0.210 0.075 -5.753 1.00 . A A . 3 PHE CZ 1 1 1 54 1 1 3 PHE H H 1.949 1.200 -2.242 1.00 . A A . 3 PHE H 1 1 1 55 1 1 3 PHE HA H 0.478 2.527 -0.169 1.00 . A A . 3 PHE HA 1 1 1 56 1 1 3 PHE HB2 H -1.372 2.351 -1.926 1.00 . A A . 3 PHE HB2 1 1 1 57 1 1 3 PHE HB3 H 0.039 3.330 -2.328 1.00 . A A . 3 PHE HB3 1 1 1 58 1 1 3 PHE HD1 H -1.784 0.230 -3.041 1.00 . A A . 3 PHE HD1 1 1 1 59 1 1 3 PHE HD2 H 1.558 2.659 -4.061 1.00 . A A . 3 PHE HD2 1 1 1 60 1 1 3 PHE HE1 H -1.483 -1.061 -5.112 1.00 . A A . 3 PHE HE1 1 1 1 61 1 1 3 PHE HE2 H 1.865 1.372 -6.135 1.00 . A A . 3 PHE HE2 1 1 1 62 1 1 3 PHE HZ H 0.343 -0.490 -6.663 1.00 . A A . 3 PHE HZ 1 1 1 63 1 1 3 PHE N N 1.768 1.404 -1.308 1.00 . A A . 3 PHE N 1 1 1 64 1 1 3 PHE O O -0.964 -0.198 -1.093 1.00 . A A . 3 PHE O 1 1 1 65 1 1 4 LEU C C -2.419 -0.511 1.694 1.00 . A A . 4 LEU C 1 1 1 66 1 1 4 LEU CA C -0.920 -0.722 1.624 1.00 . A A . 4 LEU CA 1 1 1 67 1 1 4 LEU CB C -0.395 -0.902 3.044 1.00 . A A . 4 LEU CB 1 1 1 68 1 1 4 LEU CD1 C 1.748 0.337 3.385 1.00 . A A . 4 LEU CD1 1 1 1 69 1 1 4 LEU CD2 C 1.498 -1.988 4.276 1.00 . A A . 4 LEU CD2 1 1 1 70 1 1 4 LEU CG C 1.122 -1.027 3.158 1.00 . A A . 4 LEU CG 1 1 1 71 1 1 4 LEU H H 0.268 1.016 1.490 1.00 . A A . 4 LEU H 1 1 1 72 1 1 4 LEU HA H -0.714 -1.613 1.065 1.00 . A A . 4 LEU HA 1 1 1 73 1 1 4 LEU HB2 H -0.719 -0.055 3.633 1.00 . A A . 4 LEU HB2 1 1 1 74 1 1 4 LEU HB3 H -0.845 -1.793 3.458 1.00 . A A . 4 LEU HB3 1 1 1 75 1 1 4 LEU HD11 H 2.147 0.390 4.387 1.00 . A A . 4 LEU HD11 1 1 1 76 1 1 4 LEU HD12 H 0.998 1.102 3.255 1.00 . A A . 4 LEU HD12 1 1 1 77 1 1 4 LEU HD13 H 2.544 0.488 2.672 1.00 . A A . 4 LEU HD13 1 1 1 78 1 1 4 LEU HD21 H 1.227 -2.994 3.992 1.00 . A A . 4 LEU HD21 1 1 1 79 1 1 4 LEU HD22 H 0.970 -1.715 5.178 1.00 . A A . 4 LEU HD22 1 1 1 80 1 1 4 LEU HD23 H 2.562 -1.937 4.452 1.00 . A A . 4 LEU HD23 1 1 1 81 1 1 4 LEU HG H 1.512 -1.419 2.231 1.00 . A A . 4 LEU HG 1 1 1 82 1 1 4 LEU N N -0.253 0.387 0.957 1.00 . A A . 4 LEU N 1 1 1 83 1 1 4 LEU O O -2.889 0.408 2.364 1.00 . A A . 4 LEU O 1 1 1 84 1 1 5 ARG C C -5.048 -1.575 2.519 1.00 . A A . 5 ARG C 1 1 1 85 1 1 5 ARG CA C -4.612 -1.285 1.096 1.00 . A A . 5 ARG CA 1 1 1 86 1 1 5 ARG CB C -5.228 -2.264 0.119 1.00 . A A . 5 ARG CB 1 1 1 87 1 1 5 ARG CD C -4.174 -1.623 -2.040 1.00 . A A . 5 ARG CD 1 1 1 88 1 1 5 ARG CG C -5.455 -1.647 -1.228 1.00 . A A . 5 ARG CG 1 1 1 89 1 1 5 ARG CZ C -4.226 0.475 -3.331 1.00 . A A . 5 ARG CZ 1 1 1 90 1 1 5 ARG H H -2.764 -2.117 0.548 1.00 . A A . 5 ARG H 1 1 1 91 1 1 5 ARG HA H -4.899 -0.284 0.821 1.00 . A A . 5 ARG HA 1 1 1 92 1 1 5 ARG HB2 H -4.564 -3.099 -0.006 1.00 . A A . 5 ARG HB2 1 1 1 93 1 1 5 ARG HB3 H -6.171 -2.606 0.504 1.00 . A A . 5 ARG HB3 1 1 1 94 1 1 5 ARG HD2 H -3.388 -1.182 -1.437 1.00 . A A . 5 ARG HD2 1 1 1 95 1 1 5 ARG HD3 H -3.905 -2.638 -2.294 1.00 . A A . 5 ARG HD3 1 1 1 96 1 1 5 ARG HE H -4.520 -1.347 -4.089 1.00 . A A . 5 ARG HE 1 1 1 97 1 1 5 ARG HG2 H -6.201 -2.209 -1.751 1.00 . A A . 5 ARG HG2 1 1 1 98 1 1 5 ARG HG3 H -5.793 -0.642 -1.085 1.00 . A A . 5 ARG HG3 1 1 1 99 1 1 5 ARG HH11 H -3.852 0.721 -1.358 1.00 . A A . 5 ARG HH11 1 1 1 100 1 1 5 ARG HH12 H -3.895 2.178 -2.293 1.00 . A A . 5 ARG HH12 1 1 1 101 1 1 5 ARG HH21 H -4.578 0.569 -5.319 1.00 . A A . 5 ARG HH21 1 1 1 102 1 1 5 ARG HH22 H -4.308 2.093 -4.540 1.00 . A A . 5 ARG HH22 1 1 1 103 1 1 5 ARG N N -3.176 -1.383 1.042 1.00 . A A . 5 ARG N 1 1 1 104 1 1 5 ARG NE N -4.327 -0.851 -3.268 1.00 . A A . 5 ARG NE 1 1 1 105 1 1 5 ARG NH1 N -3.970 1.182 -2.237 1.00 . A A . 5 ARG NH1 1 1 1 106 1 1 5 ARG NH2 N -4.384 1.097 -4.492 1.00 . A A . 5 ARG NH2 1 1 1 107 1 1 5 ARG O O -5.202 -2.731 2.913 1.00 . A A . 5 ARG O 1 1 1 108 1 1 6 HIS C C -5.751 0.719 5.336 1.00 . A A . 6 HIS C 1 1 1 109 1 1 6 HIS CA C -5.549 -0.653 4.702 1.00 . A A . 6 HIS CA 1 1 1 110 1 1 6 HIS CB C -4.433 -1.429 5.420 1.00 . A A . 6 HIS CB 1 1 1 111 1 1 6 HIS CD2 C -5.070 -0.657 7.826 1.00 . A A . 6 HIS CD2 1 1 1 112 1 1 6 HIS CE1 C -4.520 -2.489 8.897 1.00 . A A . 6 HIS CE1 1 1 1 113 1 1 6 HIS CG C -4.602 -1.539 6.908 1.00 . A A . 6 HIS CG 1 1 1 114 1 1 6 HIS H H -5.016 0.376 2.937 1.00 . A A . 6 HIS H 1 1 1 115 1 1 6 HIS HA H -6.469 -1.212 4.767 1.00 . A A . 6 HIS HA 1 1 1 116 1 1 6 HIS HB2 H -4.406 -2.437 5.023 1.00 . A A . 6 HIS HB2 1 1 1 117 1 1 6 HIS HB3 H -3.475 -0.944 5.220 1.00 . A A . 6 HIS HB3 1 1 1 118 1 1 6 HIS HD1 H -3.898 -3.499 7.231 1.00 . A A . 6 HIS HD1 1 1 1 119 1 1 6 HIS HD2 H -5.427 0.343 7.631 1.00 . A A . 6 HIS HD2 1 1 1 120 1 1 6 HIS HE1 H -4.356 -3.208 9.685 1.00 . A A . 6 HIS HE1 1 1 1 121 1 1 6 HIS HE2 H -5.355 -0.906 9.891 1.00 . A A . 6 HIS HE2 1 1 1 122 1 1 6 HIS N N -5.192 -0.517 3.302 1.00 . A A . 6 HIS N 1 1 1 123 1 1 6 HIS ND1 N -4.267 -2.676 7.614 1.00 . A A . 6 HIS ND1 1 1 1 124 1 1 6 HIS NE2 N -5.007 -1.273 9.052 1.00 . A A . 6 HIS NE2 1 1 1 125 1 1 6 HIS O O -4.804 1.532 5.301 1.00 . A A . 6 HIS O 1 1 2 126 1 1 1 HIS C C 5.073 1.109 -3.212 1.00 . A A . 1 HIS C 1 1 2 127 1 1 1 HIS CA C 5.357 2.036 -4.390 1.00 . A A . 1 HIS CA 1 1 2 128 1 1 1 HIS CB C 4.571 1.581 -5.621 1.00 . A A . 1 HIS CB 1 1 2 129 1 1 1 HIS CD2 C 4.298 2.945 -7.812 1.00 . A A . 1 HIS CD2 1 1 2 130 1 1 1 HIS CE1 C 3.117 4.608 -7.008 1.00 . A A . 1 HIS CE1 1 1 2 131 1 1 1 HIS CG C 4.114 2.712 -6.490 1.00 . A A . 1 HIS CG 1 1 2 132 1 1 1 HIS H1 H 7.111 1.059 -4.837 1.00 . A A . 1 HIS H1 1 1 2 133 1 1 1 HIS H2 H 7.308 2.514 -3.948 1.00 . A A . 1 HIS H2 1 1 2 134 1 1 1 HIS H3 H 6.918 2.572 -5.618 1.00 . A A . 1 HIS H3 1 1 2 135 1 1 1 HIS HA H 5.058 3.040 -4.128 1.00 . A A . 1 HIS HA 1 1 2 136 1 1 1 HIS HB2 H 5.196 0.935 -6.220 1.00 . A A . 1 HIS HB2 1 1 2 137 1 1 1 HIS HB3 H 3.698 1.033 -5.300 1.00 . A A . 1 HIS HB3 1 1 2 138 1 1 1 HIS HD1 H 3.073 3.895 -5.091 1.00 . A A . 1 HIS HD1 1 1 2 139 1 1 1 HIS HD2 H 4.839 2.316 -8.504 1.00 . A A . 1 HIS HD2 1 1 2 140 1 1 1 HIS HE1 H 2.555 5.527 -6.932 1.00 . A A . 1 HIS HE1 1 1 2 141 1 1 1 HIS HE2 H 3.707 4.594 -8.969 1.00 . A A . 1 HIS HE2 1 1 2 142 1 1 1 HIS N N 6.804 2.046 -4.729 1.00 . A A . 1 HIS N 1 1 2 143 1 1 1 HIS ND1 N 3.371 3.773 -6.016 1.00 . A A . 1 HIS ND1 1 1 2 144 1 1 1 HIS NE2 N 3.669 4.129 -8.107 1.00 . A A . 1 HIS NE2 1 1 2 145 1 1 1 HIS O O 5.363 -0.086 -3.266 1.00 . A A . 1 HIS O 1 1 2 146 1 1 2 ARG C C 2.829 1.313 -0.386 1.00 . A A . 2 ARG C 1 1 2 147 1 1 2 ARG CA C 4.180 0.893 -0.958 1.00 . A A . 2 ARG CA 1 1 2 148 1 1 2 ARG CB C 5.273 1.065 0.099 1.00 . A A . 2 ARG CB 1 1 2 149 1 1 2 ARG CD C 6.360 -0.086 2.052 1.00 . A A . 2 ARG CD 1 1 2 150 1 1 2 ARG CG C 5.049 0.227 1.347 1.00 . A A . 2 ARG CG 1 1 2 151 1 1 2 ARG CZ C 6.184 -2.462 2.684 1.00 . A A . 2 ARG CZ 1 1 2 152 1 1 2 ARG H H 4.297 2.626 -2.167 1.00 . A A . 2 ARG H 1 1 2 153 1 1 2 ARG HA H 4.128 -0.147 -1.243 1.00 . A A . 2 ARG HA 1 1 2 154 1 1 2 ARG HB2 H 6.222 0.783 -0.333 1.00 . A A . 2 ARG HB2 1 1 2 155 1 1 2 ARG HB3 H 5.315 2.104 0.392 1.00 . A A . 2 ARG HB3 1 1 2 156 1 1 2 ARG HD2 H 7.144 0.511 1.612 1.00 . A A . 2 ARG HD2 1 1 2 157 1 1 2 ARG HD3 H 6.260 0.167 3.097 1.00 . A A . 2 ARG HD3 1 1 2 158 1 1 2 ARG HE H 7.395 -1.740 1.272 1.00 . A A . 2 ARG HE 1 1 2 159 1 1 2 ARG HG2 H 4.409 0.775 2.026 1.00 . A A . 2 ARG HG2 1 1 2 160 1 1 2 ARG HG3 H 4.571 -0.704 1.062 1.00 . A A . 2 ARG HG3 1 1 2 161 1 1 2 ARG HH11 H 4.971 -1.225 3.729 1.00 . A A . 2 ARG HH11 1 1 2 162 1 1 2 ARG HH12 H 4.866 -2.900 4.154 1.00 . A A . 2 ARG HH12 1 1 2 163 1 1 2 ARG HH21 H 7.259 -3.944 1.829 1.00 . A A . 2 ARG HH21 1 1 2 164 1 1 2 ARG HH22 H 6.165 -4.444 3.076 1.00 . A A . 2 ARG HH22 1 1 2 165 1 1 2 ARG N N 4.504 1.669 -2.150 1.00 . A A . 2 ARG N 1 1 2 166 1 1 2 ARG NE N 6.719 -1.498 1.939 1.00 . A A . 2 ARG NE 1 1 2 167 1 1 2 ARG NH1 N 5.265 -2.171 3.597 1.00 . A A . 2 ARG NH1 1 1 2 168 1 1 2 ARG NH2 N 6.567 -3.720 2.516 1.00 . A A . 2 ARG NH2 1 1 2 169 1 1 2 ARG O O 2.700 1.567 0.811 1.00 . A A . 2 ARG O 1 1 2 170 1 1 3 PHE C C -0.279 0.596 -0.271 1.00 . A A . 3 PHE C 1 1 2 171 1 1 3 PHE CA C 0.492 1.782 -0.847 1.00 . A A . 3 PHE CA 1 1 2 172 1 1 3 PHE CB C -0.252 2.372 -2.045 1.00 . A A . 3 PHE CB 1 1 2 173 1 1 3 PHE CD1 C 0.905 1.852 -4.214 1.00 . A A . 3 PHE CD1 1 1 2 174 1 1 3 PHE CD2 C -1.008 0.560 -3.617 1.00 . A A . 3 PHE CD2 1 1 2 175 1 1 3 PHE CE1 C 1.032 1.128 -5.385 1.00 . A A . 3 PHE CE1 1 1 2 176 1 1 3 PHE CE2 C -0.885 -0.167 -4.785 1.00 . A A . 3 PHE CE2 1 1 2 177 1 1 3 PHE CG C -0.115 1.577 -3.316 1.00 . A A . 3 PHE CG 1 1 2 178 1 1 3 PHE CZ C 0.136 0.117 -5.670 1.00 . A A . 3 PHE CZ 1 1 2 179 1 1 3 PHE H H 1.984 1.186 -2.191 1.00 . A A . 3 PHE H 1 1 2 180 1 1 3 PHE HA H 0.586 2.540 -0.085 1.00 . A A . 3 PHE HA 1 1 2 181 1 1 3 PHE HB2 H -1.298 2.429 -1.808 1.00 . A A . 3 PHE HB2 1 1 2 182 1 1 3 PHE HB3 H 0.133 3.366 -2.235 1.00 . A A . 3 PHE HB3 1 1 2 183 1 1 3 PHE HD1 H 1.608 2.642 -3.991 1.00 . A A . 3 PHE HD1 1 1 2 184 1 1 3 PHE HD2 H -1.808 0.337 -2.928 1.00 . A A . 3 PHE HD2 1 1 2 185 1 1 3 PHE HE1 H 1.831 1.354 -6.075 1.00 . A A . 3 PHE HE1 1 1 2 186 1 1 3 PHE HE2 H -1.588 -0.957 -5.007 1.00 . A A . 3 PHE HE2 1 1 2 187 1 1 3 PHE HZ H 0.234 -0.450 -6.584 1.00 . A A . 3 PHE HZ 1 1 2 188 1 1 3 PHE N N 1.825 1.390 -1.253 1.00 . A A . 3 PHE N 1 1 2 189 1 1 3 PHE O O -0.945 -0.140 -0.998 1.00 . A A . 3 PHE O 1 1 2 190 1 1 4 LEU C C -2.360 -0.480 1.733 1.00 . A A . 4 LEU C 1 1 2 191 1 1 4 LEU CA C -0.858 -0.679 1.718 1.00 . A A . 4 LEU CA 1 1 2 192 1 1 4 LEU CB C -0.376 -0.805 3.159 1.00 . A A . 4 LEU CB 1 1 2 193 1 1 4 LEU CD1 C 1.809 0.363 3.501 1.00 . A A . 4 LEU CD1 1 1 2 194 1 1 4 LEU CD2 C 1.444 -1.912 4.480 1.00 . A A . 4 LEU CD2 1 1 2 195 1 1 4 LEU CG C 1.132 -0.984 3.316 1.00 . A A . 4 LEU CG 1 1 2 196 1 1 4 LEU H H 0.373 1.028 1.567 1.00 . A A . 4 LEU H 1 1 2 197 1 1 4 LEU HA H -0.625 -1.588 1.194 1.00 . A A . 4 LEU HA 1 1 2 198 1 1 4 LEU HB2 H -0.675 0.086 3.693 1.00 . A A . 4 LEU HB2 1 1 2 199 1 1 4 LEU HB3 H -0.872 -1.653 3.610 1.00 . A A . 4 LEU HB3 1 1 2 200 1 1 4 LEU HD11 H 2.247 0.416 4.486 1.00 . A A . 4 LEU HD11 1 1 2 201 1 1 4 LEU HD12 H 1.078 1.150 3.388 1.00 . A A . 4 LEU HD12 1 1 2 202 1 1 4 LEU HD13 H 2.580 0.480 2.756 1.00 . A A . 4 LEU HD13 1 1 2 203 1 1 4 LEU HD21 H 1.476 -2.933 4.129 1.00 . A A . 4 LEU HD21 1 1 2 204 1 1 4 LEU HD22 H 0.677 -1.815 5.234 1.00 . A A . 4 LEU HD22 1 1 2 205 1 1 4 LEU HD23 H 2.402 -1.648 4.905 1.00 . A A . 4 LEU HD23 1 1 2 206 1 1 4 LEU HG H 1.526 -1.429 2.414 1.00 . A A . 4 LEU HG 1 1 2 207 1 1 4 LEU N N -0.177 0.415 1.041 1.00 . A A . 4 LEU N 1 1 2 208 1 1 4 LEU O O -2.863 0.418 2.408 1.00 . A A . 4 LEU O 1 1 2 209 1 1 5 ARG C C -5.013 -1.561 2.433 1.00 . A A . 5 ARG C 1 1 2 210 1 1 5 ARG CA C -4.524 -1.250 1.031 1.00 . A A . 5 ARG CA 1 1 2 211 1 1 5 ARG CB C -5.101 -2.217 0.019 1.00 . A A . 5 ARG CB 1 1 2 212 1 1 5 ARG CD C -4.031 -1.410 -2.082 1.00 . A A . 5 ARG CD 1 1 2 213 1 1 5 ARG CG C -5.332 -1.565 -1.313 1.00 . A A . 5 ARG CG 1 1 2 214 1 1 5 ARG CZ C -4.594 -0.451 -4.283 1.00 . A A . 5 ARG CZ 1 1 2 215 1 1 5 ARG H H -2.648 -2.059 0.534 1.00 . A A . 5 ARG H 1 1 2 216 1 1 5 ARG HA H -4.806 -0.247 0.758 1.00 . A A . 5 ARG HA 1 1 2 217 1 1 5 ARG HB2 H -4.412 -3.028 -0.122 1.00 . A A . 5 ARG HB2 1 1 2 218 1 1 5 ARG HB3 H -6.039 -2.597 0.385 1.00 . A A . 5 ARG HB3 1 1 2 219 1 1 5 ARG HD2 H -3.235 -1.203 -1.377 1.00 . A A . 5 ARG HD2 1 1 2 220 1 1 5 ARG HD3 H -3.821 -2.333 -2.601 1.00 . A A . 5 ARG HD3 1 1 2 221 1 1 5 ARG HE H -3.759 0.554 -2.774 1.00 . A A . 5 ARG HE 1 1 2 222 1 1 5 ARG HG2 H -6.015 -2.161 -1.880 1.00 . A A . 5 ARG HG2 1 1 2 223 1 1 5 ARG HG3 H -5.753 -0.596 -1.144 1.00 . A A . 5 ARG HG3 1 1 2 224 1 1 5 ARG HH11 H -5.064 -2.408 -4.085 1.00 . A A . 5 ARG HH11 1 1 2 225 1 1 5 ARG HH12 H -5.441 -1.707 -5.622 1.00 . A A . 5 ARG HH12 1 1 2 226 1 1 5 ARG HH21 H -4.258 1.475 -4.795 1.00 . A A . 5 ARG HH21 1 1 2 227 1 1 5 ARG HH22 H -4.984 0.496 -6.025 1.00 . A A . 5 ARG HH22 1 1 2 228 1 1 5 ARG N N -3.085 -1.339 1.030 1.00 . A A . 5 ARG N 1 1 2 229 1 1 5 ARG NE N -4.099 -0.321 -3.053 1.00 . A A . 5 ARG NE 1 1 2 230 1 1 5 ARG NH1 N -5.072 -1.618 -4.696 1.00 . A A . 5 ARG NH1 1 1 2 231 1 1 5 ARG NH2 N -4.614 0.593 -5.101 1.00 . A A . 5 ARG NH2 1 1 2 232 1 1 5 ARG O O -5.178 -2.723 2.804 1.00 . A A . 5 ARG O 1 1 2 233 1 1 6 HIS C C -5.840 0.692 5.251 1.00 . A A . 6 HIS C 1 1 2 234 1 1 6 HIS CA C -5.605 -0.670 4.607 1.00 . A A . 6 HIS CA 1 1 2 235 1 1 6 HIS CB C -4.516 -1.451 5.361 1.00 . A A . 6 HIS CB 1 1 2 236 1 1 6 HIS CD2 C -5.266 -0.729 7.749 1.00 . A A . 6 HIS CD2 1 1 2 237 1 1 6 HIS CE1 C -4.768 -2.583 8.806 1.00 . A A . 6 HIS CE1 1 1 2 238 1 1 6 HIS CG C -4.756 -1.592 6.836 1.00 . A A . 6 HIS CG 1 1 2 239 1 1 6 HIS H H -5.008 0.385 2.878 1.00 . A A . 6 HIS H 1 1 2 240 1 1 6 HIS HA H -6.524 -1.235 4.627 1.00 . A A . 6 HIS HA 1 1 2 241 1 1 6 HIS HB2 H -4.460 -2.450 4.946 1.00 . A A . 6 HIS HB2 1 1 2 242 1 1 6 HIS HB3 H -3.555 -0.952 5.217 1.00 . A A . 6 HIS HB3 1 1 2 243 1 1 6 HIS HD1 H -4.067 -3.559 7.151 1.00 . A A . 6 HIS HD1 1 1 2 244 1 1 6 HIS HD2 H -5.613 0.276 7.558 1.00 . A A . 6 HIS HD2 1 1 2 245 1 1 6 HIS HE1 H -4.641 -3.319 9.586 1.00 . A A . 6 HIS HE1 1 1 2 246 1 1 6 HIS HE2 H -5.487 -0.959 9.824 1.00 . A A . 6 HIS HE2 1 1 2 247 1 1 6 HIS N N -5.193 -0.514 3.224 1.00 . A A . 6 HIS N 1 1 2 248 1 1 6 HIS ND1 N -4.454 -2.744 7.534 1.00 . A A . 6 HIS ND1 1 1 2 249 1 1 6 HIS NE2 N -5.261 -1.369 8.963 1.00 . A A . 6 HIS NE2 1 1 2 250 1 1 6 HIS O O -4.894 1.507 5.274 1.00 . A A . 6 HIS O 1 1 3 251 1 1 1 HIS C C 5.392 1.299 -3.005 1.00 . A A . 1 HIS C 1 1 3 252 1 1 1 HIS CA C 5.625 2.184 -4.225 1.00 . A A . 1 HIS CA 1 1 3 253 1 1 1 HIS CB C 4.294 2.509 -4.908 1.00 . A A . 1 HIS CB 1 1 3 254 1 1 1 HIS CD2 C 3.956 4.491 -6.546 1.00 . A A . 1 HIS CD2 1 1 3 255 1 1 1 HIS CE1 C 4.128 6.132 -5.102 1.00 . A A . 1 HIS CE1 1 1 3 256 1 1 1 HIS CG C 4.173 3.940 -5.328 1.00 . A A . 1 HIS CG 1 1 3 257 1 1 1 HIS H1 H 6.880 2.244 -5.855 1.00 . A A . 1 HIS H1 1 1 3 258 1 1 1 HIS H2 H 5.939 0.814 -5.728 1.00 . A A . 1 HIS H2 1 1 3 259 1 1 1 HIS H3 H 7.282 1.055 -4.687 1.00 . A A . 1 HIS H3 1 1 3 260 1 1 1 HIS HA H 6.096 3.102 -3.909 1.00 . A A . 1 HIS HA 1 1 3 261 1 1 1 HIS HB2 H 4.191 1.894 -5.790 1.00 . A A . 1 HIS HB2 1 1 3 262 1 1 1 HIS HB3 H 3.485 2.291 -4.227 1.00 . A A . 1 HIS HB3 1 1 3 263 1 1 1 HIS HD1 H 4.435 4.922 -3.481 1.00 . A A . 1 HIS HD1 1 1 3 264 1 1 1 HIS HD2 H 3.826 3.958 -7.477 1.00 . A A . 1 HIS HD2 1 1 3 265 1 1 1 HIS HE1 H 4.163 7.121 -4.669 1.00 . A A . 1 HIS HE1 1 1 3 266 1 1 1 HIS HE2 H 3.887 6.516 -7.099 1.00 . A A . 1 HIS HE2 1 1 3 267 1 1 1 HIS N N 6.511 1.514 -5.213 1.00 . A A . 1 HIS N 1 1 3 268 1 1 1 HIS ND1 N 4.277 4.995 -4.446 1.00 . A A . 1 HIS ND1 1 1 3 269 1 1 1 HIS NE2 N 3.933 5.854 -6.378 1.00 . A A . 1 HIS NE2 1 1 3 270 1 1 1 HIS O O 6.033 0.259 -2.848 1.00 . A A . 1 HIS O 1 1 3 271 1 1 2 ARG C C 2.803 1.376 -0.367 1.00 . A A . 2 ARG C 1 1 3 272 1 1 2 ARG CA C 4.158 0.962 -0.935 1.00 . A A . 2 ARG CA 1 1 3 273 1 1 2 ARG CB C 5.250 1.165 0.116 1.00 . A A . 2 ARG CB 1 1 3 274 1 1 2 ARG CD C 6.398 -0.011 2.015 1.00 . A A . 2 ARG CD 1 1 3 275 1 1 2 ARG CG C 5.065 0.308 1.357 1.00 . A A . 2 ARG CG 1 1 3 276 1 1 2 ARG CZ C 6.532 1.498 3.960 1.00 . A A . 2 ARG CZ 1 1 3 277 1 1 2 ARG H H 3.995 2.555 -2.320 1.00 . A A . 2 ARG H 1 1 3 278 1 1 2 ARG HA H 4.117 -0.084 -1.200 1.00 . A A . 2 ARG HA 1 1 3 279 1 1 2 ARG HB2 H 6.206 0.922 -0.324 1.00 . A A . 2 ARG HB2 1 1 3 280 1 1 2 ARG HB3 H 5.255 2.202 0.418 1.00 . A A . 2 ARG HB3 1 1 3 281 1 1 2 ARG HD2 H 6.258 -0.830 2.705 1.00 . A A . 2 ARG HD2 1 1 3 282 1 1 2 ARG HD3 H 7.102 -0.302 1.250 1.00 . A A . 2 ARG HD3 1 1 3 283 1 1 2 ARG HE H 7.637 1.662 2.306 1.00 . A A . 2 ARG HE 1 1 3 284 1 1 2 ARG HG2 H 4.445 0.845 2.064 1.00 . A A . 2 ARG HG2 1 1 3 285 1 1 2 ARG HG3 H 4.581 -0.619 1.074 1.00 . A A . 2 ARG HG3 1 1 3 286 1 1 2 ARG HH11 H 5.172 0.012 4.145 1.00 . A A . 2 ARG HH11 1 1 3 287 1 1 2 ARG HH12 H 5.286 1.086 5.498 1.00 . A A . 2 ARG HH12 1 1 3 288 1 1 2 ARG HH21 H 7.788 3.076 4.085 1.00 . A A . 2 ARG HH21 1 1 3 289 1 1 2 ARG HH22 H 6.770 2.826 5.464 1.00 . A A . 2 ARG HH22 1 1 3 290 1 1 2 ARG N N 4.472 1.718 -2.142 1.00 . A A . 2 ARG N 1 1 3 291 1 1 2 ARG NE N 6.937 1.135 2.745 1.00 . A A . 2 ARG NE 1 1 3 292 1 1 2 ARG NH1 N 5.585 0.808 4.585 1.00 . A A . 2 ARG NH1 1 1 3 293 1 1 2 ARG NH2 N 7.074 2.553 4.551 1.00 . A A . 2 ARG NH2 1 1 3 294 1 1 2 ARG O O 2.671 1.625 0.832 1.00 . A A . 2 ARG O 1 1 3 295 1 1 3 PHE C C -0.299 0.646 -0.256 1.00 . A A . 3 PHE C 1 1 3 296 1 1 3 PHE CA C 0.465 1.838 -0.828 1.00 . A A . 3 PHE CA 1 1 3 297 1 1 3 PHE CB C -0.281 2.429 -2.023 1.00 . A A . 3 PHE CB 1 1 3 298 1 1 3 PHE CD1 C 0.879 1.947 -4.199 1.00 . A A . 3 PHE CD1 1 1 3 299 1 1 3 PHE CD2 C -1.007 0.613 -3.606 1.00 . A A . 3 PHE CD2 1 1 3 300 1 1 3 PHE CE1 C 1.018 1.234 -5.374 1.00 . A A . 3 PHE CE1 1 1 3 301 1 1 3 PHE CE2 C -0.873 -0.103 -4.780 1.00 . A A . 3 PHE CE2 1 1 3 302 1 1 3 PHE CG C -0.133 1.645 -3.301 1.00 . A A . 3 PHE CG 1 1 3 303 1 1 3 PHE CZ C 0.141 0.208 -5.665 1.00 . A A . 3 PHE CZ 1 1 3 304 1 1 3 PHE H H 1.960 1.252 -2.174 1.00 . A A . 3 PHE H 1 1 3 305 1 1 3 PHE HA H 0.557 2.593 -0.063 1.00 . A A . 3 PHE HA 1 1 3 306 1 1 3 PHE HB2 H -1.329 2.474 -1.789 1.00 . A A . 3 PHE HB2 1 1 3 307 1 1 3 PHE HB3 H 0.095 3.428 -2.205 1.00 . A A . 3 PHE HB3 1 1 3 308 1 1 3 PHE HD1 H 1.567 2.748 -3.972 1.00 . A A . 3 PHE HD1 1 1 3 309 1 1 3 PHE HD2 H -1.801 0.370 -2.917 1.00 . A A . 3 PHE HD2 1 1 3 310 1 1 3 PHE HE1 H 1.810 1.480 -6.065 1.00 . A A . 3 PHE HE1 1 1 3 311 1 1 3 PHE HE2 H -1.560 -0.905 -5.006 1.00 . A A . 3 PHE HE2 1 1 3 312 1 1 3 PHE HZ H 0.247 -0.351 -6.584 1.00 . A A . 3 PHE HZ 1 1 3 313 1 1 3 PHE N N 1.800 1.453 -1.235 1.00 . A A . 3 PHE N 1 1 3 314 1 1 3 PHE O O -0.962 -0.090 -0.984 1.00 . A A . 3 PHE O 1 1 3 315 1 1 4 LEU C C -2.373 -0.458 1.738 1.00 . A A . 4 LEU C 1 1 3 316 1 1 4 LEU CA C -0.868 -0.639 1.730 1.00 . A A . 4 LEU CA 1 1 3 317 1 1 4 LEU CB C -0.392 -0.754 3.174 1.00 . A A . 4 LEU CB 1 1 3 318 1 1 4 LEU CD1 C 1.795 0.409 3.518 1.00 . A A . 4 LEU CD1 1 1 3 319 1 1 4 LEU CD2 C 1.421 -1.863 4.504 1.00 . A A . 4 LEU CD2 1 1 3 320 1 1 4 LEU CG C 1.115 -0.937 3.336 1.00 . A A . 4 LEU CG 1 1 3 321 1 1 4 LEU H H 0.353 1.074 1.583 1.00 . A A . 4 LEU H 1 1 3 322 1 1 4 LEU HA H -0.622 -1.547 1.210 1.00 . A A . 4 LEU HA 1 1 3 323 1 1 4 LEU HB2 H -0.690 0.142 3.699 1.00 . A A . 4 LEU HB2 1 1 3 324 1 1 4 LEU HB3 H -0.894 -1.597 3.630 1.00 . A A . 4 LEU HB3 1 1 3 325 1 1 4 LEU HD11 H 2.232 0.463 4.504 1.00 . A A . 4 LEU HD11 1 1 3 326 1 1 4 LEU HD12 H 1.068 1.198 3.402 1.00 . A A . 4 LEU HD12 1 1 3 327 1 1 4 LEU HD13 H 2.570 0.521 2.775 1.00 . A A . 4 LEU HD13 1 1 3 328 1 1 4 LEU HD21 H 0.603 -1.837 5.208 1.00 . A A . 4 LEU HD21 1 1 3 329 1 1 4 LEU HD22 H 2.328 -1.538 4.993 1.00 . A A . 4 LEU HD22 1 1 3 330 1 1 4 LEU HD23 H 1.550 -2.872 4.140 1.00 . A A . 4 LEU HD23 1 1 3 331 1 1 4 LEU HG H 1.510 -1.385 2.437 1.00 . A A . 4 LEU HG 1 1 3 332 1 1 4 LEU N N -0.195 0.461 1.056 1.00 . A A . 4 LEU N 1 1 3 333 1 1 4 LEU O O -2.891 0.430 2.415 1.00 . A A . 4 LEU O 1 1 3 334 1 1 5 ARG C C -5.017 -1.596 2.412 1.00 . A A . 5 ARG C 1 1 3 335 1 1 5 ARG CA C -4.523 -1.251 1.020 1.00 . A A . 5 ARG CA 1 1 3 336 1 1 5 ARG CB C -5.083 -2.205 -0.014 1.00 . A A . 5 ARG CB 1 1 3 337 1 1 5 ARG CD C -4.015 -1.350 -2.097 1.00 . A A . 5 ARG CD 1 1 3 338 1 1 5 ARG CG C -5.317 -1.530 -1.334 1.00 . A A . 5 ARG CG 1 1 3 339 1 1 5 ARG CZ C -4.579 -0.322 -4.266 1.00 . A A . 5 ARG CZ 1 1 3 340 1 1 5 ARG H H -2.636 -2.034 0.529 1.00 . A A . 5 ARG H 1 1 3 341 1 1 5 ARG HA H -4.816 -0.246 0.766 1.00 . A A . 5 ARG HA 1 1 3 342 1 1 5 ARG HB2 H -4.383 -3.004 -0.168 1.00 . A A . 5 ARG HB2 1 1 3 343 1 1 5 ARG HB3 H -6.018 -2.605 0.340 1.00 . A A . 5 ARG HB3 1 1 3 344 1 1 5 ARG HD2 H -3.220 -1.165 -1.385 1.00 . A A . 5 ARG HD2 1 1 3 345 1 1 5 ARG HD3 H -3.804 -2.257 -2.644 1.00 . A A . 5 ARG HD3 1 1 3 346 1 1 5 ARG HE H -3.740 0.634 -2.728 1.00 . A A . 5 ARG HE 1 1 3 347 1 1 5 ARG HG2 H -5.993 -2.120 -1.914 1.00 . A A . 5 ARG HG2 1 1 3 348 1 1 5 ARG HG3 H -5.745 -0.567 -1.148 1.00 . A A . 5 ARG HG3 1 1 3 349 1 1 5 ARG HH11 H -5.055 -2.284 -4.126 1.00 . A A . 5 ARG HH11 1 1 3 350 1 1 5 ARG HH12 H -5.433 -1.535 -5.640 1.00 . A A . 5 ARG HH12 1 1 3 351 1 1 5 ARG HH21 H -4.239 1.618 -4.719 1.00 . A A . 5 ARG HH21 1 1 3 352 1 1 5 ARG HH22 H -4.970 0.678 -5.978 1.00 . A A . 5 ARG HH22 1 1 3 353 1 1 5 ARG N N -3.084 -1.322 1.026 1.00 . A A . 5 ARG N 1 1 3 354 1 1 5 ARG NE N -4.083 -0.231 -3.034 1.00 . A A . 5 ARG NE 1 1 3 355 1 1 5 ARG NH1 N -5.062 -1.475 -4.713 1.00 . A A . 5 ARG NH1 1 1 3 356 1 1 5 ARG NH2 N -4.598 0.746 -5.052 1.00 . A A . 5 ARG NH2 1 1 3 357 1 1 5 ARG O O -5.170 -2.767 2.759 1.00 . A A . 5 ARG O 1 1 3 358 1 1 6 HIS C C -5.887 0.588 5.272 1.00 . A A . 6 HIS C 1 1 3 359 1 1 6 HIS CA C -5.634 -0.757 4.600 1.00 . A A . 6 HIS CA 1 1 3 360 1 1 6 HIS CB C -4.542 -1.542 5.345 1.00 . A A . 6 HIS CB 1 1 3 361 1 1 6 HIS CD2 C -5.319 -0.883 7.743 1.00 . A A . 6 HIS CD2 1 1 3 362 1 1 6 HIS CE1 C -4.815 -2.757 8.761 1.00 . A A . 6 HIS CE1 1 1 3 363 1 1 6 HIS CG C -4.793 -1.720 6.815 1.00 . A A . 6 HIS CG 1 1 3 364 1 1 6 HIS H H -5.040 0.340 2.897 1.00 . A A . 6 HIS H 1 1 3 365 1 1 6 HIS HA H -6.547 -1.331 4.602 1.00 . A A . 6 HIS HA 1 1 3 366 1 1 6 HIS HB2 H -4.470 -2.531 4.908 1.00 . A A . 6 HIS HB2 1 1 3 367 1 1 6 HIS HB3 H -3.586 -1.030 5.222 1.00 . A A . 6 HIS HB3 1 1 3 368 1 1 6 HIS HD1 H -4.092 -3.689 7.090 1.00 . A A . 6 HIS HD1 1 1 3 369 1 1 6 HIS HD2 H -5.672 0.123 7.572 1.00 . A A . 6 HIS HD2 1 1 3 370 1 1 6 HIS HE1 H -4.689 -3.510 9.525 1.00 . A A . 6 HIS HE1 1 1 3 371 1 1 6 HIS HE2 H -5.718 -1.225 9.775 1.00 . A A . 6 HIS HE2 1 1 3 372 1 1 6 HIS N N -5.215 -0.567 3.223 1.00 . A A . 6 HIS N 1 1 3 373 1 1 6 HIS ND1 N -4.488 -2.886 7.487 1.00 . A A . 6 HIS ND1 1 1 3 374 1 1 6 HIS NE2 N -5.320 -1.552 8.941 1.00 . A A . 6 HIS NE2 1 1 3 375 1 1 6 HIS O O -4.901 1.282 5.596 1.00 . A A . 6 HIS O 1 1 4 376 1 1 1 HIS C C 5.305 1.257 -3.070 1.00 . A A . 1 HIS C 1 1 4 377 1 1 1 HIS CA C 5.520 2.145 -4.291 1.00 . A A . 1 HIS CA 1 1 4 378 1 1 1 HIS CB C 4.333 2.023 -5.249 1.00 . A A . 1 HIS CB 1 1 4 379 1 1 1 HIS CD2 C 3.762 3.504 -7.301 1.00 . A A . 1 HIS CD2 1 1 4 380 1 1 1 HIS CE1 C 3.696 5.446 -6.286 1.00 . A A . 1 HIS CE1 1 1 4 381 1 1 1 HIS CG C 4.032 3.288 -5.991 1.00 . A A . 1 HIS CG 1 1 4 382 1 1 1 HIS H1 H 6.830 2.372 -5.862 1.00 . A A . 1 HIS H1 1 1 4 383 1 1 1 HIS H2 H 6.672 0.762 -5.288 1.00 . A A . 1 HIS H2 1 1 4 384 1 1 1 HIS H3 H 7.563 1.916 -4.381 1.00 . A A . 1 HIS H3 1 1 4 385 1 1 1 HIS HA H 5.613 3.171 -3.969 1.00 . A A . 1 HIS HA 1 1 4 386 1 1 1 HIS HB2 H 4.544 1.254 -5.976 1.00 . A A . 1 HIS HB2 1 1 4 387 1 1 1 HIS HB3 H 3.453 1.749 -4.686 1.00 . A A . 1 HIS HB3 1 1 4 388 1 1 1 HIS HD1 H 4.135 4.701 -4.431 1.00 . A A . 1 HIS HD1 1 1 4 389 1 1 1 HIS HD2 H 3.717 2.754 -8.078 1.00 . A A . 1 HIS HD2 1 1 4 390 1 1 1 HIS HE1 H 3.594 6.504 -6.098 1.00 . A A . 1 HIS HE1 1 1 4 391 1 1 1 HIS HE2 H 3.436 5.314 -8.313 1.00 . A A . 1 HIS HE2 1 1 4 392 1 1 1 HIS N N 6.758 1.764 -5.021 1.00 . A A . 1 HIS N 1 1 4 393 1 1 1 HIS ND1 N 3.983 4.524 -5.383 1.00 . A A . 1 HIS ND1 1 1 4 394 1 1 1 HIS NE2 N 3.559 4.853 -7.457 1.00 . A A . 1 HIS NE2 1 1 4 395 1 1 1 HIS O O 5.907 0.190 -2.953 1.00 . A A . 1 HIS O 1 1 4 396 1 1 2 ARG C C 2.794 1.348 -0.375 1.00 . A A . 2 ARG C 1 1 4 397 1 1 2 ARG CA C 4.150 0.950 -0.950 1.00 . A A . 2 ARG CA 1 1 4 398 1 1 2 ARG CB C 5.247 1.176 0.093 1.00 . A A . 2 ARG CB 1 1 4 399 1 1 2 ARG CD C 6.396 0.113 2.059 1.00 . A A . 2 ARG CD 1 1 4 400 1 1 2 ARG CG C 5.070 0.344 1.353 1.00 . A A . 2 ARG CG 1 1 4 401 1 1 2 ARG CZ C 7.284 0.379 4.342 1.00 . A A . 2 ARG CZ 1 1 4 402 1 1 2 ARG H H 3.995 2.563 -2.312 1.00 . A A . 2 ARG H 1 1 4 403 1 1 2 ARG HA H 4.124 -0.097 -1.210 1.00 . A A . 2 ARG HA 1 1 4 404 1 1 2 ARG HB2 H 6.202 0.927 -0.346 1.00 . A A . 2 ARG HB2 1 1 4 405 1 1 2 ARG HB3 H 5.251 2.219 0.374 1.00 . A A . 2 ARG HB3 1 1 4 406 1 1 2 ARG HD2 H 6.767 -0.864 1.790 1.00 . A A . 2 ARG HD2 1 1 4 407 1 1 2 ARG HD3 H 7.098 0.867 1.733 1.00 . A A . 2 ARG HD3 1 1 4 408 1 1 2 ARG HE H 5.363 0.087 3.889 1.00 . A A . 2 ARG HE 1 1 4 409 1 1 2 ARG HG2 H 4.402 0.866 2.026 1.00 . A A . 2 ARG HG2 1 1 4 410 1 1 2 ARG HG3 H 4.644 -0.615 1.082 1.00 . A A . 2 ARG HG3 1 1 4 411 1 1 2 ARG HH11 H 8.682 0.478 2.883 1.00 . A A . 2 ARG HH11 1 1 4 412 1 1 2 ARG HH12 H 9.280 0.662 4.497 1.00 . A A . 2 ARG HH12 1 1 4 413 1 1 2 ARG HH21 H 6.148 0.330 6.013 1.00 . A A . 2 ARG HH21 1 1 4 414 1 1 2 ARG HH22 H 7.842 0.577 6.274 1.00 . A A . 2 ARG HH22 1 1 4 415 1 1 2 ARG N N 4.444 1.705 -2.163 1.00 . A A . 2 ARG N 1 1 4 416 1 1 2 ARG NE N 6.262 0.186 3.512 1.00 . A A . 2 ARG NE 1 1 4 417 1 1 2 ARG NH1 N 8.516 0.518 3.868 1.00 . A A . 2 ARG NH1 1 1 4 418 1 1 2 ARG NH2 N 7.074 0.433 5.650 1.00 . A A . 2 ARG NH2 1 1 4 419 1 1 2 ARG O O 2.660 1.582 0.826 1.00 . A A . 2 ARG O 1 1 4 420 1 1 3 PHE C C -0.308 0.598 -0.274 1.00 . A A . 3 PHE C 1 1 4 421 1 1 3 PHE CA C 0.452 1.799 -0.831 1.00 . A A . 3 PHE CA 1 1 4 422 1 1 3 PHE CB C -0.297 2.402 -2.018 1.00 . A A . 3 PHE CB 1 1 4 423 1 1 3 PHE CD1 C 0.860 1.921 -4.197 1.00 . A A . 3 PHE CD1 1 1 4 424 1 1 3 PHE CD2 C -1.046 0.611 -3.617 1.00 . A A . 3 PHE CD2 1 1 4 425 1 1 3 PHE CE1 C 0.989 1.216 -5.378 1.00 . A A . 3 PHE CE1 1 1 4 426 1 1 3 PHE CE2 C -0.922 -0.097 -4.797 1.00 . A A . 3 PHE CE2 1 1 4 427 1 1 3 PHE CG C -0.157 1.627 -3.302 1.00 . A A . 3 PHE CG 1 1 4 428 1 1 3 PHE CZ C 0.097 0.206 -5.679 1.00 . A A . 3 PHE CZ 1 1 4 429 1 1 3 PHE H H 1.951 1.239 -2.183 1.00 . A A . 3 PHE H 1 1 4 430 1 1 3 PHE HA H 0.539 2.546 -0.056 1.00 . A A . 3 PHE HA 1 1 4 431 1 1 3 PHE HB2 H -1.343 2.449 -1.779 1.00 . A A . 3 PHE HB2 1 1 4 432 1 1 3 PHE HB3 H 0.082 3.402 -2.195 1.00 . A A . 3 PHE HB3 1 1 4 433 1 1 3 PHE HD1 H 1.560 2.710 -3.962 1.00 . A A . 3 PHE HD1 1 1 4 434 1 1 3 PHE HD2 H -1.844 0.374 -2.930 1.00 . A A . 3 PHE HD2 1 1 4 435 1 1 3 PHE HE1 H 1.786 1.456 -6.067 1.00 . A A . 3 PHE HE1 1 1 4 436 1 1 3 PHE HE2 H -1.621 -0.887 -5.030 1.00 . A A . 3 PHE HE2 1 1 4 437 1 1 3 PHE HZ H 0.196 -0.346 -6.602 1.00 . A A . 3 PHE HZ 1 1 4 438 1 1 3 PHE N N 1.790 1.428 -1.242 1.00 . A A . 3 PHE N 1 1 4 439 1 1 3 PHE O O -0.966 -0.133 -1.012 1.00 . A A . 3 PHE O 1 1 4 440 1 1 4 LEU C C -2.381 -0.513 1.730 1.00 . A A . 4 LEU C 1 1 4 441 1 1 4 LEU CA C -0.879 -0.713 1.695 1.00 . A A . 4 LEU CA 1 1 4 442 1 1 4 LEU CB C -0.382 -0.874 3.127 1.00 . A A . 4 LEU CB 1 1 4 443 1 1 4 LEU CD1 C 1.790 0.314 3.481 1.00 . A A . 4 LEU CD1 1 1 4 444 1 1 4 LEU CD2 C 1.466 -1.992 4.401 1.00 . A A . 4 LEU CD2 1 1 4 445 1 1 4 LEU CG C 1.130 -1.037 3.265 1.00 . A A . 4 LEU CG 1 1 4 446 1 1 4 LEU H H 0.335 1.007 1.571 1.00 . A A . 4 LEU H 1 1 4 447 1 1 4 LEU HA H -0.653 -1.608 1.147 1.00 . A A . 4 LEU HA 1 1 4 448 1 1 4 LEU HB2 H -0.689 -0.005 3.692 1.00 . A A . 4 LEU HB2 1 1 4 449 1 1 4 LEU HB3 H -0.861 -1.743 3.556 1.00 . A A . 4 LEU HB3 1 1 4 450 1 1 4 LEU HD11 H 2.567 0.453 2.745 1.00 . A A . 4 LEU HD11 1 1 4 451 1 1 4 LEU HD12 H 2.219 0.354 4.471 1.00 . A A . 4 LEU HD12 1 1 4 452 1 1 4 LEU HD13 H 1.052 1.095 3.376 1.00 . A A . 4 LEU HD13 1 1 4 453 1 1 4 LEU HD21 H 2.328 -2.583 4.131 1.00 . A A . 4 LEU HD21 1 1 4 454 1 1 4 LEU HD22 H 0.625 -2.644 4.584 1.00 . A A . 4 LEU HD22 1 1 4 455 1 1 4 LEU HD23 H 1.683 -1.426 5.295 1.00 . A A . 4 LEU HD23 1 1 4 456 1 1 4 LEU HG H 1.522 -1.452 2.349 1.00 . A A . 4 LEU HG 1 1 4 457 1 1 4 LEU N N -0.207 0.398 1.036 1.00 . A A . 4 LEU N 1 1 4 458 1 1 4 LEU O O -2.875 0.375 2.426 1.00 . A A . 4 LEU O 1 1 4 459 1 1 5 ARG C C -5.028 -1.575 2.444 1.00 . A A . 5 ARG C 1 1 4 460 1 1 5 ARG CA C -4.553 -1.266 1.037 1.00 . A A . 5 ARG CA 1 1 4 461 1 1 5 ARG CB C -5.140 -2.234 0.032 1.00 . A A . 5 ARG CB 1 1 4 462 1 1 5 ARG CD C -4.051 -1.502 -2.086 1.00 . A A . 5 ARG CD 1 1 4 463 1 1 5 ARG CG C -5.352 -1.595 -1.309 1.00 . A A . 5 ARG CG 1 1 4 464 1 1 5 ARG CZ C -4.567 -0.738 -4.374 1.00 . A A . 5 ARG CZ 1 1 4 465 1 1 5 ARG H H -2.685 -2.068 0.505 1.00 . A A . 5 ARG H 1 1 4 466 1 1 5 ARG HA H -4.838 -0.262 0.766 1.00 . A A . 5 ARG HA 1 1 4 467 1 1 5 ARG HB2 H -4.463 -3.058 -0.096 1.00 . A A . 5 ARG HB2 1 1 4 468 1 1 5 ARG HB3 H -6.085 -2.595 0.396 1.00 . A A . 5 ARG HB3 1 1 4 469 1 1 5 ARG HD2 H -3.256 -1.236 -1.399 1.00 . A A . 5 ARG HD2 1 1 4 470 1 1 5 ARG HD3 H -3.837 -2.464 -2.527 1.00 . A A . 5 ARG HD3 1 1 4 471 1 1 5 ARG HE H -3.814 0.408 -2.924 1.00 . A A . 5 ARG HE 1 1 4 472 1 1 5 ARG HG2 H -6.060 -2.174 -1.864 1.00 . A A . 5 ARG HG2 1 1 4 473 1 1 5 ARG HG3 H -5.735 -0.608 -1.154 1.00 . A A . 5 ARG HG3 1 1 4 474 1 1 5 ARG HH11 H -4.994 -2.687 -4.033 1.00 . A A . 5 ARG HH11 1 1 4 475 1 1 5 ARG HH12 H -5.335 -2.121 -5.633 1.00 . A A . 5 ARG HH12 1 1 4 476 1 1 5 ARG HH21 H -4.266 1.150 -5.028 1.00 . A A . 5 ARG HH21 1 1 4 477 1 1 5 ARG HH22 H -4.923 0.055 -6.198 1.00 . A A . 5 ARG HH22 1 1 4 478 1 1 5 ARG N N -3.115 -1.358 1.020 1.00 . A A . 5 ARG N 1 1 4 479 1 1 5 ARG NE N -4.119 -0.496 -3.143 1.00 . A A . 5 ARG NE 1 1 4 480 1 1 5 ARG NH1 N -5.001 -1.948 -4.707 1.00 . A A . 5 ARG NH1 1 1 4 481 1 1 5 ARG NH2 N -4.587 0.235 -5.274 1.00 . A A . 5 ARG NH2 1 1 4 482 1 1 5 ARG O O -5.191 -2.736 2.819 1.00 . A A . 5 ARG O 1 1 4 483 1 1 6 HIS C C -5.820 0.685 5.267 1.00 . A A . 6 HIS C 1 1 4 484 1 1 6 HIS CA C -5.595 -0.680 4.624 1.00 . A A . 6 HIS CA 1 1 4 485 1 1 6 HIS CB C -4.499 -1.462 5.367 1.00 . A A . 6 HIS CB 1 1 4 486 1 1 6 HIS CD2 C -5.214 -0.723 7.761 1.00 . A A . 6 HIS CD2 1 1 4 487 1 1 6 HIS CE1 C -4.701 -2.570 8.824 1.00 . A A . 6 HIS CE1 1 1 4 488 1 1 6 HIS CG C -4.718 -1.593 6.847 1.00 . A A . 6 HIS CG 1 1 4 489 1 1 6 HIS H H -5.015 0.371 2.887 1.00 . A A . 6 HIS H 1 1 4 490 1 1 6 HIS HA H -6.515 -1.241 4.655 1.00 . A A . 6 HIS HA 1 1 4 491 1 1 6 HIS HB2 H -4.455 -2.464 4.957 1.00 . A A . 6 HIS HB2 1 1 4 492 1 1 6 HIS HB3 H -3.538 -0.970 5.205 1.00 . A A . 6 HIS HB3 1 1 4 493 1 1 6 HIS HD1 H -4.026 -3.558 7.165 1.00 . A A . 6 HIS HD1 1 1 4 494 1 1 6 HIS HD2 H -5.564 0.280 7.568 1.00 . A A . 6 HIS HD2 1 1 4 495 1 1 6 HIS HE1 H -4.563 -3.300 9.607 1.00 . A A . 6 HIS HE1 1 1 4 496 1 1 6 HIS HE2 H -5.399 -0.936 9.841 1.00 . A A . 6 HIS HE2 1 1 4 497 1 1 6 HIS N N -5.198 -0.526 3.236 1.00 . A A . 6 HIS N 1 1 4 498 1 1 6 HIS ND1 N -4.406 -2.740 7.547 1.00 . A A . 6 HIS ND1 1 1 4 499 1 1 6 HIS NE2 N -5.192 -1.355 8.979 1.00 . A A . 6 HIS NE2 1 1 4 500 1 1 6 HIS O O -4.823 1.314 5.681 1.00 . A A . 6 HIS O 1 1 5 501 1 1 1 HIS C C 5.085 0.814 -3.196 1.00 . A A . 1 HIS C 1 1 5 502 1 1 1 HIS CA C 5.259 1.525 -4.534 1.00 . A A . 1 HIS CA 1 1 5 503 1 1 1 HIS CB C 5.496 0.504 -5.647 1.00 . A A . 1 HIS CB 1 1 5 504 1 1 1 HIS CD2 C 6.967 1.168 -7.678 1.00 . A A . 1 HIS CD2 1 1 5 505 1 1 1 HIS CE1 C 5.446 2.241 -8.837 1.00 . A A . 1 HIS CE1 1 1 5 506 1 1 1 HIS CG C 5.812 1.126 -6.972 1.00 . A A . 1 HIS CG 1 1 5 507 1 1 1 HIS H1 H 6.361 3.060 -5.347 1.00 . A A . 1 HIS H1 1 1 5 508 1 1 1 HIS H2 H 7.282 1.894 -4.489 1.00 . A A . 1 HIS H2 1 1 5 509 1 1 1 HIS H3 H 6.328 3.035 -3.633 1.00 . A A . 1 HIS H3 1 1 5 510 1 1 1 HIS HA H 4.363 2.088 -4.752 1.00 . A A . 1 HIS HA 1 1 5 511 1 1 1 HIS HB2 H 6.325 -0.131 -5.373 1.00 . A A . 1 HIS HB2 1 1 5 512 1 1 1 HIS HB3 H 4.609 -0.101 -5.766 1.00 . A A . 1 HIS HB3 1 1 5 513 1 1 1 HIS HD1 H 3.942 1.952 -7.481 1.00 . A A . 1 HIS HD1 1 1 5 514 1 1 1 HIS HD2 H 7.913 0.733 -7.387 1.00 . A A . 1 HIS HD2 1 1 5 515 1 1 1 HIS HE1 H 4.958 2.807 -9.616 1.00 . A A . 1 HIS HE1 1 1 5 516 1 1 1 HIS HE2 H 7.341 1.992 -9.573 1.00 . A A . 1 HIS HE2 1 1 5 517 1 1 1 HIS N N 6.411 2.463 -4.497 1.00 . A A . 1 HIS N 1 1 5 518 1 1 1 HIS ND1 N 4.880 1.808 -7.725 1.00 . A A . 1 HIS ND1 1 1 5 519 1 1 1 HIS NE2 N 6.712 1.866 -8.833 1.00 . A A . 1 HIS NE2 1 1 5 520 1 1 1 HIS O O 5.500 -0.334 -3.033 1.00 . A A . 1 HIS O 1 1 5 521 1 1 2 ARG C C 2.893 1.380 -0.359 1.00 . A A . 2 ARG C 1 1 5 522 1 1 2 ARG CA C 4.240 0.934 -0.917 1.00 . A A . 2 ARG CA 1 1 5 523 1 1 2 ARG CB C 5.365 1.344 0.037 1.00 . A A . 2 ARG CB 1 1 5 524 1 1 2 ARG CD C 6.636 0.602 2.072 1.00 . A A . 2 ARG CD 1 1 5 525 1 1 2 ARG CG C 5.272 0.689 1.406 1.00 . A A . 2 ARG CG 1 1 5 526 1 1 2 ARG CZ C 7.540 0.843 4.352 1.00 . A A . 2 ARG CZ 1 1 5 527 1 1 2 ARG H H 4.160 2.412 -2.430 1.00 . A A . 2 ARG H 1 1 5 528 1 1 2 ARG HA H 4.236 -0.140 -1.015 1.00 . A A . 2 ARG HA 1 1 5 529 1 1 2 ARG HB2 H 6.312 1.072 -0.404 1.00 . A A . 2 ARG HB2 1 1 5 530 1 1 2 ARG HB3 H 5.334 2.415 0.171 1.00 . A A . 2 ARG HB3 1 1 5 531 1 1 2 ARG HD2 H 7.132 -0.294 1.731 1.00 . A A . 2 ARG HD2 1 1 5 532 1 1 2 ARG HD3 H 7.218 1.466 1.785 1.00 . A A . 2 ARG HD3 1 1 5 533 1 1 2 ARG HE H 5.667 0.311 3.914 1.00 . A A . 2 ARG HE 1 1 5 534 1 1 2 ARG HG2 H 4.614 1.278 2.033 1.00 . A A . 2 ARG HG2 1 1 5 535 1 1 2 ARG HG3 H 4.873 -0.311 1.290 1.00 . A A . 2 ARG HG3 1 1 5 536 1 1 2 ARG HH11 H 8.870 1.234 2.879 1.00 . A A . 2 ARG HH11 1 1 5 537 1 1 2 ARG HH12 H 9.480 1.396 4.491 1.00 . A A . 2 ARG HH12 1 1 5 538 1 1 2 ARG HH21 H 6.468 0.524 6.035 1.00 . A A . 2 ARG HH21 1 1 5 539 1 1 2 ARG HH22 H 8.117 0.993 6.283 1.00 . A A . 2 ARG HH22 1 1 5 540 1 1 2 ARG N N 4.469 1.502 -2.241 1.00 . A A . 2 ARG N 1 1 5 541 1 1 2 ARG NE N 6.533 0.561 3.529 1.00 . A A . 2 ARG NE 1 1 5 542 1 1 2 ARG NH1 N 8.728 1.186 3.867 1.00 . A A . 2 ARG NH1 1 1 5 543 1 1 2 ARG NH2 N 7.361 0.782 5.664 1.00 . A A . 2 ARG NH2 1 1 5 544 1 1 2 ARG O O 2.763 1.656 0.834 1.00 . A A . 2 ARG O 1 1 5 545 1 1 3 PHE C C -0.221 0.696 -0.245 1.00 . A A . 3 PHE C 1 1 5 546 1 1 3 PHE CA C 0.564 1.864 -0.837 1.00 . A A . 3 PHE CA 1 1 5 547 1 1 3 PHE CB C -0.167 2.443 -2.048 1.00 . A A . 3 PHE CB 1 1 5 548 1 1 3 PHE CD1 C -0.920 0.607 -3.593 1.00 . A A . 3 PHE CD1 1 1 5 549 1 1 3 PHE CD2 C 0.992 1.892 -4.207 1.00 . A A . 3 PHE CD2 1 1 5 550 1 1 3 PHE CE1 C -0.796 -0.137 -4.750 1.00 . A A . 3 PHE CE1 1 1 5 551 1 1 3 PHE CE2 C 1.121 1.150 -5.366 1.00 . A A . 3 PHE CE2 1 1 5 552 1 1 3 PHE CG C -0.029 1.629 -3.307 1.00 . A A . 3 PHE CG 1 1 5 553 1 1 3 PHE CZ C 0.226 0.134 -5.638 1.00 . A A . 3 PHE CZ 1 1 5 554 1 1 3 PHE H H 2.056 1.228 -2.164 1.00 . A A . 3 PHE H 1 1 5 555 1 1 3 PHE HA H 0.663 2.634 -0.087 1.00 . A A . 3 PHE HA 1 1 5 556 1 1 3 PHE HB2 H -1.215 2.512 -1.819 1.00 . A A . 3 PHE HB2 1 1 5 557 1 1 3 PHE HB3 H 0.227 3.431 -2.250 1.00 . A A . 3 PHE HB3 1 1 5 558 1 1 3 PHE HD1 H -1.720 0.394 -2.901 1.00 . A A . 3 PHE HD1 1 1 5 559 1 1 3 PHE HD2 H 1.693 2.685 -3.996 1.00 . A A . 3 PHE HD2 1 1 5 560 1 1 3 PHE HE1 H -1.498 -0.931 -4.960 1.00 . A A . 3 PHE HE1 1 1 5 561 1 1 3 PHE HE2 H 1.922 1.364 -6.058 1.00 . A A . 3 PHE HE2 1 1 5 562 1 1 3 PHE HZ H 0.325 -0.446 -6.543 1.00 . A A . 3 PHE HZ 1 1 5 563 1 1 3 PHE N N 1.894 1.452 -1.231 1.00 . A A . 3 PHE N 1 1 5 564 1 1 3 PHE O O -0.889 -0.047 -0.962 1.00 . A A . 3 PHE O 1 1 5 565 1 1 4 LEU C C -2.320 -0.369 1.733 1.00 . A A . 4 LEU C 1 1 5 566 1 1 4 LEU CA C -0.814 -0.541 1.765 1.00 . A A . 4 LEU CA 1 1 5 567 1 1 4 LEU CB C -0.372 -0.603 3.220 1.00 . A A . 4 LEU CB 1 1 5 568 1 1 4 LEU CD1 C 1.875 0.386 3.687 1.00 . A A . 4 LEU CD1 1 1 5 569 1 1 4 LEU CD2 C 1.316 -1.894 4.553 1.00 . A A . 4 LEU CD2 1 1 5 570 1 1 4 LEU CG C 1.112 -0.899 3.420 1.00 . A A . 4 LEU CG 1 1 5 571 1 1 4 LEU H H 0.431 1.153 1.587 1.00 . A A . 4 LEU H 1 1 5 572 1 1 4 LEU HA H -0.551 -1.466 1.285 1.00 . A A . 4 LEU HA 1 1 5 573 1 1 4 LEU HB2 H -0.599 0.348 3.680 1.00 . A A . 4 LEU HB2 1 1 5 574 1 1 4 LEU HB3 H -0.950 -1.370 3.719 1.00 . A A . 4 LEU HB3 1 1 5 575 1 1 4 LEU HD11 H 2.042 0.493 4.748 1.00 . A A . 4 LEU HD11 1 1 5 576 1 1 4 LEU HD12 H 1.299 1.224 3.326 1.00 . A A . 4 LEU HD12 1 1 5 577 1 1 4 LEU HD13 H 2.823 0.353 3.173 1.00 . A A . 4 LEU HD13 1 1 5 578 1 1 4 LEU HD21 H 2.122 -2.567 4.300 1.00 . A A . 4 LEU HD21 1 1 5 579 1 1 4 LEU HD22 H 0.408 -2.460 4.703 1.00 . A A . 4 LEU HD22 1 1 5 580 1 1 4 LEU HD23 H 1.562 -1.362 5.460 1.00 . A A . 4 LEU HD23 1 1 5 581 1 1 4 LEU HG H 1.505 -1.332 2.513 1.00 . A A . 4 LEU HG 1 1 5 582 1 1 4 LEU N N -0.125 0.537 1.070 1.00 . A A . 4 LEU N 1 1 5 583 1 1 4 LEU O O -2.859 0.532 2.376 1.00 . A A . 4 LEU O 1 1 5 584 1 1 5 ARG C C -4.973 -1.571 2.362 1.00 . A A . 5 ARG C 1 1 5 585 1 1 5 ARG CA C -4.449 -1.197 0.988 1.00 . A A . 5 ARG CA 1 1 5 586 1 1 5 ARG CB C -4.980 -2.136 -0.074 1.00 . A A . 5 ARG CB 1 1 5 587 1 1 5 ARG CD C -3.931 -1.169 -2.116 1.00 . A A . 5 ARG CD 1 1 5 588 1 1 5 ARG CG C -5.230 -1.430 -1.375 1.00 . A A . 5 ARG CG 1 1 5 589 1 1 5 ARG CZ C -4.567 0.057 -4.157 1.00 . A A . 5 ARG CZ 1 1 5 590 1 1 5 ARG H H -2.544 -1.977 0.561 1.00 . A A . 5 ARG H 1 1 5 591 1 1 5 ARG HA H -4.744 -0.190 0.745 1.00 . A A . 5 ARG HA 1 1 5 592 1 1 5 ARG HB2 H -4.258 -2.910 -0.250 1.00 . A A . 5 ARG HB2 1 1 5 593 1 1 5 ARG HB3 H -5.905 -2.572 0.265 1.00 . A A . 5 ARG HB3 1 1 5 594 1 1 5 ARG HD2 H -3.138 -1.040 -1.389 1.00 . A A . 5 ARG HD2 1 1 5 595 1 1 5 ARG HD3 H -3.711 -2.020 -2.743 1.00 . A A . 5 ARG HD3 1 1 5 596 1 1 5 ARG HE H -3.629 0.856 -2.588 1.00 . A A . 5 ARG HE 1 1 5 597 1 1 5 ARG HG2 H -5.874 -2.030 -1.981 1.00 . A A . 5 ARG HG2 1 1 5 598 1 1 5 ARG HG3 H -5.703 -0.494 -1.163 1.00 . A A . 5 ARG HG3 1 1 5 599 1 1 5 ARG HH11 H -5.084 -1.898 -4.163 1.00 . A A . 5 ARG HH11 1 1 5 600 1 1 5 ARG HH12 H -5.515 -1.013 -5.587 1.00 . A A . 5 ARG HH12 1 1 5 601 1 1 5 ARG HH21 H -4.196 2.021 -4.459 1.00 . A A . 5 ARG HH21 1 1 5 602 1 1 5 ARG HH22 H -5.011 1.212 -5.756 1.00 . A A . 5 ARG HH22 1 1 5 603 1 1 5 ARG N N -3.008 -1.256 1.028 1.00 . A A . 5 ARG N 1 1 5 604 1 1 5 ARG NE N -4.010 0.029 -2.948 1.00 . A A . 5 ARG NE 1 1 5 605 1 1 5 ARG NH1 N -5.098 -1.042 -4.678 1.00 . A A . 5 ARG NH1 1 1 5 606 1 1 5 ARG NH2 N -4.594 1.190 -4.847 1.00 . A A . 5 ARG NH2 1 1 5 607 1 1 5 ARG O O -5.124 -2.749 2.684 1.00 . A A . 5 ARG O 1 1 5 608 1 1 6 HIS C C -5.920 0.551 5.247 1.00 . A A . 6 HIS C 1 1 5 609 1 1 6 HIS CA C -5.654 -0.779 4.549 1.00 . A A . 6 HIS CA 1 1 5 610 1 1 6 HIS CB C -4.583 -1.585 5.302 1.00 . A A . 6 HIS CB 1 1 5 611 1 1 6 HIS CD2 C -5.425 -0.994 7.694 1.00 . A A . 6 HIS CD2 1 1 5 612 1 1 6 HIS CE1 C -4.968 -2.905 8.666 1.00 . A A . 6 HIS CE1 1 1 5 613 1 1 6 HIS CG C -4.879 -1.807 6.756 1.00 . A A . 6 HIS CG 1 1 5 614 1 1 6 HIS H H -5.027 0.356 2.882 1.00 . A A . 6 HIS H 1 1 5 615 1 1 6 HIS HA H -6.568 -1.350 4.515 1.00 . A A . 6 HIS HA 1 1 5 616 1 1 6 HIS HB2 H -4.495 -2.560 4.837 1.00 . A A . 6 HIS HB2 1 1 5 617 1 1 6 HIS HB3 H -3.625 -1.067 5.224 1.00 . A A . 6 HIS HB3 1 1 5 618 1 1 6 HIS HD1 H -4.205 -3.791 6.988 1.00 . A A . 6 HIS HD1 1 1 5 619 1 1 6 HIS HD2 H -5.764 0.020 7.546 1.00 . A A . 6 HIS HD2 1 1 5 620 1 1 6 HIS HE1 H -4.871 -3.683 9.409 1.00 . A A . 6 HIS HE1 1 1 5 621 1 1 6 HIS HE2 H -5.888 -1.398 9.702 1.00 . A A . 6 HIS HE2 1 1 5 622 1 1 6 HIS N N -5.202 -0.559 3.186 1.00 . A A . 6 HIS N 1 1 5 623 1 1 6 HIS ND1 N -4.605 -2.996 7.400 1.00 . A A . 6 HIS ND1 1 1 5 624 1 1 6 HIS NE2 N -5.467 -1.701 8.871 1.00 . A A . 6 HIS NE2 1 1 5 625 1 1 6 HIS O O -7.091 0.813 5.591 1.00 . A A . 6 HIS O 1 1 6 626 1 1 1 HIS C C 5.265 1.085 -3.080 1.00 . A A . 1 HIS C 1 1 6 627 1 1 1 HIS CA C 5.422 1.798 -4.419 1.00 . A A . 1 HIS CA 1 1 6 628 1 1 1 HIS CB C 4.631 1.064 -5.503 1.00 . A A . 1 HIS CB 1 1 6 629 1 1 1 HIS CD2 C 4.830 -1.520 -5.377 1.00 . A A . 1 HIS CD2 1 1 6 630 1 1 1 HIS CE1 C 6.475 -1.784 -6.802 1.00 . A A . 1 HIS CE1 1 1 6 631 1 1 1 HIS CG C 5.178 -0.291 -5.829 1.00 . A A . 1 HIS CG 1 1 6 632 1 1 1 HIS H1 H 7.322 2.564 -4.235 1.00 . A A . 1 HIS H1 1 1 6 633 1 1 1 HIS H2 H 6.876 2.133 -5.835 1.00 . A A . 1 HIS H2 1 1 6 634 1 1 1 HIS H3 H 7.259 0.913 -4.691 1.00 . A A . 1 HIS H3 1 1 6 635 1 1 1 HIS HA H 5.048 2.807 -4.327 1.00 . A A . 1 HIS HA 1 1 6 636 1 1 1 HIS HB2 H 3.611 0.939 -5.173 1.00 . A A . 1 HIS HB2 1 1 6 637 1 1 1 HIS HB3 H 4.641 1.654 -6.408 1.00 . A A . 1 HIS HB3 1 1 6 638 1 1 1 HIS HD1 H 6.682 0.209 -7.217 1.00 . A A . 1 HIS HD1 1 1 6 639 1 1 1 HIS HD2 H 4.051 -1.742 -4.661 1.00 . A A . 1 HIS HD2 1 1 6 640 1 1 1 HIS HE1 H 7.235 -2.236 -7.421 1.00 . A A . 1 HIS HE1 1 1 6 641 1 1 1 HIS HE2 H 5.574 -3.404 -5.930 1.00 . A A . 1 HIS HE2 1 1 6 642 1 1 1 HIS N N 6.849 1.857 -4.832 1.00 . A A . 1 HIS N 1 1 6 643 1 1 1 HIS ND1 N 6.212 -0.492 -6.719 1.00 . A A . 1 HIS ND1 1 1 6 644 1 1 1 HIS NE2 N 5.651 -2.429 -5.997 1.00 . A A . 1 HIS NE2 1 1 6 645 1 1 1 HIS O O 5.912 0.069 -2.827 1.00 . A A . 1 HIS O 1 1 6 646 1 1 2 ARG C C 2.794 1.451 -0.375 1.00 . A A . 2 ARG C 1 1 6 647 1 1 2 ARG CA C 4.160 1.039 -0.912 1.00 . A A . 2 ARG CA 1 1 6 648 1 1 2 ARG CB C 5.257 1.460 0.067 1.00 . A A . 2 ARG CB 1 1 6 649 1 1 2 ARG CD C 6.484 0.689 2.120 1.00 . A A . 2 ARG CD 1 1 6 650 1 1 2 ARG CG C 5.131 0.811 1.436 1.00 . A A . 2 ARG CG 1 1 6 651 1 1 2 ARG CZ C 8.283 2.216 2.830 1.00 . A A . 2 ARG CZ 1 1 6 652 1 1 2 ARG H H 3.916 2.435 -2.484 1.00 . A A . 2 ARG H 1 1 6 653 1 1 2 ARG HA H 4.179 -0.034 -1.020 1.00 . A A . 2 ARG HA 1 1 6 654 1 1 2 ARG HB2 H 6.217 1.191 -0.348 1.00 . A A . 2 ARG HB2 1 1 6 655 1 1 2 ARG HB3 H 5.217 2.531 0.196 1.00 . A A . 2 ARG HB3 1 1 6 656 1 1 2 ARG HD2 H 6.377 0.059 2.990 1.00 . A A . 2 ARG HD2 1 1 6 657 1 1 2 ARG HD3 H 7.182 0.236 1.431 1.00 . A A . 2 ARG HD3 1 1 6 658 1 1 2 ARG HE H 6.368 2.731 2.604 1.00 . A A . 2 ARG HE 1 1 6 659 1 1 2 ARG HG2 H 4.481 1.418 2.052 1.00 . A A . 2 ARG HG2 1 1 6 660 1 1 2 ARG HG3 H 4.706 -0.179 1.318 1.00 . A A . 2 ARG HG3 1 1 6 661 1 1 2 ARG HH11 H 8.887 0.319 2.471 1.00 . A A . 2 ARG HH11 1 1 6 662 1 1 2 ARG HH12 H 10.133 1.413 2.971 1.00 . A A . 2 ARG HH12 1 1 6 663 1 1 2 ARG HH21 H 8.005 4.171 3.262 1.00 . A A . 2 ARG HH21 1 1 6 664 1 1 2 ARG HH22 H 9.632 3.599 3.421 1.00 . A A . 2 ARG HH22 1 1 6 665 1 1 2 ARG N N 4.402 1.625 -2.226 1.00 . A A . 2 ARG N 1 1 6 666 1 1 2 ARG NE N 7.004 1.989 2.537 1.00 . A A . 2 ARG NE 1 1 6 667 1 1 2 ARG NH1 N 9.174 1.235 2.751 1.00 . A A . 2 ARG NH1 1 1 6 668 1 1 2 ARG NH2 N 8.672 3.428 3.201 1.00 . A A . 2 ARG NH2 1 1 6 669 1 1 2 ARG O O 2.640 1.726 0.815 1.00 . A A . 2 ARG O 1 1 6 670 1 1 3 PHE C C -0.296 0.684 -0.296 1.00 . A A . 3 PHE C 1 1 6 671 1 1 3 PHE CA C 0.460 1.873 -0.882 1.00 . A A . 3 PHE CA 1 1 6 672 1 1 3 PHE CB C -0.275 2.427 -2.101 1.00 . A A . 3 PHE CB 1 1 6 673 1 1 3 PHE CD1 C -0.992 0.575 -3.644 1.00 . A A . 3 PHE CD1 1 1 6 674 1 1 3 PHE CD2 C 0.917 1.872 -4.243 1.00 . A A . 3 PHE CD2 1 1 6 675 1 1 3 PHE CE1 C -0.847 -0.176 -4.795 1.00 . A A . 3 PHE CE1 1 1 6 676 1 1 3 PHE CE2 C 1.068 1.124 -5.395 1.00 . A A . 3 PHE CE2 1 1 6 677 1 1 3 PHE CG C -0.113 1.606 -3.353 1.00 . A A . 3 PHE CG 1 1 6 678 1 1 3 PHE CZ C 0.185 0.099 -5.671 1.00 . A A . 3 PHE CZ 1 1 6 679 1 1 3 PHE H H 1.982 1.272 -2.191 1.00 . A A . 3 PHE H 1 1 6 680 1 1 3 PHE HA H 0.530 2.646 -0.132 1.00 . A A . 3 PHE HA 1 1 6 681 1 1 3 PHE HB2 H -1.325 2.477 -1.879 1.00 . A A . 3 PHE HB2 1 1 6 682 1 1 3 PHE HB3 H 0.101 3.422 -2.309 1.00 . A A . 3 PHE HB3 1 1 6 683 1 1 3 PHE HD1 H -1.800 0.359 -2.961 1.00 . A A . 3 PHE HD1 1 1 6 684 1 1 3 PHE HD2 H 1.609 2.673 -4.028 1.00 . A A . 3 PHE HD2 1 1 6 685 1 1 3 PHE HE1 H -1.539 -0.977 -5.009 1.00 . A A . 3 PHE HE1 1 1 6 686 1 1 3 PHE HE2 H 1.875 1.341 -6.079 1.00 . A A . 3 PHE HE2 1 1 6 687 1 1 3 PHE HZ H 0.300 -0.487 -6.572 1.00 . A A . 3 PHE HZ 1 1 6 688 1 1 3 PHE N N 1.804 1.495 -1.260 1.00 . A A . 3 PHE N 1 1 6 689 1 1 3 PHE O O -0.939 -0.077 -1.016 1.00 . A A . 3 PHE O 1 1 6 690 1 1 4 LEU C C -2.372 -0.399 1.732 1.00 . A A . 4 LEU C 1 1 6 691 1 1 4 LEU CA C -0.866 -0.568 1.711 1.00 . A A . 4 LEU CA 1 1 6 692 1 1 4 LEU CB C -0.371 -0.662 3.148 1.00 . A A . 4 LEU CB 1 1 6 693 1 1 4 LEU CD1 C 1.899 0.281 3.596 1.00 . A A . 4 LEU CD1 1 1 6 694 1 1 4 LEU CD2 C 1.349 -2.042 4.345 1.00 . A A . 4 LEU CD2 1 1 6 695 1 1 4 LEU CG C 1.116 -0.979 3.282 1.00 . A A . 4 LEU CG 1 1 6 696 1 1 4 LEU H H 0.333 1.156 1.540 1.00 . A A . 4 LEU H 1 1 6 697 1 1 4 LEU HA H -0.616 -1.479 1.200 1.00 . A A . 4 LEU HA 1 1 6 698 1 1 4 LEU HB2 H -0.569 0.282 3.635 1.00 . A A . 4 LEU HB2 1 1 6 699 1 1 4 LEU HB3 H -0.938 -1.433 3.654 1.00 . A A . 4 LEU HB3 1 1 6 700 1 1 4 LEU HD11 H 2.935 0.029 3.766 1.00 . A A . 4 LEU HD11 1 1 6 701 1 1 4 LEU HD12 H 1.490 0.749 4.478 1.00 . A A . 4 LEU HD12 1 1 6 702 1 1 4 LEU HD13 H 1.827 0.961 2.761 1.00 . A A . 4 LEU HD13 1 1 6 703 1 1 4 LEU HD21 H 0.447 -2.618 4.483 1.00 . A A . 4 LEU HD21 1 1 6 704 1 1 4 LEU HD22 H 1.618 -1.566 5.277 1.00 . A A . 4 LEU HD22 1 1 6 705 1 1 4 LEU HD23 H 2.149 -2.696 4.031 1.00 . A A . 4 LEU HD23 1 1 6 706 1 1 4 LEU HG H 1.474 -1.359 2.338 1.00 . A A . 4 LEU HG 1 1 6 707 1 1 4 LEU N N -0.204 0.527 1.021 1.00 . A A . 4 LEU N 1 1 6 708 1 1 4 LEU O O -2.892 0.482 2.416 1.00 . A A . 4 LEU O 1 1 6 709 1 1 5 ARG C C -5.002 -1.601 2.413 1.00 . A A . 5 ARG C 1 1 6 710 1 1 5 ARG CA C -4.520 -1.212 1.028 1.00 . A A . 5 ARG CA 1 1 6 711 1 1 5 ARG CB C -5.077 -2.144 -0.028 1.00 . A A . 5 ARG CB 1 1 6 712 1 1 5 ARG CD C -4.036 -1.227 -2.096 1.00 . A A . 5 ARG CD 1 1 6 713 1 1 5 ARG CG C -5.328 -1.436 -1.327 1.00 . A A . 5 ARG CG 1 1 6 714 1 1 5 ARG CZ C -4.650 -0.049 -4.172 1.00 . A A . 5 ARG CZ 1 1 6 715 1 1 5 ARG H H -2.628 -1.974 0.521 1.00 . A A . 5 ARG H 1 1 6 716 1 1 5 ARG HA H -4.825 -0.204 0.803 1.00 . A A . 5 ARG HA 1 1 6 717 1 1 5 ARG HB2 H -4.370 -2.930 -0.209 1.00 . A A . 5 ARG HB2 1 1 6 718 1 1 5 ARG HB3 H -6.005 -2.564 0.322 1.00 . A A . 5 ARG HB3 1 1 6 719 1 1 5 ARG HD2 H -3.228 -1.097 -1.385 1.00 . A A . 5 ARG HD2 1 1 6 720 1 1 5 ARG HD3 H -3.845 -2.100 -2.702 1.00 . A A . 5 ARG HD3 1 1 6 721 1 1 5 ARG HE H -3.712 0.782 -2.619 1.00 . A A . 5 ARG HE 1 1 6 722 1 1 5 ARG HG2 H -6.006 -2.016 -1.917 1.00 . A A . 5 ARG HG2 1 1 6 723 1 1 5 ARG HG3 H -5.762 -0.482 -1.111 1.00 . A A . 5 ARG HG3 1 1 6 724 1 1 5 ARG HH11 H -5.187 -1.999 -4.130 1.00 . A A . 5 ARG HH11 1 1 6 725 1 1 5 ARG HH12 H -5.602 -1.146 -5.579 1.00 . A A . 5 ARG HH12 1 1 6 726 1 1 5 ARG HH21 H -4.259 1.903 -4.523 1.00 . A A . 5 ARG HH21 1 1 6 727 1 1 5 ARG HH22 H -5.076 1.068 -5.802 1.00 . A A . 5 ARG HH22 1 1 6 728 1 1 5 ARG N N -3.080 -1.268 1.024 1.00 . A A . 5 ARG N 1 1 6 729 1 1 5 ARG NE N -4.099 -0.051 -2.960 1.00 . A A . 5 ARG NE 1 1 6 730 1 1 5 ARG NH1 N -5.190 -1.156 -4.667 1.00 . A A . 5 ARG NH1 1 1 6 731 1 1 5 ARG NH2 N -4.663 1.066 -4.892 1.00 . A A . 5 ARG NH2 1 1 6 732 1 1 5 ARG O O -5.141 -2.783 2.728 1.00 . A A . 5 ARG O 1 1 6 733 1 1 6 HIS C C -5.861 0.491 5.345 1.00 . A A . 6 HIS C 1 1 6 734 1 1 6 HIS CA C -5.618 -0.832 4.627 1.00 . A A . 6 HIS CA 1 1 6 735 1 1 6 HIS CB C -4.525 -1.646 5.339 1.00 . A A . 6 HIS CB 1 1 6 736 1 1 6 HIS CD2 C -5.293 -1.076 7.762 1.00 . A A . 6 HIS CD2 1 1 6 737 1 1 6 HIS CE1 C -4.804 -2.994 8.704 1.00 . A A . 6 HIS CE1 1 1 6 738 1 1 6 HIS CG C -4.776 -1.880 6.800 1.00 . A A . 6 HIS CG 1 1 6 739 1 1 6 HIS H H -5.044 0.321 2.953 1.00 . A A . 6 HIS H 1 1 6 740 1 1 6 HIS HA H -6.534 -1.401 4.615 1.00 . A A . 6 HIS HA 1 1 6 741 1 1 6 HIS HB2 H -4.455 -2.617 4.863 1.00 . A A . 6 HIS HB2 1 1 6 742 1 1 6 HIS HB3 H -3.570 -1.129 5.235 1.00 . A A . 6 HIS HB3 1 1 6 743 1 1 6 HIS HD1 H -4.091 -3.864 6.995 1.00 . A A . 6 HIS HD1 1 1 6 744 1 1 6 HIS HD2 H -5.638 -0.061 7.632 1.00 . A A . 6 HIS HD2 1 1 6 745 1 1 6 HIS HE1 H -4.683 -3.778 9.436 1.00 . A A . 6 HIS HE1 1 1 6 746 1 1 6 HIS HE2 H -5.531 -1.437 9.816 1.00 . A A . 6 HIS HE2 1 1 6 747 1 1 6 HIS N N -5.208 -0.598 3.254 1.00 . A A . 6 HIS N 1 1 6 748 1 1 6 HIS ND1 N -4.480 -3.074 7.425 1.00 . A A . 6 HIS ND1 1 1 6 749 1 1 6 HIS NE2 N -5.298 -1.792 8.933 1.00 . A A . 6 HIS NE2 1 1 6 750 1 1 6 HIS O O -7.037 0.901 5.448 1.00 . A A . 6 HIS O 1 1 7 751 1 1 1 HIS C C 5.121 0.984 -3.134 1.00 . A A . 1 HIS C 1 1 7 752 1 1 1 HIS CA C 5.299 1.721 -4.457 1.00 . A A . 1 HIS CA 1 1 7 753 1 1 1 HIS CB C 4.872 0.825 -5.622 1.00 . A A . 1 HIS CB 1 1 7 754 1 1 1 HIS CD2 C 5.996 1.438 -7.878 1.00 . A A . 1 HIS CD2 1 1 7 755 1 1 1 HIS CE1 C 4.421 2.737 -8.678 1.00 . A A . 1 HIS CE1 1 1 7 756 1 1 1 HIS CG C 5.001 1.483 -6.960 1.00 . A A . 1 HIS CG 1 1 7 757 1 1 1 HIS H1 H 7.261 1.262 -4.876 1.00 . A A . 1 HIS H1 1 1 7 758 1 1 1 HIS H2 H 7.048 2.570 -3.784 1.00 . A A . 1 HIS H2 1 1 7 759 1 1 1 HIS H3 H 6.744 2.789 -5.459 1.00 . A A . 1 HIS H3 1 1 7 760 1 1 1 HIS HA H 4.688 2.611 -4.450 1.00 . A A . 1 HIS HA 1 1 7 761 1 1 1 HIS HB2 H 5.487 -0.062 -5.628 1.00 . A A . 1 HIS HB2 1 1 7 762 1 1 1 HIS HB3 H 3.839 0.541 -5.488 1.00 . A A . 1 HIS HB3 1 1 7 763 1 1 1 HIS HD1 H 3.180 2.538 -7.063 1.00 . A A . 1 HIS HD1 1 1 7 764 1 1 1 HIS HD2 H 6.921 0.885 -7.794 1.00 . A A . 1 HIS HD2 1 1 7 765 1 1 1 HIS HE1 H 3.863 3.397 -9.326 1.00 . A A . 1 HIS HE1 1 1 7 766 1 1 1 HIS HE2 H 6.167 2.451 -9.709 1.00 . A A . 1 HIS HE2 1 1 7 767 1 1 1 HIS N N 6.716 2.122 -4.663 1.00 . A A . 1 HIS N 1 1 7 768 1 1 1 HIS ND1 N 4.030 2.306 -7.491 1.00 . A A . 1 HIS ND1 1 1 7 769 1 1 1 HIS NE2 N 5.610 2.225 -8.935 1.00 . A A . 1 HIS NE2 1 1 7 770 1 1 1 HIS O O 5.590 -0.143 -2.972 1.00 . A A . 1 HIS O 1 1 7 771 1 1 2 ARG C C 2.829 1.425 -0.349 1.00 . A A . 2 ARG C 1 1 7 772 1 1 2 ARG CA C 4.202 1.032 -0.882 1.00 . A A . 2 ARG CA 1 1 7 773 1 1 2 ARG CB C 5.289 1.463 0.104 1.00 . A A . 2 ARG CB 1 1 7 774 1 1 2 ARG CD C 6.561 0.772 2.156 1.00 . A A . 2 ARG CD 1 1 7 775 1 1 2 ARG CG C 5.220 0.745 1.441 1.00 . A A . 2 ARG CG 1 1 7 776 1 1 2 ARG CZ C 6.415 -0.979 3.885 1.00 . A A . 2 ARG CZ 1 1 7 777 1 1 2 ARG H H 4.092 2.523 -2.380 1.00 . A A . 2 ARG H 1 1 7 778 1 1 2 ARG HA H 4.235 -0.041 -0.996 1.00 . A A . 2 ARG HA 1 1 7 779 1 1 2 ARG HB2 H 6.256 1.267 -0.336 1.00 . A A . 2 ARG HB2 1 1 7 780 1 1 2 ARG HB3 H 5.195 2.524 0.284 1.00 . A A . 2 ARG HB3 1 1 7 781 1 1 2 ARG HD2 H 7.252 0.136 1.623 1.00 . A A . 2 ARG HD2 1 1 7 782 1 1 2 ARG HD3 H 6.933 1.786 2.156 1.00 . A A . 2 ARG HD3 1 1 7 783 1 1 2 ARG HE H 6.412 0.984 4.242 1.00 . A A . 2 ARG HE 1 1 7 784 1 1 2 ARG HG2 H 4.481 1.234 2.064 1.00 . A A . 2 ARG HG2 1 1 7 785 1 1 2 ARG HG3 H 4.932 -0.286 1.271 1.00 . A A . 2 ARG HG3 1 1 7 786 1 1 2 ARG HH11 H 6.543 -1.681 1.992 1.00 . A A . 2 ARG HH11 1 1 7 787 1 1 2 ARG HH12 H 6.440 -2.891 3.226 1.00 . A A . 2 ARG HH12 1 1 7 788 1 1 2 ARG HH21 H 6.277 -0.606 5.866 1.00 . A A . 2 ARG HH21 1 1 7 789 1 1 2 ARG HH22 H 6.288 -2.281 5.425 1.00 . A A . 2 ARG HH22 1 1 7 790 1 1 2 ARG N N 4.441 1.627 -2.191 1.00 . A A . 2 ARG N 1 1 7 791 1 1 2 ARG NE N 6.455 0.305 3.537 1.00 . A A . 2 ARG NE 1 1 7 792 1 1 2 ARG NH1 N 6.471 -1.928 2.958 1.00 . A A . 2 ARG NH1 1 1 7 793 1 1 2 ARG NH2 N 6.319 -1.317 5.163 1.00 . A A . 2 ARG NH2 1 1 7 794 1 1 2 ARG O O 2.666 1.690 0.842 1.00 . A A . 2 ARG O 1 1 7 795 1 1 3 PHE C C -0.260 0.630 -0.298 1.00 . A A . 3 PHE C 1 1 7 796 1 1 3 PHE CA C 0.494 1.829 -0.868 1.00 . A A . 3 PHE CA 1 1 7 797 1 1 3 PHE CB C -0.237 2.387 -2.089 1.00 . A A . 3 PHE CB 1 1 7 798 1 1 3 PHE CD1 C 0.972 1.839 -4.223 1.00 . A A . 3 PHE CD1 1 1 7 799 1 1 3 PHE CD2 C -0.949 0.547 -3.648 1.00 . A A . 3 PHE CD2 1 1 7 800 1 1 3 PHE CE1 C 1.129 1.097 -5.378 1.00 . A A . 3 PHE CE1 1 1 7 801 1 1 3 PHE CE2 C -0.796 -0.198 -4.802 1.00 . A A . 3 PHE CE2 1 1 7 802 1 1 3 PHE CG C -0.067 1.573 -3.344 1.00 . A A . 3 PHE CG 1 1 7 803 1 1 3 PHE CZ C 0.244 0.077 -5.668 1.00 . A A . 3 PHE CZ 1 1 7 804 1 1 3 PHE H H 2.031 1.253 -2.170 1.00 . A A . 3 PHE H 1 1 7 805 1 1 3 PHE HA H 0.551 2.597 -0.112 1.00 . A A . 3 PHE HA 1 1 7 806 1 1 3 PHE HB2 H -1.288 2.433 -1.871 1.00 . A A . 3 PHE HB2 1 1 7 807 1 1 3 PHE HB3 H 0.136 3.384 -2.290 1.00 . A A . 3 PHE HB3 1 1 7 808 1 1 3 PHE HD1 H 1.666 2.635 -3.997 1.00 . A A . 3 PHE HD1 1 1 7 809 1 1 3 PHE HD2 H -1.763 0.331 -2.974 1.00 . A A . 3 PHE HD2 1 1 7 810 1 1 3 PHE HE1 H 1.942 1.315 -6.054 1.00 . A A . 3 PHE HE1 1 1 7 811 1 1 3 PHE HE2 H -1.489 -0.996 -5.026 1.00 . A A . 3 PHE HE2 1 1 7 812 1 1 3 PHE HZ H 0.365 -0.504 -6.570 1.00 . A A . 3 PHE HZ 1 1 7 813 1 1 3 PHE N N 1.844 1.466 -1.239 1.00 . A A . 3 PHE N 1 1 7 814 1 1 3 PHE O O -0.892 -0.129 -1.031 1.00 . A A . 3 PHE O 1 1 7 815 1 1 4 LEU C C -2.353 -0.451 1.721 1.00 . A A . 4 LEU C 1 1 7 816 1 1 4 LEU CA C -0.850 -0.642 1.689 1.00 . A A . 4 LEU CA 1 1 7 817 1 1 4 LEU CB C -0.353 -0.782 3.123 1.00 . A A . 4 LEU CB 1 1 7 818 1 1 4 LEU CD1 C 1.820 0.402 3.474 1.00 . A A . 4 LEU CD1 1 1 7 819 1 1 4 LEU CD2 C 1.493 -1.903 4.396 1.00 . A A . 4 LEU CD2 1 1 7 820 1 1 4 LEU CG C 1.157 -0.947 3.260 1.00 . A A . 4 LEU CG 1 1 7 821 1 1 4 LEU H H 0.341 1.092 1.550 1.00 . A A . 4 LEU H 1 1 7 822 1 1 4 LEU HA H -0.617 -1.542 1.153 1.00 . A A . 4 LEU HA 1 1 7 823 1 1 4 LEU HB2 H -0.656 0.099 3.672 1.00 . A A . 4 LEU HB2 1 1 7 824 1 1 4 LEU HB3 H -0.837 -1.641 3.567 1.00 . A A . 4 LEU HB3 1 1 7 825 1 1 4 LEU HD11 H 2.228 0.451 4.472 1.00 . A A . 4 LEU HD11 1 1 7 826 1 1 4 LEU HD12 H 1.088 1.185 3.344 1.00 . A A . 4 LEU HD12 1 1 7 827 1 1 4 LEU HD13 H 2.614 0.528 2.753 1.00 . A A . 4 LEU HD13 1 1 7 828 1 1 4 LEU HD21 H 2.343 -2.508 4.118 1.00 . A A . 4 LEU HD21 1 1 7 829 1 1 4 LEU HD22 H 0.644 -2.541 4.592 1.00 . A A . 4 LEU HD22 1 1 7 830 1 1 4 LEU HD23 H 1.730 -1.336 5.285 1.00 . A A . 4 LEU HD23 1 1 7 831 1 1 4 LEU HG H 1.547 -1.363 2.343 1.00 . A A . 4 LEU HG 1 1 7 832 1 1 4 LEU N N -0.182 0.463 1.018 1.00 . A A . 4 LEU N 1 1 7 833 1 1 4 LEU O O -2.856 0.420 2.431 1.00 . A A . 4 LEU O 1 1 7 834 1 1 5 ARG C C -4.998 -1.564 2.400 1.00 . A A . 5 ARG C 1 1 7 835 1 1 5 ARG CA C -4.518 -1.204 1.006 1.00 . A A . 5 ARG CA 1 1 7 836 1 1 5 ARG CB C -5.099 -2.138 -0.034 1.00 . A A . 5 ARG CB 1 1 7 837 1 1 5 ARG CD C -4.045 -1.259 -2.115 1.00 . A A . 5 ARG CD 1 1 7 838 1 1 5 ARG CG C -5.340 -1.441 -1.342 1.00 . A A . 5 ARG CG 1 1 7 839 1 1 5 ARG CZ C -4.653 -0.061 -4.181 1.00 . A A . 5 ARG CZ 1 1 7 840 1 1 5 ARG H H -2.643 -1.987 0.468 1.00 . A A . 5 ARG H 1 1 7 841 1 1 5 ARG HA H -4.806 -0.193 0.770 1.00 . A A . 5 ARG HA 1 1 7 842 1 1 5 ARG HB2 H -4.408 -2.941 -0.208 1.00 . A A . 5 ARG HB2 1 1 7 843 1 1 5 ARG HB3 H -6.033 -2.533 0.324 1.00 . A A . 5 ARG HB3 1 1 7 844 1 1 5 ARG HD2 H -3.232 -1.149 -1.406 1.00 . A A . 5 ARG HD2 1 1 7 845 1 1 5 ARG HD3 H -3.876 -2.136 -2.722 1.00 . A A . 5 ARG HD3 1 1 7 846 1 1 5 ARG HE H -3.670 0.739 -2.640 1.00 . A A . 5 ARG HE 1 1 7 847 1 1 5 ARG HG2 H -6.027 -2.017 -1.924 1.00 . A A . 5 ARG HG2 1 1 7 848 1 1 5 ARG HG3 H -5.760 -0.478 -1.136 1.00 . A A . 5 ARG HG3 1 1 7 849 1 1 5 ARG HH11 H -5.242 -1.996 -4.134 1.00 . A A . 5 ARG HH11 1 1 7 850 1 1 5 ARG HH12 H -5.655 -1.130 -5.575 1.00 . A A . 5 ARG HH12 1 1 7 851 1 1 5 ARG HH21 H -4.214 1.879 -4.535 1.00 . A A . 5 ARG HH21 1 1 7 852 1 1 5 ARG HH22 H -5.071 1.070 -5.803 1.00 . A A . 5 ARG HH22 1 1 7 853 1 1 5 ARG N N -3.079 -1.288 0.992 1.00 . A A . 5 ARG N 1 1 7 854 1 1 5 ARG NE N -4.086 -0.081 -2.977 1.00 . A A . 5 ARG NE 1 1 7 855 1 1 5 ARG NH1 N -5.231 -1.152 -4.670 1.00 . A A . 5 ARG NH1 1 1 7 856 1 1 5 ARG NH2 N -4.645 1.054 -4.898 1.00 . A A . 5 ARG NH2 1 1 7 857 1 1 5 ARG O O -5.156 -2.739 2.733 1.00 . A A . 5 ARG O 1 1 7 858 1 1 6 HIS C C -5.820 0.591 5.295 1.00 . A A . 6 HIS C 1 1 7 859 1 1 6 HIS CA C -5.579 -0.748 4.606 1.00 . A A . 6 HIS CA 1 1 7 860 1 1 6 HIS CB C -4.481 -1.544 5.329 1.00 . A A . 6 HIS CB 1 1 7 861 1 1 6 HIS CD2 C -5.229 -0.913 7.743 1.00 . A A . 6 HIS CD2 1 1 7 862 1 1 6 HIS CE1 C -4.724 -2.803 8.731 1.00 . A A . 6 HIS CE1 1 1 7 863 1 1 6 HIS CG C -4.717 -1.741 6.798 1.00 . A A . 6 HIS CG 1 1 7 864 1 1 6 HIS H H -4.997 0.365 2.910 1.00 . A A . 6 HIS H 1 1 7 865 1 1 6 HIS HA H -6.494 -1.319 4.612 1.00 . A A . 6 HIS HA 1 1 7 866 1 1 6 HIS HB2 H -4.416 -2.527 4.879 1.00 . A A . 6 HIS HB2 1 1 7 867 1 1 6 HIS HB3 H -3.525 -1.032 5.202 1.00 . A A . 6 HIS HB3 1 1 7 868 1 1 6 HIS HD1 H -4.022 -3.715 7.040 1.00 . A A . 6 HIS HD1 1 1 7 869 1 1 6 HIS HD2 H -5.580 0.097 7.589 1.00 . A A . 6 HIS HD2 1 1 7 870 1 1 6 HIS HE1 H -4.593 -3.566 9.484 1.00 . A A . 6 HIS HE1 1 1 7 871 1 1 6 HIS HE2 H -5.464 -1.225 9.805 1.00 . A A . 6 HIS HE2 1 1 7 872 1 1 6 HIS N N -5.176 -0.545 3.226 1.00 . A A . 6 HIS N 1 1 7 873 1 1 6 HIS ND1 N -4.411 -2.916 7.453 1.00 . A A . 6 HIS ND1 1 1 7 874 1 1 6 HIS NE2 N -5.221 -1.598 8.932 1.00 . A A . 6 HIS NE2 1 1 7 875 1 1 6 HIS O O -6.999 0.929 5.533 1.00 . A A . 6 HIS O 1 1 8 876 1 1 1 HIS C C 5.398 1.310 -2.949 1.00 . A A . 1 HIS C 1 1 8 877 1 1 1 HIS CA C 5.573 2.097 -4.245 1.00 . A A . 1 HIS CA 1 1 8 878 1 1 1 HIS CB C 4.210 2.393 -4.877 1.00 . A A . 1 HIS CB 1 1 8 879 1 1 1 HIS CD2 C 4.123 4.792 -5.860 1.00 . A A . 1 HIS CD2 1 1 8 880 1 1 1 HIS CE1 C 3.050 5.772 -4.218 1.00 . A A . 1 HIS CE1 1 1 8 881 1 1 1 HIS CG C 3.874 3.851 -4.917 1.00 . A A . 1 HIS CG 1 1 8 882 1 1 1 HIS H1 H 5.980 0.390 -5.319 1.00 . A A . 1 HIS H1 1 1 8 883 1 1 1 HIS H2 H 7.365 1.291 -4.856 1.00 . A A . 1 HIS H2 1 1 8 884 1 1 1 HIS H3 H 6.361 1.851 -6.130 1.00 . A A . 1 HIS H3 1 1 8 885 1 1 1 HIS HA H 6.073 3.028 -4.026 1.00 . A A . 1 HIS HA 1 1 8 886 1 1 1 HIS HB2 H 4.204 2.024 -5.891 1.00 . A A . 1 HIS HB2 1 1 8 887 1 1 1 HIS HB3 H 3.440 1.889 -4.311 1.00 . A A . 1 HIS HB3 1 1 8 888 1 1 1 HIS HD1 H 2.882 4.085 -3.073 1.00 . A A . 1 HIS HD1 1 1 8 889 1 1 1 HIS HD2 H 4.637 4.639 -6.798 1.00 . A A . 1 HIS HD2 1 1 8 890 1 1 1 HIS HE1 H 2.560 6.520 -3.612 1.00 . A A . 1 HIS HE1 1 1 8 891 1 1 1 HIS HE2 H 3.711 6.850 -5.828 1.00 . A A . 1 HIS HE2 1 1 8 892 1 1 1 HIS N N 6.393 1.339 -5.226 1.00 . A A . 1 HIS N 1 1 8 893 1 1 1 HIS ND1 N 3.202 4.498 -3.902 1.00 . A A . 1 HIS ND1 1 1 8 894 1 1 1 HIS NE2 N 3.601 5.976 -5.400 1.00 . A A . 1 HIS NE2 1 1 8 895 1 1 1 HIS O O 6.106 0.333 -2.705 1.00 . A A . 1 HIS O 1 1 8 896 1 1 2 ARG C C 2.809 1.457 -0.314 1.00 . A A . 2 ARG C 1 1 8 897 1 1 2 ARG CA C 4.185 1.077 -0.852 1.00 . A A . 2 ARG CA 1 1 8 898 1 1 2 ARG CB C 5.265 1.438 0.171 1.00 . A A . 2 ARG CB 1 1 8 899 1 1 2 ARG CD C 6.484 0.626 2.212 1.00 . A A . 2 ARG CD 1 1 8 900 1 1 2 ARG CG C 5.157 0.659 1.472 1.00 . A A . 2 ARG CG 1 1 8 901 1 1 2 ARG CZ C 5.863 1.971 4.183 1.00 . A A . 2 ARG CZ 1 1 8 902 1 1 2 ARG H H 3.920 2.527 -2.372 1.00 . A A . 2 ARG H 1 1 8 903 1 1 2 ARG HA H 4.209 0.012 -1.025 1.00 . A A . 2 ARG HA 1 1 8 904 1 1 2 ARG HB2 H 6.235 1.242 -0.262 1.00 . A A . 2 ARG HB2 1 1 8 905 1 1 2 ARG HB3 H 5.189 2.491 0.400 1.00 . A A . 2 ARG HB3 1 1 8 906 1 1 2 ARG HD2 H 6.539 -0.287 2.786 1.00 . A A . 2 ARG HD2 1 1 8 907 1 1 2 ARG HD3 H 7.286 0.646 1.489 1.00 . A A . 2 ARG HD3 1 1 8 908 1 1 2 ARG HE H 7.346 2.408 2.920 1.00 . A A . 2 ARG HE 1 1 8 909 1 1 2 ARG HG2 H 4.415 1.131 2.104 1.00 . A A . 2 ARG HG2 1 1 8 910 1 1 2 ARG HG3 H 4.854 -0.358 1.247 1.00 . A A . 2 ARG HG3 1 1 8 911 1 1 2 ARG HH11 H 4.728 0.320 3.905 1.00 . A A . 2 ARG HH11 1 1 8 912 1 1 2 ARG HH12 H 4.313 1.282 5.284 1.00 . A A . 2 ARG HH12 1 1 8 913 1 1 2 ARG HH21 H 6.802 3.674 4.733 1.00 . A A . 2 ARG HH21 1 1 8 914 1 1 2 ARG HH22 H 5.491 3.186 5.754 1.00 . A A . 2 ARG HH22 1 1 8 915 1 1 2 ARG N N 4.451 1.742 -2.122 1.00 . A A . 2 ARG N 1 1 8 916 1 1 2 ARG NE N 6.634 1.764 3.117 1.00 . A A . 2 ARG NE 1 1 8 917 1 1 2 ARG NH1 N 4.888 1.121 4.481 1.00 . A A . 2 ARG NH1 1 1 8 918 1 1 2 ARG NH2 N 6.069 3.030 4.953 1.00 . A A . 2 ARG NH2 1 1 8 919 1 1 2 ARG O O 2.643 1.698 0.882 1.00 . A A . 2 ARG O 1 1 8 920 1 1 3 PHE C C -0.278 0.657 -0.279 1.00 . A A . 3 PHE C 1 1 8 921 1 1 3 PHE CA C 0.473 1.868 -0.826 1.00 . A A . 3 PHE CA 1 1 8 922 1 1 3 PHE CB C -0.259 2.450 -2.035 1.00 . A A . 3 PHE CB 1 1 8 923 1 1 3 PHE CD1 C -0.965 0.637 -3.630 1.00 . A A . 3 PHE CD1 1 1 8 924 1 1 3 PHE CD2 C 0.949 1.949 -4.181 1.00 . A A . 3 PHE CD2 1 1 8 925 1 1 3 PHE CE1 C -0.811 -0.084 -4.799 1.00 . A A . 3 PHE CE1 1 1 8 926 1 1 3 PHE CE2 C 1.109 1.230 -5.351 1.00 . A A . 3 PHE CE2 1 1 8 927 1 1 3 PHE CG C -0.087 1.661 -3.307 1.00 . A A . 3 PHE CG 1 1 8 928 1 1 3 PHE CZ C 0.227 0.213 -5.660 1.00 . A A . 3 PHE CZ 1 1 8 929 1 1 3 PHE H H 2.011 1.322 -2.141 1.00 . A A . 3 PHE H 1 1 8 930 1 1 3 PHE HA H 0.530 2.622 -0.056 1.00 . A A . 3 PHE HA 1 1 8 931 1 1 3 PHE HB2 H -1.310 2.489 -1.817 1.00 . A A . 3 PHE HB2 1 1 8 932 1 1 3 PHE HB3 H 0.112 3.451 -2.217 1.00 . A A . 3 PHE HB3 1 1 8 933 1 1 3 PHE HD1 H -1.777 0.404 -2.959 1.00 . A A . 3 PHE HD1 1 1 8 934 1 1 3 PHE HD2 H 1.639 2.744 -3.941 1.00 . A A . 3 PHE HD2 1 1 8 935 1 1 3 PHE HE1 H -1.501 -0.879 -5.038 1.00 . A A . 3 PHE HE1 1 1 8 936 1 1 3 PHE HE2 H 1.921 1.464 -6.023 1.00 . A A . 3 PHE HE2 1 1 8 937 1 1 3 PHE HZ H 0.350 -0.350 -6.574 1.00 . A A . 3 PHE HZ 1 1 8 938 1 1 3 PHE N N 1.825 1.515 -1.205 1.00 . A A . 3 PHE N 1 1 8 939 1 1 3 PHE O O -0.909 -0.088 -1.026 1.00 . A A . 3 PHE O 1 1 8 940 1 1 4 LEU C C -2.369 -0.469 1.714 1.00 . A A . 4 LEU C 1 1 8 941 1 1 4 LEU CA C -0.866 -0.653 1.684 1.00 . A A . 4 LEU CA 1 1 8 942 1 1 4 LEU CB C -0.372 -0.816 3.117 1.00 . A A . 4 LEU CB 1 1 8 943 1 1 4 LEU CD1 C 1.796 0.372 3.493 1.00 . A A . 4 LEU CD1 1 1 8 944 1 1 4 LEU CD2 C 1.475 -1.948 4.379 1.00 . A A . 4 LEU CD2 1 1 8 945 1 1 4 LEU CG C 1.139 -0.977 3.256 1.00 . A A . 4 LEU CG 1 1 8 946 1 1 4 LEU H H 0.322 1.086 1.577 1.00 . A A . 4 LEU H 1 1 8 947 1 1 4 LEU HA H -0.628 -1.543 1.133 1.00 . A A . 4 LEU HA 1 1 8 948 1 1 4 LEU HB2 H -0.681 0.054 3.681 1.00 . A A . 4 LEU HB2 1 1 8 949 1 1 4 LEU HB3 H -0.853 -1.685 3.544 1.00 . A A . 4 LEU HB3 1 1 8 950 1 1 4 LEU HD11 H 1.061 1.153 3.372 1.00 . A A . 4 LEU HD11 1 1 8 951 1 1 4 LEU HD12 H 2.591 0.512 2.777 1.00 . A A . 4 LEU HD12 1 1 8 952 1 1 4 LEU HD13 H 2.199 0.407 4.493 1.00 . A A . 4 LEU HD13 1 1 8 953 1 1 4 LEU HD21 H 0.952 -1.654 5.277 1.00 . A A . 4 LEU HD21 1 1 8 954 1 1 4 LEU HD22 H 2.540 -1.933 4.561 1.00 . A A . 4 LEU HD22 1 1 8 955 1 1 4 LEU HD23 H 1.172 -2.945 4.096 1.00 . A A . 4 LEU HD23 1 1 8 956 1 1 4 LEU HG H 1.533 -1.377 2.334 1.00 . A A . 4 LEU HG 1 1 8 957 1 1 4 LEU N N -0.200 0.465 1.034 1.00 . A A . 4 LEU N 1 1 8 958 1 1 4 LEU O O -2.877 0.398 2.426 1.00 . A A . 4 LEU O 1 1 8 959 1 1 5 ARG C C -5.009 -1.597 2.386 1.00 . A A . 5 ARG C 1 1 8 960 1 1 5 ARG CA C -4.530 -1.230 0.994 1.00 . A A . 5 ARG CA 1 1 8 961 1 1 5 ARG CB C -5.104 -2.165 -0.050 1.00 . A A . 5 ARG CB 1 1 8 962 1 1 5 ARG CD C -4.039 -1.299 -2.130 1.00 . A A . 5 ARG CD 1 1 8 963 1 1 5 ARG CG C -5.337 -1.470 -1.360 1.00 . A A . 5 ARG CG 1 1 8 964 1 1 5 ARG CZ C -4.618 -0.212 -4.266 1.00 . A A . 5 ARG CZ 1 1 8 965 1 1 5 ARG H H -2.651 -2.002 0.456 1.00 . A A . 5 ARG H 1 1 8 966 1 1 5 ARG HA H -4.823 -0.220 0.759 1.00 . A A . 5 ARG HA 1 1 8 967 1 1 5 ARG HB2 H -4.412 -2.968 -0.218 1.00 . A A . 5 ARG HB2 1 1 8 968 1 1 5 ARG HB3 H -6.040 -2.560 0.303 1.00 . A A . 5 ARG HB3 1 1 8 969 1 1 5 ARG HD2 H -3.234 -1.144 -1.422 1.00 . A A . 5 ARG HD2 1 1 8 970 1 1 5 ARG HD3 H -3.850 -2.198 -2.698 1.00 . A A . 5 ARG HD3 1 1 8 971 1 1 5 ARG HE H -3.719 0.688 -2.728 1.00 . A A . 5 ARG HE 1 1 8 972 1 1 5 ARG HG2 H -6.027 -2.043 -1.942 1.00 . A A . 5 ARG HG2 1 1 8 973 1 1 5 ARG HG3 H -5.751 -0.504 -1.159 1.00 . A A . 5 ARG HG3 1 1 8 974 1 1 5 ARG HH11 H -5.144 -2.162 -4.155 1.00 . A A . 5 ARG HH11 1 1 8 975 1 1 5 ARG HH12 H -5.533 -1.372 -5.646 1.00 . A A . 5 ARG HH12 1 1 8 976 1 1 5 ARG HH21 H -4.233 1.727 -4.687 1.00 . A A . 5 ARG HH21 1 1 8 977 1 1 5 ARG HH22 H -5.016 0.835 -5.948 1.00 . A A . 5 ARG HH22 1 1 8 978 1 1 5 ARG N N -3.091 -1.306 0.982 1.00 . A A . 5 ARG N 1 1 8 979 1 1 5 ARG NE N -4.093 -0.160 -3.043 1.00 . A A . 5 ARG NE 1 1 8 980 1 1 5 ARG NH1 N -5.141 -1.342 -4.726 1.00 . A A . 5 ARG NH1 1 1 8 981 1 1 5 ARG NH2 N -4.623 0.872 -5.030 1.00 . A A . 5 ARG NH2 1 1 8 982 1 1 5 ARG O O -5.162 -2.773 2.715 1.00 . A A . 5 ARG O 1 1 8 983 1 1 6 HIS C C -5.843 0.545 5.288 1.00 . A A . 6 HIS C 1 1 8 984 1 1 6 HIS CA C -5.597 -0.791 4.594 1.00 . A A . 6 HIS CA 1 1 8 985 1 1 6 HIS CB C -4.497 -1.587 5.314 1.00 . A A . 6 HIS CB 1 1 8 986 1 1 6 HIS CD2 C -5.240 -0.959 7.730 1.00 . A A . 6 HIS CD2 1 1 8 987 1 1 6 HIS CE1 C -4.724 -2.847 8.716 1.00 . A A . 6 HIS CE1 1 1 8 988 1 1 6 HIS CG C -4.729 -1.785 6.784 1.00 . A A . 6 HIS CG 1 1 8 989 1 1 6 HIS H H -5.019 0.332 2.902 1.00 . A A . 6 HIS H 1 1 8 990 1 1 6 HIS HA H -6.511 -1.364 4.598 1.00 . A A . 6 HIS HA 1 1 8 991 1 1 6 HIS HB2 H -4.433 -2.570 4.863 1.00 . A A . 6 HIS HB2 1 1 8 992 1 1 6 HIS HB3 H -3.542 -1.075 5.185 1.00 . A A . 6 HIS HB3 1 1 8 993 1 1 6 HIS HD1 H -4.025 -3.757 7.023 1.00 . A A . 6 HIS HD1 1 1 8 994 1 1 6 HIS HD2 H -5.595 0.049 7.577 1.00 . A A . 6 HIS HD2 1 1 8 995 1 1 6 HIS HE1 H -4.588 -3.610 9.468 1.00 . A A . 6 HIS HE1 1 1 8 996 1 1 6 HIS HE2 H -5.446 -1.265 9.797 1.00 . A A . 6 HIS HE2 1 1 8 997 1 1 6 HIS N N -5.194 -0.580 3.215 1.00 . A A . 6 HIS N 1 1 8 998 1 1 6 HIS ND1 N -4.415 -2.959 7.437 1.00 . A A . 6 HIS ND1 1 1 8 999 1 1 6 HIS NE2 N -5.225 -1.644 8.920 1.00 . A A . 6 HIS NE2 1 1 8 1000 1 1 6 HIS O O -4.929 1.396 5.271 1.00 . A A . 6 HIS O 1 1 9 1001 1 1 1 HIS C C 4.770 2.241 -2.575 1.00 . A A . 1 HIS C 1 1 9 1002 1 1 1 HIS CA C 5.139 2.770 -3.958 1.00 . A A . 1 HIS CA 1 1 9 1003 1 1 1 HIS CB C 4.191 2.200 -5.016 1.00 . A A . 1 HIS CB 1 1 9 1004 1 1 1 HIS CD2 C 2.692 3.288 -6.833 1.00 . A A . 1 HIS CD2 1 1 9 1005 1 1 1 HIS CE1 C 2.052 5.055 -5.706 1.00 . A A . 1 HIS CE1 1 1 9 1006 1 1 1 HIS CG C 3.273 3.223 -5.611 1.00 . A A . 1 HIS CG 1 1 9 1007 1 1 1 HIS H1 H 6.783 2.914 -5.188 1.00 . A A . 1 HIS H1 1 1 9 1008 1 1 1 HIS H2 H 6.551 1.368 -4.479 1.00 . A A . 1 HIS H2 1 1 9 1009 1 1 1 HIS H3 H 7.149 2.668 -3.531 1.00 . A A . 1 HIS H3 1 1 9 1010 1 1 1 HIS HA H 5.062 3.847 -3.955 1.00 . A A . 1 HIS HA 1 1 9 1011 1 1 1 HIS HB2 H 4.773 1.773 -5.818 1.00 . A A . 1 HIS HB2 1 1 9 1012 1 1 1 HIS HB3 H 3.583 1.427 -4.569 1.00 . A A . 1 HIS HB3 1 1 9 1013 1 1 1 HIS HD1 H 3.102 4.586 -4.013 1.00 . A A . 1 HIS HD1 1 1 9 1014 1 1 1 HIS HD2 H 2.802 2.569 -7.634 1.00 . A A . 1 HIS HD2 1 1 9 1015 1 1 1 HIS HE1 H 1.573 5.985 -5.437 1.00 . A A . 1 HIS HE1 1 1 9 1016 1 1 1 HIS HE2 H 1.331 4.696 -7.588 1.00 . A A . 1 HIS HE2 1 1 9 1017 1 1 1 HIS N N 6.531 2.396 -4.322 1.00 . A A . 1 HIS N 1 1 9 1018 1 1 1 HIS ND1 N 2.852 4.345 -4.930 1.00 . A A . 1 HIS ND1 1 1 9 1019 1 1 1 HIS NE2 N 1.940 4.436 -6.866 1.00 . A A . 1 HIS NE2 1 1 9 1020 1 1 1 HIS O O 4.665 3.005 -1.616 1.00 . A A . 1 HIS O 1 1 9 1021 1 1 2 ARG C C 2.899 0.853 -0.682 1.00 . A A . 2 ARG C 1 1 9 1022 1 1 2 ARG CA C 4.217 0.298 -1.216 1.00 . A A . 2 ARG CA 1 1 9 1023 1 1 2 ARG CB C 5.329 0.507 -0.186 1.00 . A A . 2 ARG CB 1 1 9 1024 1 1 2 ARG CD C 6.339 -0.495 1.885 1.00 . A A . 2 ARG CD 1 1 9 1025 1 1 2 ARG CG C 5.051 -0.161 1.150 1.00 . A A . 2 ARG CG 1 1 9 1026 1 1 2 ARG CZ C 7.875 -2.406 2.131 1.00 . A A . 2 ARG CZ 1 1 9 1027 1 1 2 ARG H H 4.673 0.373 -3.282 1.00 . A A . 2 ARG H 1 1 9 1028 1 1 2 ARG HA H 4.101 -0.759 -1.394 1.00 . A A . 2 ARG HA 1 1 9 1029 1 1 2 ARG HB2 H 6.251 0.105 -0.581 1.00 . A A . 2 ARG HB2 1 1 9 1030 1 1 2 ARG HB3 H 5.453 1.566 -0.016 1.00 . A A . 2 ARG HB3 1 1 9 1031 1 1 2 ARG HD2 H 7.130 0.134 1.504 1.00 . A A . 2 ARG HD2 1 1 9 1032 1 1 2 ARG HD3 H 6.199 -0.298 2.938 1.00 . A A . 2 ARG HD3 1 1 9 1033 1 1 2 ARG HE H 6.082 -2.484 1.258 1.00 . A A . 2 ARG HE 1 1 9 1034 1 1 2 ARG HG2 H 4.463 0.511 1.761 1.00 . A A . 2 ARG HG2 1 1 9 1035 1 1 2 ARG HG3 H 4.498 -1.076 0.975 1.00 . A A . 2 ARG HG3 1 1 9 1036 1 1 2 ARG HH11 H 8.568 -0.671 2.905 1.00 . A A . 2 ARG HH11 1 1 9 1037 1 1 2 ARG HH12 H 9.629 -2.030 3.063 1.00 . A A . 2 ARG HH12 1 1 9 1038 1 1 2 ARG HH21 H 7.476 -4.273 1.466 1.00 . A A . 2 ARG HH21 1 1 9 1039 1 1 2 ARG HH22 H 9.010 -4.075 2.246 1.00 . A A . 2 ARG HH22 1 1 9 1040 1 1 2 ARG N N 4.574 0.929 -2.481 1.00 . A A . 2 ARG N 1 1 9 1041 1 1 2 ARG NE N 6.720 -1.895 1.711 1.00 . A A . 2 ARG NE 1 1 9 1042 1 1 2 ARG NH1 N 8.763 -1.639 2.751 1.00 . A A . 2 ARG NH1 1 1 9 1043 1 1 2 ARG NH2 N 8.142 -3.690 1.932 1.00 . A A . 2 ARG NH2 1 1 9 1044 1 1 2 ARG O O 2.810 1.269 0.473 1.00 . A A . 2 ARG O 1 1 9 1045 1 1 3 PHE C C -0.230 0.299 -0.408 1.00 . A A . 3 PHE C 1 1 9 1046 1 1 3 PHE CA C 0.574 1.362 -1.154 1.00 . A A . 3 PHE CA 1 1 9 1047 1 1 3 PHE CB C -0.176 1.821 -2.404 1.00 . A A . 3 PHE CB 1 1 9 1048 1 1 3 PHE CD1 C 0.901 0.995 -4.518 1.00 . A A . 3 PHE CD1 1 1 9 1049 1 1 3 PHE CD2 C -1.020 -0.160 -3.706 1.00 . A A . 3 PHE CD2 1 1 9 1050 1 1 3 PHE CE1 C 0.977 0.124 -5.588 1.00 . A A . 3 PHE CE1 1 1 9 1051 1 1 3 PHE CE2 C -0.949 -1.034 -4.773 1.00 . A A . 3 PHE CE2 1 1 9 1052 1 1 3 PHE CG C -0.097 0.864 -3.564 1.00 . A A . 3 PHE CG 1 1 9 1053 1 1 3 PHE CZ C 0.051 -0.893 -5.715 1.00 . A A . 3 PHE CZ 1 1 9 1054 1 1 3 PHE H H 2.003 0.525 -2.438 1.00 . A A . 3 PHE H 1 1 9 1055 1 1 3 PHE HA H 0.721 2.210 -0.502 1.00 . A A . 3 PHE HA 1 1 9 1056 1 1 3 PHE HB2 H -1.214 1.948 -2.158 1.00 . A A . 3 PHE HB2 1 1 9 1057 1 1 3 PHE HB3 H 0.241 2.766 -2.728 1.00 . A A . 3 PHE HB3 1 1 9 1058 1 1 3 PHE HD1 H 1.627 1.789 -4.419 1.00 . A A . 3 PHE HD1 1 1 9 1059 1 1 3 PHE HD2 H -1.803 -0.271 -2.972 1.00 . A A . 3 PHE HD2 1 1 9 1060 1 1 3 PHE HE1 H 1.759 0.238 -6.324 1.00 . A A . 3 PHE HE1 1 1 9 1061 1 1 3 PHE HE2 H -1.675 -1.829 -4.870 1.00 . A A . 3 PHE HE2 1 1 9 1062 1 1 3 PHE HZ H 0.108 -1.575 -6.550 1.00 . A A . 3 PHE HZ 1 1 9 1063 1 1 3 PHE N N 1.877 0.859 -1.532 1.00 . A A . 3 PHE N 1 1 9 1064 1 1 3 PHE O O -0.948 -0.494 -1.014 1.00 . A A . 3 PHE O 1 1 9 1065 1 1 4 LEU C C -2.304 -0.458 1.716 1.00 . A A . 4 LEU C 1 1 9 1066 1 1 4 LEU CA C -0.804 -0.674 1.748 1.00 . A A . 4 LEU CA 1 1 9 1067 1 1 4 LEU CB C -0.334 -0.571 3.192 1.00 . A A . 4 LEU CB 1 1 9 1068 1 1 4 LEU CD1 C 1.956 0.386 3.482 1.00 . A A . 4 LEU CD1 1 1 9 1069 1 1 4 LEU CD2 C 1.341 -1.740 4.653 1.00 . A A . 4 LEU CD2 1 1 9 1070 1 1 4 LEU CG C 1.143 -0.893 3.403 1.00 . A A . 4 LEU CG 1 1 9 1071 1 1 4 LEU H H 0.495 0.938 1.341 1.00 . A A . 4 LEU H 1 1 9 1072 1 1 4 LEU HA H -0.579 -1.659 1.381 1.00 . A A . 4 LEU HA 1 1 9 1073 1 1 4 LEU HB2 H -0.520 0.437 3.535 1.00 . A A . 4 LEU HB2 1 1 9 1074 1 1 4 LEU HB3 H -0.927 -1.250 3.792 1.00 . A A . 4 LEU HB3 1 1 9 1075 1 1 4 LEU HD11 H 1.382 1.200 3.066 1.00 . A A . 4 LEU HD11 1 1 9 1076 1 1 4 LEU HD12 H 2.869 0.265 2.918 1.00 . A A . 4 LEU HD12 1 1 9 1077 1 1 4 LEU HD13 H 2.193 0.600 4.513 1.00 . A A . 4 LEU HD13 1 1 9 1078 1 1 4 LEU HD21 H 2.025 -2.547 4.436 1.00 . A A . 4 LEU HD21 1 1 9 1079 1 1 4 LEU HD22 H 0.391 -2.149 4.966 1.00 . A A . 4 LEU HD22 1 1 9 1080 1 1 4 LEU HD23 H 1.746 -1.126 5.443 1.00 . A A . 4 LEU HD23 1 1 9 1081 1 1 4 LEU HG H 1.499 -1.455 2.553 1.00 . A A . 4 LEU HG 1 1 9 1082 1 1 4 LEU N N -0.098 0.288 0.914 1.00 . A A . 4 LEU N 1 1 9 1083 1 1 4 LEU O O -2.800 0.550 2.220 1.00 . A A . 4 LEU O 1 1 9 1084 1 1 5 ARG C C -4.979 -1.458 2.566 1.00 . A A . 5 ARG C 1 1 9 1085 1 1 5 ARG CA C -4.472 -1.317 1.143 1.00 . A A . 5 ARG CA 1 1 9 1086 1 1 5 ARG CB C -5.053 -2.390 0.246 1.00 . A A . 5 ARG CB 1 1 9 1087 1 1 5 ARG CD C -3.998 -1.822 -1.938 1.00 . A A . 5 ARG CD 1 1 9 1088 1 1 5 ARG CG C -5.293 -1.888 -1.148 1.00 . A A . 5 ARG CG 1 1 9 1089 1 1 5 ARG CZ C -4.572 -1.115 -4.229 1.00 . A A . 5 ARG CZ 1 1 9 1090 1 1 5 ARG H H -2.602 -2.218 0.811 1.00 . A A . 5 ARG H 1 1 9 1091 1 1 5 ARG HA H -4.739 -0.350 0.753 1.00 . A A . 5 ARG HA 1 1 9 1092 1 1 5 ARG HB2 H -4.364 -3.211 0.190 1.00 . A A . 5 ARG HB2 1 1 9 1093 1 1 5 ARG HB3 H -5.989 -2.729 0.657 1.00 . A A . 5 ARG HB3 1 1 9 1094 1 1 5 ARG HD2 H -3.197 -1.539 -1.265 1.00 . A A . 5 ARG HD2 1 1 9 1095 1 1 5 ARG HD3 H -3.791 -2.798 -2.352 1.00 . A A . 5 ARG HD3 1 1 9 1096 1 1 5 ARG HE H -3.729 0.052 -2.847 1.00 . A A . 5 ARG HE 1 1 9 1097 1 1 5 ARG HG2 H -5.981 -2.541 -1.642 1.00 . A A . 5 ARG HG2 1 1 9 1098 1 1 5 ARG HG3 H -5.711 -0.905 -1.084 1.00 . A A . 5 ARG HG3 1 1 9 1099 1 1 5 ARG HH11 H -5.050 -3.035 -3.808 1.00 . A A . 5 ARG HH11 1 1 9 1100 1 1 5 ARG HH12 H -5.431 -2.511 -5.413 1.00 . A A . 5 ARG HH12 1 1 9 1101 1 1 5 ARG HH21 H -4.233 0.740 -4.957 1.00 . A A . 5 ARG HH21 1 1 9 1102 1 1 5 ARG HH22 H -4.968 -0.369 -6.065 1.00 . A A . 5 ARG HH22 1 1 9 1103 1 1 5 ARG N N -3.034 -1.419 1.169 1.00 . A A . 5 ARG N 1 1 9 1104 1 1 5 ARG NE N -4.071 -0.848 -3.024 1.00 . A A . 5 ARG NE 1 1 9 1105 1 1 5 ARG NH1 N -5.057 -2.319 -4.505 1.00 . A A . 5 ARG NH1 1 1 9 1106 1 1 5 ARG NH2 N -4.593 -0.171 -5.160 1.00 . A A . 5 ARG NH2 1 1 9 1107 1 1 5 ARG O O -5.159 -2.567 3.068 1.00 . A A . 5 ARG O 1 1 9 1108 1 1 6 HIS C C -5.785 1.116 5.102 1.00 . A A . 6 HIS C 1 1 9 1109 1 1 6 HIS CA C -5.588 -0.315 4.614 1.00 . A A . 6 HIS CA 1 1 9 1110 1 1 6 HIS CB C -4.534 -1.043 5.464 1.00 . A A . 6 HIS CB 1 1 9 1111 1 1 6 HIS CD2 C -5.278 -0.033 7.747 1.00 . A A . 6 HIS CD2 1 1 9 1112 1 1 6 HIS CE1 C -4.853 -1.772 9.012 1.00 . A A . 6 HIS CE1 1 1 9 1113 1 1 6 HIS CG C -4.791 -1.010 6.943 1.00 . A A . 6 HIS CG 1 1 9 1114 1 1 6 HIS H H -4.962 0.527 2.782 1.00 . A A . 6 HIS H 1 1 9 1115 1 1 6 HIS HA H -6.526 -0.844 4.683 1.00 . A A . 6 HIS HA 1 1 9 1116 1 1 6 HIS HB2 H -4.509 -2.083 5.164 1.00 . A A . 6 HIS HB2 1 1 9 1117 1 1 6 HIS HB3 H -3.555 -0.596 5.278 1.00 . A A . 6 HIS HB3 1 1 9 1118 1 1 6 HIS HD1 H -4.174 -2.951 7.484 1.00 . A A . 6 HIS HD1 1 1 9 1119 1 1 6 HIS HD2 H -5.589 0.954 7.441 1.00 . A A . 6 HIS HD2 1 1 9 1120 1 1 6 HIS HE1 H -4.757 -2.419 9.871 1.00 . A A . 6 HIS HE1 1 1 9 1121 1 1 6 HIS HE2 H -5.502 -0.014 9.834 1.00 . A A . 6 HIS HE2 1 1 9 1122 1 1 6 HIS N N -5.158 -0.324 3.227 1.00 . A A . 6 HIS N 1 1 9 1123 1 1 6 HIS ND1 N -4.535 -2.085 7.769 1.00 . A A . 6 HIS ND1 1 1 9 1124 1 1 6 HIS NE2 N -5.305 -0.533 9.026 1.00 . A A . 6 HIS NE2 1 1 9 1125 1 1 6 HIS O O -4.772 1.827 5.273 1.00 . A A . 6 HIS O 1 1 10 1126 1 1 1 HIS C C 5.266 1.078 -3.072 1.00 . A A . 1 HIS C 1 1 10 1127 1 1 1 HIS CA C 5.408 1.768 -4.425 1.00 . A A . 1 HIS CA 1 1 10 1128 1 1 1 HIS CB C 4.641 0.991 -5.496 1.00 . A A . 1 HIS CB 1 1 10 1129 1 1 1 HIS CD2 C 5.260 1.569 -7.948 1.00 . A A . 1 HIS CD2 1 1 10 1130 1 1 1 HIS CE1 C 3.785 3.155 -8.285 1.00 . A A . 1 HIS CE1 1 1 10 1131 1 1 1 HIS CG C 4.547 1.710 -6.806 1.00 . A A . 1 HIS CG 1 1 10 1132 1 1 1 HIS H1 H 7.229 0.898 -4.823 1.00 . A A . 1 HIS H1 1 1 10 1133 1 1 1 HIS H2 H 7.321 2.475 -4.152 1.00 . A A . 1 HIS H2 1 1 10 1134 1 1 1 HIS H3 H 6.863 2.263 -5.792 1.00 . A A . 1 HIS H3 1 1 10 1135 1 1 1 HIS HA H 5.006 2.768 -4.355 1.00 . A A . 1 HIS HA 1 1 10 1136 1 1 1 HIS HB2 H 5.137 0.048 -5.671 1.00 . A A . 1 HIS HB2 1 1 10 1137 1 1 1 HIS HB3 H 3.637 0.804 -5.145 1.00 . A A . 1 HIS HB3 1 1 10 1138 1 1 1 HIS HD1 H 2.967 3.048 -6.413 1.00 . A A . 1 HIS HD1 1 1 10 1139 1 1 1 HIS HD2 H 6.068 0.871 -8.118 1.00 . A A . 1 HIS HD2 1 1 10 1140 1 1 1 HIS HE1 H 3.206 3.938 -8.752 1.00 . A A . 1 HIS HE1 1 1 10 1141 1 1 1 HIS HE2 H 5.024 2.540 -9.795 1.00 . A A . 1 HIS HE2 1 1 10 1142 1 1 1 HIS N N 6.834 1.859 -4.835 1.00 . A A . 1 HIS N 1 1 10 1143 1 1 1 HIS ND1 N 3.631 2.712 -7.050 1.00 . A A . 1 HIS ND1 1 1 10 1144 1 1 1 HIS NE2 N 4.767 2.478 -8.851 1.00 . A A . 1 HIS NE2 1 1 10 1145 1 1 1 HIS O O 5.928 0.075 -2.803 1.00 . A A . 1 HIS O 1 1 10 1146 1 1 2 ARG C C 2.799 1.464 -0.368 1.00 . A A . 2 ARG C 1 1 10 1147 1 1 2 ARG CA C 4.168 1.055 -0.901 1.00 . A A . 2 ARG CA 1 1 10 1148 1 1 2 ARG CB C 5.264 1.505 0.068 1.00 . A A . 2 ARG CB 1 1 10 1149 1 1 2 ARG CD C 6.502 0.809 2.139 1.00 . A A . 2 ARG CD 1 1 10 1150 1 1 2 ARG CG C 5.150 0.881 1.449 1.00 . A A . 2 ARG CG 1 1 10 1151 1 1 2 ARG CZ C 8.597 -0.459 1.864 1.00 . A A . 2 ARG CZ 1 1 10 1152 1 1 2 ARG H H 3.899 2.419 -2.498 1.00 . A A . 2 ARG H 1 1 10 1153 1 1 2 ARG HA H 4.197 -0.019 -0.991 1.00 . A A . 2 ARG HA 1 1 10 1154 1 1 2 ARG HB2 H 6.225 1.237 -0.346 1.00 . A A . 2 ARG HB2 1 1 10 1155 1 1 2 ARG HB3 H 5.214 2.578 0.176 1.00 . A A . 2 ARG HB3 1 1 10 1156 1 1 2 ARG HD2 H 7.055 1.708 1.914 1.00 . A A . 2 ARG HD2 1 1 10 1157 1 1 2 ARG HD3 H 6.344 0.742 3.206 1.00 . A A . 2 ARG HD3 1 1 10 1158 1 1 2 ARG HE H 6.797 -1.080 1.264 1.00 . A A . 2 ARG HE 1 1 10 1159 1 1 2 ARG HG2 H 4.482 1.483 2.052 1.00 . A A . 2 ARG HG2 1 1 10 1160 1 1 2 ARG HG3 H 4.751 -0.122 1.350 1.00 . A A . 2 ARG HG3 1 1 10 1161 1 1 2 ARG HH11 H 8.815 1.333 2.776 1.00 . A A . 2 ARG HH11 1 1 10 1162 1 1 2 ARG HH12 H 10.274 0.422 2.570 1.00 . A A . 2 ARG HH12 1 1 10 1163 1 1 2 ARG HH21 H 8.715 -2.279 0.994 1.00 . A A . 2 ARG HH21 1 1 10 1164 1 1 2 ARG HH22 H 10.217 -1.628 1.559 1.00 . A A . 2 ARG HH22 1 1 10 1165 1 1 2 ARG N N 4.398 1.620 -2.225 1.00 . A A . 2 ARG N 1 1 10 1166 1 1 2 ARG NE N 7.281 -0.348 1.702 1.00 . A A . 2 ARG NE 1 1 10 1167 1 1 2 ARG NH1 N 9.285 0.512 2.452 1.00 . A A . 2 ARG NH1 1 1 10 1168 1 1 2 ARG NH2 N 9.228 -1.545 1.437 1.00 . A A . 2 ARG NH2 1 1 10 1169 1 1 2 ARG O O 2.640 1.744 0.820 1.00 . A A . 2 ARG O 1 1 10 1170 1 1 3 PHE C C -0.290 0.682 -0.299 1.00 . A A . 3 PHE C 1 1 10 1171 1 1 3 PHE CA C 0.465 1.871 -0.888 1.00 . A A . 3 PHE CA 1 1 10 1172 1 1 3 PHE CB C -0.267 2.415 -2.114 1.00 . A A . 3 PHE CB 1 1 10 1173 1 1 3 PHE CD1 C 0.940 1.841 -4.243 1.00 . A A . 3 PHE CD1 1 1 10 1174 1 1 3 PHE CD2 C -0.979 0.556 -3.650 1.00 . A A . 3 PHE CD2 1 1 10 1175 1 1 3 PHE CE1 C 1.095 1.086 -5.390 1.00 . A A . 3 PHE CE1 1 1 10 1176 1 1 3 PHE CE2 C -0.829 -0.203 -4.795 1.00 . A A . 3 PHE CE2 1 1 10 1177 1 1 3 PHE CG C -0.098 1.585 -3.359 1.00 . A A . 3 PHE CG 1 1 10 1178 1 1 3 PHE CZ C 0.210 0.062 -5.666 1.00 . A A . 3 PHE CZ 1 1 10 1179 1 1 3 PHE H H 1.996 1.271 -2.185 1.00 . A A . 3 PHE H 1 1 10 1180 1 1 3 PHE HA H 0.527 2.650 -0.142 1.00 . A A . 3 PHE HA 1 1 10 1181 1 1 3 PHE HB2 H -1.318 2.464 -1.896 1.00 . A A . 3 PHE HB2 1 1 10 1182 1 1 3 PHE HB3 H 0.107 3.409 -2.327 1.00 . A A . 3 PHE HB3 1 1 10 1183 1 1 3 PHE HD1 H 1.634 2.640 -4.028 1.00 . A A . 3 PHE HD1 1 1 10 1184 1 1 3 PHE HD2 H -1.792 0.348 -2.971 1.00 . A A . 3 PHE HD2 1 1 10 1185 1 1 3 PHE HE1 H 1.907 1.296 -6.070 1.00 . A A . 3 PHE HE1 1 1 10 1186 1 1 3 PHE HE2 H -1.522 -1.003 -5.008 1.00 . A A . 3 PHE HE2 1 1 10 1187 1 1 3 PHE HZ H 0.329 -0.530 -6.561 1.00 . A A . 3 PHE HZ 1 1 10 1188 1 1 3 PHE N N 1.813 1.498 -1.257 1.00 . A A . 3 PHE N 1 1 10 1189 1 1 3 PHE O O -0.925 -0.086 -1.019 1.00 . A A . 3 PHE O 1 1 10 1190 1 1 4 LEU C C -2.373 -0.393 1.734 1.00 . A A . 4 LEU C 1 1 10 1191 1 1 4 LEU CA C -0.866 -0.561 1.712 1.00 . A A . 4 LEU CA 1 1 10 1192 1 1 4 LEU CB C -0.371 -0.652 3.148 1.00 . A A . 4 LEU CB 1 1 10 1193 1 1 4 LEU CD1 C 1.898 0.288 3.604 1.00 . A A . 4 LEU CD1 1 1 10 1194 1 1 4 LEU CD2 C 1.347 -2.040 4.338 1.00 . A A . 4 LEU CD2 1 1 10 1195 1 1 4 LEU CG C 1.115 -0.970 3.282 1.00 . A A . 4 LEU CG 1 1 10 1196 1 1 4 LEU H H 0.326 1.168 1.538 1.00 . A A . 4 LEU H 1 1 10 1197 1 1 4 LEU HA H -0.616 -1.473 1.203 1.00 . A A . 4 LEU HA 1 1 10 1198 1 1 4 LEU HB2 H -0.568 0.293 3.634 1.00 . A A . 4 LEU HB2 1 1 10 1199 1 1 4 LEU HB3 H -0.939 -1.422 3.656 1.00 . A A . 4 LEU HB3 1 1 10 1200 1 1 4 LEU HD11 H 1.508 0.733 4.507 1.00 . A A . 4 LEU HD11 1 1 10 1201 1 1 4 LEU HD12 H 1.800 0.986 2.786 1.00 . A A . 4 LEU HD12 1 1 10 1202 1 1 4 LEU HD13 H 2.939 0.039 3.743 1.00 . A A . 4 LEU HD13 1 1 10 1203 1 1 4 LEU HD21 H 1.220 -1.609 5.321 1.00 . A A . 4 LEU HD21 1 1 10 1204 1 1 4 LEU HD22 H 2.350 -2.428 4.243 1.00 . A A . 4 LEU HD22 1 1 10 1205 1 1 4 LEU HD23 H 0.636 -2.841 4.202 1.00 . A A . 4 LEU HD23 1 1 10 1206 1 1 4 LEU HG H 1.474 -1.345 2.335 1.00 . A A . 4 LEU HG 1 1 10 1207 1 1 4 LEU N N -0.205 0.533 1.019 1.00 . A A . 4 LEU N 1 1 10 1208 1 1 4 LEU O O -2.894 0.482 2.424 1.00 . A A . 4 LEU O 1 1 10 1209 1 1 5 ARG C C -5.001 -1.600 2.407 1.00 . A A . 5 ARG C 1 1 10 1210 1 1 5 ARG CA C -4.520 -1.203 1.024 1.00 . A A . 5 ARG CA 1 1 10 1211 1 1 5 ARG CB C -5.076 -2.130 -0.036 1.00 . A A . 5 ARG CB 1 1 10 1212 1 1 5 ARG CD C -4.030 -1.202 -2.098 1.00 . A A . 5 ARG CD 1 1 10 1213 1 1 5 ARG CG C -5.325 -1.416 -1.333 1.00 . A A . 5 ARG CG 1 1 10 1214 1 1 5 ARG CZ C -4.650 -0.003 -4.160 1.00 . A A . 5 ARG CZ 1 1 10 1215 1 1 5 ARG H H -2.628 -1.959 0.511 1.00 . A A . 5 ARG H 1 1 10 1216 1 1 5 ARG HA H -4.826 -0.194 0.804 1.00 . A A . 5 ARG HA 1 1 10 1217 1 1 5 ARG HB2 H -4.369 -2.916 -0.220 1.00 . A A . 5 ARG HB2 1 1 10 1218 1 1 5 ARG HB3 H -6.005 -2.550 0.310 1.00 . A A . 5 ARG HB3 1 1 10 1219 1 1 5 ARG HD2 H -3.224 -1.079 -1.384 1.00 . A A . 5 ARG HD2 1 1 10 1220 1 1 5 ARG HD3 H -3.839 -2.071 -2.710 1.00 . A A . 5 ARG HD3 1 1 10 1221 1 1 5 ARG HE H -3.695 0.808 -2.607 1.00 . A A . 5 ARG HE 1 1 10 1222 1 1 5 ARG HG2 H -6.000 -1.994 -1.927 1.00 . A A . 5 ARG HG2 1 1 10 1223 1 1 5 ARG HG3 H -5.760 -0.463 -1.114 1.00 . A A . 5 ARG HG3 1 1 10 1224 1 1 5 ARG HH11 H -5.200 -1.950 -4.129 1.00 . A A . 5 ARG HH11 1 1 10 1225 1 1 5 ARG HH12 H -5.620 -1.083 -5.568 1.00 . A A . 5 ARG HH12 1 1 10 1226 1 1 5 ARG HH21 H -4.247 1.948 -4.498 1.00 . A A . 5 ARG HH21 1 1 10 1227 1 1 5 ARG HH22 H -5.079 1.129 -5.778 1.00 . A A . 5 ARG HH22 1 1 10 1228 1 1 5 ARG N N -3.080 -1.257 1.019 1.00 . A A . 5 ARG N 1 1 10 1229 1 1 5 ARG NE N -4.091 -0.019 -2.952 1.00 . A A . 5 ARG NE 1 1 10 1230 1 1 5 ARG NH1 N -5.202 -1.102 -4.660 1.00 . A A . 5 ARG NH1 1 1 10 1231 1 1 5 ARG NH2 N -4.660 1.116 -4.870 1.00 . A A . 5 ARG NH2 1 1 10 1232 1 1 5 ARG O O -5.138 -2.784 2.715 1.00 . A A . 5 ARG O 1 1 10 1233 1 1 6 HIS C C -5.863 0.476 5.350 1.00 . A A . 6 HIS C 1 1 10 1234 1 1 6 HIS CA C -5.616 -0.843 4.625 1.00 . A A . 6 HIS CA 1 1 10 1235 1 1 6 HIS CB C -4.522 -1.657 5.334 1.00 . A A . 6 HIS CB 1 1 10 1236 1 1 6 HIS CD2 C -5.296 -1.108 7.759 1.00 . A A . 6 HIS CD2 1 1 10 1237 1 1 6 HIS CE1 C -4.813 -3.034 8.686 1.00 . A A . 6 HIS CE1 1 1 10 1238 1 1 6 HIS CG C -4.777 -1.904 6.793 1.00 . A A . 6 HIS CG 1 1 10 1239 1 1 6 HIS H H -5.045 0.319 2.957 1.00 . A A . 6 HIS H 1 1 10 1240 1 1 6 HIS HA H -6.531 -1.415 4.611 1.00 . A A . 6 HIS HA 1 1 10 1241 1 1 6 HIS HB2 H -4.444 -2.624 4.851 1.00 . A A . 6 HIS HB2 1 1 10 1242 1 1 6 HIS HB3 H -3.568 -1.134 5.238 1.00 . A A . 6 HIS HB3 1 1 10 1243 1 1 6 HIS HD1 H -4.093 -3.890 6.973 1.00 . A A . 6 HIS HD1 1 1 10 1244 1 1 6 HIS HD2 H -5.640 -0.092 7.637 1.00 . A A . 6 HIS HD2 1 1 10 1245 1 1 6 HIS HE1 H -4.696 -3.825 9.413 1.00 . A A . 6 HIS HE1 1 1 10 1246 1 1 6 HIS HE2 H -5.707 -1.546 9.771 1.00 . A A . 6 HIS HE2 1 1 10 1247 1 1 6 HIS N N -5.207 -0.601 3.253 1.00 . A A . 6 HIS N 1 1 10 1248 1 1 6 HIS ND1 N -4.484 -3.104 7.409 1.00 . A A . 6 HIS ND1 1 1 10 1249 1 1 6 HIS NE2 N -5.307 -1.834 8.924 1.00 . A A . 6 HIS NE2 1 1 10 1250 1 1 6 HIS O O -4.956 1.335 5.339 1.00 . A A . 6 HIS O 1 1 11 1251 1 1 1 HIS C C 4.698 0.913 -3.328 1.00 . A A . 1 HIS C 1 1 11 1252 1 1 1 HIS CA C 5.025 1.822 -4.510 1.00 . A A . 1 HIS CA 1 1 11 1253 1 1 1 HIS CB C 5.208 0.992 -5.782 1.00 . A A . 1 HIS CB 1 1 11 1254 1 1 1 HIS CD2 C 6.350 2.331 -7.688 1.00 . A A . 1 HIS CD2 1 1 11 1255 1 1 1 HIS CE1 C 4.548 2.918 -8.790 1.00 . A A . 1 HIS CE1 1 1 11 1256 1 1 1 HIS CG C 5.284 1.817 -7.029 1.00 . A A . 1 HIS CG 1 1 11 1257 1 1 1 HIS H1 H 7.075 1.949 -4.400 1.00 . A A . 1 HIS H1 1 1 11 1258 1 1 1 HIS H2 H 6.235 2.951 -3.289 1.00 . A A . 1 HIS H2 1 1 11 1259 1 1 1 HIS H3 H 6.300 3.376 -4.950 1.00 . A A . 1 HIS H3 1 1 11 1260 1 1 1 HIS HA H 4.212 2.518 -4.654 1.00 . A A . 1 HIS HA 1 1 11 1261 1 1 1 HIS HB2 H 6.123 0.424 -5.704 1.00 . A A . 1 HIS HB2 1 1 11 1262 1 1 1 HIS HB3 H 4.375 0.312 -5.882 1.00 . A A . 1 HIS HB3 1 1 11 1263 1 1 1 HIS HD1 H 3.242 1.985 -7.521 1.00 . A A . 1 HIS HD1 1 1 11 1264 1 1 1 HIS HD2 H 7.389 2.226 -7.407 1.00 . A A . 1 HIS HD2 1 1 11 1265 1 1 1 HIS HE1 H 3.891 3.353 -9.529 1.00 . A A . 1 HIS HE1 1 1 11 1266 1 1 1 HIS HE2 H 6.398 3.563 -9.387 1.00 . A A . 1 HIS HE2 1 1 11 1267 1 1 1 HIS N N 6.271 2.594 -4.265 1.00 . A A . 1 HIS N 1 1 11 1268 1 1 1 HIS ND1 N 4.171 2.203 -7.745 1.00 . A A . 1 HIS ND1 1 1 11 1269 1 1 1 HIS NE2 N 5.865 3.011 -8.778 1.00 . A A . 1 HIS NE2 1 1 11 1270 1 1 1 HIS O O 4.551 -0.299 -3.485 1.00 . A A . 1 HIS O 1 1 11 1271 1 1 2 ARG C C 2.951 1.207 -0.335 1.00 . A A . 2 ARG C 1 1 11 1272 1 1 2 ARG CA C 4.277 0.753 -0.936 1.00 . A A . 2 ARG CA 1 1 11 1273 1 1 2 ARG CB C 5.399 0.910 0.091 1.00 . A A . 2 ARG CB 1 1 11 1274 1 1 2 ARG CD C 6.522 -0.326 1.972 1.00 . A A . 2 ARG CD 1 1 11 1275 1 1 2 ARG CG C 5.195 0.069 1.341 1.00 . A A . 2 ARG CG 1 1 11 1276 1 1 2 ARG CZ C 7.674 0.015 4.123 1.00 . A A . 2 ARG CZ 1 1 11 1277 1 1 2 ARG H H 4.715 2.478 -2.083 1.00 . A A . 2 ARG H 1 1 11 1278 1 1 2 ARG HA H 4.195 -0.289 -1.207 1.00 . A A . 2 ARG HA 1 1 11 1279 1 1 2 ARG HB2 H 6.334 0.619 -0.365 1.00 . A A . 2 ARG HB2 1 1 11 1280 1 1 2 ARG HB3 H 5.459 1.947 0.387 1.00 . A A . 2 ARG HB3 1 1 11 1281 1 1 2 ARG HD2 H 6.508 -1.387 2.172 1.00 . A A . 2 ARG HD2 1 1 11 1282 1 1 2 ARG HD3 H 7.318 -0.102 1.277 1.00 . A A . 2 ARG HD3 1 1 11 1283 1 1 2 ARG HE H 6.229 1.187 3.401 1.00 . A A . 2 ARG HE 1 1 11 1284 1 1 2 ARG HG2 H 4.624 0.643 2.058 1.00 . A A . 2 ARG HG2 1 1 11 1285 1 1 2 ARG HG3 H 4.651 -0.829 1.073 1.00 . A A . 2 ARG HG3 1 1 11 1286 1 1 2 ARG HH11 H 8.305 -1.600 3.081 1.00 . A A . 2 ARG HH11 1 1 11 1287 1 1 2 ARG HH12 H 9.100 -1.337 4.596 1.00 . A A . 2 ARG HH12 1 1 11 1288 1 1 2 ARG HH21 H 7.274 1.534 5.395 1.00 . A A . 2 ARG HH21 1 1 11 1289 1 1 2 ARG HH22 H 8.515 0.441 5.910 1.00 . A A . 2 ARG HH22 1 1 11 1290 1 1 2 ARG N N 4.587 1.508 -2.145 1.00 . A A . 2 ARG N 1 1 11 1291 1 1 2 ARG NE N 6.768 0.388 3.222 1.00 . A A . 2 ARG NE 1 1 11 1292 1 1 2 ARG NH1 N 8.421 -1.063 3.916 1.00 . A A . 2 ARG NH1 1 1 11 1293 1 1 2 ARG NH2 N 7.834 0.721 5.234 1.00 . A A . 2 ARG NH2 1 1 11 1294 1 1 2 ARG O O 2.844 1.414 0.875 1.00 . A A . 2 ARG O 1 1 11 1295 1 1 3 PHE C C -0.179 0.618 -0.213 1.00 . A A . 3 PHE C 1 1 11 1296 1 1 3 PHE CA C 0.633 1.795 -0.747 1.00 . A A . 3 PHE CA 1 1 11 1297 1 1 3 PHE CB C -0.098 2.469 -1.907 1.00 . A A . 3 PHE CB 1 1 11 1298 1 1 3 PHE CD1 C -0.971 0.764 -3.536 1.00 . A A . 3 PHE CD1 1 1 11 1299 1 1 3 PHE CD2 C 0.998 1.979 -4.115 1.00 . A A . 3 PHE CD2 1 1 11 1300 1 1 3 PHE CE1 C -0.905 0.080 -4.735 1.00 . A A . 3 PHE CE1 1 1 11 1301 1 1 3 PHE CE2 C 1.070 1.297 -5.315 1.00 . A A . 3 PHE CE2 1 1 11 1302 1 1 3 PHE CG C -0.021 1.720 -3.211 1.00 . A A . 3 PHE CG 1 1 11 1303 1 1 3 PHE CZ C 0.117 0.347 -5.625 1.00 . A A . 3 PHE CZ 1 1 11 1304 1 1 3 PHE H H 2.083 1.194 -2.134 1.00 . A A . 3 PHE H 1 1 11 1305 1 1 3 PHE HA H 0.769 2.514 0.047 1.00 . A A . 3 PHE HA 1 1 11 1306 1 1 3 PHE HB2 H -1.136 2.569 -1.650 1.00 . A A . 3 PHE HB2 1 1 11 1307 1 1 3 PHE HB3 H 0.333 3.450 -2.065 1.00 . A A . 3 PHE HB3 1 1 11 1308 1 1 3 PHE HD1 H -1.770 0.555 -2.842 1.00 . A A . 3 PHE HD1 1 1 11 1309 1 1 3 PHE HD2 H 1.744 2.722 -3.873 1.00 . A A . 3 PHE HD2 1 1 11 1310 1 1 3 PHE HE1 H -1.651 -0.663 -4.975 1.00 . A A . 3 PHE HE1 1 1 11 1311 1 1 3 PHE HE2 H 1.870 1.507 -6.009 1.00 . A A . 3 PHE HE2 1 1 11 1312 1 1 3 PHE HZ H 0.171 -0.187 -6.562 1.00 . A A . 3 PHE HZ 1 1 11 1313 1 1 3 PHE N N 1.943 1.365 -1.186 1.00 . A A . 3 PHE N 1 1 11 1314 1 1 3 PHE O O -0.884 -0.058 -0.959 1.00 . A A . 3 PHE O 1 1 11 1315 1 1 4 LEU C C -2.279 -0.499 1.706 1.00 . A A . 4 LEU C 1 1 11 1316 1 1 4 LEU CA C -0.779 -0.714 1.734 1.00 . A A . 4 LEU CA 1 1 11 1317 1 1 4 LEU CB C -0.336 -0.854 3.187 1.00 . A A . 4 LEU CB 1 1 11 1318 1 1 4 LEU CD1 C 1.896 0.213 3.569 1.00 . A A . 4 LEU CD1 1 1 11 1319 1 1 4 LEU CD2 C 1.403 -2.039 4.549 1.00 . A A . 4 LEU CD2 1 1 11 1320 1 1 4 LEU CG C 1.158 -1.102 3.376 1.00 . A A . 4 LEU CG 1 1 11 1321 1 1 4 LEU H H 0.516 0.946 1.629 1.00 . A A . 4 LEU H 1 1 11 1322 1 1 4 LEU HA H -0.542 -1.623 1.210 1.00 . A A . 4 LEU HA 1 1 11 1323 1 1 4 LEU HB2 H -0.606 0.052 3.711 1.00 . A A . 4 LEU HB2 1 1 11 1324 1 1 4 LEU HB3 H -0.881 -1.677 3.630 1.00 . A A . 4 LEU HB3 1 1 11 1325 1 1 4 LEU HD11 H 1.201 1.033 3.473 1.00 . A A . 4 LEU HD11 1 1 11 1326 1 1 4 LEU HD12 H 2.666 0.304 2.817 1.00 . A A . 4 LEU HD12 1 1 11 1327 1 1 4 LEU HD13 H 2.347 0.235 4.550 1.00 . A A . 4 LEU HD13 1 1 11 1328 1 1 4 LEU HD21 H 2.441 -2.338 4.561 1.00 . A A . 4 LEU HD21 1 1 11 1329 1 1 4 LEU HD22 H 0.778 -2.914 4.448 1.00 . A A . 4 LEU HD22 1 1 11 1330 1 1 4 LEU HD23 H 1.164 -1.531 5.472 1.00 . A A . 4 LEU HD23 1 1 11 1331 1 1 4 LEU HG H 1.549 -1.569 2.484 1.00 . A A . 4 LEU HG 1 1 11 1332 1 1 4 LEU N N -0.067 0.378 1.089 1.00 . A A . 4 LEU N 1 1 11 1333 1 1 4 LEU O O -2.790 0.423 2.342 1.00 . A A . 4 LEU O 1 1 11 1334 1 1 5 ARG C C -4.959 -1.522 2.366 1.00 . A A . 5 ARG C 1 1 11 1335 1 1 5 ARG CA C -4.430 -1.273 0.966 1.00 . A A . 5 ARG CA 1 1 11 1336 1 1 5 ARG CB C -4.981 -2.282 -0.018 1.00 . A A . 5 ARG CB 1 1 11 1337 1 1 5 ARG CD C -3.758 -1.707 -2.110 1.00 . A A . 5 ARG CD 1 1 11 1338 1 1 5 ARG CG C -5.101 -1.714 -1.402 1.00 . A A . 5 ARG CG 1 1 11 1339 1 1 5 ARG CZ C -4.069 -1.418 -4.541 1.00 . A A . 5 ARG CZ 1 1 11 1340 1 1 5 ARG H H -2.551 -2.109 0.545 1.00 . A A . 5 ARG H 1 1 11 1341 1 1 5 ARG HA H -4.698 -0.281 0.641 1.00 . A A . 5 ARG HA 1 1 11 1342 1 1 5 ARG HB2 H -4.317 -3.126 -0.062 1.00 . A A . 5 ARG HB2 1 1 11 1343 1 1 5 ARG HB3 H -5.952 -2.603 0.309 1.00 . A A . 5 ARG HB3 1 1 11 1344 1 1 5 ARG HD2 H -3.017 -1.285 -1.441 1.00 . A A . 5 ARG HD2 1 1 11 1345 1 1 5 ARG HD3 H -3.486 -2.723 -2.352 1.00 . A A . 5 ARG HD3 1 1 11 1346 1 1 5 ARG HE H -3.608 0.041 -3.261 1.00 . A A . 5 ARG HE 1 1 11 1347 1 1 5 ARG HG2 H -5.799 -2.299 -1.961 1.00 . A A . 5 ARG HG2 1 1 11 1348 1 1 5 ARG HG3 H -5.456 -0.707 -1.321 1.00 . A A . 5 ARG HG3 1 1 11 1349 1 1 5 ARG HH11 H -4.352 -3.314 -3.893 1.00 . A A . 5 ARG HH11 1 1 11 1350 1 1 5 ARG HH12 H -4.548 -3.075 -5.595 1.00 . A A . 5 ARG HH12 1 1 11 1351 1 1 5 ARG HH21 H -3.871 0.351 -5.499 1.00 . A A . 5 ARG HH21 1 1 11 1352 1 1 5 ARG HH22 H -4.277 -0.998 -6.507 1.00 . A A . 5 ARG HH22 1 1 11 1353 1 1 5 ARG N N -2.993 -1.372 1.009 1.00 . A A . 5 ARG N 1 1 11 1354 1 1 5 ARG NE N -3.796 -0.916 -3.337 1.00 . A A . 5 ARG NE 1 1 11 1355 1 1 5 ARG NH1 N -4.346 -2.708 -4.687 1.00 . A A . 5 ARG NH1 1 1 11 1356 1 1 5 ARG NH2 N -4.073 -0.623 -5.603 1.00 . A A . 5 ARG NH2 1 1 11 1357 1 1 5 ARG O O -5.143 -2.666 2.780 1.00 . A A . 5 ARG O 1 1 11 1358 1 1 6 HIS C C -5.817 0.851 5.075 1.00 . A A . 6 HIS C 1 1 11 1359 1 1 6 HIS CA C -5.602 -0.539 4.485 1.00 . A A . 6 HIS CA 1 1 11 1360 1 1 6 HIS CB C -4.551 -1.319 5.292 1.00 . A A . 6 HIS CB 1 1 11 1361 1 1 6 HIS CD2 C -5.332 -0.483 7.633 1.00 . A A . 6 HIS CD2 1 1 11 1362 1 1 6 HIS CE1 C -4.897 -2.302 8.776 1.00 . A A . 6 HIS CE1 1 1 11 1363 1 1 6 HIS CG C -4.823 -1.394 6.767 1.00 . A A . 6 HIS CG 1 1 11 1364 1 1 6 HIS H H -4.950 0.441 2.731 1.00 . A A . 6 HIS H 1 1 11 1365 1 1 6 HIS HA H -6.535 -1.079 4.501 1.00 . A A . 6 HIS HA 1 1 11 1366 1 1 6 HIS HB2 H -4.518 -2.336 4.919 1.00 . A A . 6 HIS HB2 1 1 11 1367 1 1 6 HIS HB3 H -3.573 -0.857 5.147 1.00 . A A . 6 HIS HB3 1 1 11 1368 1 1 6 HIS HD1 H -4.185 -3.361 7.177 1.00 . A A . 6 HIS HD1 1 1 11 1369 1 1 6 HIS HD2 H -5.652 0.520 7.394 1.00 . A A . 6 HIS HD2 1 1 11 1370 1 1 6 HIS HE1 H -4.802 -3.007 9.588 1.00 . A A . 6 HIS HE1 1 1 11 1371 1 1 6 HIS HE2 H -5.611 -0.626 9.709 1.00 . A A . 6 HIS HE2 1 1 11 1372 1 1 6 HIS N N -5.152 -0.441 3.108 1.00 . A A . 6 HIS N 1 1 11 1373 1 1 6 HIS ND1 N -4.561 -2.522 7.517 1.00 . A A . 6 HIS ND1 1 1 11 1374 1 1 6 HIS NE2 N -5.366 -1.073 8.872 1.00 . A A . 6 HIS NE2 1 1 11 1375 1 1 6 HIS O O -6.989 1.262 5.205 1.00 . A A . 6 HIS O 1 1 12 1376 1 1 1 HIS C C 5.316 0.965 -3.124 1.00 . A A . 1 HIS C 1 1 12 1377 1 1 1 HIS CA C 5.441 1.621 -4.495 1.00 . A A . 1 HIS CA 1 1 12 1378 1 1 1 HIS CB C 5.420 0.556 -5.592 1.00 . A A . 1 HIS CB 1 1 12 1379 1 1 1 HIS CD2 C 5.199 0.740 -8.170 1.00 . A A . 1 HIS CD2 1 1 12 1380 1 1 1 HIS CE1 C 3.582 2.218 -8.249 1.00 . A A . 1 HIS CE1 1 1 12 1381 1 1 1 HIS CG C 4.869 1.050 -6.894 1.00 . A A . 1 HIS CG 1 1 12 1382 1 1 1 HIS H1 H 7.483 1.714 -4.729 1.00 . A A . 1 HIS H1 1 1 12 1383 1 1 1 HIS H2 H 6.819 2.944 -3.733 1.00 . A A . 1 HIS H2 1 1 12 1384 1 1 1 HIS H3 H 6.623 3.017 -5.436 1.00 . A A . 1 HIS H3 1 1 12 1385 1 1 1 HIS HA H 4.611 2.296 -4.639 1.00 . A A . 1 HIS HA 1 1 12 1386 1 1 1 HIS HB2 H 6.427 0.211 -5.769 1.00 . A A . 1 HIS HB2 1 1 12 1387 1 1 1 HIS HB3 H 4.811 -0.275 -5.267 1.00 . A A . 1 HIS HB3 1 1 12 1388 1 1 1 HIS HD1 H 3.398 2.400 -6.219 1.00 . A A . 1 HIS HD1 1 1 12 1389 1 1 1 HIS HD2 H 5.962 0.041 -8.483 1.00 . A A . 1 HIS HD2 1 1 12 1390 1 1 1 HIS HE1 H 2.831 2.902 -8.618 1.00 . A A . 1 HIS HE1 1 1 12 1391 1 1 1 HIS HE2 H 4.334 1.395 -9.967 1.00 . A A . 1 HIS HE2 1 1 12 1392 1 1 1 HIS N N 6.705 2.394 -4.609 1.00 . A A . 1 HIS N 1 1 12 1393 1 1 1 HIS ND1 N 3.853 1.979 -6.978 1.00 . A A . 1 HIS ND1 1 1 12 1394 1 1 1 HIS NE2 N 4.385 1.479 -8.992 1.00 . A A . 1 HIS NE2 1 1 12 1395 1 1 1 HIS O O 6.042 0.022 -2.808 1.00 . A A . 1 HIS O 1 1 12 1396 1 1 2 ARG C C 2.822 1.381 -0.426 1.00 . A A . 2 ARG C 1 1 12 1397 1 1 2 ARG CA C 4.172 0.934 -0.976 1.00 . A A . 2 ARG CA 1 1 12 1398 1 1 2 ARG CB C 5.294 1.377 -0.034 1.00 . A A . 2 ARG CB 1 1 12 1399 1 1 2 ARG CD C 6.578 0.717 2.021 1.00 . A A . 2 ARG CD 1 1 12 1400 1 1 2 ARG CG C 5.216 0.746 1.346 1.00 . A A . 2 ARG CG 1 1 12 1401 1 1 2 ARG CZ C 6.586 2.801 3.337 1.00 . A A . 2 ARG CZ 1 1 12 1402 1 1 2 ARG H H 3.845 2.222 -2.623 1.00 . A A . 2 ARG H 1 1 12 1403 1 1 2 ARG HA H 4.178 -0.143 -1.047 1.00 . A A . 2 ARG HA 1 1 12 1404 1 1 2 ARG HB2 H 6.243 1.112 -0.475 1.00 . A A . 2 ARG HB2 1 1 12 1405 1 1 2 ARG HB3 H 5.248 2.450 0.081 1.00 . A A . 2 ARG HB3 1 1 12 1406 1 1 2 ARG HD2 H 6.501 0.148 2.935 1.00 . A A . 2 ARG HD2 1 1 12 1407 1 1 2 ARG HD3 H 7.284 0.239 1.358 1.00 . A A . 2 ARG HD3 1 1 12 1408 1 1 2 ARG HE H 7.774 2.428 1.777 1.00 . A A . 2 ARG HE 1 1 12 1409 1 1 2 ARG HG2 H 4.535 1.323 1.959 1.00 . A A . 2 ARG HG2 1 1 12 1410 1 1 2 ARG HG3 H 4.851 -0.269 1.248 1.00 . A A . 2 ARG HG3 1 1 12 1411 1 1 2 ARG HH11 H 5.242 1.423 3.958 1.00 . A A . 2 ARG HH11 1 1 12 1412 1 1 2 ARG HH12 H 5.267 2.897 4.866 1.00 . A A . 2 ARG HH12 1 1 12 1413 1 1 2 ARG HH21 H 7.808 4.368 2.970 1.00 . A A . 2 ARG HH21 1 1 12 1414 1 1 2 ARG HH22 H 6.724 4.569 4.306 1.00 . A A . 2 ARG HH22 1 1 12 1415 1 1 2 ARG N N 4.392 1.471 -2.313 1.00 . A A . 2 ARG N 1 1 12 1416 1 1 2 ARG NE N 7.060 2.060 2.338 1.00 . A A . 2 ARG NE 1 1 12 1417 1 1 2 ARG NH1 N 5.619 2.335 4.117 1.00 . A A . 2 ARG NH1 1 1 12 1418 1 1 2 ARG NH2 N 7.080 4.012 3.555 1.00 . A A . 2 ARG NH2 1 1 12 1419 1 1 2 ARG O O 2.694 1.696 0.757 1.00 . A A . 2 ARG O 1 1 12 1420 1 1 3 PHE C C -0.282 0.662 -0.274 1.00 . A A . 3 PHE C 1 1 12 1421 1 1 3 PHE CA C 0.484 1.819 -0.910 1.00 . A A . 3 PHE CA 1 1 12 1422 1 1 3 PHE CB C -0.260 2.343 -2.138 1.00 . A A . 3 PHE CB 1 1 12 1423 1 1 3 PHE CD1 C 0.900 1.728 -4.280 1.00 . A A . 3 PHE CD1 1 1 12 1424 1 1 3 PHE CD2 C -0.995 0.443 -3.614 1.00 . A A . 3 PHE CD2 1 1 12 1425 1 1 3 PHE CE1 C 1.036 0.947 -5.413 1.00 . A A . 3 PHE CE1 1 1 12 1426 1 1 3 PHE CE2 C -0.864 -0.341 -4.744 1.00 . A A . 3 PHE CE2 1 1 12 1427 1 1 3 PHE CG C -0.115 1.486 -3.367 1.00 . A A . 3 PHE CG 1 1 12 1428 1 1 3 PHE CZ C 0.153 -0.089 -5.644 1.00 . A A . 3 PHE CZ 1 1 12 1429 1 1 3 PHE H H 1.978 1.157 -2.221 1.00 . A A . 3 PHE H 1 1 12 1430 1 1 3 PHE HA H 0.576 2.616 -0.188 1.00 . A A . 3 PHE HA 1 1 12 1431 1 1 3 PHE HB2 H -1.307 2.407 -1.906 1.00 . A A . 3 PHE HB2 1 1 12 1432 1 1 3 PHE HB3 H 0.121 3.329 -2.377 1.00 . A A . 3 PHE HB3 1 1 12 1433 1 1 3 PHE HD1 H 1.593 2.537 -4.100 1.00 . A A . 3 PHE HD1 1 1 12 1434 1 1 3 PHE HD2 H -1.790 0.245 -2.913 1.00 . A A . 3 PHE HD2 1 1 12 1435 1 1 3 PHE HE1 H 1.831 1.148 -6.116 1.00 . A A . 3 PHE HE1 1 1 12 1436 1 1 3 PHE HE2 H -1.556 -1.151 -4.923 1.00 . A A . 3 PHE HE2 1 1 12 1437 1 1 3 PHE HZ H 0.257 -0.700 -6.529 1.00 . A A . 3 PHE HZ 1 1 12 1438 1 1 3 PHE N N 1.818 1.410 -1.295 1.00 . A A . 3 PHE N 1 1 12 1439 1 1 3 PHE O O -0.945 -0.113 -0.961 1.00 . A A . 3 PHE O 1 1 12 1440 1 1 4 LEU C C -2.358 -0.351 1.762 1.00 . A A . 4 LEU C 1 1 12 1441 1 1 4 LEU CA C -0.851 -0.516 1.778 1.00 . A A . 4 LEU CA 1 1 12 1442 1 1 4 LEU CB C -0.388 -0.541 3.229 1.00 . A A . 4 LEU CB 1 1 12 1443 1 1 4 LEU CD1 C 1.855 0.481 3.636 1.00 . A A . 4 LEU CD1 1 1 12 1444 1 1 4 LEU CD2 C 1.334 -1.782 4.565 1.00 . A A . 4 LEU CD2 1 1 12 1445 1 1 4 LEU CG C 1.101 -0.816 3.413 1.00 . A A . 4 LEU CG 1 1 12 1446 1 1 4 LEU H H 0.373 1.186 1.540 1.00 . A A . 4 LEU H 1 1 12 1447 1 1 4 LEU HA H -0.590 -1.450 1.316 1.00 . A A . 4 LEU HA 1 1 12 1448 1 1 4 LEU HB2 H -0.620 0.418 3.672 1.00 . A A . 4 LEU HB2 1 1 12 1449 1 1 4 LEU HB3 H -0.951 -1.303 3.752 1.00 . A A . 4 LEU HB3 1 1 12 1450 1 1 4 LEU HD11 H 2.794 0.446 3.105 1.00 . A A . 4 LEU HD11 1 1 12 1451 1 1 4 LEU HD12 H 2.040 0.615 4.691 1.00 . A A . 4 LEU HD12 1 1 12 1452 1 1 4 LEU HD13 H 1.263 1.305 3.266 1.00 . A A . 4 LEU HD13 1 1 12 1453 1 1 4 LEU HD21 H 0.774 -2.690 4.393 1.00 . A A . 4 LEU HD21 1 1 12 1454 1 1 4 LEU HD22 H 1.006 -1.327 5.488 1.00 . A A . 4 LEU HD22 1 1 12 1455 1 1 4 LEU HD23 H 2.386 -2.015 4.633 1.00 . A A . 4 LEU HD23 1 1 12 1456 1 1 4 LEU HG H 1.485 -1.267 2.510 1.00 . A A . 4 LEU HG 1 1 12 1457 1 1 4 LEU N N -0.178 0.547 1.046 1.00 . A A . 4 LEU N 1 1 12 1458 1 1 4 LEU O O -2.895 0.546 2.412 1.00 . A A . 4 LEU O 1 1 12 1459 1 1 5 ARG C C -4.996 -1.579 2.414 1.00 . A A . 5 ARG C 1 1 12 1460 1 1 5 ARG CA C -4.489 -1.186 1.039 1.00 . A A . 5 ARG CA 1 1 12 1461 1 1 5 ARG CB C -5.028 -2.114 -0.030 1.00 . A A . 5 ARG CB 1 1 12 1462 1 1 5 ARG CD C -3.997 -1.109 -2.063 1.00 . A A . 5 ARG CD 1 1 12 1463 1 1 5 ARG CG C -5.290 -1.390 -1.319 1.00 . A A . 5 ARG CG 1 1 12 1464 1 1 5 ARG CZ C -4.624 0.101 -4.119 1.00 . A A . 5 ARG CZ 1 1 12 1465 1 1 5 ARG H H -2.586 -1.957 0.590 1.00 . A A . 5 ARG H 1 1 12 1466 1 1 5 ARG HA H -4.790 -0.178 0.812 1.00 . A A . 5 ARG HA 1 1 12 1467 1 1 5 ARG HB2 H -4.306 -2.884 -0.222 1.00 . A A . 5 ARG HB2 1 1 12 1468 1 1 5 ARG HB3 H -5.949 -2.556 0.312 1.00 . A A . 5 ARG HB3 1 1 12 1469 1 1 5 ARG HD2 H -3.204 -0.967 -1.338 1.00 . A A . 5 ARG HD2 1 1 12 1470 1 1 5 ARG HD3 H -3.763 -1.957 -2.690 1.00 . A A . 5 ARG HD3 1 1 12 1471 1 1 5 ARG HE H -3.746 0.925 -2.527 1.00 . A A . 5 ARG HE 1 1 12 1472 1 1 5 ARG HG2 H -5.933 -1.986 -1.930 1.00 . A A . 5 ARG HG2 1 1 12 1473 1 1 5 ARG HG3 H -5.769 -0.461 -1.091 1.00 . A A . 5 ARG HG3 1 1 12 1474 1 1 5 ARG HH11 H -5.088 -1.868 -4.135 1.00 . A A . 5 ARG HH11 1 1 12 1475 1 1 5 ARG HH12 H -5.510 -0.994 -5.569 1.00 . A A . 5 ARG HH12 1 1 12 1476 1 1 5 ARG HH21 H -4.300 2.074 -4.413 1.00 . A A . 5 ARG HH21 1 1 12 1477 1 1 5 ARG HH22 H -5.063 1.243 -5.727 1.00 . A A . 5 ARG HH22 1 1 12 1478 1 1 5 ARG N N -3.049 -1.240 1.063 1.00 . A A . 5 ARG N 1 1 12 1479 1 1 5 ARG NE N -4.095 0.087 -2.897 1.00 . A A . 5 ARG NE 1 1 12 1480 1 1 5 ARG NH1 N -5.114 -1.012 -4.651 1.00 . A A . 5 ARG NH1 1 1 12 1481 1 1 5 ARG NH2 N -4.665 1.232 -4.809 1.00 . A A . 5 ARG NH2 1 1 12 1482 1 1 5 ARG O O -5.140 -2.761 2.724 1.00 . A A . 5 ARG O 1 1 12 1483 1 1 6 HIS C C -5.945 0.507 5.321 1.00 . A A . 6 HIS C 1 1 12 1484 1 1 6 HIS CA C -5.655 -0.814 4.616 1.00 . A A . 6 HIS CA 1 1 12 1485 1 1 6 HIS CB C -4.560 -1.597 5.359 1.00 . A A . 6 HIS CB 1 1 12 1486 1 1 6 HIS CD2 C -5.406 -1.045 7.759 1.00 . A A . 6 HIS CD2 1 1 12 1487 1 1 6 HIS CE1 C -4.897 -2.951 8.716 1.00 . A A . 6 HIS CE1 1 1 12 1488 1 1 6 HIS CG C -4.845 -1.837 6.813 1.00 . A A . 6 HIS CG 1 1 12 1489 1 1 6 HIS H H -5.051 0.342 2.955 1.00 . A A . 6 HIS H 1 1 12 1490 1 1 6 HIS HA H -6.556 -1.405 4.587 1.00 . A A . 6 HIS HA 1 1 12 1491 1 1 6 HIS HB2 H -4.450 -2.566 4.886 1.00 . A A . 6 HIS HB2 1 1 12 1492 1 1 6 HIS HB3 H -3.617 -1.054 5.281 1.00 . A A . 6 HIS HB3 1 1 12 1493 1 1 6 HIS HD1 H -4.118 -3.804 7.028 1.00 . A A . 6 HIS HD1 1 1 12 1494 1 1 6 HIS HD2 H -5.772 -0.039 7.619 1.00 . A A . 6 HIS HD2 1 1 12 1495 1 1 6 HIS HE1 H -4.777 -3.731 9.452 1.00 . A A . 6 HIS HE1 1 1 12 1496 1 1 6 HIS HE2 H -5.850 -1.474 9.766 1.00 . A A . 6 HIS HE2 1 1 12 1497 1 1 6 HIS N N -5.219 -0.577 3.252 1.00 . A A . 6 HIS N 1 1 12 1498 1 1 6 HIS ND1 N -4.537 -3.024 7.447 1.00 . A A . 6 HIS ND1 1 1 12 1499 1 1 6 HIS NE2 N -5.426 -1.761 8.930 1.00 . A A . 6 HIS NE2 1 1 12 1500 1 1 6 HIS O O -4.983 1.152 5.788 1.00 . A A . 6 HIS O 1 1 13 1501 1 1 1 HIS C C 4.620 2.170 -2.681 1.00 . A A . 1 HIS C 1 1 13 1502 1 1 1 HIS CA C 4.960 2.515 -4.128 1.00 . A A . 1 HIS CA 1 1 13 1503 1 1 1 HIS CB C 4.273 1.540 -5.088 1.00 . A A . 1 HIS CB 1 1 13 1504 1 1 1 HIS CD2 C 3.362 1.937 -7.484 1.00 . A A . 1 HIS CD2 1 1 13 1505 1 1 1 HIS CE1 C 2.124 3.698 -7.068 1.00 . A A . 1 HIS CE1 1 1 13 1506 1 1 1 HIS CG C 3.483 2.217 -6.164 1.00 . A A . 1 HIS CG 1 1 13 1507 1 1 1 HIS H1 H 6.873 3.190 -3.781 1.00 . A A . 1 HIS H1 1 1 13 1508 1 1 1 HIS H2 H 6.593 2.622 -5.376 1.00 . A A . 1 HIS H2 1 1 13 1509 1 1 1 HIS H3 H 6.753 1.507 -4.082 1.00 . A A . 1 HIS H3 1 1 13 1510 1 1 1 HIS HA H 4.622 3.519 -4.340 1.00 . A A . 1 HIS HA 1 1 13 1511 1 1 1 HIS HB2 H 5.023 0.926 -5.564 1.00 . A A . 1 HIS HB2 1 1 13 1512 1 1 1 HIS HB3 H 3.600 0.907 -4.528 1.00 . A A . 1 HIS HB3 1 1 13 1513 1 1 1 HIS HD1 H 2.573 3.773 -5.073 1.00 . A A . 1 HIS HD1 1 1 13 1514 1 1 1 HIS HD2 H 3.845 1.129 -8.015 1.00 . A A . 1 HIS HD2 1 1 13 1515 1 1 1 HIS HE1 H 1.454 4.536 -7.192 1.00 . A A . 1 HIS HE1 1 1 13 1516 1 1 1 HIS HE2 H 2.308 2.974 -8.975 1.00 . A A . 1 HIS HE2 1 1 13 1517 1 1 1 HIS N N 6.427 2.453 -4.363 1.00 . A A . 1 HIS N 1 1 13 1518 1 1 1 HIS ND1 N 2.696 3.326 -5.936 1.00 . A A . 1 HIS ND1 1 1 13 1519 1 1 1 HIS NE2 N 2.513 2.873 -8.022 1.00 . A A . 1 HIS NE2 1 1 13 1520 1 1 1 HIS O O 4.369 3.057 -1.865 1.00 . A A . 1 HIS O 1 1 13 1521 1 1 2 ARG C C 2.954 0.943 -0.549 1.00 . A A . 2 ARG C 1 1 13 1522 1 1 2 ARG CA C 4.309 0.418 -1.017 1.00 . A A . 2 ARG CA 1 1 13 1523 1 1 2 ARG CB C 5.404 0.863 -0.046 1.00 . A A . 2 ARG CB 1 1 13 1524 1 1 2 ARG CD C 6.775 -0.191 1.777 1.00 . A A . 2 ARG CD 1 1 13 1525 1 1 2 ARG CG C 5.372 0.127 1.283 1.00 . A A . 2 ARG CG 1 1 13 1526 1 1 2 ARG CZ C 6.711 0.178 4.213 1.00 . A A . 2 ARG CZ 1 1 13 1527 1 1 2 ARG H H 4.825 0.217 -3.060 1.00 . A A . 2 ARG H 1 1 13 1528 1 1 2 ARG HA H 4.275 -0.661 -1.034 1.00 . A A . 2 ARG HA 1 1 13 1529 1 1 2 ARG HB2 H 6.366 0.693 -0.506 1.00 . A A . 2 ARG HB2 1 1 13 1530 1 1 2 ARG HB3 H 5.289 1.919 0.148 1.00 . A A . 2 ARG HB3 1 1 13 1531 1 1 2 ARG HD2 H 7.193 -0.969 1.156 1.00 . A A . 2 ARG HD2 1 1 13 1532 1 1 2 ARG HD3 H 7.382 0.699 1.695 1.00 . A A . 2 ARG HD3 1 1 13 1533 1 1 2 ARG HE H 6.834 -1.607 3.329 1.00 . A A . 2 ARG HE 1 1 13 1534 1 1 2 ARG HG2 H 4.876 0.750 2.016 1.00 . A A . 2 ARG HG2 1 1 13 1535 1 1 2 ARG HG3 H 4.824 -0.800 1.158 1.00 . A A . 2 ARG HG3 1 1 13 1536 1 1 2 ARG HH11 H 6.625 1.871 3.108 1.00 . A A . 2 ARG HH11 1 1 13 1537 1 1 2 ARG HH12 H 6.584 2.101 4.824 1.00 . A A . 2 ARG HH12 1 1 13 1538 1 1 2 ARG HH21 H 6.780 -1.304 5.585 1.00 . A A . 2 ARG HH21 1 1 13 1539 1 1 2 ARG HH22 H 6.672 0.300 6.230 1.00 . A A . 2 ARG HH22 1 1 13 1540 1 1 2 ARG N N 4.615 0.878 -2.367 1.00 . A A . 2 ARG N 1 1 13 1541 1 1 2 ARG NE N 6.778 -0.642 3.167 1.00 . A A . 2 ARG NE 1 1 13 1542 1 1 2 ARG NH1 N 6.634 1.491 4.033 1.00 . A A . 2 ARG NH1 1 1 13 1543 1 1 2 ARG NH2 N 6.722 -0.316 5.444 1.00 . A A . 2 ARG NH2 1 1 13 1544 1 1 2 ARG O O 2.804 1.367 0.597 1.00 . A A . 2 ARG O 1 1 13 1545 1 1 3 PHE C C -0.167 0.311 -0.404 1.00 . A A . 3 PHE C 1 1 13 1546 1 1 3 PHE CA C 0.639 1.388 -1.126 1.00 . A A . 3 PHE CA 1 1 13 1547 1 1 3 PHE CB C -0.070 1.816 -2.411 1.00 . A A . 3 PHE CB 1 1 13 1548 1 1 3 PHE CD1 C -0.846 -0.189 -3.716 1.00 . A A . 3 PHE CD1 1 1 13 1549 1 1 3 PHE CD2 C 1.103 0.964 -4.463 1.00 . A A . 3 PHE CD2 1 1 13 1550 1 1 3 PHE CE1 C -0.725 -1.080 -4.766 1.00 . A A . 3 PHE CE1 1 1 13 1551 1 1 3 PHE CE2 C 1.230 0.075 -5.514 1.00 . A A . 3 PHE CE2 1 1 13 1552 1 1 3 PHE CG C 0.066 0.842 -3.551 1.00 . A A . 3 PHE CG 1 1 13 1553 1 1 3 PHE CZ C 0.315 -0.948 -5.666 1.00 . A A . 3 PHE CZ 1 1 13 1554 1 1 3 PHE H H 2.143 0.576 -2.339 1.00 . A A . 3 PHE H 1 1 13 1555 1 1 3 PHE HA H 0.737 2.245 -0.477 1.00 . A A . 3 PHE HA 1 1 13 1556 1 1 3 PHE HB2 H -1.118 1.932 -2.205 1.00 . A A . 3 PHE HB2 1 1 13 1557 1 1 3 PHE HB3 H 0.345 2.763 -2.735 1.00 . A A . 3 PHE HB3 1 1 13 1558 1 1 3 PHE HD1 H -1.660 -0.294 -3.015 1.00 . A A . 3 PHE HD1 1 1 13 1559 1 1 3 PHE HD2 H 1.820 1.763 -4.346 1.00 . A A . 3 PHE HD2 1 1 13 1560 1 1 3 PHE HE1 H -1.442 -1.879 -4.882 1.00 . A A . 3 PHE HE1 1 1 13 1561 1 1 3 PHE HE2 H 2.043 0.181 -6.216 1.00 . A A . 3 PHE HE2 1 1 13 1562 1 1 3 PHE HZ H 0.411 -1.643 -6.486 1.00 . A A . 3 PHE HZ 1 1 13 1563 1 1 3 PHE N N 1.970 0.916 -1.443 1.00 . A A . 3 PHE N 1 1 13 1564 1 1 3 PHE O O -0.836 -0.508 -1.031 1.00 . A A . 3 PHE O 1 1 13 1565 1 1 4 LEU C C -2.298 -0.439 1.706 1.00 . A A . 4 LEU C 1 1 13 1566 1 1 4 LEU CA C -0.798 -0.658 1.737 1.00 . A A . 4 LEU CA 1 1 13 1567 1 1 4 LEU CB C -0.331 -0.582 3.184 1.00 . A A . 4 LEU CB 1 1 13 1568 1 1 4 LEU CD1 C 1.939 0.421 3.479 1.00 . A A . 4 LEU CD1 1 1 13 1569 1 1 4 LEU CD2 C 1.372 -1.732 4.622 1.00 . A A . 4 LEU CD2 1 1 13 1570 1 1 4 LEU CG C 1.153 -0.874 3.385 1.00 . A A . 4 LEU CG 1 1 13 1571 1 1 4 LEU H H 0.470 0.985 1.366 1.00 . A A . 4 LEU H 1 1 13 1572 1 1 4 LEU HA H -0.574 -1.636 1.353 1.00 . A A . 4 LEU HA 1 1 13 1573 1 1 4 LEU HB2 H -0.541 0.412 3.553 1.00 . A A . 4 LEU HB2 1 1 13 1574 1 1 4 LEU HB3 H -0.907 -1.291 3.765 1.00 . A A . 4 LEU HB3 1 1 13 1575 1 1 4 LEU HD11 H 1.339 1.232 3.095 1.00 . A A . 4 LEU HD11 1 1 13 1576 1 1 4 LEU HD12 H 2.843 0.335 2.894 1.00 . A A . 4 LEU HD12 1 1 13 1577 1 1 4 LEU HD13 H 2.193 0.616 4.509 1.00 . A A . 4 LEU HD13 1 1 13 1578 1 1 4 LEU HD21 H 0.556 -1.582 5.313 1.00 . A A . 4 LEU HD21 1 1 13 1579 1 1 4 LEU HD22 H 2.301 -1.450 5.096 1.00 . A A . 4 LEU HD22 1 1 13 1580 1 1 4 LEU HD23 H 1.416 -2.772 4.336 1.00 . A A . 4 LEU HD23 1 1 13 1581 1 1 4 LEU HG H 1.519 -1.417 2.527 1.00 . A A . 4 LEU HG 1 1 13 1582 1 1 4 LEU N N -0.088 0.316 0.923 1.00 . A A . 4 LEU N 1 1 13 1583 1 1 4 LEU O O -2.796 0.546 2.252 1.00 . A A . 4 LEU O 1 1 13 1584 1 1 5 ARG C C -4.976 -1.453 2.502 1.00 . A A . 5 ARG C 1 1 13 1585 1 1 5 ARG CA C -4.464 -1.271 1.085 1.00 . A A . 5 ARG CA 1 1 13 1586 1 1 5 ARG CB C -5.041 -2.318 0.155 1.00 . A A . 5 ARG CB 1 1 13 1587 1 1 5 ARG CD C -3.952 -1.715 -2.003 1.00 . A A . 5 ARG CD 1 1 13 1588 1 1 5 ARG CG C -5.257 -1.782 -1.230 1.00 . A A . 5 ARG CG 1 1 13 1589 1 1 5 ARG CZ C -4.508 -0.793 -4.220 1.00 . A A . 5 ARG CZ 1 1 13 1590 1 1 5 ARG H H -2.594 -2.158 0.723 1.00 . A A . 5 ARG H 1 1 13 1591 1 1 5 ARG HA H -4.730 -0.293 0.722 1.00 . A A . 5 ARG HA 1 1 13 1592 1 1 5 ARG HB2 H -4.357 -3.142 0.089 1.00 . A A . 5 ARG HB2 1 1 13 1593 1 1 5 ARG HB3 H -5.985 -2.659 0.545 1.00 . A A . 5 ARG HB3 1 1 13 1594 1 1 5 ARG HD2 H -3.146 -1.522 -1.304 1.00 . A A . 5 ARG HD2 1 1 13 1595 1 1 5 ARG HD3 H -3.786 -2.664 -2.490 1.00 . A A . 5 ARG HD3 1 1 13 1596 1 1 5 ARG HE H -3.557 0.199 -2.773 1.00 . A A . 5 ARG HE 1 1 13 1597 1 1 5 ARG HG2 H -5.948 -2.415 -1.746 1.00 . A A . 5 ARG HG2 1 1 13 1598 1 1 5 ARG HG3 H -5.663 -0.795 -1.148 1.00 . A A . 5 ARG HG3 1 1 13 1599 1 1 5 ARG HH11 H -5.110 -2.704 -3.937 1.00 . A A . 5 ARG HH11 1 1 13 1600 1 1 5 ARG HH12 H -5.484 -2.030 -5.487 1.00 . A A . 5 ARG HH12 1 1 13 1601 1 1 5 ARG HH21 H -4.051 1.085 -4.811 1.00 . A A . 5 ARG HH21 1 1 13 1602 1 1 5 ARG HH22 H -4.883 0.120 -5.984 1.00 . A A . 5 ARG HH22 1 1 13 1603 1 1 5 ARG N N -3.026 -1.375 1.114 1.00 . A A . 5 ARG N 1 1 13 1604 1 1 5 ARG NE N -3.969 -0.658 -3.011 1.00 . A A . 5 ARG NE 1 1 13 1605 1 1 5 ARG NH1 N -5.081 -1.936 -4.577 1.00 . A A . 5 ARG NH1 1 1 13 1606 1 1 5 ARG NH2 N -4.478 0.220 -5.075 1.00 . A A . 5 ARG NH2 1 1 13 1607 1 1 5 ARG O O -5.159 -2.576 2.971 1.00 . A A . 5 ARG O 1 1 13 1608 1 1 6 HIS C C -5.800 1.045 5.107 1.00 . A A . 6 HIS C 1 1 13 1609 1 1 6 HIS CA C -5.591 -0.371 4.581 1.00 . A A . 6 HIS CA 1 1 13 1610 1 1 6 HIS CB C -4.533 -1.112 5.415 1.00 . A A . 6 HIS CB 1 1 13 1611 1 1 6 HIS CD2 C -5.307 -0.189 7.724 1.00 . A A . 6 HIS CD2 1 1 13 1612 1 1 6 HIS CE1 C -4.887 -1.971 8.929 1.00 . A A . 6 HIS CE1 1 1 13 1613 1 1 6 HIS CG C -4.806 -1.134 6.890 1.00 . A A . 6 HIS CG 1 1 13 1614 1 1 6 HIS H H -4.958 0.524 2.776 1.00 . A A . 6 HIS H 1 1 13 1615 1 1 6 HIS HA H -6.524 -0.909 4.632 1.00 . A A . 6 HIS HA 1 1 13 1616 1 1 6 HIS HB2 H -4.489 -2.141 5.079 1.00 . A A . 6 HIS HB2 1 1 13 1617 1 1 6 HIS HB3 H -3.559 -0.645 5.254 1.00 . A A . 6 HIS HB3 1 1 13 1618 1 1 6 HIS HD1 H -4.184 -3.091 7.368 1.00 . A A . 6 HIS HD1 1 1 13 1619 1 1 6 HIS HD2 H -5.619 0.807 7.450 1.00 . A A . 6 HIS HD2 1 1 13 1620 1 1 6 HIS HE1 H -4.798 -2.649 9.765 1.00 . A A . 6 HIS HE1 1 1 13 1621 1 1 6 HIS HE2 H -5.580 -0.255 9.804 1.00 . A A . 6 HIS HE2 1 1 13 1622 1 1 6 HIS N N -5.156 -0.339 3.196 1.00 . A A . 6 HIS N 1 1 13 1623 1 1 6 HIS ND1 N -4.553 -2.238 7.679 1.00 . A A . 6 HIS ND1 1 1 13 1624 1 1 6 HIS NE2 N -5.346 -0.735 8.983 1.00 . A A . 6 HIS NE2 1 1 13 1625 1 1 6 HIS O O -6.905 1.329 5.615 1.00 . A A . 6 HIS O 1 1 14 1626 1 1 1 HIS C C 4.784 2.259 -2.533 1.00 . A A . 1 HIS C 1 1 14 1627 1 1 1 HIS CA C 5.140 2.838 -3.900 1.00 . A A . 1 HIS CA 1 1 14 1628 1 1 1 HIS CB C 4.124 2.385 -4.952 1.00 . A A . 1 HIS CB 1 1 14 1629 1 1 1 HIS CD2 C 3.021 4.017 -6.640 1.00 . A A . 1 HIS CD2 1 1 14 1630 1 1 1 HIS CE1 C 1.684 5.060 -5.250 1.00 . A A . 1 HIS CE1 1 1 14 1631 1 1 1 HIS CG C 3.212 3.480 -5.412 1.00 . A A . 1 HIS CG 1 1 14 1632 1 1 1 HIS H1 H 6.434 1.398 -4.594 1.00 . A A . 1 HIS H1 1 1 14 1633 1 1 1 HIS H2 H 7.142 2.544 -3.530 1.00 . A A . 1 HIS H2 1 1 14 1634 1 1 1 HIS H3 H 6.769 2.986 -5.147 1.00 . A A . 1 HIS H3 1 1 14 1635 1 1 1 HIS HA H 5.130 3.916 -3.838 1.00 . A A . 1 HIS HA 1 1 14 1636 1 1 1 HIS HB2 H 4.654 2.012 -5.815 1.00 . A A . 1 HIS HB2 1 1 14 1637 1 1 1 HIS HB3 H 3.515 1.593 -4.540 1.00 . A A . 1 HIS HB3 1 1 14 1638 1 1 1 HIS HD1 H 2.264 3.995 -3.601 1.00 . A A . 1 HIS HD1 1 1 14 1639 1 1 1 HIS HD2 H 3.526 3.729 -7.551 1.00 . A A . 1 HIS HD2 1 1 14 1640 1 1 1 HIS HE1 H 0.946 5.737 -4.847 1.00 . A A . 1 HIS HE1 1 1 14 1641 1 1 1 HIS HE2 H 1.788 5.615 -7.218 1.00 . A A . 1 HIS HE2 1 1 14 1642 1 1 1 HIS N N 6.493 2.402 -4.332 1.00 . A A . 1 HIS N 1 1 14 1643 1 1 1 HIS ND1 N 2.360 4.155 -4.563 1.00 . A A . 1 HIS ND1 1 1 14 1644 1 1 1 HIS NE2 N 2.068 4.997 -6.511 1.00 . A A . 1 HIS NE2 1 1 14 1645 1 1 1 HIS O O 4.739 2.979 -1.536 1.00 . A A . 1 HIS O 1 1 14 1646 1 1 2 ARG C C 2.883 0.824 -0.674 1.00 . A A . 2 ARG C 1 1 14 1647 1 1 2 ARG CA C 4.186 0.277 -1.250 1.00 . A A . 2 ARG CA 1 1 14 1648 1 1 2 ARG CB C 5.315 0.431 -0.229 1.00 . A A . 2 ARG CB 1 1 14 1649 1 1 2 ARG CD C 6.342 -0.682 1.779 1.00 . A A . 2 ARG CD 1 1 14 1650 1 1 2 ARG CG C 5.048 -0.289 1.082 1.00 . A A . 2 ARG CG 1 1 14 1651 1 1 2 ARG CZ C 5.812 -2.788 2.944 1.00 . A A . 2 ARG CZ 1 1 14 1652 1 1 2 ARG H H 4.588 0.432 -3.323 1.00 . A A . 2 ARG H 1 1 14 1653 1 1 2 ARG HA H 4.055 -0.771 -1.468 1.00 . A A . 2 ARG HA 1 1 14 1654 1 1 2 ARG HB2 H 6.226 0.035 -0.654 1.00 . A A . 2 ARG HB2 1 1 14 1655 1 1 2 ARG HB3 H 5.454 1.481 -0.017 1.00 . A A . 2 ARG HB3 1 1 14 1656 1 1 2 ARG HD2 H 7.176 -0.352 1.178 1.00 . A A . 2 ARG HD2 1 1 14 1657 1 1 2 ARG HD3 H 6.379 -0.194 2.742 1.00 . A A . 2 ARG HD3 1 1 14 1658 1 1 2 ARG HE H 7.005 -2.630 1.352 1.00 . A A . 2 ARG HE 1 1 14 1659 1 1 2 ARG HG2 H 4.486 0.368 1.732 1.00 . A A . 2 ARG HG2 1 1 14 1660 1 1 2 ARG HG3 H 4.471 -1.184 0.879 1.00 . A A . 2 ARG HG3 1 1 14 1661 1 1 2 ARG HH11 H 4.927 -1.148 3.732 1.00 . A A . 2 ARG HH11 1 1 14 1662 1 1 2 ARG HH12 H 4.570 -2.641 4.533 1.00 . A A . 2 ARG HH12 1 1 14 1663 1 1 2 ARG HH21 H 6.536 -4.595 2.403 1.00 . A A . 2 ARG HH21 1 1 14 1664 1 1 2 ARG HH22 H 5.484 -4.598 3.779 1.00 . A A . 2 ARG HH22 1 1 14 1665 1 1 2 ARG N N 4.535 0.954 -2.495 1.00 . A A . 2 ARG N 1 1 14 1666 1 1 2 ARG NE N 6.440 -2.126 1.975 1.00 . A A . 2 ARG NE 1 1 14 1667 1 1 2 ARG NH1 N 5.040 -2.139 3.807 1.00 . A A . 2 ARG NH1 1 1 14 1668 1 1 2 ARG NH2 N 5.955 -4.101 3.051 1.00 . A A . 2 ARG NH2 1 1 14 1669 1 1 2 ARG O O 2.812 1.182 0.502 1.00 . A A . 2 ARG O 1 1 14 1670 1 1 3 PHE C C -0.247 0.295 -0.389 1.00 . A A . 3 PHE C 1 1 14 1671 1 1 3 PHE CA C 0.559 1.385 -1.089 1.00 . A A . 3 PHE CA 1 1 14 1672 1 1 3 PHE CB C -0.201 1.918 -2.303 1.00 . A A . 3 PHE CB 1 1 14 1673 1 1 3 PHE CD1 C -1.100 0.024 -3.693 1.00 . A A . 3 PHE CD1 1 1 14 1674 1 1 3 PHE CD2 C 0.838 1.177 -4.466 1.00 . A A . 3 PHE CD2 1 1 14 1675 1 1 3 PHE CE1 C -1.057 -0.798 -4.804 1.00 . A A . 3 PHE CE1 1 1 14 1676 1 1 3 PHE CE2 C 0.886 0.359 -5.578 1.00 . A A . 3 PHE CE2 1 1 14 1677 1 1 3 PHE CG C -0.153 1.019 -3.511 1.00 . A A . 3 PHE CG 1 1 14 1678 1 1 3 PHE CZ C -0.062 -0.630 -5.747 1.00 . A A . 3 PHE CZ 1 1 14 1679 1 1 3 PHE H H 1.960 0.595 -2.432 1.00 . A A . 3 PHE H 1 1 14 1680 1 1 3 PHE HA H 0.725 2.196 -0.397 1.00 . A A . 3 PHE HA 1 1 14 1681 1 1 3 PHE HB2 H -1.233 2.048 -2.035 1.00 . A A . 3 PHE HB2 1 1 14 1682 1 1 3 PHE HB3 H 0.225 2.872 -2.586 1.00 . A A . 3 PHE HB3 1 1 14 1683 1 1 3 PHE HD1 H -1.878 -0.108 -2.957 1.00 . A A . 3 PHE HD1 1 1 14 1684 1 1 3 PHE HD2 H 1.580 1.950 -4.335 1.00 . A A . 3 PHE HD2 1 1 14 1685 1 1 3 PHE HE1 H -1.801 -1.570 -4.933 1.00 . A A . 3 PHE HE1 1 1 14 1686 1 1 3 PHE HE2 H 1.665 0.492 -6.314 1.00 . A A . 3 PHE HE2 1 1 14 1687 1 1 3 PHE HZ H -0.027 -1.271 -6.616 1.00 . A A . 3 PHE HZ 1 1 14 1688 1 1 3 PHE N N 1.851 0.886 -1.509 1.00 . A A . 3 PHE N 1 1 14 1689 1 1 3 PHE O O -0.982 -0.459 -1.025 1.00 . A A . 3 PHE O 1 1 14 1690 1 1 4 LEU C C -2.299 -0.545 1.717 1.00 . A A . 4 LEU C 1 1 14 1691 1 1 4 LEU CA C -0.802 -0.780 1.724 1.00 . A A . 4 LEU CA 1 1 14 1692 1 1 4 LEU CB C -0.313 -0.751 3.168 1.00 . A A . 4 LEU CB 1 1 14 1693 1 1 4 LEU CD1 C 1.942 0.320 3.349 1.00 . A A . 4 LEU CD1 1 1 14 1694 1 1 4 LEU CD2 C 1.457 -1.791 4.607 1.00 . A A . 4 LEU CD2 1 1 14 1695 1 1 4 LEU CG C 1.184 -0.997 3.338 1.00 . A A . 4 LEU CG 1 1 14 1696 1 1 4 LEU H H 0.507 0.838 1.378 1.00 . A A . 4 LEU H 1 1 14 1697 1 1 4 LEU HA H -0.594 -1.748 1.306 1.00 . A A . 4 LEU HA 1 1 14 1698 1 1 4 LEU HB2 H -0.555 0.216 3.587 1.00 . A A . 4 LEU HB2 1 1 14 1699 1 1 4 LEU HB3 H -0.852 -1.506 3.724 1.00 . A A . 4 LEU HB3 1 1 14 1700 1 1 4 LEU HD11 H 2.683 0.312 2.564 1.00 . A A . 4 LEU HD11 1 1 14 1701 1 1 4 LEU HD12 H 2.429 0.450 4.304 1.00 . A A . 4 LEU HD12 1 1 14 1702 1 1 4 LEU HD13 H 1.252 1.134 3.183 1.00 . A A . 4 LEU HD13 1 1 14 1703 1 1 4 LEU HD21 H 2.296 -2.451 4.445 1.00 . A A . 4 LEU HD21 1 1 14 1704 1 1 4 LEU HD22 H 0.584 -2.373 4.863 1.00 . A A . 4 LEU HD22 1 1 14 1705 1 1 4 LEU HD23 H 1.685 -1.111 5.415 1.00 . A A . 4 LEU HD23 1 1 14 1706 1 1 4 LEU HG H 1.540 -1.573 2.497 1.00 . A A . 4 LEU HG 1 1 14 1707 1 1 4 LEU N N -0.098 0.216 0.929 1.00 . A A . 4 LEU N 1 1 14 1708 1 1 4 LEU O O -2.777 0.454 2.256 1.00 . A A . 4 LEU O 1 1 14 1709 1 1 5 ARG C C -4.969 -1.445 2.575 1.00 . A A . 5 ARG C 1 1 14 1710 1 1 5 ARG CA C -4.482 -1.363 1.140 1.00 . A A . 5 ARG CA 1 1 14 1711 1 1 5 ARG CB C -5.079 -2.467 0.294 1.00 . A A . 5 ARG CB 1 1 14 1712 1 1 5 ARG CD C -3.926 -2.145 -1.889 1.00 . A A . 5 ARG CD 1 1 14 1713 1 1 5 ARG CG C -5.242 -2.053 -1.139 1.00 . A A . 5 ARG CG 1 1 14 1714 1 1 5 ARG CZ C -4.320 -2.081 -4.324 1.00 . A A . 5 ARG CZ 1 1 14 1715 1 1 5 ARG H H -2.629 -2.274 0.762 1.00 . A A . 5 ARG H 1 1 14 1716 1 1 5 ARG HA H -4.747 -0.410 0.715 1.00 . A A . 5 ARG HA 1 1 14 1717 1 1 5 ARG HB2 H -4.428 -3.320 0.321 1.00 . A A . 5 ARG HB2 1 1 14 1718 1 1 5 ARG HB3 H -6.043 -2.734 0.687 1.00 . A A . 5 ARG HB3 1 1 14 1719 1 1 5 ARG HD2 H -3.153 -1.679 -1.289 1.00 . A A . 5 ARG HD2 1 1 14 1720 1 1 5 ARG HD3 H -3.682 -3.186 -2.041 1.00 . A A . 5 ARG HD3 1 1 14 1721 1 1 5 ARG HE H -3.775 -0.520 -3.208 1.00 . A A . 5 ARG HE 1 1 14 1722 1 1 5 ARG HG2 H -5.967 -2.686 -1.607 1.00 . A A . 5 ARG HG2 1 1 14 1723 1 1 5 ARG HG3 H -5.582 -1.038 -1.159 1.00 . A A . 5 ARG HG3 1 1 14 1724 1 1 5 ARG HH11 H -4.625 -3.898 -3.486 1.00 . A A . 5 ARG HH11 1 1 14 1725 1 1 5 ARG HH12 H -4.879 -3.818 -5.196 1.00 . A A . 5 ARG HH12 1 1 14 1726 1 1 5 ARG HH21 H -4.114 -0.419 -5.455 1.00 . A A . 5 ARG HH21 1 1 14 1727 1 1 5 ARG HH22 H -4.591 -1.846 -6.313 1.00 . A A . 5 ARG HH22 1 1 14 1728 1 1 5 ARG N N -3.047 -1.481 1.149 1.00 . A A . 5 ARG N 1 1 14 1729 1 1 5 ARG NE N -3.990 -1.474 -3.185 1.00 . A A . 5 ARG NE 1 1 14 1730 1 1 5 ARG NH1 N -4.633 -3.371 -4.335 1.00 . A A . 5 ARG NH1 1 1 14 1731 1 1 5 ARG NH2 N -4.344 -1.392 -5.457 1.00 . A A . 5 ARG NH2 1 1 14 1732 1 1 5 ARG O O -5.154 -2.532 3.121 1.00 . A A . 5 ARG O 1 1 14 1733 1 1 6 HIS C C -5.705 1.231 5.025 1.00 . A A . 6 HIS C 1 1 14 1734 1 1 6 HIS CA C -5.529 -0.220 4.588 1.00 . A A . 6 HIS CA 1 1 14 1735 1 1 6 HIS CB C -4.464 -0.925 5.446 1.00 . A A . 6 HIS CB 1 1 14 1736 1 1 6 HIS CD2 C -5.158 0.179 7.702 1.00 . A A . 6 HIS CD2 1 1 14 1737 1 1 6 HIS CE1 C -4.716 -1.512 9.025 1.00 . A A . 6 HIS CE1 1 1 14 1738 1 1 6 HIS CG C -4.691 -0.832 6.927 1.00 . A A . 6 HIS CG 1 1 14 1739 1 1 6 HIS H H -4.923 0.546 2.716 1.00 . A A . 6 HIS H 1 1 14 1740 1 1 6 HIS HA H -6.469 -0.738 4.694 1.00 . A A . 6 HIS HA 1 1 14 1741 1 1 6 HIS HB2 H -4.456 -1.977 5.186 1.00 . A A . 6 HIS HB2 1 1 14 1742 1 1 6 HIS HB3 H -3.484 -0.497 5.222 1.00 . A A . 6 HIS HB3 1 1 14 1743 1 1 6 HIS HD1 H -4.072 -2.753 7.532 1.00 . A A . 6 HIS HD1 1 1 14 1744 1 1 6 HIS HD2 H -5.470 1.155 7.363 1.00 . A A . 6 HIS HD2 1 1 14 1745 1 1 6 HIS HE1 H -4.607 -2.126 9.907 1.00 . A A . 6 HIS HE1 1 1 14 1746 1 1 6 HIS HE2 H -5.362 0.274 9.789 1.00 . A A . 6 HIS HE2 1 1 14 1747 1 1 6 HIS N N -5.123 -0.285 3.196 1.00 . A A . 6 HIS N 1 1 14 1748 1 1 6 HIS ND1 N -4.423 -1.875 7.789 1.00 . A A . 6 HIS ND1 1 1 14 1749 1 1 6 HIS NE2 N -5.162 -0.271 8.999 1.00 . A A . 6 HIS NE2 1 1 14 1750 1 1 6 HIS O O -4.683 1.893 5.302 1.00 . A A . 6 HIS O 1 1 15 1751 1 1 1 HIS C C 4.619 0.733 -3.176 1.00 . A A . 1 HIS C 1 1 15 1752 1 1 1 HIS CA C 4.934 1.414 -4.505 1.00 . A A . 1 HIS CA 1 1 15 1753 1 1 1 HIS CB C 5.353 0.372 -5.545 1.00 . A A . 1 HIS CB 1 1 15 1754 1 1 1 HIS CD2 C 6.648 0.990 -7.705 1.00 . A A . 1 HIS CD2 1 1 15 1755 1 1 1 HIS CE1 C 5.008 1.952 -8.798 1.00 . A A . 1 HIS CE1 1 1 15 1756 1 1 1 HIS CG C 5.549 0.940 -6.916 1.00 . A A . 1 HIS CG 1 1 15 1757 1 1 1 HIS H1 H 6.351 2.670 -5.309 1.00 . A A . 1 HIS H1 1 1 15 1758 1 1 1 HIS H2 H 6.801 1.945 -3.821 1.00 . A A . 1 HIS H2 1 1 15 1759 1 1 1 HIS H3 H 5.656 3.224 -3.844 1.00 . A A . 1 HIS H3 1 1 15 1760 1 1 1 HIS HA H 4.053 1.930 -4.854 1.00 . A A . 1 HIS HA 1 1 15 1761 1 1 1 HIS HB2 H 6.284 -0.080 -5.237 1.00 . A A . 1 HIS HB2 1 1 15 1762 1 1 1 HIS HB3 H 4.591 -0.391 -5.606 1.00 . A A . 1 HIS HB3 1 1 15 1763 1 1 1 HIS HD1 H 3.616 1.674 -7.324 1.00 . A A . 1 HIS HD1 1 1 15 1764 1 1 1 HIS HD2 H 7.628 0.603 -7.465 1.00 . A A . 1 HIS HD2 1 1 15 1765 1 1 1 HIS HE1 H 4.444 2.462 -9.564 1.00 . A A . 1 HIS HE1 1 1 15 1766 1 1 1 HIS HE2 H 6.854 1.734 -9.658 1.00 . A A . 1 HIS HE2 1 1 15 1767 1 1 1 HIS N N 6.035 2.402 -4.356 1.00 . A A . 1 HIS N 1 1 15 1768 1 1 1 HIS ND1 N 4.539 1.552 -7.629 1.00 . A A . 1 HIS ND1 1 1 15 1769 1 1 1 HIS NE2 N 6.285 1.623 -8.868 1.00 . A A . 1 HIS NE2 1 1 15 1770 1 1 1 HIS O O 4.361 -0.470 -3.129 1.00 . A A . 1 HIS O 1 1 15 1771 1 1 2 ARG C C 2.981 1.423 -0.289 1.00 . A A . 2 ARG C 1 1 15 1772 1 1 2 ARG CA C 4.359 0.982 -0.769 1.00 . A A . 2 ARG CA 1 1 15 1773 1 1 2 ARG CB C 5.430 1.436 0.224 1.00 . A A . 2 ARG CB 1 1 15 1774 1 1 2 ARG CD C 6.602 0.704 2.321 1.00 . A A . 2 ARG CD 1 1 15 1775 1 1 2 ARG CG C 5.265 0.835 1.609 1.00 . A A . 2 ARG CG 1 1 15 1776 1 1 2 ARG CZ C 6.402 2.108 4.337 1.00 . A A . 2 ARG CZ 1 1 15 1777 1 1 2 ARG H H 4.855 2.462 -2.199 1.00 . A A . 2 ARG H 1 1 15 1778 1 1 2 ARG HA H 4.375 -0.095 -0.832 1.00 . A A . 2 ARG HA 1 1 15 1779 1 1 2 ARG HB2 H 6.400 1.153 -0.156 1.00 . A A . 2 ARG HB2 1 1 15 1780 1 1 2 ARG HB3 H 5.388 2.512 0.314 1.00 . A A . 2 ARG HB3 1 1 15 1781 1 1 2 ARG HD2 H 6.995 -0.285 2.141 1.00 . A A . 2 ARG HD2 1 1 15 1782 1 1 2 ARG HD3 H 7.283 1.440 1.919 1.00 . A A . 2 ARG HD3 1 1 15 1783 1 1 2 ARG HE H 6.449 0.113 4.332 1.00 . A A . 2 ARG HE 1 1 15 1784 1 1 2 ARG HG2 H 4.618 1.476 2.193 1.00 . A A . 2 ARG HG2 1 1 15 1785 1 1 2 ARG HG3 H 4.818 -0.148 1.514 1.00 . A A . 2 ARG HG3 1 1 15 1786 1 1 2 ARG HH11 H 6.524 3.145 2.605 1.00 . A A . 2 ARG HH11 1 1 15 1787 1 1 2 ARG HH12 H 6.381 4.107 4.037 1.00 . A A . 2 ARG HH12 1 1 15 1788 1 1 2 ARG HH21 H 6.261 1.377 6.216 1.00 . A A . 2 ARG HH21 1 1 15 1789 1 1 2 ARG HH22 H 6.231 3.104 6.087 1.00 . A A . 2 ARG HH22 1 1 15 1790 1 1 2 ARG N N 4.643 1.511 -2.098 1.00 . A A . 2 ARG N 1 1 15 1791 1 1 2 ARG NE N 6.478 0.910 3.762 1.00 . A A . 2 ARG NE 1 1 15 1792 1 1 2 ARG NH1 N 6.439 3.210 3.599 1.00 . A A . 2 ARG NH1 1 1 15 1793 1 1 2 ARG NH2 N 6.289 2.204 5.655 1.00 . A A . 2 ARG NH2 1 1 15 1794 1 1 2 ARG O O 2.791 1.737 0.886 1.00 . A A . 2 ARG O 1 1 15 1795 1 1 3 PHE C C -0.114 0.677 -0.288 1.00 . A A . 3 PHE C 1 1 15 1796 1 1 3 PHE CA C 0.668 1.843 -0.886 1.00 . A A . 3 PHE CA 1 1 15 1797 1 1 3 PHE CB C -0.023 2.361 -2.147 1.00 . A A . 3 PHE CB 1 1 15 1798 1 1 3 PHE CD1 C -0.725 0.467 -3.645 1.00 . A A . 3 PHE CD1 1 1 15 1799 1 1 3 PHE CD2 C 1.230 1.704 -4.224 1.00 . A A . 3 PHE CD2 1 1 15 1800 1 1 3 PHE CE1 C -0.557 -0.329 -4.762 1.00 . A A . 3 PHE CE1 1 1 15 1801 1 1 3 PHE CE2 C 1.404 0.911 -5.342 1.00 . A A . 3 PHE CE2 1 1 15 1802 1 1 3 PHE CG C 0.165 1.491 -3.361 1.00 . A A . 3 PHE CG 1 1 15 1803 1 1 3 PHE CZ C 0.509 -0.107 -5.612 1.00 . A A . 3 PHE CZ 1 1 15 1804 1 1 3 PHE H H 2.227 1.188 -2.123 1.00 . A A . 3 PHE H 1 1 15 1805 1 1 3 PHE HA H 0.719 2.640 -0.160 1.00 . A A . 3 PHE HA 1 1 15 1806 1 1 3 PHE HB2 H -1.078 2.432 -1.958 1.00 . A A . 3 PHE HB2 1 1 15 1807 1 1 3 PHE HB3 H 0.373 3.342 -2.380 1.00 . A A . 3 PHE HB3 1 1 15 1808 1 1 3 PHE HD1 H -1.559 0.292 -2.982 1.00 . A A . 3 PHE HD1 1 1 15 1809 1 1 3 PHE HD2 H 1.930 2.499 -4.014 1.00 . A A . 3 PHE HD2 1 1 15 1810 1 1 3 PHE HE1 H -1.257 -1.123 -4.971 1.00 . A A . 3 PHE HE1 1 1 15 1811 1 1 3 PHE HE2 H 2.238 1.086 -6.005 1.00 . A A . 3 PHE HE2 1 1 15 1812 1 1 3 PHE HZ H 0.643 -0.727 -6.486 1.00 . A A . 3 PHE HZ 1 1 15 1813 1 1 3 PHE N N 2.021 1.444 -1.207 1.00 . A A . 3 PHE N 1 1 15 1814 1 1 3 PHE O O -0.736 -0.104 -1.006 1.00 . A A . 3 PHE O 1 1 15 1815 1 1 4 LEU C C -2.264 -0.334 1.697 1.00 . A A . 4 LEU C 1 1 15 1816 1 1 4 LEU CA C -0.759 -0.511 1.732 1.00 . A A . 4 LEU CA 1 1 15 1817 1 1 4 LEU CB C -0.314 -0.570 3.187 1.00 . A A . 4 LEU CB 1 1 15 1818 1 1 4 LEU CD1 C 1.940 0.390 3.681 1.00 . A A . 4 LEU CD1 1 1 15 1819 1 1 4 LEU CD2 C 1.366 -1.908 4.485 1.00 . A A . 4 LEU CD2 1 1 15 1820 1 1 4 LEU CG C 1.167 -0.881 3.381 1.00 . A A . 4 LEU CG 1 1 15 1821 1 1 4 LEU H H 0.455 1.202 1.553 1.00 . A A . 4 LEU H 1 1 15 1822 1 1 4 LEU HA H -0.498 -1.438 1.254 1.00 . A A . 4 LEU HA 1 1 15 1823 1 1 4 LEU HB2 H -0.530 0.385 3.643 1.00 . A A . 4 LEU HB2 1 1 15 1824 1 1 4 LEU HB3 H -0.898 -1.330 3.691 1.00 . A A . 4 LEU HB3 1 1 15 1825 1 1 4 LEU HD11 H 1.898 1.042 2.822 1.00 . A A . 4 LEU HD11 1 1 15 1826 1 1 4 LEU HD12 H 2.969 0.143 3.896 1.00 . A A . 4 LEU HD12 1 1 15 1827 1 1 4 LEU HD13 H 1.500 0.886 4.533 1.00 . A A . 4 LEU HD13 1 1 15 1828 1 1 4 LEU HD21 H 0.594 -1.789 5.231 1.00 . A A . 4 LEU HD21 1 1 15 1829 1 1 4 LEU HD22 H 2.334 -1.763 4.942 1.00 . A A . 4 LEU HD22 1 1 15 1830 1 1 4 LEU HD23 H 1.311 -2.902 4.065 1.00 . A A . 4 LEU HD23 1 1 15 1831 1 1 4 LEU HG H 1.558 -1.291 2.462 1.00 . A A . 4 LEU HG 1 1 15 1832 1 1 4 LEU N N -0.067 0.560 1.034 1.00 . A A . 4 LEU N 1 1 15 1833 1 1 4 LEU O O -2.803 0.554 2.358 1.00 . A A . 4 LEU O 1 1 15 1834 1 1 5 ARG C C -4.923 -1.539 2.283 1.00 . A A . 5 ARG C 1 1 15 1835 1 1 5 ARG CA C -4.390 -1.135 0.921 1.00 . A A . 5 ARG CA 1 1 15 1836 1 1 5 ARG CB C -4.918 -2.045 -0.167 1.00 . A A . 5 ARG CB 1 1 15 1837 1 1 5 ARG CD C -3.839 -1.017 -2.165 1.00 . A A . 5 ARG CD 1 1 15 1838 1 1 5 ARG CG C -5.150 -1.306 -1.453 1.00 . A A . 5 ARG CG 1 1 15 1839 1 1 5 ARG CZ C -4.500 0.430 -4.047 1.00 . A A . 5 ARG CZ 1 1 15 1840 1 1 5 ARG H H -2.486 -1.912 0.485 1.00 . A A . 5 ARG H 1 1 15 1841 1 1 5 ARG HA H -4.679 -0.122 0.701 1.00 . A A . 5 ARG HA 1 1 15 1842 1 1 5 ARG HB2 H -4.201 -2.821 -0.355 1.00 . A A . 5 ARG HB2 1 1 15 1843 1 1 5 ARG HB3 H -5.850 -2.481 0.153 1.00 . A A . 5 ARG HB3 1 1 15 1844 1 1 5 ARG HD2 H -3.046 -0.980 -1.427 1.00 . A A . 5 ARG HD2 1 1 15 1845 1 1 5 ARG HD3 H -3.642 -1.813 -2.867 1.00 . A A . 5 ARG HD3 1 1 15 1846 1 1 5 ARG HE H -3.417 1.017 -2.477 1.00 . A A . 5 ARG HE 1 1 15 1847 1 1 5 ARG HG2 H -5.778 -1.894 -2.086 1.00 . A A . 5 ARG HG2 1 1 15 1848 1 1 5 ARG HG3 H -5.633 -0.379 -1.225 1.00 . A A . 5 ARG HG3 1 1 15 1849 1 1 5 ARG HH11 H -5.150 -1.480 -4.192 1.00 . A A . 5 ARG HH11 1 1 15 1850 1 1 5 ARG HH12 H -5.600 -0.441 -5.502 1.00 . A A . 5 ARG HH12 1 1 15 1851 1 1 5 ARG HH21 H -4.009 2.385 -4.199 1.00 . A A . 5 ARG HH21 1 1 15 1852 1 1 5 ARG HH22 H -4.953 1.753 -5.507 1.00 . A A . 5 ARG HH22 1 1 15 1853 1 1 5 ARG N N -2.951 -1.201 0.968 1.00 . A A . 5 ARG N 1 1 15 1854 1 1 5 ARG NE N -3.878 0.254 -2.883 1.00 . A A . 5 ARG NE 1 1 15 1855 1 1 5 ARG NH1 N -5.135 -0.580 -4.628 1.00 . A A . 5 ARG NH1 1 1 15 1856 1 1 5 ARG NH2 N -4.486 1.621 -4.632 1.00 . A A . 5 ARG NH2 1 1 15 1857 1 1 5 ARG O O -5.080 -2.724 2.577 1.00 . A A . 5 ARG O 1 1 15 1858 1 1 6 HIS C C -5.903 0.520 5.200 1.00 . A A . 6 HIS C 1 1 15 1859 1 1 6 HIS CA C -5.610 -0.794 4.484 1.00 . A A . 6 HIS CA 1 1 15 1860 1 1 6 HIS CB C -4.533 -1.594 5.233 1.00 . A A . 6 HIS CB 1 1 15 1861 1 1 6 HIS CD2 C -5.410 -1.063 7.627 1.00 . A A . 6 HIS CD2 1 1 15 1862 1 1 6 HIS CE1 C -4.932 -2.984 8.569 1.00 . A A . 6 HIS CE1 1 1 15 1863 1 1 6 HIS CG C -4.841 -1.849 6.680 1.00 . A A . 6 HIS CG 1 1 15 1864 1 1 6 HIS H H -4.971 0.375 2.846 1.00 . A A . 6 HIS H 1 1 15 1865 1 1 6 HIS HA H -6.515 -1.379 4.434 1.00 . A A . 6 HIS HA 1 1 15 1866 1 1 6 HIS HB2 H -4.422 -2.558 4.752 1.00 . A A . 6 HIS HB2 1 1 15 1867 1 1 6 HIS HB3 H -3.584 -1.058 5.176 1.00 . A A . 6 HIS HB3 1 1 15 1868 1 1 6 HIS HD1 H -4.135 -3.824 6.883 1.00 . A A . 6 HIS HD1 1 1 15 1869 1 1 6 HIS HD2 H -5.764 -0.052 7.494 1.00 . A A . 6 HIS HD2 1 1 15 1870 1 1 6 HIS HE1 H -4.830 -3.774 9.298 1.00 . A A . 6 HIS HE1 1 1 15 1871 1 1 6 HIS HE2 H -5.729 -1.450 9.666 1.00 . A A . 6 HIS HE2 1 1 15 1872 1 1 6 HIS N N -5.151 -0.545 3.129 1.00 . A A . 6 HIS N 1 1 15 1873 1 1 6 HIS ND1 N -4.554 -3.045 7.305 1.00 . A A . 6 HIS ND1 1 1 15 1874 1 1 6 HIS NE2 N -5.453 -1.792 8.790 1.00 . A A . 6 HIS NE2 1 1 15 1875 1 1 6 HIS O O -7.096 0.849 5.368 1.00 . A A . 6 HIS O 1 1 16 1876 1 1 1 HIS C C 5.201 1.162 -3.104 1.00 . A A . 1 HIS C 1 1 16 1877 1 1 1 HIS CA C 5.496 2.042 -4.314 1.00 . A A . 1 HIS CA 1 1 16 1878 1 1 1 HIS CB C 4.364 1.934 -5.338 1.00 . A A . 1 HIS CB 1 1 16 1879 1 1 1 HIS CD2 C 3.658 3.555 -7.237 1.00 . A A . 1 HIS CD2 1 1 16 1880 1 1 1 HIS CE1 C 3.610 5.411 -6.070 1.00 . A A . 1 HIS CE1 1 1 16 1881 1 1 1 HIS CG C 3.999 3.244 -5.963 1.00 . A A . 1 HIS CG 1 1 16 1882 1 1 1 HIS H1 H 7.065 2.426 -5.588 1.00 . A A . 1 HIS H1 1 1 16 1883 1 1 1 HIS H2 H 6.585 0.780 -5.520 1.00 . A A . 1 HIS H2 1 1 16 1884 1 1 1 HIS H3 H 7.470 1.473 -4.223 1.00 . A A . 1 HIS H3 1 1 16 1885 1 1 1 HIS HA H 5.583 3.068 -3.989 1.00 . A A . 1 HIS HA 1 1 16 1886 1 1 1 HIS HB2 H 4.665 1.262 -6.127 1.00 . A A . 1 HIS HB2 1 1 16 1887 1 1 1 HIS HB3 H 3.484 1.539 -4.852 1.00 . A A . 1 HIS HB3 1 1 16 1888 1 1 1 HIS HD1 H 4.155 4.534 -4.304 1.00 . A A . 1 HIS HD1 1 1 16 1889 1 1 1 HIS HD2 H 3.585 2.867 -8.067 1.00 . A A . 1 HIS HD2 1 1 16 1890 1 1 1 HIS HE1 H 3.499 6.449 -5.795 1.00 . A A . 1 HIS HE1 1 1 16 1891 1 1 1 HIS HE2 H 3.080 5.403 -8.048 1.00 . A A . 1 HIS HE2 1 1 16 1892 1 1 1 HIS N N 6.768 1.644 -4.970 1.00 . A A . 1 HIS N 1 1 16 1893 1 1 1 HIS ND1 N 3.959 4.429 -5.258 1.00 . A A . 1 HIS ND1 1 1 16 1894 1 1 1 HIS NE2 N 3.422 4.907 -7.276 1.00 . A A . 1 HIS NE2 1 1 16 1895 1 1 1 HIS O O 5.598 -0.002 -3.059 1.00 . A A . 1 HIS O 1 1 16 1896 1 1 2 ARG C C 2.790 1.414 -0.388 1.00 . A A . 2 ARG C 1 1 16 1897 1 1 2 ARG CA C 4.161 0.995 -0.911 1.00 . A A . 2 ARG CA 1 1 16 1898 1 1 2 ARG CB C 5.224 1.227 0.165 1.00 . A A . 2 ARG CB 1 1 16 1899 1 1 2 ARG CD C 6.273 0.178 2.190 1.00 . A A . 2 ARG CD 1 1 16 1900 1 1 2 ARG CG C 4.977 0.444 1.443 1.00 . A A . 2 ARG CG 1 1 16 1901 1 1 2 ARG CZ C 7.093 0.331 4.510 1.00 . A A . 2 ARG CZ 1 1 16 1902 1 1 2 ARG H H 4.218 2.660 -2.216 1.00 . A A . 2 ARG H 1 1 16 1903 1 1 2 ARG HA H 4.133 -0.056 -1.154 1.00 . A A . 2 ARG HA 1 1 16 1904 1 1 2 ARG HB2 H 6.187 0.937 -0.229 1.00 . A A . 2 ARG HB2 1 1 16 1905 1 1 2 ARG HB3 H 5.247 2.278 0.410 1.00 . A A . 2 ARG HB3 1 1 16 1906 1 1 2 ARG HD2 H 6.637 -0.801 1.917 1.00 . A A . 2 ARG HD2 1 1 16 1907 1 1 2 ARG HD3 H 6.999 0.924 1.902 1.00 . A A . 2 ARG HD3 1 1 16 1908 1 1 2 ARG HE H 5.174 0.181 3.982 1.00 . A A . 2 ARG HE 1 1 16 1909 1 1 2 ARG HG2 H 4.316 1.016 2.081 1.00 . A A . 2 ARG HG2 1 1 16 1910 1 1 2 ARG HG3 H 4.515 -0.504 1.191 1.00 . A A . 2 ARG HG3 1 1 16 1911 1 1 2 ARG HH11 H 8.546 0.380 3.103 1.00 . A A . 2 ARG HH11 1 1 16 1912 1 1 2 ARG HH12 H 9.096 0.480 4.742 1.00 . A A . 2 ARG HH12 1 1 16 1913 1 1 2 ARG HH21 H 5.896 0.312 6.138 1.00 . A A . 2 ARG HH21 1 1 16 1914 1 1 2 ARG HH22 H 7.593 0.440 6.465 1.00 . A A . 2 ARG HH22 1 1 16 1915 1 1 2 ARG N N 4.505 1.727 -2.123 1.00 . A A . 2 ARG N 1 1 16 1916 1 1 2 ARG NE N 6.091 0.228 3.639 1.00 . A A . 2 ARG NE 1 1 16 1917 1 1 2 ARG NH1 N 8.348 0.403 4.083 1.00 . A A . 2 ARG NH1 1 1 16 1918 1 1 2 ARG NH2 N 6.840 0.364 5.811 1.00 . A A . 2 ARG NH2 1 1 16 1919 1 1 2 ARG O O 2.630 1.708 0.797 1.00 . A A . 2 ARG O 1 1 16 1920 1 1 3 PHE C C -0.296 0.642 -0.301 1.00 . A A . 3 PHE C 1 1 16 1921 1 1 3 PHE CA C 0.457 1.823 -0.905 1.00 . A A . 3 PHE CA 1 1 16 1922 1 1 3 PHE CB C -0.279 2.357 -2.134 1.00 . A A . 3 PHE CB 1 1 16 1923 1 1 3 PHE CD1 C -0.980 0.470 -3.643 1.00 . A A . 3 PHE CD1 1 1 16 1924 1 1 3 PHE CD2 C 0.905 1.786 -4.277 1.00 . A A . 3 PHE CD2 1 1 16 1925 1 1 3 PHE CE1 C -0.833 -0.295 -4.785 1.00 . A A . 3 PHE CE1 1 1 16 1926 1 1 3 PHE CE2 C 1.057 1.023 -5.419 1.00 . A A . 3 PHE CE2 1 1 16 1927 1 1 3 PHE CG C -0.114 1.519 -3.375 1.00 . A A . 3 PHE CG 1 1 16 1928 1 1 3 PHE CZ C 0.187 -0.019 -5.674 1.00 . A A . 3 PHE CZ 1 1 16 1929 1 1 3 PHE H H 1.981 1.205 -2.204 1.00 . A A . 3 PHE H 1 1 16 1930 1 1 3 PHE HA H 0.526 2.609 -0.168 1.00 . A A . 3 PHE HA 1 1 16 1931 1 1 3 PHE HB2 H -1.329 2.407 -1.913 1.00 . A A . 3 PHE HB2 1 1 16 1932 1 1 3 PHE HB3 H 0.094 3.350 -2.356 1.00 . A A . 3 PHE HB3 1 1 16 1933 1 1 3 PHE HD1 H -1.778 0.253 -2.951 1.00 . A A . 3 PHE HD1 1 1 16 1934 1 1 3 PHE HD2 H 1.587 2.600 -4.080 1.00 . A A . 3 PHE HD2 1 1 16 1935 1 1 3 PHE HE1 H -1.515 -1.109 -4.981 1.00 . A A . 3 PHE HE1 1 1 16 1936 1 1 3 PHE HE2 H 1.856 1.241 -6.113 1.00 . A A . 3 PHE HE2 1 1 16 1937 1 1 3 PHE HZ H 0.303 -0.616 -6.566 1.00 . A A . 3 PHE HZ 1 1 16 1938 1 1 3 PHE N N 1.802 1.441 -1.277 1.00 . A A . 3 PHE N 1 1 16 1939 1 1 3 PHE O O -0.937 -0.132 -1.009 1.00 . A A . 3 PHE O 1 1 16 1940 1 1 4 LEU C C -2.371 -0.410 1.744 1.00 . A A . 4 LEU C 1 1 16 1941 1 1 4 LEU CA C -0.865 -0.581 1.723 1.00 . A A . 4 LEU CA 1 1 16 1942 1 1 4 LEU CB C -0.364 -0.661 3.159 1.00 . A A . 4 LEU CB 1 1 16 1943 1 1 4 LEU CD1 C 1.911 0.280 3.586 1.00 . A A . 4 LEU CD1 1 1 16 1944 1 1 4 LEU CD2 C 1.360 -2.034 4.358 1.00 . A A . 4 LEU CD2 1 1 16 1945 1 1 4 LEU CG C 1.122 -0.980 3.288 1.00 . A A . 4 LEU CG 1 1 16 1946 1 1 4 LEU H H 0.330 1.143 1.529 1.00 . A A . 4 LEU H 1 1 16 1947 1 1 4 LEU HA H -0.618 -1.498 1.220 1.00 . A A . 4 LEU HA 1 1 16 1948 1 1 4 LEU HB2 H -0.558 0.290 3.636 1.00 . A A . 4 LEU HB2 1 1 16 1949 1 1 4 LEU HB3 H -0.932 -1.424 3.676 1.00 . A A . 4 LEU HB3 1 1 16 1950 1 1 4 LEU HD11 H 1.797 0.973 2.766 1.00 . A A . 4 LEU HD11 1 1 16 1951 1 1 4 LEU HD12 H 2.955 0.031 3.705 1.00 . A A . 4 LEU HD12 1 1 16 1952 1 1 4 LEU HD13 H 1.541 0.731 4.494 1.00 . A A . 4 LEU HD13 1 1 16 1953 1 1 4 LEU HD21 H 2.419 -2.115 4.554 1.00 . A A . 4 LEU HD21 1 1 16 1954 1 1 4 LEU HD22 H 0.983 -2.987 4.016 1.00 . A A . 4 LEU HD22 1 1 16 1955 1 1 4 LEU HD23 H 0.847 -1.749 5.265 1.00 . A A . 4 LEU HD23 1 1 16 1956 1 1 4 LEU HG H 1.473 -1.370 2.345 1.00 . A A . 4 LEU HG 1 1 16 1957 1 1 4 LEU N N -0.205 0.505 1.018 1.00 . A A . 4 LEU N 1 1 16 1958 1 1 4 LEU O O -2.890 0.468 2.434 1.00 . A A . 4 LEU O 1 1 16 1959 1 1 5 ARG C C -5.006 -1.593 2.415 1.00 . A A . 5 ARG C 1 1 16 1960 1 1 5 ARG CA C -4.520 -1.210 1.030 1.00 . A A . 5 ARG CA 1 1 16 1961 1 1 5 ARG CB C -5.079 -2.142 -0.025 1.00 . A A . 5 ARG CB 1 1 16 1962 1 1 5 ARG CD C -4.001 -1.269 -2.092 1.00 . A A . 5 ARG CD 1 1 16 1963 1 1 5 ARG CG C -5.305 -1.438 -1.332 1.00 . A A . 5 ARG CG 1 1 16 1964 1 1 5 ARG CZ C -4.450 -0.220 -4.281 1.00 . A A . 5 ARG CZ 1 1 16 1965 1 1 5 ARG H H -2.631 -1.974 0.520 1.00 . A A . 5 ARG H 1 1 16 1966 1 1 5 ARG HA H -4.819 -0.201 0.802 1.00 . A A . 5 ARG HA 1 1 16 1967 1 1 5 ARG HB2 H -4.379 -2.939 -0.193 1.00 . A A . 5 ARG HB2 1 1 16 1968 1 1 5 ARG HB3 H -6.015 -2.547 0.318 1.00 . A A . 5 ARG HB3 1 1 16 1969 1 1 5 ARG HD2 H -3.205 -1.107 -1.375 1.00 . A A . 5 ARG HD2 1 1 16 1970 1 1 5 ARG HD3 H -3.802 -2.172 -2.649 1.00 . A A . 5 ARG HD3 1 1 16 1971 1 1 5 ARG HE H -3.753 0.735 -2.673 1.00 . A A . 5 ARG HE 1 1 16 1972 1 1 5 ARG HG2 H -5.993 -2.006 -1.922 1.00 . A A . 5 ARG HG2 1 1 16 1973 1 1 5 ARG HG3 H -5.715 -0.472 -1.127 1.00 . A A . 5 ARG HG3 1 1 16 1974 1 1 5 ARG HH11 H -4.879 -2.197 -4.209 1.00 . A A . 5 ARG HH11 1 1 16 1975 1 1 5 ARG HH12 H -5.166 -1.430 -5.734 1.00 . A A . 5 ARG HH12 1 1 16 1976 1 1 5 ARG HH21 H -4.133 1.736 -4.677 1.00 . A A . 5 ARG HH21 1 1 16 1977 1 1 5 ARG HH22 H -4.744 0.801 -6.000 1.00 . A A . 5 ARG HH22 1 1 16 1978 1 1 5 ARG N N -3.080 -1.272 1.028 1.00 . A A . 5 ARG N 1 1 16 1979 1 1 5 ARG NE N -4.045 -0.136 -3.014 1.00 . A A . 5 ARG NE 1 1 16 1980 1 1 5 ARG NH1 N -4.866 -1.378 -4.781 1.00 . A A . 5 ARG NH1 1 1 16 1981 1 1 5 ARG NH2 N -4.442 0.861 -5.049 1.00 . A A . 5 ARG NH2 1 1 16 1982 1 1 5 ARG O O -5.151 -2.773 2.734 1.00 . A A . 5 ARG O 1 1 16 1983 1 1 6 HIS C C -5.877 0.516 5.329 1.00 . A A . 6 HIS C 1 1 16 1984 1 1 6 HIS CA C -5.622 -0.812 4.624 1.00 . A A . 6 HIS CA 1 1 16 1985 1 1 6 HIS CB C -4.527 -1.612 5.348 1.00 . A A . 6 HIS CB 1 1 16 1986 1 1 6 HIS CD2 C -5.319 -1.032 7.762 1.00 . A A . 6 HIS CD2 1 1 16 1987 1 1 6 HIS CE1 C -4.808 -2.935 8.723 1.00 . A A . 6 HIS CE1 1 1 16 1988 1 1 6 HIS CG C -4.783 -1.837 6.810 1.00 . A A . 6 HIS CG 1 1 16 1989 1 1 6 HIS H H -5.040 0.330 2.947 1.00 . A A . 6 HIS H 1 1 16 1990 1 1 6 HIS HA H -6.534 -1.388 4.613 1.00 . A A . 6 HIS HA 1 1 16 1991 1 1 6 HIS HB2 H -4.447 -2.586 4.880 1.00 . A A . 6 HIS HB2 1 1 16 1992 1 1 6 HIS HB3 H -3.574 -1.090 5.244 1.00 . A A . 6 HIS HB3 1 1 16 1993 1 1 6 HIS HD1 H -4.070 -3.809 7.028 1.00 . A A . 6 HIS HD1 1 1 16 1994 1 1 6 HIS HD2 H -5.677 -0.023 7.622 1.00 . A A . 6 HIS HD2 1 1 16 1995 1 1 6 HIS HE1 H -4.682 -3.711 9.463 1.00 . A A . 6 HIS HE1 1 1 16 1996 1 1 6 HIS HE2 H -5.581 -1.385 9.815 1.00 . A A . 6 HIS HE2 1 1 16 1997 1 1 6 HIS N N -5.208 -0.586 3.251 1.00 . A A . 6 HIS N 1 1 16 1998 1 1 6 HIS ND1 N -4.474 -3.021 7.448 1.00 . A A . 6 HIS ND1 1 1 16 1999 1 1 6 HIS NE2 N -5.322 -1.739 8.939 1.00 . A A . 6 HIS NE2 1 1 16 2000 1 1 6 HIS O O -4.987 1.390 5.281 1.00 . A A . 6 HIS O 1 1 17 2001 1 1 1 HIS C C 4.668 2.163 -2.678 1.00 . A A . 1 HIS C 1 1 17 2002 1 1 1 HIS CA C 5.008 2.558 -4.113 1.00 . A A . 1 HIS CA 1 1 17 2003 1 1 1 HIS CB C 4.238 1.683 -5.106 1.00 . A A . 1 HIS CB 1 1 17 2004 1 1 1 HIS CD2 C 3.076 2.193 -7.369 1.00 . A A . 1 HIS CD2 1 1 17 2005 1 1 1 HIS CE1 C 2.215 4.143 -6.855 1.00 . A A . 1 HIS CE1 1 1 17 2006 1 1 1 HIS CG C 3.426 2.468 -6.090 1.00 . A A . 1 HIS CG 1 1 17 2007 1 1 1 HIS H1 H 6.976 2.775 -3.555 1.00 . A A . 1 HIS H1 1 1 17 2008 1 1 1 HIS H2 H 6.686 2.950 -5.238 1.00 . A A . 1 HIS H2 1 1 17 2009 1 1 1 HIS H3 H 6.654 1.393 -4.516 1.00 . A A . 1 HIS H3 1 1 17 2010 1 1 1 HIS HA H 4.738 3.592 -4.267 1.00 . A A . 1 HIS HA 1 1 17 2011 1 1 1 HIS HB2 H 4.940 1.080 -5.662 1.00 . A A . 1 HIS HB2 1 1 17 2012 1 1 1 HIS HB3 H 3.567 1.035 -4.561 1.00 . A A . 1 HIS HB3 1 1 17 2013 1 1 1 HIS HD1 H 2.946 4.170 -4.944 1.00 . A A . 1 HIS HD1 1 1 17 2014 1 1 1 HIS HD2 H 3.340 1.307 -7.930 1.00 . A A . 1 HIS HD2 1 1 17 2015 1 1 1 HIS HE1 H 1.681 5.080 -6.918 1.00 . A A . 1 HIS HE1 1 1 17 2016 1 1 1 HIS HE2 H 2.007 3.370 -8.740 1.00 . A A . 1 HIS HE2 1 1 17 2017 1 1 1 HIS N N 6.462 2.405 -4.379 1.00 . A A . 1 HIS N 1 1 17 2018 1 1 1 HIS ND1 N 2.871 3.696 -5.799 1.00 . A A . 1 HIS ND1 1 1 17 2019 1 1 1 HIS NE2 N 2.324 3.250 -7.821 1.00 . A A . 1 HIS NE2 1 1 17 2020 1 1 1 HIS O O 4.485 3.022 -1.816 1.00 . A A . 1 HIS O 1 1 17 2021 1 1 2 ARG C C 2.944 0.914 -0.596 1.00 . A A . 2 ARG C 1 1 17 2022 1 1 2 ARG CA C 4.271 0.352 -1.098 1.00 . A A . 2 ARG CA 1 1 17 2023 1 1 2 ARG CB C 5.392 0.704 -0.117 1.00 . A A . 2 ARG CB 1 1 17 2024 1 1 2 ARG CD C 6.506 -0.085 1.994 1.00 . A A . 2 ARG CD 1 1 17 2025 1 1 2 ARG CG C 5.184 0.127 1.274 1.00 . A A . 2 ARG CG 1 1 17 2026 1 1 2 ARG CZ C 7.778 -1.994 2.894 1.00 . A A . 2 ARG CZ 1 1 17 2027 1 1 2 ARG H H 4.746 0.222 -3.157 1.00 . A A . 2 ARG H 1 1 17 2028 1 1 2 ARG HA H 4.190 -0.723 -1.164 1.00 . A A . 2 ARG HA 1 1 17 2029 1 1 2 ARG HB2 H 6.326 0.325 -0.505 1.00 . A A . 2 ARG HB2 1 1 17 2030 1 1 2 ARG HB3 H 5.456 1.778 -0.033 1.00 . A A . 2 ARG HB3 1 1 17 2031 1 1 2 ARG HD2 H 7.314 0.082 1.296 1.00 . A A . 2 ARG HD2 1 1 17 2032 1 1 2 ARG HD3 H 6.579 0.627 2.803 1.00 . A A . 2 ARG HD3 1 1 17 2033 1 1 2 ARG HE H 5.798 -1.954 2.644 1.00 . A A . 2 ARG HE 1 1 17 2034 1 1 2 ARG HG2 H 4.578 0.814 1.851 1.00 . A A . 2 ARG HG2 1 1 17 2035 1 1 2 ARG HG3 H 4.675 -0.826 1.186 1.00 . A A . 2 ARG HG3 1 1 17 2036 1 1 2 ARG HH11 H 8.909 -0.389 2.406 1.00 . A A . 2 ARG HH11 1 1 17 2037 1 1 2 ARG HH12 H 9.779 -1.746 3.038 1.00 . A A . 2 ARG HH12 1 1 17 2038 1 1 2 ARG HH21 H 6.942 -3.741 3.473 1.00 . A A . 2 ARG HH21 1 1 17 2039 1 1 2 ARG HH22 H 8.663 -3.648 3.643 1.00 . A A . 2 ARG HH22 1 1 17 2040 1 1 2 ARG N N 4.587 0.859 -2.429 1.00 . A A . 2 ARG N 1 1 17 2041 1 1 2 ARG NE N 6.623 -1.435 2.539 1.00 . A A . 2 ARG NE 1 1 17 2042 1 1 2 ARG NH1 N 8.915 -1.321 2.769 1.00 . A A . 2 ARG NH1 1 1 17 2043 1 1 2 ARG NH2 N 7.796 -3.229 3.376 1.00 . A A . 2 ARG NH2 1 1 17 2044 1 1 2 ARG O O 2.837 1.350 0.550 1.00 . A A . 2 ARG O 1 1 17 2045 1 1 3 PHE C C -0.184 0.356 -0.358 1.00 . A A . 3 PHE C 1 1 17 2046 1 1 3 PHE CA C 0.626 1.410 -1.111 1.00 . A A . 3 PHE CA 1 1 17 2047 1 1 3 PHE CB C -0.108 1.844 -2.379 1.00 . A A . 3 PHE CB 1 1 17 2048 1 1 3 PHE CD1 C -0.950 -0.154 -3.654 1.00 . A A . 3 PHE CD1 1 1 17 2049 1 1 3 PHE CD2 C 0.998 0.963 -4.456 1.00 . A A . 3 PHE CD2 1 1 17 2050 1 1 3 PHE CE1 C -0.870 -1.052 -4.702 1.00 . A A . 3 PHE CE1 1 1 17 2051 1 1 3 PHE CE2 C 1.084 0.067 -5.505 1.00 . A A . 3 PHE CE2 1 1 17 2052 1 1 3 PHE CG C -0.018 0.863 -3.518 1.00 . A A . 3 PHE CG 1 1 17 2053 1 1 3 PHE CZ C 0.149 -0.942 -5.628 1.00 . A A . 3 PHE CZ 1 1 17 2054 1 1 3 PHE H H 2.074 0.552 -2.358 1.00 . A A . 3 PHE H 1 1 17 2055 1 1 3 PHE HA H 0.761 2.269 -0.471 1.00 . A A . 3 PHE HA 1 1 17 2056 1 1 3 PHE HB2 H -1.148 1.979 -2.148 1.00 . A A . 3 PHE HB2 1 1 17 2057 1 1 3 PHE HB3 H 0.314 2.781 -2.719 1.00 . A A . 3 PHE HB3 1 1 17 2058 1 1 3 PHE HD1 H -1.748 -0.242 -2.932 1.00 . A A . 3 PHE HD1 1 1 17 2059 1 1 3 PHE HD2 H 1.731 1.751 -4.362 1.00 . A A . 3 PHE HD2 1 1 17 2060 1 1 3 PHE HE1 H -1.602 -1.840 -4.795 1.00 . A A . 3 PHE HE1 1 1 17 2061 1 1 3 PHE HE2 H 1.881 0.155 -6.228 1.00 . A A . 3 PHE HE2 1 1 17 2062 1 1 3 PHE HZ H 0.213 -1.643 -6.447 1.00 . A A . 3 PHE HZ 1 1 17 2063 1 1 3 PHE N N 1.935 0.903 -1.461 1.00 . A A . 3 PHE N 1 1 17 2064 1 1 3 PHE O O -0.888 -0.453 -0.960 1.00 . A A . 3 PHE O 1 1 17 2065 1 1 4 LEU C C -2.280 -0.389 1.743 1.00 . A A . 4 LEU C 1 1 17 2066 1 1 4 LEU CA C -0.778 -0.585 1.806 1.00 . A A . 4 LEU CA 1 1 17 2067 1 1 4 LEU CB C -0.338 -0.446 3.257 1.00 . A A . 4 LEU CB 1 1 17 2068 1 1 4 LEU CD1 C 1.934 0.553 3.561 1.00 . A A . 4 LEU CD1 1 1 17 2069 1 1 4 LEU CD2 C 1.326 -1.550 4.777 1.00 . A A . 4 LEU CD2 1 1 17 2070 1 1 4 LEU CG C 1.140 -0.740 3.501 1.00 . A A . 4 LEU CG 1 1 17 2071 1 1 4 LEU H H 0.515 1.029 1.389 1.00 . A A . 4 LEU H 1 1 17 2072 1 1 4 LEU HA H -0.534 -1.574 1.463 1.00 . A A . 4 LEU HA 1 1 17 2073 1 1 4 LEU HB2 H -0.546 0.566 3.575 1.00 . A A . 4 LEU HB2 1 1 17 2074 1 1 4 LEU HB3 H -0.932 -1.122 3.860 1.00 . A A . 4 LEU HB3 1 1 17 2075 1 1 4 LEU HD11 H 1.343 1.354 3.144 1.00 . A A . 4 LEU HD11 1 1 17 2076 1 1 4 LEU HD12 H 2.843 0.441 2.989 1.00 . A A . 4 LEU HD12 1 1 17 2077 1 1 4 LEU HD13 H 2.178 0.780 4.588 1.00 . A A . 4 LEU HD13 1 1 17 2078 1 1 4 LEU HD21 H 2.301 -1.346 5.194 1.00 . A A . 4 LEU HD21 1 1 17 2079 1 1 4 LEU HD22 H 1.244 -2.603 4.550 1.00 . A A . 4 LEU HD22 1 1 17 2080 1 1 4 LEU HD23 H 0.564 -1.275 5.492 1.00 . A A . 4 LEU HD23 1 1 17 2081 1 1 4 LEU HG H 1.520 -1.320 2.674 1.00 . A A . 4 LEU HG 1 1 17 2082 1 1 4 LEU N N -0.069 0.369 0.966 1.00 . A A . 4 LEU N 1 1 17 2083 1 1 4 LEU O O -2.804 0.591 2.274 1.00 . A A . 4 LEU O 1 1 17 2084 1 1 5 ARG C C -4.959 -1.464 2.486 1.00 . A A . 5 ARG C 1 1 17 2085 1 1 5 ARG CA C -4.421 -1.252 1.084 1.00 . A A . 5 ARG CA 1 1 17 2086 1 1 5 ARG CB C -4.972 -2.285 0.123 1.00 . A A . 5 ARG CB 1 1 17 2087 1 1 5 ARG CD C -3.956 -1.399 -1.974 1.00 . A A . 5 ARG CD 1 1 17 2088 1 1 5 ARG CG C -5.247 -1.697 -1.230 1.00 . A A . 5 ARG CG 1 1 17 2089 1 1 5 ARG CZ C -4.737 -0.187 -3.972 1.00 . A A . 5 ARG CZ 1 1 17 2090 1 1 5 ARG H H -2.529 -2.115 0.762 1.00 . A A . 5 ARG H 1 1 17 2091 1 1 5 ARG HA H -4.691 -0.272 0.733 1.00 . A A . 5 ARG HA 1 1 17 2092 1 1 5 ARG HB2 H -4.254 -3.073 0.004 1.00 . A A . 5 ARG HB2 1 1 17 2093 1 1 5 ARG HB3 H -5.892 -2.686 0.518 1.00 . A A . 5 ARG HB3 1 1 17 2094 1 1 5 ARG HD2 H -3.168 -1.237 -1.249 1.00 . A A . 5 ARG HD2 1 1 17 2095 1 1 5 ARG HD3 H -3.708 -2.248 -2.594 1.00 . A A . 5 ARG HD3 1 1 17 2096 1 1 5 ARG HE H -3.642 0.609 -2.506 1.00 . A A . 5 ARG HE 1 1 17 2097 1 1 5 ARG HG2 H -5.834 -2.385 -1.796 1.00 . A A . 5 ARG HG2 1 1 17 2098 1 1 5 ARG HG3 H -5.789 -0.785 -1.096 1.00 . A A . 5 ARG HG3 1 1 17 2099 1 1 5 ARG HH11 H -5.291 -2.131 -3.902 1.00 . A A . 5 ARG HH11 1 1 17 2100 1 1 5 ARG HH12 H -5.831 -1.255 -5.294 1.00 . A A . 5 ARG HH12 1 1 17 2101 1 1 5 ARG HH21 H -4.352 1.764 -4.337 1.00 . A A . 5 ARG HH21 1 1 17 2102 1 1 5 ARG HH22 H -5.298 0.957 -5.542 1.00 . A A . 5 ARG HH22 1 1 17 2103 1 1 5 ARG N N -2.982 -1.337 1.140 1.00 . A A . 5 ARG N 1 1 17 2104 1 1 5 ARG NE N -4.075 -0.212 -2.817 1.00 . A A . 5 ARG NE 1 1 17 2105 1 1 5 ARG NH1 N -5.335 -1.281 -4.427 1.00 . A A . 5 ARG NH1 1 1 17 2106 1 1 5 ARG NH2 N -4.801 0.937 -4.675 1.00 . A A . 5 ARG NH2 1 1 17 2107 1 1 5 ARG O O -5.138 -2.598 2.932 1.00 . A A . 5 ARG O 1 1 17 2108 1 1 6 HIS C C -5.902 0.976 5.107 1.00 . A A . 6 HIS C 1 1 17 2109 1 1 6 HIS CA C -5.631 -0.425 4.569 1.00 . A A . 6 HIS CA 1 1 17 2110 1 1 6 HIS CB C -4.567 -1.136 5.420 1.00 . A A . 6 HIS CB 1 1 17 2111 1 1 6 HIS CD2 C -5.440 -0.286 7.722 1.00 . A A . 6 HIS CD2 1 1 17 2112 1 1 6 HIS CE1 C -4.995 -2.076 8.907 1.00 . A A . 6 HIS CE1 1 1 17 2113 1 1 6 HIS CG C -4.882 -1.197 6.887 1.00 . A A . 6 HIS CG 1 1 17 2114 1 1 6 HIS H H -4.972 0.508 2.793 1.00 . A A . 6 HIS H 1 1 17 2115 1 1 6 HIS HA H -6.545 -0.997 4.595 1.00 . A A . 6 HIS HA 1 1 17 2116 1 1 6 HIS HB2 H -4.470 -2.156 5.068 1.00 . A A . 6 HIS HB2 1 1 17 2117 1 1 6 HIS HB3 H -3.610 -0.626 5.297 1.00 . A A . 6 HIS HB3 1 1 17 2118 1 1 6 HIS HD1 H -4.206 -3.140 7.347 1.00 . A A . 6 HIS HD1 1 1 17 2119 1 1 6 HIS HD2 H -5.779 0.704 7.458 1.00 . A A . 6 HIS HD2 1 1 17 2120 1 1 6 HIS HE1 H -4.909 -2.767 9.732 1.00 . A A . 6 HIS HE1 1 1 17 2121 1 1 6 HIS HE2 H -5.925 -0.463 9.757 1.00 . A A . 6 HIS HE2 1 1 17 2122 1 1 6 HIS N N -5.168 -0.364 3.194 1.00 . A A . 6 HIS N 1 1 17 2123 1 1 6 HIS ND1 N -4.614 -2.306 7.663 1.00 . A A . 6 HIS ND1 1 1 17 2124 1 1 6 HIS NE2 N -5.497 -0.858 8.969 1.00 . A A . 6 HIS NE2 1 1 17 2125 1 1 6 HIS O O -4.975 1.813 5.071 1.00 . A A . 6 HIS O 1 1 18 2126 1 1 1 HIS C C 4.722 2.260 -2.594 1.00 . A A . 1 HIS C 1 1 18 2127 1 1 1 HIS CA C 5.106 2.710 -4.001 1.00 . A A . 1 HIS CA 1 1 18 2128 1 1 1 HIS CB C 4.261 1.976 -5.045 1.00 . A A . 1 HIS CB 1 1 18 2129 1 1 1 HIS CD2 C 3.196 3.100 -7.127 1.00 . A A . 1 HIS CD2 1 1 18 2130 1 1 1 HIS CE1 C 1.721 4.353 -6.096 1.00 . A A . 1 HIS CE1 1 1 18 2131 1 1 1 HIS CG C 3.330 2.875 -5.798 1.00 . A A . 1 HIS CG 1 1 18 2132 1 1 1 HIS H1 H 6.657 1.409 -4.364 1.00 . A A . 1 HIS H1 1 1 18 2133 1 1 1 HIS H2 H 7.094 2.815 -3.483 1.00 . A A . 1 HIS H2 1 1 18 2134 1 1 1 HIS H3 H 6.787 2.917 -5.168 1.00 . A A . 1 HIS H3 1 1 18 2135 1 1 1 HIS HA H 4.935 3.773 -4.089 1.00 . A A . 1 HIS HA 1 1 18 2136 1 1 1 HIS HB2 H 4.916 1.505 -5.761 1.00 . A A . 1 HIS HB2 1 1 18 2137 1 1 1 HIS HB3 H 3.668 1.219 -4.554 1.00 . A A . 1 HIS HB3 1 1 18 2138 1 1 1 HIS HD1 H 2.239 3.738 -4.214 1.00 . A A . 1 HIS HD1 1 1 18 2139 1 1 1 HIS HD2 H 3.774 2.640 -7.916 1.00 . A A . 1 HIS HD2 1 1 18 2140 1 1 1 HIS HE1 H 0.926 5.058 -5.904 1.00 . A A . 1 HIS HE1 1 1 18 2141 1 1 1 HIS HE2 H 1.934 4.445 -8.130 1.00 . A A . 1 HIS HE2 1 1 18 2142 1 1 1 HIS N N 6.540 2.438 -4.279 1.00 . A A . 1 HIS N 1 1 18 2143 1 1 1 HIS ND1 N 2.392 3.676 -5.180 1.00 . A A . 1 HIS ND1 1 1 18 2144 1 1 1 HIS NE2 N 2.191 4.022 -7.285 1.00 . A A . 1 HIS NE2 1 1 18 2145 1 1 1 HIS O O 4.536 3.083 -1.698 1.00 . A A . 1 HIS O 1 1 18 2146 1 1 2 ARG C C 2.888 0.901 -0.649 1.00 . A A . 2 ARG C 1 1 18 2147 1 1 2 ARG CA C 4.251 0.390 -1.108 1.00 . A A . 2 ARG CA 1 1 18 2148 1 1 2 ARG CB C 5.318 0.742 -0.070 1.00 . A A . 2 ARG CB 1 1 18 2149 1 1 2 ARG CD C 6.545 -0.347 1.830 1.00 . A A . 2 ARG CD 1 1 18 2150 1 1 2 ARG CG C 5.184 -0.036 1.228 1.00 . A A . 2 ARG CG 1 1 18 2151 1 1 2 ARG CZ C 7.484 -1.595 3.736 1.00 . A A . 2 ARG CZ 1 1 18 2152 1 1 2 ARG H H 4.772 0.342 -3.160 1.00 . A A . 2 ARG H 1 1 18 2153 1 1 2 ARG HA H 4.203 -0.683 -1.211 1.00 . A A . 2 ARG HA 1 1 18 2154 1 1 2 ARG HB2 H 6.292 0.538 -0.489 1.00 . A A . 2 ARG HB2 1 1 18 2155 1 1 2 ARG HB3 H 5.248 1.796 0.158 1.00 . A A . 2 ARG HB3 1 1 18 2156 1 1 2 ARG HD2 H 7.129 -0.892 1.104 1.00 . A A . 2 ARG HD2 1 1 18 2157 1 1 2 ARG HD3 H 7.041 0.583 2.065 1.00 . A A . 2 ARG HD3 1 1 18 2158 1 1 2 ARG HE H 5.536 -1.362 3.370 1.00 . A A . 2 ARG HE 1 1 18 2159 1 1 2 ARG HG2 H 4.616 0.555 1.935 1.00 . A A . 2 ARG HG2 1 1 18 2160 1 1 2 ARG HG3 H 4.667 -0.967 1.028 1.00 . A A . 2 ARG HG3 1 1 18 2161 1 1 2 ARG HH11 H 8.866 -0.782 2.503 1.00 . A A . 2 ARG HH11 1 1 18 2162 1 1 2 ARG HH12 H 9.502 -1.664 3.851 1.00 . A A . 2 ARG HH12 1 1 18 2163 1 1 2 ARG HH21 H 6.370 -2.522 5.144 1.00 . A A . 2 ARG HH21 1 1 18 2164 1 1 2 ARG HH22 H 8.085 -2.652 5.350 1.00 . A A . 2 ARG HH22 1 1 18 2165 1 1 2 ARG N N 4.609 0.949 -2.407 1.00 . A A . 2 ARG N 1 1 18 2166 1 1 2 ARG NE N 6.436 -1.147 3.048 1.00 . A A . 2 ARG NE 1 1 18 2167 1 1 2 ARG NH1 N 8.719 -1.325 3.329 1.00 . A A . 2 ARG NH1 1 1 18 2168 1 1 2 ARG NH2 N 7.298 -2.315 4.833 1.00 . A A . 2 ARG NH2 1 1 18 2169 1 1 2 ARG O O 2.736 1.358 0.485 1.00 . A A . 2 ARG O 1 1 18 2170 1 1 3 PHE C C -0.217 0.210 -0.464 1.00 . A A . 3 PHE C 1 1 18 2171 1 1 3 PHE CA C 0.562 1.280 -1.224 1.00 . A A . 3 PHE CA 1 1 18 2172 1 1 3 PHE CB C -0.163 1.653 -2.516 1.00 . A A . 3 PHE CB 1 1 18 2173 1 1 3 PHE CD1 C -0.941 -0.400 -3.744 1.00 . A A . 3 PHE CD1 1 1 18 2174 1 1 3 PHE CD2 C 1.005 0.725 -4.538 1.00 . A A . 3 PHE CD2 1 1 18 2175 1 1 3 PHE CE1 C -0.822 -1.329 -4.760 1.00 . A A . 3 PHE CE1 1 1 18 2176 1 1 3 PHE CE2 C 1.130 -0.202 -5.556 1.00 . A A . 3 PHE CE2 1 1 18 2177 1 1 3 PHE CG C -0.030 0.637 -3.620 1.00 . A A . 3 PHE CG 1 1 18 2178 1 1 3 PHE CZ C 0.215 -1.230 -5.667 1.00 . A A . 3 PHE CZ 1 1 18 2179 1 1 3 PHE H H 2.075 0.461 -2.420 1.00 . A A . 3 PHE H 1 1 18 2180 1 1 3 PHE HA H 0.646 2.159 -0.603 1.00 . A A . 3 PHE HA 1 1 18 2181 1 1 3 PHE HB2 H -1.210 1.765 -2.304 1.00 . A A . 3 PHE HB2 1 1 18 2182 1 1 3 PHE HB3 H 0.237 2.591 -2.881 1.00 . A A . 3 PHE HB3 1 1 18 2183 1 1 3 PHE HD1 H -1.753 -0.479 -3.038 1.00 . A A . 3 PHE HD1 1 1 18 2184 1 1 3 PHE HD2 H 1.721 1.529 -4.453 1.00 . A A . 3 PHE HD2 1 1 18 2185 1 1 3 PHE HE1 H -1.539 -2.133 -4.845 1.00 . A A . 3 PHE HE1 1 1 18 2186 1 1 3 PHE HE2 H 1.942 -0.122 -6.263 1.00 . A A . 3 PHE HE2 1 1 18 2187 1 1 3 PHE HZ H 0.310 -1.955 -6.461 1.00 . A A . 3 PHE HZ 1 1 18 2188 1 1 3 PHE N N 1.901 0.826 -1.535 1.00 . A A . 3 PHE N 1 1 18 2189 1 1 3 PHE O O -0.874 -0.640 -1.062 1.00 . A A . 3 PHE O 1 1 18 2190 1 1 4 LEU C C -2.320 -0.477 1.715 1.00 . A A . 4 LEU C 1 1 18 2191 1 1 4 LEU CA C -0.822 -0.708 1.704 1.00 . A A . 4 LEU CA 1 1 18 2192 1 1 4 LEU CB C -0.313 -0.626 3.137 1.00 . A A . 4 LEU CB 1 1 18 2193 1 1 4 LEU CD1 C 1.913 0.502 3.284 1.00 . A A . 4 LEU CD1 1 1 18 2194 1 1 4 LEU CD2 C 1.502 -1.616 4.556 1.00 . A A . 4 LEU CD2 1 1 18 2195 1 1 4 LEU CG C 1.191 -0.834 3.288 1.00 . A A . 4 LEU CG 1 1 18 2196 1 1 4 LEU H H 0.413 0.948 1.282 1.00 . A A . 4 LEU H 1 1 18 2197 1 1 4 LEU HA H -0.616 -1.689 1.319 1.00 . A A . 4 LEU HA 1 1 18 2198 1 1 4 LEU HB2 H -0.569 0.347 3.531 1.00 . A A . 4 LEU HB2 1 1 18 2199 1 1 4 LEU HB3 H -0.827 -1.376 3.724 1.00 . A A . 4 LEU HB3 1 1 18 2200 1 1 4 LEU HD11 H 2.707 0.476 2.552 1.00 . A A . 4 LEU HD11 1 1 18 2201 1 1 4 LEU HD12 H 2.330 0.691 4.262 1.00 . A A . 4 LEU HD12 1 1 18 2202 1 1 4 LEU HD13 H 1.216 1.285 3.031 1.00 . A A . 4 LEU HD13 1 1 18 2203 1 1 4 LEU HD21 H 2.429 -1.259 4.981 1.00 . A A . 4 LEU HD21 1 1 18 2204 1 1 4 LEU HD22 H 1.597 -2.665 4.318 1.00 . A A . 4 LEU HD22 1 1 18 2205 1 1 4 LEU HD23 H 0.703 -1.480 5.269 1.00 . A A . 4 LEU HD23 1 1 18 2206 1 1 4 LEU HG H 1.550 -1.403 2.444 1.00 . A A . 4 LEU HG 1 1 18 2207 1 1 4 LEU N N -0.133 0.256 0.861 1.00 . A A . 4 LEU N 1 1 18 2208 1 1 4 LEU O O -2.795 0.503 2.289 1.00 . A A . 4 LEU O 1 1 18 2209 1 1 5 ARG C C -4.985 -1.430 2.565 1.00 . A A . 5 ARG C 1 1 18 2210 1 1 5 ARG CA C -4.509 -1.275 1.133 1.00 . A A . 5 ARG CA 1 1 18 2211 1 1 5 ARG CB C -5.121 -2.326 0.232 1.00 . A A . 5 ARG CB 1 1 18 2212 1 1 5 ARG CD C -4.086 -1.710 -1.951 1.00 . A A . 5 ARG CD 1 1 18 2213 1 1 5 ARG CG C -5.375 -1.800 -1.151 1.00 . A A . 5 ARG CG 1 1 18 2214 1 1 5 ARG CZ C -4.756 -0.526 -4.006 1.00 . A A . 5 ARG CZ 1 1 18 2215 1 1 5 ARG H H -2.657 -2.175 0.708 1.00 . A A . 5 ARG H 1 1 18 2216 1 1 5 ARG HA H -4.773 -0.299 0.762 1.00 . A A . 5 ARG HA 1 1 18 2217 1 1 5 ARG HB2 H -4.446 -3.156 0.153 1.00 . A A . 5 ARG HB2 1 1 18 2218 1 1 5 ARG HB3 H -6.056 -2.656 0.654 1.00 . A A . 5 ARG HB3 1 1 18 2219 1 1 5 ARG HD2 H -3.256 -1.612 -1.261 1.00 . A A . 5 ARG HD2 1 1 18 2220 1 1 5 ARG HD3 H -3.970 -2.615 -2.528 1.00 . A A . 5 ARG HD3 1 1 18 2221 1 1 5 ARG HE H -3.561 0.221 -2.593 1.00 . A A . 5 ARG HE 1 1 18 2222 1 1 5 ARG HG2 H -6.062 -2.449 -1.651 1.00 . A A . 5 ARG HG2 1 1 18 2223 1 1 5 ARG HG3 H -5.799 -0.822 -1.065 1.00 . A A . 5 ARG HG3 1 1 18 2224 1 1 5 ARG HH11 H -5.520 -2.390 -3.827 1.00 . A A . 5 ARG HH11 1 1 18 2225 1 1 5 ARG HH12 H -5.978 -1.535 -5.261 1.00 . A A . 5 ARG HH12 1 1 18 2226 1 1 5 ARG HH21 H -4.164 1.348 -4.478 1.00 . A A . 5 ARG HH21 1 1 18 2227 1 1 5 ARG HH22 H -5.208 0.587 -5.631 1.00 . A A . 5 ARG HH22 1 1 18 2228 1 1 5 ARG N N -3.072 -1.395 1.124 1.00 . A A . 5 ARG N 1 1 18 2229 1 1 5 ARG NE N -4.086 -0.563 -2.856 1.00 . A A . 5 ARG NE 1 1 18 2230 1 1 5 ARG NH1 N -5.477 -1.570 -4.396 1.00 . A A . 5 ARG NH1 1 1 18 2231 1 1 5 ARG NH2 N -4.706 0.558 -4.768 1.00 . A A . 5 ARG NH2 1 1 18 2232 1 1 5 ARG O O -5.169 -2.543 3.056 1.00 . A A . 5 ARG O 1 1 18 2233 1 1 6 HIS C C -5.732 1.119 5.144 1.00 . A A . 6 HIS C 1 1 18 2234 1 1 6 HIS CA C -5.528 -0.307 4.642 1.00 . A A . 6 HIS CA 1 1 18 2235 1 1 6 HIS CB C -4.444 -1.024 5.462 1.00 . A A . 6 HIS CB 1 1 18 2236 1 1 6 HIS CD2 C -5.158 -0.055 7.771 1.00 . A A . 6 HIS CD2 1 1 18 2237 1 1 6 HIS CE1 C -4.701 -1.811 9.001 1.00 . A A . 6 HIS CE1 1 1 18 2238 1 1 6 HIS CG C -4.676 -1.016 6.945 1.00 . A A . 6 HIS CG 1 1 18 2239 1 1 6 HIS H H -4.934 0.551 2.807 1.00 . A A . 6 HIS H 1 1 18 2240 1 1 6 HIS HA H -6.457 -0.848 4.731 1.00 . A A . 6 HIS HA 1 1 18 2241 1 1 6 HIS HB2 H -4.403 -2.060 5.147 1.00 . A A . 6 HIS HB2 1 1 18 2242 1 1 6 HIS HB3 H -3.477 -0.555 5.265 1.00 . A A . 6 HIS HB3 1 1 18 2243 1 1 6 HIS HD1 H -4.037 -2.961 7.446 1.00 . A A . 6 HIS HD1 1 1 18 2244 1 1 6 HIS HD2 H -5.480 0.934 7.485 1.00 . A A . 6 HIS HD2 1 1 18 2245 1 1 6 HIS HE1 H -4.587 -2.471 9.849 1.00 . A A . 6 HIS HE1 1 1 18 2246 1 1 6 HIS HE2 H -5.370 -0.077 9.860 1.00 . A A . 6 HIS HE2 1 1 18 2247 1 1 6 HIS N N -5.132 -0.302 3.246 1.00 . A A . 6 HIS N 1 1 18 2248 1 1 6 HIS ND1 N -4.399 -2.102 7.749 1.00 . A A . 6 HIS ND1 1 1 18 2249 1 1 6 HIS NE2 N -5.162 -0.575 9.042 1.00 . A A . 6 HIS NE2 1 1 18 2250 1 1 6 HIS O O -6.805 1.395 5.720 1.00 . A A . 6 HIS O 1 1 19 2251 1 1 1 HIS C C 5.360 1.184 -3.084 1.00 . A A . 1 HIS C 1 1 19 2252 1 1 1 HIS CA C 5.477 1.919 -4.414 1.00 . A A . 1 HIS CA 1 1 19 2253 1 1 1 HIS CB C 4.595 1.247 -5.468 1.00 . A A . 1 HIS CB 1 1 19 2254 1 1 1 HIS CD2 C 4.664 1.722 -8.017 1.00 . A A . 1 HIS CD2 1 1 19 2255 1 1 1 HIS CE1 C 3.999 3.810 -7.971 1.00 . A A . 1 HIS CE1 1 1 19 2256 1 1 1 HIS CG C 4.447 2.051 -6.722 1.00 . A A . 1 HIS CG 1 1 19 2257 1 1 1 HIS H1 H 7.420 2.589 -4.311 1.00 . A A . 1 HIS H1 1 1 19 2258 1 1 1 HIS H2 H 6.868 2.232 -5.897 1.00 . A A . 1 HIS H2 1 1 19 2259 1 1 1 HIS H3 H 7.253 0.958 -4.812 1.00 . A A . 1 HIS H3 1 1 19 2260 1 1 1 HIS HA H 5.155 2.941 -4.281 1.00 . A A . 1 HIS HA 1 1 19 2261 1 1 1 HIS HB2 H 5.026 0.293 -5.733 1.00 . A A . 1 HIS HB2 1 1 19 2262 1 1 1 HIS HB3 H 3.610 1.089 -5.055 1.00 . A A . 1 HIS HB3 1 1 19 2263 1 1 1 HIS HD1 H 3.797 3.896 -5.936 1.00 . A A . 1 HIS HD1 1 1 19 2264 1 1 1 HIS HD2 H 4.999 0.763 -8.388 1.00 . A A . 1 HIS HD2 1 1 19 2265 1 1 1 HIS HE1 H 3.712 4.805 -8.279 1.00 . A A . 1 HIS HE1 1 1 19 2266 1 1 1 HIS HE2 H 4.344 2.861 -9.752 1.00 . A A . 1 HIS HE2 1 1 19 2267 1 1 1 HIS N N 6.881 1.925 -4.902 1.00 . A A . 1 HIS N 1 1 19 2268 1 1 1 HIS ND1 N 4.033 3.366 -6.727 1.00 . A A . 1 HIS ND1 1 1 19 2269 1 1 1 HIS NE2 N 4.378 2.833 -8.773 1.00 . A A . 1 HIS NE2 1 1 19 2270 1 1 1 HIS O O 6.178 0.322 -2.764 1.00 . A A . 1 HIS O 1 1 19 2271 1 1 2 ARG C C 2.787 1.358 -0.412 1.00 . A A . 2 ARG C 1 1 19 2272 1 1 2 ARG CA C 4.113 0.905 -1.014 1.00 . A A . 2 ARG CA 1 1 19 2273 1 1 2 ARG CB C 5.262 1.237 -0.061 1.00 . A A . 2 ARG CB 1 1 19 2274 1 1 2 ARG CD C 6.586 0.206 1.808 1.00 . A A . 2 ARG CD 1 1 19 2275 1 1 2 ARG CG C 5.196 0.481 1.256 1.00 . A A . 2 ARG CG 1 1 19 2276 1 1 2 ARG CZ C 7.229 2.256 3.018 1.00 . A A . 2 ARG CZ 1 1 19 2277 1 1 2 ARG H H 3.717 2.226 -2.619 1.00 . A A . 2 ARG H 1 1 19 2278 1 1 2 ARG HA H 4.080 -0.164 -1.163 1.00 . A A . 2 ARG HA 1 1 19 2279 1 1 2 ARG HB2 H 6.196 0.994 -0.545 1.00 . A A . 2 ARG HB2 1 1 19 2280 1 1 2 ARG HB3 H 5.242 2.295 0.154 1.00 . A A . 2 ARG HB3 1 1 19 2281 1 1 2 ARG HD2 H 6.489 -0.284 2.765 1.00 . A A . 2 ARG HD2 1 1 19 2282 1 1 2 ARG HD3 H 7.108 -0.445 1.123 1.00 . A A . 2 ARG HD3 1 1 19 2283 1 1 2 ARG HE H 8.014 1.657 1.284 1.00 . A A . 2 ARG HE 1 1 19 2284 1 1 2 ARG HG2 H 4.645 1.075 1.973 1.00 . A A . 2 ARG HG2 1 1 19 2285 1 1 2 ARG HG3 H 4.689 -0.463 1.094 1.00 . A A . 2 ARG HG3 1 1 19 2286 1 1 2 ARG HH11 H 5.793 1.163 3.930 1.00 . A A . 2 ARG HH11 1 1 19 2287 1 1 2 ARG HH12 H 6.261 2.610 4.757 1.00 . A A . 2 ARG HH12 1 1 19 2288 1 1 2 ARG HH21 H 8.634 3.558 2.374 1.00 . A A . 2 ARG HH21 1 1 19 2289 1 1 2 ARG HH22 H 7.874 3.969 3.875 1.00 . A A . 2 ARG HH22 1 1 19 2290 1 1 2 ARG N N 4.336 1.531 -2.311 1.00 . A A . 2 ARG N 1 1 19 2291 1 1 2 ARG NE N 7.361 1.433 1.980 1.00 . A A . 2 ARG NE 1 1 19 2292 1 1 2 ARG NH1 N 6.356 1.987 3.981 1.00 . A A . 2 ARG NH1 1 1 19 2293 1 1 2 ARG NH2 N 7.973 3.351 3.095 1.00 . A A . 2 ARG NH2 1 1 19 2294 1 1 2 ARG O O 2.695 1.617 0.788 1.00 . A A . 2 ARG O 1 1 19 2295 1 1 3 PHE C C -0.320 0.700 -0.204 1.00 . A A . 3 PHE C 1 1 19 2296 1 1 3 PHE CA C 0.449 1.871 -0.807 1.00 . A A . 3 PHE CA 1 1 19 2297 1 1 3 PHE CB C -0.324 2.467 -1.984 1.00 . A A . 3 PHE CB 1 1 19 2298 1 1 3 PHE CD1 C -1.219 0.672 -3.503 1.00 . A A . 3 PHE CD1 1 1 19 2299 1 1 3 PHE CD2 C 0.735 1.859 -4.180 1.00 . A A . 3 PHE CD2 1 1 19 2300 1 1 3 PHE CE1 C -1.170 -0.076 -4.664 1.00 . A A . 3 PHE CE1 1 1 19 2301 1 1 3 PHE CE2 C 0.789 1.114 -5.342 1.00 . A A . 3 PHE CE2 1 1 19 2302 1 1 3 PHE CG C -0.268 1.648 -3.246 1.00 . A A . 3 PHE CG 1 1 19 2303 1 1 3 PHE CZ C -0.164 0.144 -5.584 1.00 . A A . 3 PHE CZ 1 1 19 2304 1 1 3 PHE H H 1.887 1.238 -2.193 1.00 . A A . 3 PHE H 1 1 19 2305 1 1 3 PHE HA H 0.580 2.630 -0.051 1.00 . A A . 3 PHE HA 1 1 19 2306 1 1 3 PHE HB2 H -1.357 2.562 -1.705 1.00 . A A . 3 PHE HB2 1 1 19 2307 1 1 3 PHE HB3 H 0.084 3.446 -2.207 1.00 . A A . 3 PHE HB3 1 1 19 2308 1 1 3 PHE HD1 H -2.007 0.498 -2.785 1.00 . A A . 3 PHE HD1 1 1 19 2309 1 1 3 PHE HD2 H 1.481 2.617 -3.992 1.00 . A A . 3 PHE HD2 1 1 19 2310 1 1 3 PHE HE1 H -1.917 -0.833 -4.852 1.00 . A A . 3 PHE HE1 1 1 19 2311 1 1 3 PHE HE2 H 1.577 1.288 -6.060 1.00 . A A . 3 PHE HE2 1 1 19 2312 1 1 3 PHE HZ H -0.124 -0.440 -6.492 1.00 . A A . 3 PHE HZ 1 1 19 2313 1 1 3 PHE N N 1.760 1.451 -1.252 1.00 . A A . 3 PHE N 1 1 19 2314 1 1 3 PHE O O -1.021 -0.027 -0.905 1.00 . A A . 3 PHE O 1 1 19 2315 1 1 4 LEU C C -2.351 -0.402 1.785 1.00 . A A . 4 LEU C 1 1 19 2316 1 1 4 LEU CA C -0.843 -0.563 1.807 1.00 . A A . 4 LEU CA 1 1 19 2317 1 1 4 LEU CB C -0.381 -0.612 3.258 1.00 . A A . 4 LEU CB 1 1 19 2318 1 1 4 LEU CD1 C 1.885 0.357 3.675 1.00 . A A . 4 LEU CD1 1 1 19 2319 1 1 4 LEU CD2 C 1.315 -1.908 4.578 1.00 . A A . 4 LEU CD2 1 1 19 2320 1 1 4 LEU CG C 1.102 -0.922 3.438 1.00 . A A . 4 LEU CG 1 1 19 2321 1 1 4 LEU H H 0.406 1.125 1.608 1.00 . A A . 4 LEU H 1 1 19 2322 1 1 4 LEU HA H -0.576 -1.487 1.326 1.00 . A A . 4 LEU HA 1 1 19 2323 1 1 4 LEU HB2 H -0.590 0.347 3.710 1.00 . A A . 4 LEU HB2 1 1 19 2324 1 1 4 LEU HB3 H -0.960 -1.367 3.777 1.00 . A A . 4 LEU HB3 1 1 19 2325 1 1 4 LEU HD11 H 1.294 1.202 3.354 1.00 . A A . 4 LEU HD11 1 1 19 2326 1 1 4 LEU HD12 H 2.804 0.324 3.109 1.00 . A A . 4 LEU HD12 1 1 19 2327 1 1 4 LEU HD13 H 2.110 0.453 4.727 1.00 . A A . 4 LEU HD13 1 1 19 2328 1 1 4 LEU HD21 H 1.363 -2.912 4.182 1.00 . A A . 4 LEU HD21 1 1 19 2329 1 1 4 LEU HD22 H 0.494 -1.836 5.276 1.00 . A A . 4 LEU HD22 1 1 19 2330 1 1 4 LEU HD23 H 2.240 -1.677 5.086 1.00 . A A . 4 LEU HD23 1 1 19 2331 1 1 4 LEU HG H 1.475 -1.370 2.529 1.00 . A A . 4 LEU HG 1 1 19 2332 1 1 4 LEU N N -0.174 0.520 1.104 1.00 . A A . 4 LEU N 1 1 19 2333 1 1 4 LEU O O -2.894 0.478 2.454 1.00 . A A . 4 LEU O 1 1 19 2334 1 1 5 ARG C C -4.997 -1.597 2.399 1.00 . A A . 5 ARG C 1 1 19 2335 1 1 5 ARG CA C -4.480 -1.219 1.025 1.00 . A A . 5 ARG CA 1 1 19 2336 1 1 5 ARG CB C -5.024 -2.149 -0.040 1.00 . A A . 5 ARG CB 1 1 19 2337 1 1 5 ARG CD C -4.162 -0.793 -1.950 1.00 . A A . 5 ARG CD 1 1 19 2338 1 1 5 ARG CG C -5.387 -1.407 -1.293 1.00 . A A . 5 ARG CG 1 1 19 2339 1 1 5 ARG CZ C -5.291 0.764 -3.491 1.00 . A A . 5 ARG CZ 1 1 19 2340 1 1 5 ARG H H -2.568 -1.978 0.568 1.00 . A A . 5 ARG H 1 1 19 2341 1 1 5 ARG HA H -4.777 -0.212 0.787 1.00 . A A . 5 ARG HA 1 1 19 2342 1 1 5 ARG HB2 H -4.277 -2.877 -0.288 1.00 . A A . 5 ARG HB2 1 1 19 2343 1 1 5 ARG HB3 H -5.906 -2.644 0.335 1.00 . A A . 5 ARG HB3 1 1 19 2344 1 1 5 ARG HD2 H -3.375 -0.711 -1.211 1.00 . A A . 5 ARG HD2 1 1 19 2345 1 1 5 ARG HD3 H -3.836 -1.439 -2.752 1.00 . A A . 5 ARG HD3 1 1 19 2346 1 1 5 ARG HE H -3.977 1.295 -2.086 1.00 . A A . 5 ARG HE 1 1 19 2347 1 1 5 ARG HG2 H -5.852 -2.083 -1.972 1.00 . A A . 5 ARG HG2 1 1 19 2348 1 1 5 ARG HG3 H -6.071 -0.628 -1.035 1.00 . A A . 5 ARG HG3 1 1 19 2349 1 1 5 ARG HH11 H -5.789 -1.179 -3.750 1.00 . A A . 5 ARG HH11 1 1 19 2350 1 1 5 ARG HH12 H -6.574 -0.062 -4.816 1.00 . A A . 5 ARG HH12 1 1 19 2351 1 1 5 ARG HH21 H -5.009 2.765 -3.486 1.00 . A A . 5 ARG HH21 1 1 19 2352 1 1 5 ARG HH22 H -6.131 2.175 -4.666 1.00 . A A . 5 ARG HH22 1 1 19 2353 1 1 5 ARG N N -3.037 -1.274 1.058 1.00 . A A . 5 ARG N 1 1 19 2354 1 1 5 ARG NE N -4.442 0.534 -2.491 1.00 . A A . 5 ARG NE 1 1 19 2355 1 1 5 ARG NH1 N -5.937 -0.242 -4.066 1.00 . A A . 5 ARG NH1 1 1 19 2356 1 1 5 ARG NH2 N -5.493 2.003 -3.916 1.00 . A A . 5 ARG NH2 1 1 19 2357 1 1 5 ARG O O -5.143 -2.776 2.722 1.00 . A A . 5 ARG O 1 1 19 2358 1 1 6 HIS C C -5.941 0.527 5.280 1.00 . A A . 6 HIS C 1 1 19 2359 1 1 6 HIS CA C -5.666 -0.804 4.589 1.00 . A A . 6 HIS CA 1 1 19 2360 1 1 6 HIS CB C -4.585 -1.594 5.342 1.00 . A A . 6 HIS CB 1 1 19 2361 1 1 6 HIS CD2 C -5.433 -1.011 7.733 1.00 . A A . 6 HIS CD2 1 1 19 2362 1 1 6 HIS CE1 C -4.964 -2.919 8.706 1.00 . A A . 6 HIS CE1 1 1 19 2363 1 1 6 HIS CG C -4.880 -1.819 6.796 1.00 . A A . 6 HIS CG 1 1 19 2364 1 1 6 HIS H H -5.051 0.329 2.918 1.00 . A A . 6 HIS H 1 1 19 2365 1 1 6 HIS HA H -6.576 -1.384 4.562 1.00 . A A . 6 HIS HA 1 1 19 2366 1 1 6 HIS HB2 H -4.483 -2.568 4.878 1.00 . A A . 6 HIS HB2 1 1 19 2367 1 1 6 HIS HB3 H -3.635 -1.063 5.266 1.00 . A A . 6 HIS HB3 1 1 19 2368 1 1 6 HIS HD1 H -4.187 -3.796 7.029 1.00 . A A . 6 HIS HD1 1 1 19 2369 1 1 6 HIS HD2 H -5.780 0.001 7.584 1.00 . A A . 6 HIS HD2 1 1 19 2370 1 1 6 HIS HE1 H -4.864 -3.696 9.448 1.00 . A A . 6 HIS HE1 1 1 19 2371 1 1 6 HIS HE2 H -5.872 -1.408 9.748 1.00 . A A . 6 HIS HE2 1 1 19 2372 1 1 6 HIS N N -5.222 -0.585 3.224 1.00 . A A . 6 HIS N 1 1 19 2373 1 1 6 HIS ND1 N -4.597 -3.007 7.440 1.00 . A A . 6 HIS ND1 1 1 19 2374 1 1 6 HIS NE2 N -5.473 -1.719 8.909 1.00 . A A . 6 HIS NE2 1 1 19 2375 1 1 6 HIS O O -7.127 0.835 5.520 1.00 . A A . 6 HIS O 1 1 20 2376 1 1 1 HIS C C 4.821 2.248 -2.617 1.00 . A A . 1 HIS C 1 1 20 2377 1 1 1 HIS CA C 5.188 2.692 -4.030 1.00 . A A . 1 HIS CA 1 1 20 2378 1 1 1 HIS CB C 4.181 2.142 -5.043 1.00 . A A . 1 HIS CB 1 1 20 2379 1 1 1 HIS CD2 C 3.025 3.638 -6.819 1.00 . A A . 1 HIS CD2 1 1 20 2380 1 1 1 HIS CE1 C 1.637 4.696 -5.492 1.00 . A A . 1 HIS CE1 1 1 20 2381 1 1 1 HIS CG C 3.230 3.174 -5.563 1.00 . A A . 1 HIS CG 1 1 20 2382 1 1 1 HIS H1 H 7.204 2.509 -3.659 1.00 . A A . 1 HIS H1 1 1 20 2383 1 1 1 HIS H2 H 6.791 2.648 -5.319 1.00 . A A . 1 HIS H2 1 1 20 2384 1 1 1 HIS H3 H 6.505 1.178 -4.482 1.00 . A A . 1 HIS H3 1 1 20 2385 1 1 1 HIS HA H 5.182 3.771 -4.073 1.00 . A A . 1 HIS HA 1 1 20 2386 1 1 1 HIS HB2 H 4.717 1.731 -5.885 1.00 . A A . 1 HIS HB2 1 1 20 2387 1 1 1 HIS HB3 H 3.602 1.358 -4.576 1.00 . A A . 1 HIS HB3 1 1 20 2388 1 1 1 HIS HD1 H 2.249 3.744 -3.787 1.00 . A A . 1 HIS HD1 1 1 20 2389 1 1 1 HIS HD2 H 3.547 3.323 -7.712 1.00 . A A . 1 HIS HD2 1 1 20 2390 1 1 1 HIS HE1 H 0.868 5.361 -5.128 1.00 . A A . 1 HIS HE1 1 1 20 2391 1 1 1 HIS HE2 H 1.735 5.155 -7.485 1.00 . A A . 1 HIS HE2 1 1 20 2392 1 1 1 HIS N N 6.545 2.214 -4.407 1.00 . A A . 1 HIS N 1 1 20 2393 1 1 1 HIS ND1 N 2.345 3.857 -4.755 1.00 . A A . 1 HIS ND1 1 1 20 2394 1 1 1 HIS NE2 N 2.031 4.583 -6.746 1.00 . A A . 1 HIS NE2 1 1 20 2395 1 1 1 HIS O O 4.751 3.064 -1.698 1.00 . A A . 1 HIS O 1 1 20 2396 1 1 2 ARG C C 2.895 0.937 -0.662 1.00 . A A . 2 ARG C 1 1 20 2397 1 1 2 ARG CA C 4.236 0.391 -1.148 1.00 . A A . 2 ARG CA 1 1 20 2398 1 1 2 ARG CB C 5.330 0.700 -0.123 1.00 . A A . 2 ARG CB 1 1 20 2399 1 1 2 ARG CD C 6.377 -0.131 2.003 1.00 . A A . 2 ARG CD 1 1 20 2400 1 1 2 ARG CG C 5.078 0.084 1.243 1.00 . A A . 2 ARG CG 1 1 20 2401 1 1 2 ARG CZ C 7.072 -1.060 4.176 1.00 . A A . 2 ARG CZ 1 1 20 2402 1 1 2 ARG H H 4.667 0.348 -3.222 1.00 . A A . 2 ARG H 1 1 20 2403 1 1 2 ARG HA H 4.154 -0.680 -1.259 1.00 . A A . 2 ARG HA 1 1 20 2404 1 1 2 ARG HB2 H 6.272 0.324 -0.495 1.00 . A A . 2 ARG HB2 1 1 20 2405 1 1 2 ARG HB3 H 5.403 1.771 -0.003 1.00 . A A . 2 ARG HB3 1 1 20 2406 1 1 2 ARG HD2 H 7.088 -0.608 1.346 1.00 . A A . 2 ARG HD2 1 1 20 2407 1 1 2 ARG HD3 H 6.761 0.830 2.311 1.00 . A A . 2 ARG HD3 1 1 20 2408 1 1 2 ARG HE H 5.360 -1.490 3.243 1.00 . A A . 2 ARG HE 1 1 20 2409 1 1 2 ARG HG2 H 4.443 0.748 1.816 1.00 . A A . 2 ARG HG2 1 1 20 2410 1 1 2 ARG HG3 H 4.584 -0.872 1.111 1.00 . A A . 2 ARG HG3 1 1 20 2411 1 1 2 ARG HH11 H 8.399 0.224 3.351 1.00 . A A . 2 ARG HH11 1 1 20 2412 1 1 2 ARG HH12 H 8.864 -0.443 4.880 1.00 . A A . 2 ARG HH12 1 1 20 2413 1 1 2 ARG HH21 H 5.971 -2.369 5.254 1.00 . A A . 2 ARG HH21 1 1 20 2414 1 1 2 ARG HH22 H 7.486 -1.915 5.960 1.00 . A A . 2 ARG HH22 1 1 20 2415 1 1 2 ARG N N 4.591 0.948 -2.451 1.00 . A A . 2 ARG N 1 1 20 2416 1 1 2 ARG NE N 6.188 -0.968 3.185 1.00 . A A . 2 ARG NE 1 1 20 2417 1 1 2 ARG NH1 N 8.205 -0.370 4.132 1.00 . A A . 2 ARG NH1 1 1 20 2418 1 1 2 ARG NH2 N 6.822 -1.846 5.215 1.00 . A A . 2 ARG NH2 1 1 20 2419 1 1 2 ARG O O 2.778 1.405 0.471 1.00 . A A . 2 ARG O 1 1 20 2420 1 1 3 PHE C C -0.223 0.311 -0.406 1.00 . A A . 3 PHE C 1 1 20 2421 1 1 3 PHE CA C 0.564 1.360 -1.189 1.00 . A A . 3 PHE CA 1 1 20 2422 1 1 3 PHE CB C -0.180 1.738 -2.469 1.00 . A A . 3 PHE CB 1 1 20 2423 1 1 3 PHE CD1 C 0.955 0.822 -4.513 1.00 . A A . 3 PHE CD1 1 1 20 2424 1 1 3 PHE CD2 C -0.970 -0.317 -3.688 1.00 . A A . 3 PHE CD2 1 1 20 2425 1 1 3 PHE CE1 C 1.068 -0.102 -5.535 1.00 . A A . 3 PHE CE1 1 1 20 2426 1 1 3 PHE CE2 C -0.863 -1.244 -4.708 1.00 . A A . 3 PHE CE2 1 1 20 2427 1 1 3 PHE CG C -0.063 0.725 -3.578 1.00 . A A . 3 PHE CG 1 1 20 2428 1 1 3 PHE CZ C 0.158 -1.136 -5.632 1.00 . A A . 3 PHE CZ 1 1 20 2429 1 1 3 PHE H H 2.033 0.500 -2.411 1.00 . A A . 3 PHE H 1 1 20 2430 1 1 3 PHE HA H 0.678 2.241 -0.576 1.00 . A A . 3 PHE HA 1 1 20 2431 1 1 3 PHE HB2 H -1.224 1.852 -2.242 1.00 . A A . 3 PHE HB2 1 1 20 2432 1 1 3 PHE HB3 H 0.218 2.675 -2.836 1.00 . A A . 3 PHE HB3 1 1 20 2433 1 1 3 PHE HD1 H 1.667 1.629 -4.437 1.00 . A A . 3 PHE HD1 1 1 20 2434 1 1 3 PHE HD2 H -1.770 -0.402 -2.968 1.00 . A A . 3 PHE HD2 1 1 20 2435 1 1 3 PHE HE1 H 1.866 -0.014 -6.256 1.00 . A A . 3 PHE HE1 1 1 20 2436 1 1 3 PHE HE2 H -1.576 -2.052 -4.782 1.00 . A A . 3 PHE HE2 1 1 20 2437 1 1 3 PHE HZ H 0.245 -1.858 -6.430 1.00 . A A . 3 PHE HZ 1 1 20 2438 1 1 3 PHE N N 1.886 0.875 -1.525 1.00 . A A . 3 PHE N 1 1 20 2439 1 1 3 PHE O O -0.908 -0.528 -0.987 1.00 . A A . 3 PHE O 1 1 20 2440 1 1 4 LEU C C -2.312 -0.386 1.740 1.00 . A A . 4 LEU C 1 1 20 2441 1 1 4 LEU CA C -0.810 -0.586 1.776 1.00 . A A . 4 LEU CA 1 1 20 2442 1 1 4 LEU CB C -0.344 -0.444 3.218 1.00 . A A . 4 LEU CB 1 1 20 2443 1 1 4 LEU CD1 C 1.927 0.555 3.510 1.00 . A A . 4 LEU CD1 1 1 20 2444 1 1 4 LEU CD2 C 1.345 -1.571 4.693 1.00 . A A . 4 LEU CD2 1 1 20 2445 1 1 4 LEU CG C 1.137 -0.738 3.436 1.00 . A A . 4 LEU CG 1 1 20 2446 1 1 4 LEU H H 0.453 1.044 1.326 1.00 . A A . 4 LEU H 1 1 20 2447 1 1 4 LEU HA H -0.573 -1.577 1.433 1.00 . A A . 4 LEU HA 1 1 20 2448 1 1 4 LEU HB2 H -0.546 0.568 3.539 1.00 . A A . 4 LEU HB2 1 1 20 2449 1 1 4 LEU HB3 H -0.927 -1.119 3.832 1.00 . A A . 4 LEU HB3 1 1 20 2450 1 1 4 LEU HD11 H 2.099 0.813 4.544 1.00 . A A . 4 LEU HD11 1 1 20 2451 1 1 4 LEU HD12 H 1.367 1.342 3.029 1.00 . A A . 4 LEU HD12 1 1 20 2452 1 1 4 LEU HD13 H 2.873 0.426 3.007 1.00 . A A . 4 LEU HD13 1 1 20 2453 1 1 4 LEU HD21 H 0.432 -2.096 4.932 1.00 . A A . 4 LEU HD21 1 1 20 2454 1 1 4 LEU HD22 H 1.613 -0.923 5.514 1.00 . A A . 4 LEU HD22 1 1 20 2455 1 1 4 LEU HD23 H 2.137 -2.285 4.524 1.00 . A A . 4 LEU HD23 1 1 20 2456 1 1 4 LEU HG H 1.507 -1.300 2.592 1.00 . A A . 4 LEU HG 1 1 20 2457 1 1 4 LEU N N -0.114 0.361 0.917 1.00 . A A . 4 LEU N 1 1 20 2458 1 1 4 LEU O O -2.824 0.596 2.278 1.00 . A A . 4 LEU O 1 1 20 2459 1 1 5 ARG C C -4.979 -1.471 2.532 1.00 . A A . 5 ARG C 1 1 20 2460 1 1 5 ARG CA C -4.465 -1.249 1.123 1.00 . A A . 5 ARG CA 1 1 20 2461 1 1 5 ARG CB C -5.031 -2.275 0.163 1.00 . A A . 5 ARG CB 1 1 20 2462 1 1 5 ARG CD C -4.013 -1.465 -1.963 1.00 . A A . 5 ARG CD 1 1 20 2463 1 1 5 ARG CG C -5.302 -1.684 -1.190 1.00 . A A . 5 ARG CG 1 1 20 2464 1 1 5 ARG CZ C -4.726 -0.271 -3.997 1.00 . A A . 5 ARG CZ 1 1 20 2465 1 1 5 ARG H H -2.582 -2.115 0.770 1.00 . A A . 5 ARG H 1 1 20 2466 1 1 5 ARG HA H -4.741 -0.265 0.784 1.00 . A A . 5 ARG HA 1 1 20 2467 1 1 5 ARG HB2 H -4.320 -3.070 0.041 1.00 . A A . 5 ARG HB2 1 1 20 2468 1 1 5 ARG HB3 H -5.953 -2.667 0.560 1.00 . A A . 5 ARG HB3 1 1 20 2469 1 1 5 ARG HD2 H -3.204 -1.329 -1.255 1.00 . A A . 5 ARG HD2 1 1 20 2470 1 1 5 ARG HD3 H -3.818 -2.338 -2.569 1.00 . A A . 5 ARG HD3 1 1 20 2471 1 1 5 ARG HE H -3.641 0.525 -2.523 1.00 . A A . 5 ARG HE 1 1 20 2472 1 1 5 ARG HG2 H -5.940 -2.343 -1.738 1.00 . A A . 5 ARG HG2 1 1 20 2473 1 1 5 ARG HG3 H -5.789 -0.741 -1.053 1.00 . A A . 5 ARG HG3 1 1 20 2474 1 1 5 ARG HH11 H -5.328 -2.200 -3.903 1.00 . A A . 5 ARG HH11 1 1 20 2475 1 1 5 ARG HH12 H -5.819 -1.337 -5.321 1.00 . A A . 5 ARG HH12 1 1 20 2476 1 1 5 ARG HH21 H -4.286 1.663 -4.388 1.00 . A A . 5 ARG HH21 1 1 20 2477 1 1 5 ARG HH22 H -5.227 0.856 -5.598 1.00 . A A . 5 ARG HH22 1 1 20 2478 1 1 5 ARG N N -3.026 -1.335 1.153 1.00 . A A . 5 ARG N 1 1 20 2479 1 1 5 ARG NE N -4.088 -0.291 -2.829 1.00 . A A . 5 ARG NE 1 1 20 2480 1 1 5 ARG NH1 N -5.341 -1.359 -4.443 1.00 . A A . 5 ARG NH1 1 1 20 2481 1 1 5 ARG NH2 N -4.748 0.840 -4.720 1.00 . A A . 5 ARG NH2 1 1 20 2482 1 1 5 ARG O O -5.148 -2.606 2.975 1.00 . A A . 5 ARG O 1 1 20 2483 1 1 6 HIS C C -5.878 0.955 5.181 1.00 . A A . 6 HIS C 1 1 20 2484 1 1 6 HIS CA C -5.613 -0.444 4.633 1.00 . A A . 6 HIS CA 1 1 20 2485 1 1 6 HIS CB C -4.530 -1.155 5.460 1.00 . A A . 6 HIS CB 1 1 20 2486 1 1 6 HIS CD2 C -5.362 -0.323 7.782 1.00 . A A . 6 HIS CD2 1 1 20 2487 1 1 6 HIS CE1 C -4.899 -2.124 8.943 1.00 . A A . 6 HIS CE1 1 1 20 2488 1 1 6 HIS CG C -4.819 -1.227 6.930 1.00 . A A . 6 HIS CG 1 1 20 2489 1 1 6 HIS H H -4.987 0.500 2.851 1.00 . A A . 6 HIS H 1 1 20 2490 1 1 6 HIS HA H -6.525 -1.019 4.674 1.00 . A A . 6 HIS HA 1 1 20 2491 1 1 6 HIS HB2 H -4.433 -2.171 5.098 1.00 . A A . 6 HIS HB2 1 1 20 2492 1 1 6 HIS HB3 H -3.579 -0.637 5.323 1.00 . A A . 6 HIS HB3 1 1 20 2493 1 1 6 HIS HD1 H -4.138 -3.175 7.362 1.00 . A A . 6 HIS HD1 1 1 20 2494 1 1 6 HIS HD2 H -5.702 0.671 7.531 1.00 . A A . 6 HIS HD2 1 1 20 2495 1 1 6 HIS HE1 H -4.799 -2.821 9.762 1.00 . A A . 6 HIS HE1 1 1 20 2496 1 1 6 HIS HE2 H -5.803 -0.512 9.826 1.00 . A A . 6 HIS HE2 1 1 20 2497 1 1 6 HIS N N -5.176 -0.375 3.251 1.00 . A A . 6 HIS N 1 1 20 2498 1 1 6 HIS ND1 N -4.540 -2.344 7.691 1.00 . A A . 6 HIS ND1 1 1 20 2499 1 1 6 HIS NE2 N -5.399 -0.906 9.024 1.00 . A A . 6 HIS NE2 1 1 20 2500 1 1 6 HIS O O -7.065 1.312 5.339 1.00 . A A . 6 HIS O 1 1 stop_ save_
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