NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
628780 | 6cxp | 30447 | cing | 4-filtered-FRED | STAR | entry | full | 47 |
data_FRED_restraints_with_modified_coordinates_PDB_code_6cxp # This FRED archive file contains, for PDB entry <6cxp>: # # - 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_6cxp _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 6cxp _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 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 HA . 1 . HA 1 1 1 1 2 1 1 1 HIS QB . 1 . HB# 1 1 2 1 1 1 1 1 HIS HA . 1 . HA 1 1 2 1 2 1 1 1 HIS HD2 . 1 . HD2 1 1 3 1 1 1 1 1 HIS HA . 1 . HA 1 1 3 1 2 1 1 2 ARG H . 2 . HN 1 1 4 1 1 1 1 1 HIS HA . 1 . HA 1 1 4 1 2 1 1 2 ARG QB . 2 . HB# 1 1 5 1 1 1 1 1 HIS QB . 1 . HB# 1 1 5 1 2 1 1 1 HIS HD2 . 1 . HD2 1 1 6 1 1 1 1 2 ARG HA . 2 . HA 1 1 6 1 2 1 1 2 ARG QB . 2 . HB# 1 1 7 1 1 1 1 2 ARG HA . 2 . HA 1 1 7 1 2 1 1 2 ARG QD . 2 . HD# 1 1 8 1 1 1 1 2 ARG HA . 2 . HA 1 1 8 1 2 1 1 3 PHE H . 3 . HN 1 1 9 1 1 1 1 2 ARG HA . 2 . HA 1 1 9 1 2 1 1 3 PHE QD . 3 . HD1 1 1 10 1 1 1 1 2 ARG QB . 2 . HB# 1 1 10 1 2 1 1 2 ARG QD . 2 . HD# 1 1 11 1 1 1 1 2 ARG QB . 2 . HB# 1 1 11 1 2 1 1 3 PHE H . 3 . HN 1 1 12 1 1 1 1 3 PHE H . 3 . HN 1 1 12 1 2 1 1 3 PHE HB2 . 3 . HB2 1 1 13 1 1 1 1 3 PHE H . 3 . HN 1 1 13 1 2 1 1 3 PHE HB3 . 3 . HB1 1 1 14 1 1 1 1 3 PHE H . 3 . HN 1 1 14 1 2 1 1 3 PHE QD . 3 . HD# 1 1 15 1 1 1 1 3 PHE HA . 3 . HA 1 1 15 1 2 1 1 3 PHE HB2 . 3 . HB2 1 1 16 1 1 1 1 3 PHE HA . 3 . HA 1 1 16 1 2 1 1 3 PHE HB3 . 3 . HB1 1 1 17 1 1 1 1 3 PHE HA . 3 . HA 1 1 17 1 2 1 1 4 LEU H . 4 . HN 1 1 18 1 1 1 1 3 PHE HB2 . 3 . HB2 1 1 18 1 2 1 1 3 PHE QD . 3 . HD# 1 1 19 1 1 1 1 3 PHE HB2 . 3 . HB2 1 1 19 1 2 1 1 4 LEU H . 4 . HN 1 1 20 1 1 1 1 3 PHE HB3 . 3 . HB1 1 1 20 1 2 1 1 3 PHE QD . 3 . HD# 1 1 21 1 1 1 1 3 PHE HB3 . 3 . HB1 1 1 21 1 2 1 1 4 LEU H . 4 . HN 1 1 22 1 1 1 1 3 PHE QD . 3 . HD1 1 1 22 1 2 1 1 4 LEU HG . 4 . HG 1 1 23 1 1 1 1 4 LEU H . 4 . HN 1 1 23 1 2 1 1 4 LEU QB . 4 . HB# 1 1 24 1 1 1 1 4 LEU H . 4 . HN 1 1 24 1 2 1 1 4 LEU HG . 4 . HG 1 1 25 1 1 1 1 4 LEU HA . 4 . HA 1 1 25 1 2 1 1 4 LEU QB . 4 . HB# 1 1 26 1 1 1 1 4 LEU HA . 4 . HA 1 1 26 1 2 1 1 4 LEU MD1 . 4 . HD1# 1 1 27 1 1 1 1 4 LEU HA . 4 . HA 1 1 27 1 2 1 1 4 LEU HG . 4 . HG 1 1 28 1 1 1 1 4 LEU HA . 4 . HA 1 1 28 1 2 1 1 5 ARG H . 5 . HN 1 1 29 1 1 1 1 4 LEU QB . 4 . HB# 1 1 29 1 2 1 1 4 LEU MD2 . 4 . HD2# 1 1 30 1 1 1 1 5 ARG H . 5 . HN 1 1 30 1 2 1 1 5 ARG HB3 . 5 . HB1 1 1 31 1 1 1 1 5 ARG H . 5 . HN 1 1 31 1 2 1 1 5 ARG HG2 . 5 . HG2 1 1 32 1 1 1 1 5 ARG HA . 5 . HA 1 1 32 1 2 1 1 5 ARG HB2 . 5 . HB2 1 1 33 1 1 1 1 5 ARG HA . 5 . HA 1 1 33 1 2 1 1 5 ARG QD . 5 . HD# 1 1 34 1 1 1 1 5 ARG HA . 5 . HA 1 1 34 1 2 1 1 5 ARG HG2 . 5 . HG2 1 1 35 1 1 1 1 5 ARG HA . 5 . HA 1 1 35 1 2 1 1 5 ARG HG3 . 5 . HG1 1 1 36 1 1 1 1 5 ARG HA . 5 . HA 1 1 36 1 2 1 1 6 HIS H . 6 . HN 1 1 37 1 1 1 1 5 ARG HA . 5 . HA 1 1 37 1 2 1 1 6 HIS HD2 . 6 . HD2 1 1 38 1 1 1 1 5 ARG HB2 . 5 . HB2 1 1 38 1 2 1 1 5 ARG QD . 5 . HD# 1 1 39 1 1 1 1 5 ARG HB2 . 5 . HB2 1 1 39 1 2 1 1 5 ARG HG2 . 5 . HG2 1 1 40 1 1 1 1 5 ARG HB2 . 5 . HB2 1 1 40 1 2 1 1 5 ARG HG3 . 5 . HG1 1 1 41 1 1 1 1 5 ARG HB3 . 5 . HB1 1 1 41 1 2 1 1 5 ARG QD . 5 . HD# 1 1 42 1 1 1 1 5 ARG HB3 . 5 . HB1 1 1 42 1 2 1 1 6 HIS H . 6 . HN 1 1 43 1 1 1 1 5 ARG HE . 5 . HE 1 1 43 1 2 1 1 6 HIS HA . 6 . HA 1 1 44 1 1 1 1 6 HIS H . 6 . HN 1 1 44 1 2 1 1 6 HIS HB3 . 6 . HB1 1 1 45 1 1 1 1 6 HIS HA . 6 . HA 1 1 45 1 2 1 1 6 HIS HB2 . 6 . HB2 1 1 46 1 1 1 1 6 HIS HA . 6 . HA 1 1 46 1 2 1 1 6 HIS HB3 . 6 . HB1 1 1 47 1 1 1 1 6 HIS HA . 6 . HA 1 1 47 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 . . . . . . 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 . . . . . 5.0 1.8 5.0 1 1 5 1 . . . . . 3.4 1.8 3.4 1 1 6 1 . . . . . 2.8 1.8 2.8 1 1 7 1 . . . . . 5.0 1.8 5.0 1 1 8 1 . . . . . 2.8 1.8 2.8 1 1 9 1 . . . . . 5.0 1.8 5.0 1 1 10 1 . . . . . 2.8 1.8 2.8 1 1 11 1 . . . . . 5.0 1.8 5.0 1 1 12 1 . . . . . 3.4 1.8 3.4 1 1 13 1 . . . . . 3.4 1.8 3.4 1 1 14 1 . . . . . 5.0 1.8 5.0 1 1 15 1 . . . . . 2.8 1.8 2.8 1 1 16 1 . . . . . 2.8 1.8 2.8 1 1 17 1 . . . . . 2.8 1.8 2.8 1 1 18 1 . . . . . 2.8 1.8 2.8 1 1 19 1 . . . . . 5.0 1.8 5.0 1 1 20 1 . . . . . 2.8 1.8 2.8 1 1 21 1 . . . . . 5.0 1.8 5.0 1 1 22 1 . . . . . 5.0 1.8 5.0 1 1 23 1 . . . . . 3.4 1.8 3.4 1 1 24 1 . . . . . 2.8 1.8 2.8 1 1 25 1 . . . . . . 1.8 2.8 1 1 26 1 . . . . . 3.4 1.8 3.4 1 1 27 1 . . . . . . 1.8 2.8 1 1 28 1 . . . . . 2.8 1.8 2.8 1 1 29 1 . . . . . 2.8 1.8 2.8 1 1 30 1 . . . . . . 1.8 3.4 1 1 31 1 . . . . . 5.0 1.8 5.0 1 1 32 1 . . . . . . 1.8 2.8 1 1 33 1 . . . . . 3.4 1.8 3.4 1 1 34 1 . . . . . 3.4 1.8 3.4 1 1 35 1 . . . . . 3.4 1.8 3.4 1 1 36 1 . . . . . 2.8 1.8 2.8 1 1 37 1 . . . . . 5.0 1.8 5.0 1 1 38 1 . . . . . 3.4 1.8 3.4 1 1 39 1 . . . . . 2.8 1.8 2.8 1 1 40 1 . . . . . 2.8 1.8 2.8 1 1 41 1 . . . . . 2.8 1.8 2.8 1 1 42 1 . . . . . 5.0 1.8 5.0 1 1 43 1 . . . . . 5.0 1.8 5.0 1 1 44 1 . . . . . 3.4 1.8 3.4 1 1 45 1 . . . . . 2.8 1.8 2.8 1 1 46 1 . . . . . 2.8 1.8 2.8 1 1 47 1 . . . . . 5.0 1.8 5.0 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 2.911 3.434 3.974 1.00 . A A . 1 HIS C 1 1 1 2 1 1 1 HIS CA C 3.704 4.560 4.630 1.00 . A A . 1 HIS CA 1 1 1 3 1 1 1 HIS CB C 5.202 4.245 4.594 1.00 . A A . 1 HIS CB 1 1 1 4 1 1 1 HIS CD2 C 7.016 5.096 2.946 1.00 . A A . 1 HIS CD2 1 1 1 5 1 1 1 HIS CE1 C 6.665 7.249 3.168 1.00 . A A . 1 HIS CE1 1 1 1 6 1 1 1 HIS CG C 6.007 5.254 3.836 1.00 . A A . 1 HIS CG 1 1 1 7 1 1 1 HIS H1 H 4.031 5.320 6.514 1.00 . A A . 1 HIS H1 1 1 1 8 1 1 1 HIS H2 H 3.213 3.812 6.483 1.00 . A A . 1 HIS H2 1 1 1 9 1 1 1 HIS H3 H 2.383 5.250 6.048 1.00 . A A . 1 HIS H3 1 1 1 10 1 1 1 HIS HA H 3.522 5.478 4.092 1.00 . A A . 1 HIS HA 1 1 1 11 1 1 1 HIS HB2 H 5.580 4.212 5.605 1.00 . A A . 1 HIS HB2 1 1 1 12 1 1 1 HIS HB3 H 5.351 3.282 4.128 1.00 . A A . 1 HIS HB3 1 1 1 13 1 1 1 HIS HD1 H 5.147 7.050 4.526 1.00 . A A . 1 HIS HD1 1 1 1 14 1 1 1 HIS HD2 H 7.435 4.157 2.613 1.00 . A A . 1 HIS HD2 1 1 1 15 1 1 1 HIS HE1 H 6.743 8.320 3.054 1.00 . A A . 1 HIS HE1 1 1 1 16 1 1 1 HIS HE2 H 8.176 6.552 1.975 1.00 . A A . 1 HIS HE2 1 1 1 17 1 1 1 HIS N N 3.296 4.753 6.046 1.00 . A A . 1 HIS N 1 1 1 18 1 1 1 HIS ND1 N 5.812 6.615 3.953 1.00 . A A . 1 HIS ND1 1 1 1 19 1 1 1 HIS NE2 N 7.406 6.350 2.547 1.00 . A A . 1 HIS NE2 1 1 1 20 1 1 1 HIS O O 3.389 2.786 3.043 1.00 . A A . 1 HIS O 1 1 1 21 1 1 2 ARG C C 0.457 2.469 2.478 1.00 . A A . 2 ARG C 1 1 1 22 1 1 2 ARG CA C 0.838 2.160 3.921 1.00 . A A . 2 ARG CA 1 1 1 23 1 1 2 ARG CB C -0.422 2.010 4.774 1.00 . A A . 2 ARG CB 1 1 1 24 1 1 2 ARG CD C -1.517 0.097 5.984 1.00 . A A . 2 ARG CD 1 1 1 25 1 1 2 ARG CG C -1.093 0.652 4.634 1.00 . A A . 2 ARG CG 1 1 1 26 1 1 2 ARG CZ C -1.242 -2.325 5.624 1.00 . A A . 2 ARG CZ 1 1 1 27 1 1 2 ARG H H 1.368 3.757 5.205 1.00 . A A . 2 ARG H 1 1 1 28 1 1 2 ARG HA H 1.391 1.233 3.944 1.00 . A A . 2 ARG HA 1 1 1 29 1 1 2 ARG HB2 H -0.159 2.153 5.812 1.00 . A A . 2 ARG HB2 1 1 1 30 1 1 2 ARG HB3 H -1.132 2.770 4.484 1.00 . A A . 2 ARG HB3 1 1 1 31 1 1 2 ARG HD2 H -0.665 0.111 6.648 1.00 . A A . 2 ARG HD2 1 1 1 32 1 1 2 ARG HD3 H -2.297 0.725 6.388 1.00 . A A . 2 ARG HD3 1 1 1 33 1 1 2 ARG HE H -2.976 -1.416 6.011 1.00 . A A . 2 ARG HE 1 1 1 34 1 1 2 ARG HG2 H -1.971 0.758 4.008 1.00 . A A . 2 ARG HG2 1 1 1 35 1 1 2 ARG HG3 H -0.395 -0.037 4.173 1.00 . A A . 2 ARG HG3 1 1 1 36 1 1 2 ARG HH11 H 0.473 -1.259 5.499 1.00 . A A . 2 ARG HH11 1 1 1 37 1 1 2 ARG HH12 H 0.639 -2.965 5.250 1.00 . A A . 2 ARG HH12 1 1 1 38 1 1 2 ARG HH21 H -2.759 -3.659 5.684 1.00 . A A . 2 ARG HH21 1 1 1 39 1 1 2 ARG HH22 H -1.195 -4.328 5.354 1.00 . A A . 2 ARG HH22 1 1 1 40 1 1 2 ARG N N 1.696 3.207 4.464 1.00 . A A . 2 ARG N 1 1 1 41 1 1 2 ARG NE N -2.015 -1.273 5.881 1.00 . A A . 2 ARG NE 1 1 1 42 1 1 2 ARG NH1 N 0.064 -2.170 5.443 1.00 . A A . 2 ARG NH1 1 1 1 43 1 1 2 ARG NH2 N -1.776 -3.537 5.548 1.00 . A A . 2 ARG NH2 1 1 1 44 1 1 2 ARG O O -0.605 3.033 2.212 1.00 . A A . 2 ARG O 1 1 1 45 1 1 3 PHE C C 0.389 1.145 -0.510 1.00 . A A . 3 PHE C 1 1 1 46 1 1 3 PHE CA C 1.089 2.338 0.132 1.00 . A A . 3 PHE CA 1 1 1 47 1 1 3 PHE CB C 2.404 2.628 -0.587 1.00 . A A . 3 PHE CB 1 1 1 48 1 1 3 PHE CD1 C 2.629 5.099 -0.214 1.00 . A A . 3 PHE CD1 1 1 1 49 1 1 3 PHE CD2 C 2.488 4.299 -2.457 1.00 . A A . 3 PHE CD2 1 1 1 50 1 1 3 PHE CE1 C 2.726 6.397 -0.680 1.00 . A A . 3 PHE CE1 1 1 1 51 1 1 3 PHE CE2 C 2.585 5.595 -2.928 1.00 . A A . 3 PHE CE2 1 1 1 52 1 1 3 PHE CG C 2.509 4.037 -1.096 1.00 . A A . 3 PHE CG 1 1 1 53 1 1 3 PHE CZ C 2.704 6.645 -2.038 1.00 . A A . 3 PHE CZ 1 1 1 54 1 1 3 PHE H H 2.161 1.655 1.823 1.00 . A A . 3 PHE H 1 1 1 55 1 1 3 PHE HA H 0.453 3.201 0.048 1.00 . A A . 3 PHE HA 1 1 1 56 1 1 3 PHE HB2 H 3.219 2.465 0.103 1.00 . A A . 3 PHE HB2 1 1 1 57 1 1 3 PHE HB3 H 2.503 1.958 -1.432 1.00 . A A . 3 PHE HB3 1 1 1 58 1 1 3 PHE HD1 H 2.647 4.906 0.849 1.00 . A A . 3 PHE HD1 1 1 1 59 1 1 3 PHE HD2 H 2.395 3.479 -3.153 1.00 . A A . 3 PHE HD2 1 1 1 60 1 1 3 PHE HE1 H 2.818 7.216 0.018 1.00 . A A . 3 PHE HE1 1 1 1 61 1 1 3 PHE HE2 H 2.568 5.786 -3.991 1.00 . A A . 3 PHE HE2 1 1 1 62 1 1 3 PHE HZ H 2.780 7.658 -2.405 1.00 . A A . 3 PHE HZ 1 1 1 63 1 1 3 PHE N N 1.332 2.099 1.549 1.00 . A A . 3 PHE N 1 1 1 64 1 1 3 PHE O O 1.039 0.229 -1.015 1.00 . A A . 3 PHE O 1 1 1 65 1 1 4 LEU C C -1.340 -0.174 -2.513 1.00 . A A . 4 LEU C 1 1 1 66 1 1 4 LEU CA C -1.730 0.078 -1.060 1.00 . A A . 4 LEU CA 1 1 1 67 1 1 4 LEU CB C -3.221 0.405 -0.969 1.00 . A A . 4 LEU CB 1 1 1 68 1 1 4 LEU CD1 C -3.696 2.064 0.846 1.00 . A A . 4 LEU CD1 1 1 1 69 1 1 4 LEU CD2 C -5.172 0.064 0.568 1.00 . A A . 4 LEU CD2 1 1 1 70 1 1 4 LEU CG C -3.752 0.598 0.451 1.00 . A A . 4 LEU CG 1 1 1 71 1 1 4 LEU H H -1.400 1.916 -0.064 1.00 . A A . 4 LEU H 1 1 1 72 1 1 4 LEU HA H -1.533 -0.813 -0.486 1.00 . A A . 4 LEU HA 1 1 1 73 1 1 4 LEU HB2 H -3.404 1.313 -1.527 1.00 . A A . 4 LEU HB2 1 1 1 74 1 1 4 LEU HB3 H -3.774 -0.399 -1.431 1.00 . A A . 4 LEU HB3 1 1 1 75 1 1 4 LEU HD11 H -3.778 2.677 -0.039 1.00 . A A . 4 LEU HD11 1 1 1 76 1 1 4 LEU HD12 H -2.757 2.267 1.339 1.00 . A A . 4 LEU HD12 1 1 1 77 1 1 4 LEU HD13 H -4.512 2.288 1.517 1.00 . A A . 4 LEU HD13 1 1 1 78 1 1 4 LEU HD21 H -5.721 0.655 1.287 1.00 . A A . 4 LEU HD21 1 1 1 79 1 1 4 LEU HD22 H -5.145 -0.965 0.894 1.00 . A A . 4 LEU HD22 1 1 1 80 1 1 4 LEU HD23 H -5.660 0.124 -0.394 1.00 . A A . 4 LEU HD23 1 1 1 81 1 1 4 LEU HG H -3.128 0.045 1.138 1.00 . A A . 4 LEU HG 1 1 1 82 1 1 4 LEU N N -0.940 1.160 -0.484 1.00 . A A . 4 LEU N 1 1 1 83 1 1 4 LEU O O -0.799 0.706 -3.183 1.00 . A A . 4 LEU O 1 1 1 84 1 1 5 ARG C C -2.064 -2.996 -4.792 1.00 . A A . 5 ARG C 1 1 1 85 1 1 5 ARG CA C -1.296 -1.749 -4.368 1.00 . A A . 5 ARG CA 1 1 1 86 1 1 5 ARG CB C 0.209 -1.987 -4.514 1.00 . A A . 5 ARG CB 1 1 1 87 1 1 5 ARG CD C 2.237 -1.041 -5.660 1.00 . A A . 5 ARG CD 1 1 1 88 1 1 5 ARG CG C 0.784 -1.460 -5.819 1.00 . A A . 5 ARG CG 1 1 1 89 1 1 5 ARG CZ C 3.748 0.655 -6.615 1.00 . A A . 5 ARG CZ 1 1 1 90 1 1 5 ARG H H -2.050 -2.040 -2.412 1.00 . A A . 5 ARG H 1 1 1 91 1 1 5 ARG HA H -1.585 -0.928 -5.007 1.00 . A A . 5 ARG HA 1 1 1 92 1 1 5 ARG HB2 H 0.721 -1.494 -3.696 1.00 . A A . 5 ARG HB2 1 1 1 93 1 1 5 ARG HB3 H 0.400 -3.053 -4.465 1.00 . A A . 5 ARG HB3 1 1 1 94 1 1 5 ARG HD2 H 2.453 -0.928 -4.608 1.00 . A A . 5 ARG HD2 1 1 1 95 1 1 5 ARG HD3 H 2.868 -1.813 -6.075 1.00 . A A . 5 ARG HD3 1 1 1 96 1 1 5 ARG HE H 1.756 0.773 -6.605 1.00 . A A . 5 ARG HE 1 1 1 97 1 1 5 ARG HG2 H 0.724 -2.236 -6.567 1.00 . A A . 5 ARG HG2 1 1 1 98 1 1 5 ARG HG3 H 0.204 -0.605 -6.137 1.00 . A A . 5 ARG HG3 1 1 1 99 1 1 5 ARG HH11 H 4.687 -0.942 -5.802 1.00 . A A . 5 ARG HH11 1 1 1 100 1 1 5 ARG HH12 H 5.728 0.264 -6.480 1.00 . A A . 5 ARG HH12 1 1 1 101 1 1 5 ARG HH21 H 3.123 2.361 -7.498 1.00 . A A . 5 ARG HH21 1 1 1 102 1 1 5 ARG HH22 H 4.840 2.141 -7.443 1.00 . A A . 5 ARG HH22 1 1 1 103 1 1 5 ARG N N -1.618 -1.381 -2.995 1.00 . A A . 5 ARG N 1 1 1 104 1 1 5 ARG NE N 2.520 0.221 -6.340 1.00 . A A . 5 ARG NE 1 1 1 105 1 1 5 ARG NH1 N 4.808 -0.067 -6.271 1.00 . A A . 5 ARG NH1 1 1 1 106 1 1 5 ARG NH2 N 3.917 1.814 -7.236 1.00 . A A . 5 ARG NH2 1 1 1 107 1 1 5 ARG O O -1.650 -4.120 -4.504 1.00 . A A . 5 ARG O 1 1 1 108 1 1 6 HIS C C -4.151 -3.875 -7.460 1.00 . A A . 6 HIS C 1 1 1 109 1 1 6 HIS CA C -4.010 -3.900 -5.941 1.00 . A A . 6 HIS CA 1 1 1 110 1 1 6 HIS CB C -5.392 -3.842 -5.288 1.00 . A A . 6 HIS CB 1 1 1 111 1 1 6 HIS CD2 C -7.211 -2.252 -6.234 1.00 . A A . 6 HIS CD2 1 1 1 112 1 1 6 HIS CE1 C -6.506 -0.384 -5.328 1.00 . A A . 6 HIS CE1 1 1 1 113 1 1 6 HIS CG C -6.104 -2.543 -5.511 1.00 . A A . 6 HIS CG 1 1 1 114 1 1 6 HIS H H -3.462 -1.873 -5.676 1.00 . A A . 6 HIS H 1 1 1 115 1 1 6 HIS HA H -3.524 -4.820 -5.652 1.00 . A A . 6 HIS HA 1 1 1 116 1 1 6 HIS HB2 H -6.010 -4.632 -5.697 1.00 . A A . 6 HIS HB2 1 1 1 117 1 1 6 HIS HB3 H -5.284 -3.984 -4.219 1.00 . A A . 6 HIS HB3 1 1 1 118 1 1 6 HIS HD1 H -4.906 -1.232 -4.376 1.00 . A A . 6 HIS HD1 1 1 1 119 1 1 6 HIS HD2 H -7.805 -2.950 -6.808 1.00 . A A . 6 HIS HD2 1 1 1 120 1 1 6 HIS HE1 H -6.426 0.656 -5.046 1.00 . A A . 6 HIS HE1 1 1 1 121 1 1 6 HIS HE2 H -8.125 -0.393 -6.583 1.00 . A A . 6 HIS HE2 1 1 1 122 1 1 6 HIS N N -3.184 -2.791 -5.477 1.00 . A A . 6 HIS N 1 1 1 123 1 1 6 HIS ND1 N -5.686 -1.351 -4.957 1.00 . A A . 6 HIS ND1 1 1 1 124 1 1 6 HIS NE2 N -7.439 -0.904 -6.104 1.00 . A A . 6 HIS NE2 1 1 1 125 1 1 6 HIS O O -3.316 -3.221 -8.120 1.00 . A A . 6 HIS O 1 1 2 126 1 1 1 HIS C C 2.571 3.790 3.700 1.00 . A A . 1 HIS C 1 1 2 127 1 1 1 HIS CA C 3.011 5.154 4.222 1.00 . A A . 1 HIS CA 1 1 2 128 1 1 1 HIS CB C 4.535 5.276 4.163 1.00 . A A . 1 HIS CB 1 1 2 129 1 1 1 HIS CD2 C 5.297 7.513 5.231 1.00 . A A . 1 HIS CD2 1 1 2 130 1 1 1 HIS CE1 C 5.702 8.628 3.387 1.00 . A A . 1 HIS CE1 1 1 2 131 1 1 1 HIS CG C 5.024 6.691 4.191 1.00 . A A . 1 HIS CG 1 1 2 132 1 1 1 HIS H1 H 2.763 4.481 6.151 1.00 . A A . 1 HIS H1 1 1 2 133 1 1 1 HIS H2 H 1.556 5.578 5.615 1.00 . A A . 1 HIS H2 1 1 2 134 1 1 1 HIS H3 H 3.122 6.152 6.019 1.00 . A A . 1 HIS H3 1 1 2 135 1 1 1 HIS HA H 2.568 5.925 3.609 1.00 . A A . 1 HIS HA 1 1 2 136 1 1 1 HIS HB2 H 4.963 4.760 5.009 1.00 . A A . 1 HIS HB2 1 1 2 137 1 1 1 HIS HB3 H 4.890 4.818 3.251 1.00 . A A . 1 HIS HB3 1 1 2 138 1 1 1 HIS HD1 H 5.185 7.098 2.129 1.00 . A A . 1 HIS HD1 1 1 2 139 1 1 1 HIS HD2 H 5.203 7.272 6.281 1.00 . A A . 1 HIS HD2 1 1 2 140 1 1 1 HIS HE1 H 5.981 9.414 2.702 1.00 . A A . 1 HIS HE1 1 1 2 141 1 1 1 HIS HE2 H 5.899 9.525 5.217 1.00 . A A . 1 HIS HE2 1 1 2 142 1 1 1 HIS N N 2.574 5.360 5.628 1.00 . A A . 1 HIS N 1 1 2 143 1 1 1 HIS ND1 N 5.287 7.419 3.050 1.00 . A A . 1 HIS ND1 1 1 2 144 1 1 1 HIS NE2 N 5.716 8.710 4.705 1.00 . A A . 1 HIS NE2 1 1 2 145 1 1 1 HIS O O 3.221 3.209 2.831 1.00 . A A . 1 HIS O 1 1 2 146 1 1 2 ARG C C 0.357 2.067 2.412 1.00 . A A . 2 ARG C 1 1 2 147 1 1 2 ARG CA C 0.939 1.990 3.820 1.00 . A A . 2 ARG CA 1 1 2 148 1 1 2 ARG CB C -0.132 1.511 4.802 1.00 . A A . 2 ARG CB 1 1 2 149 1 1 2 ARG CD C -1.554 -0.391 5.621 1.00 . A A . 2 ARG CD 1 1 2 150 1 1 2 ARG CG C -0.357 0.008 4.772 1.00 . A A . 2 ARG CG 1 1 2 151 1 1 2 ARG CZ C -2.311 -2.315 6.961 1.00 . A A . 2 ARG CZ 1 1 2 152 1 1 2 ARG H H 0.988 3.796 4.922 1.00 . A A . 2 ARG H 1 1 2 153 1 1 2 ARG HA H 1.756 1.285 3.820 1.00 . A A . 2 ARG HA 1 1 2 154 1 1 2 ARG HB2 H 0.164 1.789 5.803 1.00 . A A . 2 ARG HB2 1 1 2 155 1 1 2 ARG HB3 H -1.066 1.998 4.565 1.00 . A A . 2 ARG HB3 1 1 2 156 1 1 2 ARG HD2 H -1.671 0.329 6.416 1.00 . A A . 2 ARG HD2 1 1 2 157 1 1 2 ARG HD3 H -2.437 -0.387 4.999 1.00 . A A . 2 ARG HD3 1 1 2 158 1 1 2 ARG HE H -0.553 -2.195 6.025 1.00 . A A . 2 ARG HE 1 1 2 159 1 1 2 ARG HG2 H -0.535 -0.299 3.749 1.00 . A A . 2 ARG HG2 1 1 2 160 1 1 2 ARG HG3 H 0.527 -0.486 5.156 1.00 . A A . 2 ARG HG3 1 1 2 161 1 1 2 ARG HH11 H -3.637 -0.792 6.859 1.00 . A A . 2 ARG HH11 1 1 2 162 1 1 2 ARG HH12 H -4.146 -2.156 7.795 1.00 . A A . 2 ARG HH12 1 1 2 163 1 1 2 ARG HH21 H -1.220 -3.991 7.255 1.00 . A A . 2 ARG HH21 1 1 2 164 1 1 2 ARG HH22 H -2.774 -3.973 8.021 1.00 . A A . 2 ARG HH22 1 1 2 165 1 1 2 ARG N N 1.464 3.285 4.234 1.00 . A A . 2 ARG N 1 1 2 166 1 1 2 ARG NE N -1.391 -1.720 6.205 1.00 . A A . 2 ARG NE 1 1 2 167 1 1 2 ARG NH1 N -3.459 -1.704 7.226 1.00 . A A . 2 ARG NH1 1 1 2 168 1 1 2 ARG NH2 N -2.083 -3.526 7.452 1.00 . A A . 2 ARG NH2 1 1 2 169 1 1 2 ARG O O -0.861 2.080 2.231 1.00 . A A . 2 ARG O 1 1 2 170 1 1 3 PHE C C 0.640 0.805 -0.574 1.00 . A A . 3 PHE C 1 1 2 171 1 1 3 PHE CA C 0.811 2.198 0.025 1.00 . A A . 3 PHE CA 1 1 2 172 1 1 3 PHE CB C 1.821 3.001 -0.791 1.00 . A A . 3 PHE CB 1 1 2 173 1 1 3 PHE CD1 C 0.979 5.342 -0.467 1.00 . A A . 3 PHE CD1 1 1 2 174 1 1 3 PHE CD2 C 1.039 4.456 -2.680 1.00 . A A . 3 PHE CD2 1 1 2 175 1 1 3 PHE CE1 C 0.471 6.532 -0.954 1.00 . A A . 3 PHE CE1 1 1 2 176 1 1 3 PHE CE2 C 0.531 5.643 -3.173 1.00 . A A . 3 PHE CE2 1 1 2 177 1 1 3 PHE CG C 1.269 4.292 -1.324 1.00 . A A . 3 PHE CG 1 1 2 178 1 1 3 PHE CZ C 0.247 6.682 -2.308 1.00 . A A . 3 PHE CZ 1 1 2 179 1 1 3 PHE H H 2.194 2.107 1.624 1.00 . A A . 3 PHE H 1 1 2 180 1 1 3 PHE HA H -0.136 2.707 -0.002 1.00 . A A . 3 PHE HA 1 1 2 181 1 1 3 PHE HB2 H 2.666 3.239 -0.162 1.00 . A A . 3 PHE HB2 1 1 2 182 1 1 3 PHE HB3 H 2.151 2.406 -1.634 1.00 . A A . 3 PHE HB3 1 1 2 183 1 1 3 PHE HD1 H 1.155 5.226 0.592 1.00 . A A . 3 PHE HD1 1 1 2 184 1 1 3 PHE HD2 H 1.261 3.644 -3.357 1.00 . A A . 3 PHE HD2 1 1 2 185 1 1 3 PHE HE1 H 0.249 7.342 -0.276 1.00 . A A . 3 PHE HE1 1 1 2 186 1 1 3 PHE HE2 H 0.357 5.758 -4.232 1.00 . A A . 3 PHE HE2 1 1 2 187 1 1 3 PHE HZ H -0.151 7.611 -2.691 1.00 . A A . 3 PHE HZ 1 1 2 188 1 1 3 PHE N N 1.236 2.120 1.417 1.00 . A A . 3 PHE N 1 1 2 189 1 1 3 PHE O O 1.534 0.292 -1.246 1.00 . A A . 3 PHE O 1 1 2 190 1 1 4 LEU C C -0.652 -1.190 -2.352 1.00 . A A . 4 LEU C 1 1 2 191 1 1 4 LEU CA C -0.807 -1.138 -0.835 1.00 . A A . 4 LEU CA 1 1 2 192 1 1 4 LEU CB C -2.222 -1.560 -0.441 1.00 . A A . 4 LEU CB 1 1 2 193 1 1 4 LEU CD1 C -3.042 -0.293 1.557 1.00 . A A . 4 LEU CD1 1 1 2 194 1 1 4 LEU CD2 C -3.425 -2.760 1.403 1.00 . A A . 4 LEU CD2 1 1 2 195 1 1 4 LEU CG C -2.480 -1.616 1.065 1.00 . A A . 4 LEU CG 1 1 2 196 1 1 4 LEU H H -1.189 0.655 0.221 1.00 . A A . 4 LEU H 1 1 2 197 1 1 4 LEU HA H -0.102 -1.822 -0.389 1.00 . A A . 4 LEU HA 1 1 2 198 1 1 4 LEU HB2 H -2.919 -0.861 -0.880 1.00 . A A . 4 LEU HB2 1 1 2 199 1 1 4 LEU HB3 H -2.412 -2.539 -0.853 1.00 . A A . 4 LEU HB3 1 1 2 200 1 1 4 LEU HD11 H -3.575 0.192 0.754 1.00 . A A . 4 LEU HD11 1 1 2 201 1 1 4 LEU HD12 H -2.231 0.340 1.886 1.00 . A A . 4 LEU HD12 1 1 2 202 1 1 4 LEU HD13 H -3.716 -0.473 2.382 1.00 . A A . 4 LEU HD13 1 1 2 203 1 1 4 LEU HD21 H -2.976 -3.697 1.109 1.00 . A A . 4 LEU HD21 1 1 2 204 1 1 4 LEU HD22 H -4.357 -2.625 0.874 1.00 . A A . 4 LEU HD22 1 1 2 205 1 1 4 LEU HD23 H -3.613 -2.769 2.467 1.00 . A A . 4 LEU HD23 1 1 2 206 1 1 4 LEU HG H -1.545 -1.790 1.576 1.00 . A A . 4 LEU HG 1 1 2 207 1 1 4 LEU N N -0.516 0.196 -0.323 1.00 . A A . 4 LEU N 1 1 2 208 1 1 4 LEU O O -0.282 -0.200 -2.983 1.00 . A A . 4 LEU O 1 1 2 209 1 1 5 ARG C C -2.150 -3.035 -4.957 1.00 . A A . 5 ARG C 1 1 2 210 1 1 5 ARG CA C -0.832 -2.534 -4.374 1.00 . A A . 5 ARG CA 1 1 2 211 1 1 5 ARG CB C 0.292 -3.517 -4.704 1.00 . A A . 5 ARG CB 1 1 2 212 1 1 5 ARG CD C 1.000 -5.004 -6.602 1.00 . A A . 5 ARG CD 1 1 2 213 1 1 5 ARG CG C 0.617 -3.593 -6.187 1.00 . A A . 5 ARG CG 1 1 2 214 1 1 5 ARG CZ C 2.108 -6.115 -8.503 1.00 . A A . 5 ARG CZ 1 1 2 215 1 1 5 ARG H H -1.229 -3.105 -2.375 1.00 . A A . 5 ARG H 1 1 2 216 1 1 5 ARG HA H -0.600 -1.575 -4.813 1.00 . A A . 5 ARG HA 1 1 2 217 1 1 5 ARG HB2 H 1.188 -3.212 -4.176 1.00 . A A . 5 ARG HB2 1 1 2 218 1 1 5 ARG HB3 H 0.000 -4.506 -4.370 1.00 . A A . 5 ARG HB3 1 1 2 219 1 1 5 ARG HD2 H 1.766 -5.367 -5.934 1.00 . A A . 5 ARG HD2 1 1 2 220 1 1 5 ARG HD3 H 0.128 -5.637 -6.527 1.00 . A A . 5 ARG HD3 1 1 2 221 1 1 5 ARG HE H 1.390 -4.253 -8.526 1.00 . A A . 5 ARG HE 1 1 2 222 1 1 5 ARG HG2 H -0.250 -3.285 -6.752 1.00 . A A . 5 ARG HG2 1 1 2 223 1 1 5 ARG HG3 H 1.442 -2.928 -6.399 1.00 . A A . 5 ARG HG3 1 1 2 224 1 1 5 ARG HH11 H 1.961 -7.252 -6.836 1.00 . A A . 5 ARG HH11 1 1 2 225 1 1 5 ARG HH12 H 2.736 -8.011 -8.187 1.00 . A A . 5 ARG HH12 1 1 2 226 1 1 5 ARG HH21 H 2.408 -5.249 -10.304 1.00 . A A . 5 ARG HH21 1 1 2 227 1 1 5 ARG HH22 H 2.990 -6.873 -10.155 1.00 . A A . 5 ARG HH22 1 1 2 228 1 1 5 ARG N N -0.939 -2.352 -2.931 1.00 . A A . 5 ARG N 1 1 2 229 1 1 5 ARG NE N 1.506 -5.053 -7.972 1.00 . A A . 5 ARG NE 1 1 2 230 1 1 5 ARG NH1 N 2.282 -7.216 -7.783 1.00 . A A . 5 ARG NH1 1 1 2 231 1 1 5 ARG NH2 N 2.537 -6.076 -9.757 1.00 . A A . 5 ARG NH2 1 1 2 232 1 1 5 ARG O O -2.289 -4.215 -5.281 1.00 . A A . 5 ARG O 1 1 2 233 1 1 6 HIS C C -4.789 -1.567 -6.797 1.00 . A A . 6 HIS C 1 1 2 234 1 1 6 HIS CA C -4.423 -2.480 -5.631 1.00 . A A . 6 HIS CA 1 1 2 235 1 1 6 HIS CB C -5.492 -2.389 -4.542 1.00 . A A . 6 HIS CB 1 1 2 236 1 1 6 HIS CD2 C -6.452 -0.069 -3.891 1.00 . A A . 6 HIS CD2 1 1 2 237 1 1 6 HIS CE1 C -4.844 0.578 -2.549 1.00 . A A . 6 HIS CE1 1 1 2 238 1 1 6 HIS CG C -5.531 -1.061 -3.853 1.00 . A A . 6 HIS CG 1 1 2 239 1 1 6 HIS H H -2.944 -1.206 -4.812 1.00 . A A . 6 HIS H 1 1 2 240 1 1 6 HIS HA H -4.372 -3.498 -5.989 1.00 . A A . 6 HIS HA 1 1 2 241 1 1 6 HIS HB2 H -6.465 -2.561 -4.986 1.00 . A A . 6 HIS HB2 1 1 2 242 1 1 6 HIS HB3 H -5.298 -3.149 -3.792 1.00 . A A . 6 HIS HB3 1 1 2 243 1 1 6 HIS HD1 H -3.725 -1.121 -2.768 1.00 . A A . 6 HIS HD1 1 1 2 244 1 1 6 HIS HD2 H -7.371 -0.069 -4.460 1.00 . A A . 6 HIS HD2 1 1 2 245 1 1 6 HIS HE1 H -4.249 1.167 -1.866 1.00 . A A . 6 HIS HE1 1 1 2 246 1 1 6 HIS HE2 H -6.417 1.819 -2.973 1.00 . A A . 6 HIS HE2 1 1 2 247 1 1 6 HIS N N -3.115 -2.131 -5.088 1.00 . A A . 6 HIS N 1 1 2 248 1 1 6 HIS ND1 N -4.536 -0.623 -3.004 1.00 . A A . 6 HIS ND1 1 1 2 249 1 1 6 HIS NE2 N -6.001 0.937 -3.073 1.00 . A A . 6 HIS NE2 1 1 2 250 1 1 6 HIS O O -4.956 -0.352 -6.565 1.00 . A A . 6 HIS O 1 1 3 251 1 1 1 HIS C C 2.726 3.789 3.892 1.00 . A A . 1 HIS C 1 1 3 252 1 1 1 HIS CA C 3.221 5.101 4.492 1.00 . A A . 1 HIS CA 1 1 3 253 1 1 1 HIS CB C 4.749 5.157 4.450 1.00 . A A . 1 HIS CB 1 1 3 254 1 1 1 HIS CD2 C 4.740 7.667 5.104 1.00 . A A . 1 HIS CD2 1 1 3 255 1 1 1 HIS CE1 C 6.787 8.163 4.499 1.00 . A A . 1 HIS CE1 1 1 3 256 1 1 1 HIS CG C 5.302 6.539 4.610 1.00 . A A . 1 HIS CG 1 1 3 257 1 1 1 HIS H1 H 2.926 4.335 6.379 1.00 . A A . 1 HIS H1 1 1 3 258 1 1 1 HIS H2 H 1.773 5.511 5.896 1.00 . A A . 1 HIS H2 1 1 3 259 1 1 1 HIS H3 H 3.359 5.992 6.342 1.00 . A A . 1 HIS H3 1 1 3 260 1 1 1 HIS HA H 2.819 5.924 3.919 1.00 . A A . 1 HIS HA 1 1 3 261 1 1 1 HIS HB2 H 5.147 4.546 5.247 1.00 . A A . 1 HIS HB2 1 1 3 262 1 1 1 HIS HB3 H 5.090 4.769 3.501 1.00 . A A . 1 HIS HB3 1 1 3 263 1 1 1 HIS HD1 H 7.248 6.280 3.844 1.00 . A A . 1 HIS HD1 1 1 3 264 1 1 1 HIS HD2 H 3.735 7.766 5.491 1.00 . A A . 1 HIS HD2 1 1 3 265 1 1 1 HIS HE1 H 7.700 8.709 4.312 1.00 . A A . 1 HIS HE1 1 1 3 266 1 1 1 HIS HE2 H 5.589 9.566 5.387 1.00 . A A . 1 HIS HE2 1 1 3 267 1 1 1 HIS N N 2.780 5.248 5.905 1.00 . A A . 1 HIS N 1 1 3 268 1 1 1 HIS ND1 N 6.585 6.884 4.239 1.00 . A A . 1 HIS ND1 1 1 3 269 1 1 1 HIS NE2 N 5.683 8.661 5.023 1.00 . A A . 1 HIS NE2 1 1 3 270 1 1 1 HIS O O 3.351 3.234 2.989 1.00 . A A . 1 HIS O 1 1 3 271 1 1 2 ARG C C 0.520 2.216 2.477 1.00 . A A . 2 ARG C 1 1 3 272 1 1 2 ARG CA C 1.021 2.053 3.908 1.00 . A A . 2 ARG CA 1 1 3 273 1 1 2 ARG CB C -0.127 1.606 4.816 1.00 . A A . 2 ARG CB 1 1 3 274 1 1 2 ARG CD C -1.764 -0.243 5.276 1.00 . A A . 2 ARG CD 1 1 3 275 1 1 2 ARG CG C -0.360 0.104 4.806 1.00 . A A . 2 ARG CG 1 1 3 276 1 1 2 ARG CZ C -1.884 -2.656 4.788 1.00 . A A . 2 ARG CZ 1 1 3 277 1 1 2 ARG H H 1.143 3.787 5.116 1.00 . A A . 2 ARG H 1 1 3 278 1 1 2 ARG HA H 1.794 1.300 3.924 1.00 . A A . 2 ARG HA 1 1 3 279 1 1 2 ARG HB2 H 0.091 1.909 5.829 1.00 . A A . 2 ARG HB2 1 1 3 280 1 1 2 ARG HB3 H -1.036 2.092 4.492 1.00 . A A . 2 ARG HB3 1 1 3 281 1 1 2 ARG HD2 H -1.734 -0.452 6.335 1.00 . A A . 2 ARG HD2 1 1 3 282 1 1 2 ARG HD3 H -2.410 0.603 5.094 1.00 . A A . 2 ARG HD3 1 1 3 283 1 1 2 ARG HE H -3.010 -1.256 3.920 1.00 . A A . 2 ARG HE 1 1 3 284 1 1 2 ARG HG2 H -0.227 -0.265 3.797 1.00 . A A . 2 ARG HG2 1 1 3 285 1 1 2 ARG HG3 H 0.359 -0.366 5.467 1.00 . A A . 2 ARG HG3 1 1 3 286 1 1 2 ARG HH11 H -0.511 -2.151 6.185 1.00 . A A . 2 ARG HH11 1 1 3 287 1 1 2 ARG HH12 H -0.616 -3.842 5.824 1.00 . A A . 2 ARG HH12 1 1 3 288 1 1 2 ARG HH21 H -3.149 -3.479 3.444 1.00 . A A . 2 ARG HH21 1 1 3 289 1 1 2 ARG HH22 H -2.113 -4.596 4.267 1.00 . A A . 2 ARG HH22 1 1 3 290 1 1 2 ARG N N 1.598 3.299 4.398 1.00 . A A . 2 ARG N 1 1 3 291 1 1 2 ARG NE N -2.301 -1.410 4.579 1.00 . A A . 2 ARG NE 1 1 3 292 1 1 2 ARG NH1 N -0.925 -2.903 5.672 1.00 . A A . 2 ARG NH1 1 1 3 293 1 1 2 ARG NH2 N -2.426 -3.659 4.111 1.00 . A A . 2 ARG NH2 1 1 3 294 1 1 2 ARG O O -0.668 2.434 2.245 1.00 . A A . 2 ARG O 1 1 3 295 1 1 3 PHE C C 0.682 0.905 -0.485 1.00 . A A . 3 PHE C 1 1 3 296 1 1 3 PHE CA C 1.091 2.248 0.112 1.00 . A A . 3 PHE CA 1 1 3 297 1 1 3 PHE CB C 2.267 2.833 -0.665 1.00 . A A . 3 PHE CB 1 1 3 298 1 1 3 PHE CD1 C 1.886 5.294 -0.355 1.00 . A A . 3 PHE CD1 1 1 3 299 1 1 3 PHE CD2 C 1.868 4.415 -2.572 1.00 . A A . 3 PHE CD2 1 1 3 300 1 1 3 PHE CE1 C 1.643 6.560 -0.851 1.00 . A A . 3 PHE CE1 1 1 3 301 1 1 3 PHE CE2 C 1.624 5.679 -3.074 1.00 . A A . 3 PHE CE2 1 1 3 302 1 1 3 PHE CG C 2.002 4.208 -1.208 1.00 . A A . 3 PHE CG 1 1 3 303 1 1 3 PHE CZ C 1.512 6.753 -2.213 1.00 . A A . 3 PHE CZ 1 1 3 304 1 1 3 PHE H H 2.369 1.937 1.769 1.00 . A A . 3 PHE H 1 1 3 305 1 1 3 PHE HA H 0.260 2.927 0.042 1.00 . A A . 3 PHE HA 1 1 3 306 1 1 3 PHE HB2 H 3.120 2.898 -0.006 1.00 . A A . 3 PHE HB2 1 1 3 307 1 1 3 PHE HB3 H 2.501 2.183 -1.499 1.00 . A A . 3 PHE HB3 1 1 3 308 1 1 3 PHE HD1 H 1.989 5.144 0.710 1.00 . A A . 3 PHE HD1 1 1 3 309 1 1 3 PHE HD2 H 1.956 3.576 -3.246 1.00 . A A . 3 PHE HD2 1 1 3 310 1 1 3 PHE HE1 H 1.555 7.398 -0.176 1.00 . A A . 3 PHE HE1 1 1 3 311 1 1 3 PHE HE2 H 1.522 5.827 -4.139 1.00 . A A . 3 PHE HE2 1 1 3 312 1 1 3 PHE HZ H 1.321 7.742 -2.603 1.00 . A A . 3 PHE HZ 1 1 3 313 1 1 3 PHE N N 1.437 2.110 1.521 1.00 . A A . 3 PHE N 1 1 3 314 1 1 3 PHE O O 1.496 0.214 -1.100 1.00 . A A . 3 PHE O 1 1 3 315 1 1 4 LEU C C -0.860 -0.837 -2.321 1.00 . A A . 4 LEU C 1 1 3 316 1 1 4 LEU CA C -1.101 -0.721 -0.819 1.00 . A A . 4 LEU CA 1 1 3 317 1 1 4 LEU CB C -2.595 -0.843 -0.521 1.00 . A A . 4 LEU CB 1 1 3 318 1 1 4 LEU CD1 C -3.276 0.599 1.410 1.00 . A A . 4 LEU CD1 1 1 3 319 1 1 4 LEU CD2 C -4.133 -1.744 1.243 1.00 . A A . 4 LEU CD2 1 1 3 320 1 1 4 LEU CG C -2.958 -0.818 0.964 1.00 . A A . 4 LEU CG 1 1 3 321 1 1 4 LEU H H -1.183 1.132 0.199 1.00 . A A . 4 LEU H 1 1 3 322 1 1 4 LEU HA H -0.579 -1.522 -0.319 1.00 . A A . 4 LEU HA 1 1 3 323 1 1 4 LEU HB2 H -3.107 -0.027 -1.010 1.00 . A A . 4 LEU HB2 1 1 3 324 1 1 4 LEU HB3 H -2.951 -1.773 -0.940 1.00 . A A . 4 LEU HB3 1 1 3 325 1 1 4 LEU HD11 H -2.379 1.064 1.790 1.00 . A A . 4 LEU HD11 1 1 3 326 1 1 4 LEU HD12 H -4.026 0.573 2.186 1.00 . A A . 4 LEU HD12 1 1 3 327 1 1 4 LEU HD13 H -3.646 1.166 0.569 1.00 . A A . 4 LEU HD13 1 1 3 328 1 1 4 LEU HD21 H -4.735 -1.332 2.040 1.00 . A A . 4 LEU HD21 1 1 3 329 1 1 4 LEU HD22 H -3.764 -2.716 1.536 1.00 . A A . 4 LEU HD22 1 1 3 330 1 1 4 LEU HD23 H -4.734 -1.842 0.351 1.00 . A A . 4 LEU HD23 1 1 3 331 1 1 4 LEU HG H -2.112 -1.165 1.539 1.00 . A A . 4 LEU HG 1 1 3 332 1 1 4 LEU N N -0.583 0.540 -0.300 1.00 . A A . 4 LEU N 1 1 3 333 1 1 4 LEU O O -0.280 0.057 -2.938 1.00 . A A . 4 LEU O 1 1 3 334 1 1 5 ARG C C -2.246 -3.086 -4.867 1.00 . A A . 5 ARG C 1 1 3 335 1 1 5 ARG CA C -1.143 -2.178 -4.333 1.00 . A A . 5 ARG CA 1 1 3 336 1 1 5 ARG CB C 0.226 -2.799 -4.614 1.00 . A A . 5 ARG CB 1 1 3 337 1 1 5 ARG CD C 1.339 -4.261 -6.328 1.00 . A A . 5 ARG CD 1 1 3 338 1 1 5 ARG CG C 0.504 -3.012 -6.092 1.00 . A A . 5 ARG CG 1 1 3 339 1 1 5 ARG CZ C 1.930 -5.760 -8.192 1.00 . A A . 5 ARG CZ 1 1 3 340 1 1 5 ARG H H -1.763 -2.621 -2.358 1.00 . A A . 5 ARG H 1 1 3 341 1 1 5 ARG HA H -1.205 -1.224 -4.834 1.00 . A A . 5 ARG HA 1 1 3 342 1 1 5 ARG HB2 H 0.994 -2.146 -4.216 1.00 . A A . 5 ARG HB2 1 1 3 343 1 1 5 ARG HB3 H 0.282 -3.761 -4.116 1.00 . A A . 5 ARG HB3 1 1 3 344 1 1 5 ARG HD2 H 2.374 -4.029 -6.126 1.00 . A A . 5 ARG HD2 1 1 3 345 1 1 5 ARG HD3 H 1.005 -5.035 -5.653 1.00 . A A . 5 ARG HD3 1 1 3 346 1 1 5 ARG HE H 0.583 -4.291 -8.289 1.00 . A A . 5 ARG HE 1 1 3 347 1 1 5 ARG HG2 H -0.436 -3.117 -6.614 1.00 . A A . 5 ARG HG2 1 1 3 348 1 1 5 ARG HG3 H 1.038 -2.155 -6.476 1.00 . A A . 5 ARG HG3 1 1 3 349 1 1 5 ARG HH11 H 2.938 -6.120 -6.475 1.00 . A A . 5 ARG HH11 1 1 3 350 1 1 5 ARG HH12 H 3.335 -7.161 -7.800 1.00 . A A . 5 ARG HH12 1 1 3 351 1 1 5 ARG HH21 H 1.103 -5.660 -10.033 1.00 . A A . 5 ARG HH21 1 1 3 352 1 1 5 ARG HH22 H 2.294 -6.900 -9.821 1.00 . A A . 5 ARG HH22 1 1 3 353 1 1 5 ARG N N -1.309 -1.944 -2.903 1.00 . A A . 5 ARG N 1 1 3 354 1 1 5 ARG NE N 1.222 -4.746 -7.702 1.00 . A A . 5 ARG NE 1 1 3 355 1 1 5 ARG NH1 N 2.806 -6.399 -7.426 1.00 . A A . 5 ARG NH1 1 1 3 356 1 1 5 ARG NH2 N 1.762 -6.138 -9.452 1.00 . A A . 5 ARG NH2 1 1 3 357 1 1 5 ARG O O -2.265 -4.285 -4.589 1.00 . A A . 5 ARG O 1 1 3 358 1 1 6 HIS C C -5.024 -2.431 -7.239 1.00 . A A . 6 HIS C 1 1 3 359 1 1 6 HIS CA C -4.269 -3.265 -6.208 1.00 . A A . 6 HIS CA 1 1 3 360 1 1 6 HIS CB C -5.225 -3.723 -5.106 1.00 . A A . 6 HIS CB 1 1 3 361 1 1 6 HIS CD2 C -6.456 -5.343 -6.717 1.00 . A A . 6 HIS CD2 1 1 3 362 1 1 6 HIS CE1 C -8.349 -5.504 -5.623 1.00 . A A . 6 HIS CE1 1 1 3 363 1 1 6 HIS CG C -6.352 -4.571 -5.608 1.00 . A A . 6 HIS CG 1 1 3 364 1 1 6 HIS H H -3.093 -1.547 -5.821 1.00 . A A . 6 HIS H 1 1 3 365 1 1 6 HIS HA H -3.856 -4.134 -6.699 1.00 . A A . 6 HIS HA 1 1 3 366 1 1 6 HIS HB2 H -4.673 -4.303 -4.377 1.00 . A A . 6 HIS HB2 1 1 3 367 1 1 6 HIS HB3 H -5.653 -2.851 -4.625 1.00 . A A . 6 HIS HB3 1 1 3 368 1 1 6 HIS HD1 H -7.792 -4.254 -4.102 1.00 . A A . 6 HIS HD1 1 1 3 369 1 1 6 HIS HD2 H -5.696 -5.484 -7.472 1.00 . A A . 6 HIS HD2 1 1 3 370 1 1 6 HIS HE1 H -9.354 -5.785 -5.343 1.00 . A A . 6 HIS HE1 1 1 3 371 1 1 6 HIS HE2 H -8.031 -6.587 -7.332 1.00 . A A . 6 HIS HE2 1 1 3 372 1 1 6 HIS N N -3.162 -2.507 -5.635 1.00 . A A . 6 HIS N 1 1 3 373 1 1 6 HIS ND1 N -7.556 -4.694 -4.945 1.00 . A A . 6 HIS ND1 1 1 3 374 1 1 6 HIS NE2 N -7.706 -5.910 -6.702 1.00 . A A . 6 HIS NE2 1 1 3 375 1 1 6 HIS O O -5.896 -1.636 -6.831 1.00 . A A . 6 HIS O 1 1 4 376 1 1 1 HIS C C 2.652 3.685 3.627 1.00 . A A . 1 HIS C 1 1 4 377 1 1 1 HIS CA C 3.306 4.989 4.070 1.00 . A A . 1 HIS CA 1 1 4 378 1 1 1 HIS CB C 4.789 4.990 3.694 1.00 . A A . 1 HIS CB 1 1 4 379 1 1 1 HIS CD2 C 6.237 4.097 5.653 1.00 . A A . 1 HIS CD2 1 1 4 380 1 1 1 HIS CE1 C 6.581 2.068 4.898 1.00 . A A . 1 HIS CE1 1 1 4 381 1 1 1 HIS CG C 5.602 3.994 4.461 1.00 . A A . 1 HIS CG 1 1 4 382 1 1 1 HIS H1 H 2.213 5.463 5.748 1.00 . A A . 1 HIS H1 1 1 4 383 1 1 1 HIS H2 H 3.867 5.916 5.820 1.00 . A A . 1 HIS H2 1 1 4 384 1 1 1 HIS H3 H 3.417 4.269 5.994 1.00 . A A . 1 HIS H3 1 1 4 385 1 1 1 HIS HA H 2.814 5.815 3.579 1.00 . A A . 1 HIS HA 1 1 4 386 1 1 1 HIS HB2 H 4.887 4.759 2.644 1.00 . A A . 1 HIS HB2 1 1 4 387 1 1 1 HIS HB3 H 5.200 5.971 3.882 1.00 . A A . 1 HIS HB3 1 1 4 388 1 1 1 HIS HD1 H 5.508 2.327 3.175 1.00 . A A . 1 HIS HD1 1 1 4 389 1 1 1 HIS HD2 H 6.265 4.970 6.290 1.00 . A A . 1 HIS HD2 1 1 4 390 1 1 1 HIS HE1 H 6.922 1.047 4.814 1.00 . A A . 1 HIS HE1 1 1 4 391 1 1 1 HIS HE2 H 7.440 2.694 6.648 1.00 . A A . 1 HIS HE2 1 1 4 392 1 1 1 HIS N N 3.190 5.176 5.541 1.00 . A A . 1 HIS N 1 1 4 393 1 1 1 HIS ND1 N 5.837 2.710 4.014 1.00 . A A . 1 HIS ND1 1 1 4 394 1 1 1 HIS NE2 N 6.837 2.888 5.901 1.00 . A A . 1 HIS NE2 1 1 4 395 1 1 1 HIS O O 3.128 3.022 2.705 1.00 . A A . 1 HIS O 1 1 4 396 1 1 2 ARG C C 0.157 2.218 2.600 1.00 . A A . 2 ARG C 1 1 4 397 1 1 2 ARG CA C 0.837 2.097 3.960 1.00 . A A . 2 ARG CA 1 1 4 398 1 1 2 ARG CB C -0.201 1.786 5.040 1.00 . A A . 2 ARG CB 1 1 4 399 1 1 2 ARG CD C -0.574 1.445 7.501 1.00 . A A . 2 ARG CD 1 1 4 400 1 1 2 ARG CG C 0.406 1.304 6.347 1.00 . A A . 2 ARG CG 1 1 4 401 1 1 2 ARG CZ C -2.782 0.540 8.115 1.00 . A A . 2 ARG CZ 1 1 4 402 1 1 2 ARG H H 1.226 3.892 5.013 1.00 . A A . 2 ARG H 1 1 4 403 1 1 2 ARG HA H 1.555 1.292 3.920 1.00 . A A . 2 ARG HA 1 1 4 404 1 1 2 ARG HB2 H -0.773 2.680 5.242 1.00 . A A . 2 ARG HB2 1 1 4 405 1 1 2 ARG HB3 H -0.867 1.019 4.673 1.00 . A A . 2 ARG HB3 1 1 4 406 1 1 2 ARG HD2 H -0.159 0.958 8.370 1.00 . A A . 2 ARG HD2 1 1 4 407 1 1 2 ARG HD3 H -0.714 2.496 7.710 1.00 . A A . 2 ARG HD3 1 1 4 408 1 1 2 ARG HE H -2.071 0.658 6.254 1.00 . A A . 2 ARG HE 1 1 4 409 1 1 2 ARG HG2 H 0.678 0.261 6.244 1.00 . A A . 2 ARG HG2 1 1 4 410 1 1 2 ARG HG3 H 1.290 1.894 6.562 1.00 . A A . 2 ARG HG3 1 1 4 411 1 1 2 ARG HH11 H -1.677 1.188 9.681 1.00 . A A . 2 ARG HH11 1 1 4 412 1 1 2 ARG HH12 H -3.233 0.547 10.086 1.00 . A A . 2 ARG HH12 1 1 4 413 1 1 2 ARG HH21 H -4.120 -0.185 6.785 1.00 . A A . 2 ARG HH21 1 1 4 414 1 1 2 ARG HH22 H -4.620 -0.233 8.442 1.00 . A A . 2 ARG HH22 1 1 4 415 1 1 2 ARG N N 1.557 3.322 4.288 1.00 . A A . 2 ARG N 1 1 4 416 1 1 2 ARG NE N -1.870 0.845 7.195 1.00 . A A . 2 ARG NE 1 1 4 417 1 1 2 ARG NH1 N -2.544 0.778 9.399 1.00 . A A . 2 ARG NH1 1 1 4 418 1 1 2 ARG NH2 N -3.935 -0.004 7.751 1.00 . A A . 2 ARG NH2 1 1 4 419 1 1 2 ARG O O -1.068 2.312 2.512 1.00 . A A . 2 ARG O 1 1 4 420 1 1 3 PHE C C 0.384 0.962 -0.494 1.00 . A A . 3 PHE C 1 1 4 421 1 1 3 PHE CA C 0.438 2.327 0.185 1.00 . A A . 3 PHE CA 1 1 4 422 1 1 3 PHE CB C 1.297 3.290 -0.632 1.00 . A A . 3 PHE CB 1 1 4 423 1 1 3 PHE CD1 C 0.874 5.750 -0.385 1.00 . A A . 3 PHE CD1 1 1 4 424 1 1 3 PHE CD2 C -0.388 4.541 -2.008 1.00 . A A . 3 PHE CD2 1 1 4 425 1 1 3 PHE CE1 C 0.216 6.914 -0.737 1.00 . A A . 3 PHE CE1 1 1 4 426 1 1 3 PHE CE2 C -1.049 5.701 -2.364 1.00 . A A . 3 PHE CE2 1 1 4 427 1 1 3 PHE CG C 0.580 4.552 -1.016 1.00 . A A . 3 PHE CG 1 1 4 428 1 1 3 PHE CZ C -0.747 6.889 -1.727 1.00 . A A . 3 PHE CZ 1 1 4 429 1 1 3 PHE H H 1.928 2.140 1.676 1.00 . A A . 3 PHE H 1 1 4 430 1 1 3 PHE HA H -0.559 2.724 0.248 1.00 . A A . 3 PHE HA 1 1 4 431 1 1 3 PHE HB2 H 2.161 3.567 -0.046 1.00 . A A . 3 PHE HB2 1 1 4 432 1 1 3 PHE HB3 H 1.617 2.797 -1.542 1.00 . A A . 3 PHE HB3 1 1 4 433 1 1 3 PHE HD1 H 1.627 5.771 0.389 1.00 . A A . 3 PHE HD1 1 1 4 434 1 1 3 PHE HD2 H -0.625 3.612 -2.506 1.00 . A A . 3 PHE HD2 1 1 4 435 1 1 3 PHE HE1 H 0.454 7.841 -0.237 1.00 . A A . 3 PHE HE1 1 1 4 436 1 1 3 PHE HE2 H -1.801 5.678 -3.138 1.00 . A A . 3 PHE HE2 1 1 4 437 1 1 3 PHE HZ H -1.262 7.797 -2.004 1.00 . A A . 3 PHE HZ 1 1 4 438 1 1 3 PHE N N 0.960 2.216 1.541 1.00 . A A . 3 PHE N 1 1 4 439 1 1 3 PHE O O 1.265 0.612 -1.279 1.00 . A A . 3 PHE O 1 1 4 440 1 1 4 LEU C C -0.827 -1.075 -2.286 1.00 . A A . 4 LEU C 1 1 4 441 1 1 4 LEU CA C -0.826 -1.135 -0.761 1.00 . A A . 4 LEU CA 1 1 4 442 1 1 4 LEU CB C -2.127 -1.766 -0.263 1.00 . A A . 4 LEU CB 1 1 4 443 1 1 4 LEU CD1 C -2.887 -0.737 1.889 1.00 . A A . 4 LEU CD1 1 1 4 444 1 1 4 LEU CD2 C -2.967 -3.220 1.599 1.00 . A A . 4 LEU CD2 1 1 4 445 1 1 4 LEU CG C -2.216 -1.942 1.252 1.00 . A A . 4 LEU CG 1 1 4 446 1 1 4 LEU H H -1.324 0.527 0.450 1.00 . A A . 4 LEU H 1 1 4 447 1 1 4 LEU HA H 0.003 -1.743 -0.436 1.00 . A A . 4 LEU HA 1 1 4 448 1 1 4 LEU HB2 H -2.950 -1.143 -0.583 1.00 . A A . 4 LEU HB2 1 1 4 449 1 1 4 LEU HB3 H -2.232 -2.736 -0.724 1.00 . A A . 4 LEU HB3 1 1 4 450 1 1 4 LEU HD11 H -3.559 -0.282 1.177 1.00 . A A . 4 LEU HD11 1 1 4 451 1 1 4 LEU HD12 H -2.133 -0.021 2.182 1.00 . A A . 4 LEU HD12 1 1 4 452 1 1 4 LEU HD13 H -3.443 -1.052 2.760 1.00 . A A . 4 LEU HD13 1 1 4 453 1 1 4 LEU HD21 H -3.787 -3.353 0.910 1.00 . A A . 4 LEU HD21 1 1 4 454 1 1 4 LEU HD22 H -3.350 -3.150 2.606 1.00 . A A . 4 LEU HD22 1 1 4 455 1 1 4 LEU HD23 H -2.295 -4.063 1.526 1.00 . A A . 4 LEU HD23 1 1 4 456 1 1 4 LEU HG H -1.218 -2.019 1.657 1.00 . A A . 4 LEU HG 1 1 4 457 1 1 4 LEU N N -0.656 0.194 -0.184 1.00 . A A . 4 LEU N 1 1 4 458 1 1 4 LEU O O -0.829 0.006 -2.874 1.00 . A A . 4 LEU O 1 1 4 459 1 1 5 ARG C C -2.108 -2.982 -4.882 1.00 . A A . 5 ARG C 1 1 4 460 1 1 5 ARG CA C -0.828 -2.325 -4.375 1.00 . A A . 5 ARG CA 1 1 4 461 1 1 5 ARG CB C 0.390 -3.110 -4.863 1.00 . A A . 5 ARG CB 1 1 4 462 1 1 5 ARG CD C 1.520 -3.884 -6.970 1.00 . A A . 5 ARG CD 1 1 4 463 1 1 5 ARG CG C 0.841 -2.723 -6.262 1.00 . A A . 5 ARG CG 1 1 4 464 1 1 5 ARG CZ C 1.854 -3.098 -9.282 1.00 . A A . 5 ARG CZ 1 1 4 465 1 1 5 ARG H H -0.826 -3.071 -2.394 1.00 . A A . 5 ARG H 1 1 4 466 1 1 5 ARG HA H -0.776 -1.319 -4.763 1.00 . A A . 5 ARG HA 1 1 4 467 1 1 5 ARG HB2 H 1.214 -2.936 -4.182 1.00 . A A . 5 ARG HB2 1 1 4 468 1 1 5 ARG HB3 H 0.146 -4.166 -4.866 1.00 . A A . 5 ARG HB3 1 1 4 469 1 1 5 ARG HD2 H 2.148 -4.403 -6.261 1.00 . A A . 5 ARG HD2 1 1 4 470 1 1 5 ARG HD3 H 0.761 -4.557 -7.340 1.00 . A A . 5 ARG HD3 1 1 4 471 1 1 5 ARG HE H 3.312 -3.383 -7.949 1.00 . A A . 5 ARG HE 1 1 4 472 1 1 5 ARG HG2 H -0.021 -2.419 -6.837 1.00 . A A . 5 ARG HG2 1 1 4 473 1 1 5 ARG HG3 H 1.536 -1.899 -6.190 1.00 . A A . 5 ARG HG3 1 1 4 474 1 1 5 ARG HH11 H -0.075 -3.455 -8.788 1.00 . A A . 5 ARG HH11 1 1 4 475 1 1 5 ARG HH12 H 0.186 -2.902 -10.408 1.00 . A A . 5 ARG HH12 1 1 4 476 1 1 5 ARG HH21 H 3.657 -2.655 -10.079 1.00 . A A . 5 ARG HH21 1 1 4 477 1 1 5 ARG HH22 H 2.305 -2.448 -11.142 1.00 . A A . 5 ARG HH22 1 1 4 478 1 1 5 ARG N N -0.827 -2.244 -2.919 1.00 . A A . 5 ARG N 1 1 4 479 1 1 5 ARG NE N 2.343 -3.435 -8.091 1.00 . A A . 5 ARG NE 1 1 4 480 1 1 5 ARG NH1 N 0.548 -3.157 -9.511 1.00 . A A . 5 ARG NH1 1 1 4 481 1 1 5 ARG NH2 N 2.672 -2.701 -10.247 1.00 . A A . 5 ARG NH2 1 1 4 482 1 1 5 ARG O O -2.229 -4.207 -4.886 1.00 . A A . 5 ARG O 1 1 4 483 1 1 6 HIS C C -4.638 -2.070 -7.191 1.00 . A A . 6 HIS C 1 1 4 484 1 1 6 HIS CA C -4.332 -2.660 -5.819 1.00 . A A . 6 HIS CA 1 1 4 485 1 1 6 HIS CB C -5.463 -2.327 -4.844 1.00 . A A . 6 HIS CB 1 1 4 486 1 1 6 HIS CD2 C -6.588 0.001 -5.042 1.00 . A A . 6 HIS CD2 1 1 4 487 1 1 6 HIS CE1 C -5.173 1.146 -3.820 1.00 . A A . 6 HIS CE1 1 1 4 488 1 1 6 HIS CG C -5.636 -0.859 -4.609 1.00 . A A . 6 HIS CG 1 1 4 489 1 1 6 HIS H H -2.905 -1.192 -5.281 1.00 . A A . 6 HIS H 1 1 4 490 1 1 6 HIS HA H -4.252 -3.733 -5.911 1.00 . A A . 6 HIS HA 1 1 4 491 1 1 6 HIS HB2 H -6.395 -2.712 -5.239 1.00 . A A . 6 HIS HB2 1 1 4 492 1 1 6 HIS HB3 H -5.254 -2.796 -3.889 1.00 . A A . 6 HIS HB3 1 1 4 493 1 1 6 HIS HD1 H -3.965 -0.449 -3.392 1.00 . A A . 6 HIS HD1 1 1 4 494 1 1 6 HIS HD2 H -7.435 -0.242 -5.668 1.00 . A A . 6 HIS HD2 1 1 4 495 1 1 6 HIS HE1 H -4.686 1.958 -3.300 1.00 . A A . 6 HIS HE1 1 1 4 496 1 1 6 HIS HE2 H -6.739 2.076 -4.757 1.00 . A A . 6 HIS HE2 1 1 4 497 1 1 6 HIS N N -3.060 -2.159 -5.309 1.00 . A A . 6 HIS N 1 1 4 498 1 1 6 HIS ND1 N -4.764 -0.110 -3.847 1.00 . A A . 6 HIS ND1 1 1 4 499 1 1 6 HIS NE2 N -6.277 1.240 -4.538 1.00 . A A . 6 HIS NE2 1 1 4 500 1 1 6 HIS O O -3.865 -1.201 -7.647 1.00 . A A . 6 HIS O 1 1 5 501 1 1 1 HIS C C 2.608 3.297 4.031 1.00 . A A . 1 HIS C 1 1 5 502 1 1 1 HIS CA C 3.566 4.330 4.615 1.00 . A A . 1 HIS CA 1 1 5 503 1 1 1 HIS CB C 4.898 3.669 4.975 1.00 . A A . 1 HIS CB 1 1 5 504 1 1 1 HIS CD2 C 4.739 1.436 6.286 1.00 . A A . 1 HIS CD2 1 1 5 505 1 1 1 HIS CE1 C 4.742 2.258 8.319 1.00 . A A . 1 HIS CE1 1 1 5 506 1 1 1 HIS CG C 4.820 2.784 6.180 1.00 . A A . 1 HIS CG 1 1 5 507 1 1 1 HIS H1 H 2.280 5.642 5.541 1.00 . A A . 1 HIS H1 1 1 5 508 1 1 1 HIS H2 H 3.781 5.426 6.343 1.00 . A A . 1 HIS H2 1 1 5 509 1 1 1 HIS H3 H 2.582 4.201 6.418 1.00 . A A . 1 HIS H3 1 1 5 510 1 1 1 HIS HA H 3.740 5.103 3.882 1.00 . A A . 1 HIS HA 1 1 5 511 1 1 1 HIS HB2 H 5.230 3.068 4.143 1.00 . A A . 1 HIS HB2 1 1 5 512 1 1 1 HIS HB3 H 5.631 4.438 5.173 1.00 . A A . 1 HIS HB3 1 1 5 513 1 1 1 HIS HD1 H 4.867 4.213 7.729 1.00 . A A . 1 HIS HD1 1 1 5 514 1 1 1 HIS HD2 H 4.717 0.729 5.469 1.00 . A A . 1 HIS HD2 1 1 5 515 1 1 1 HIS HE1 H 4.721 2.336 9.396 1.00 . A A . 1 HIS HE1 1 1 5 516 1 1 1 HIS HE2 H 4.541 0.244 8.003 1.00 . A A . 1 HIS HE2 1 1 5 517 1 1 1 HIS N N 3.001 4.956 5.839 1.00 . A A . 1 HIS N 1 1 5 518 1 1 1 HIS ND1 N 4.818 3.269 7.472 1.00 . A A . 1 HIS ND1 1 1 5 519 1 1 1 HIS NE2 N 4.692 1.136 7.625 1.00 . A A . 1 HIS NE2 1 1 5 520 1 1 1 HIS O O 3.033 2.333 3.394 1.00 . A A . 1 HIS O 1 1 5 521 1 1 2 ARG C C 0.213 2.667 2.220 1.00 . A A . 2 ARG C 1 1 5 522 1 1 2 ARG CA C 0.297 2.591 3.742 1.00 . A A . 2 ARG CA 1 1 5 523 1 1 2 ARG CB C -1.065 2.914 4.359 1.00 . A A . 2 ARG CB 1 1 5 524 1 1 2 ARG CD C -3.325 2.056 5.043 1.00 . A A . 2 ARG CD 1 1 5 525 1 1 2 ARG CG C -2.081 1.794 4.209 1.00 . A A . 2 ARG CG 1 1 5 526 1 1 2 ARG CZ C -2.686 1.325 7.308 1.00 . A A . 2 ARG CZ 1 1 5 527 1 1 2 ARG H H 1.035 4.292 4.763 1.00 . A A . 2 ARG H 1 1 5 528 1 1 2 ARG HA H 0.582 1.588 4.024 1.00 . A A . 2 ARG HA 1 1 5 529 1 1 2 ARG HB2 H -0.932 3.112 5.412 1.00 . A A . 2 ARG HB2 1 1 5 530 1 1 2 ARG HB3 H -1.463 3.798 3.883 1.00 . A A . 2 ARG HB3 1 1 5 531 1 1 2 ARG HD2 H -3.829 2.926 4.650 1.00 . A A . 2 ARG HD2 1 1 5 532 1 1 2 ARG HD3 H -3.978 1.199 4.972 1.00 . A A . 2 ARG HD3 1 1 5 533 1 1 2 ARG HE H -3.020 3.217 6.768 1.00 . A A . 2 ARG HE 1 1 5 534 1 1 2 ARG HG2 H -2.368 1.717 3.168 1.00 . A A . 2 ARG HG2 1 1 5 535 1 1 2 ARG HG3 H -1.629 0.864 4.534 1.00 . A A . 2 ARG HG3 1 1 5 536 1 1 2 ARG HH11 H -2.863 -0.175 5.961 1.00 . A A . 2 ARG HH11 1 1 5 537 1 1 2 ARG HH12 H -2.414 -0.663 7.561 1.00 . A A . 2 ARG HH12 1 1 5 538 1 1 2 ARG HH21 H -2.429 2.577 8.873 1.00 . A A . 2 ARG HH21 1 1 5 539 1 1 2 ARG HH22 H -2.168 0.899 9.214 1.00 . A A . 2 ARG HH22 1 1 5 540 1 1 2 ARG N N 1.313 3.505 4.250 1.00 . A A . 2 ARG N 1 1 5 541 1 1 2 ARG NE N -3.001 2.291 6.448 1.00 . A A . 2 ARG NE 1 1 5 542 1 1 2 ARG NH1 N -2.652 0.059 6.910 1.00 . A A . 2 ARG NH1 1 1 5 543 1 1 2 ARG NH2 N -2.404 1.625 8.568 1.00 . A A . 2 ARG NH2 1 1 5 544 1 1 2 ARG O O -0.745 3.209 1.667 1.00 . A A . 2 ARG O 1 1 5 545 1 1 3 PHE C C 0.679 0.845 -0.478 1.00 . A A . 3 PHE C 1 1 5 546 1 1 3 PHE CA C 1.267 2.132 0.093 1.00 . A A . 3 PHE CA 1 1 5 547 1 1 3 PHE CB C 2.703 2.314 -0.389 1.00 . A A . 3 PHE CB 1 1 5 548 1 1 3 PHE CD1 C 3.637 4.642 -0.456 1.00 . A A . 3 PHE CD1 1 1 5 549 1 1 3 PHE CD2 C 2.463 3.836 -2.369 1.00 . A A . 3 PHE CD2 1 1 5 550 1 1 3 PHE CE1 C 3.856 5.848 -1.095 1.00 . A A . 3 PHE CE1 1 1 5 551 1 1 3 PHE CE2 C 2.678 5.040 -3.012 1.00 . A A . 3 PHE CE2 1 1 5 552 1 1 3 PHE CG C 2.939 3.624 -1.085 1.00 . A A . 3 PHE CG 1 1 5 553 1 1 3 PHE CZ C 3.376 6.047 -2.374 1.00 . A A . 3 PHE CZ 1 1 5 554 1 1 3 PHE H H 1.958 1.708 2.048 1.00 . A A . 3 PHE H 1 1 5 555 1 1 3 PHE HA H 0.680 2.965 -0.249 1.00 . A A . 3 PHE HA 1 1 5 556 1 1 3 PHE HB2 H 3.364 2.271 0.464 1.00 . A A . 3 PHE HB2 1 1 5 557 1 1 3 PHE HB3 H 2.950 1.518 -1.081 1.00 . A A . 3 PHE HB3 1 1 5 558 1 1 3 PHE HD1 H 4.013 4.487 0.545 1.00 . A A . 3 PHE HD1 1 1 5 559 1 1 3 PHE HD2 H 1.917 3.049 -2.868 1.00 . A A . 3 PHE HD2 1 1 5 560 1 1 3 PHE HE1 H 4.402 6.634 -0.593 1.00 . A A . 3 PHE HE1 1 1 5 561 1 1 3 PHE HE2 H 2.302 5.193 -4.013 1.00 . A A . 3 PHE HE2 1 1 5 562 1 1 3 PHE HZ H 3.546 6.989 -2.875 1.00 . A A . 3 PHE HZ 1 1 5 563 1 1 3 PHE N N 1.223 2.124 1.550 1.00 . A A . 3 PHE N 1 1 5 564 1 1 3 PHE O O 1.395 -0.129 -0.708 1.00 . A A . 3 PHE O 1 1 5 565 1 1 4 LEU C C -0.684 -0.768 -2.560 1.00 . A A . 4 LEU C 1 1 5 566 1 1 4 LEU CA C -1.319 -0.317 -1.249 1.00 . A A . 4 LEU CA 1 1 5 567 1 1 4 LEU CB C -2.800 -0.004 -1.467 1.00 . A A . 4 LEU CB 1 1 5 568 1 1 4 LEU CD1 C -3.565 1.897 -0.029 1.00 . A A . 4 LEU CD1 1 1 5 569 1 1 4 LEU CD2 C -4.991 -0.144 -0.257 1.00 . A A . 4 LEU CD2 1 1 5 570 1 1 4 LEU CG C -3.567 0.388 -0.205 1.00 . A A . 4 LEU CG 1 1 5 571 1 1 4 LEU H H -1.149 1.655 -0.500 1.00 . A A . 4 LEU H 1 1 5 572 1 1 4 LEU HA H -1.235 -1.115 -0.527 1.00 . A A . 4 LEU HA 1 1 5 573 1 1 4 LEU HB2 H -2.874 0.807 -2.177 1.00 . A A . 4 LEU HB2 1 1 5 574 1 1 4 LEU HB3 H -3.272 -0.877 -1.892 1.00 . A A . 4 LEU HB3 1 1 5 575 1 1 4 LEU HD11 H -4.485 2.207 0.444 1.00 . A A . 4 LEU HD11 1 1 5 576 1 1 4 LEU HD12 H -3.479 2.372 -0.996 1.00 . A A . 4 LEU HD12 1 1 5 577 1 1 4 LEU HD13 H -2.727 2.185 0.588 1.00 . A A . 4 LEU HD13 1 1 5 578 1 1 4 LEU HD21 H -5.352 -0.307 0.748 1.00 . A A . 4 LEU HD21 1 1 5 579 1 1 4 LEU HD22 H -5.008 -1.077 -0.801 1.00 . A A . 4 LEU HD22 1 1 5 580 1 1 4 LEU HD23 H -5.626 0.574 -0.755 1.00 . A A . 4 LEU HD23 1 1 5 581 1 1 4 LEU HG H -3.077 -0.046 0.654 1.00 . A A . 4 LEU HG 1 1 5 582 1 1 4 LEU N N -0.632 0.849 -0.705 1.00 . A A . 4 LEU N 1 1 5 583 1 1 4 LEU O O 0.289 -0.176 -3.026 1.00 . A A . 4 LEU O 1 1 5 584 1 1 5 ARG C C -1.801 -3.159 -5.134 1.00 . A A . 5 ARG C 1 1 5 585 1 1 5 ARG CA C -0.729 -2.351 -4.409 1.00 . A A . 5 ARG CA 1 1 5 586 1 1 5 ARG CB C 0.501 -3.224 -4.154 1.00 . A A . 5 ARG CB 1 1 5 587 1 1 5 ARG CD C 2.944 -3.394 -4.716 1.00 . A A . 5 ARG CD 1 1 5 588 1 1 5 ARG CG C 1.547 -3.134 -5.254 1.00 . A A . 5 ARG CG 1 1 5 589 1 1 5 ARG CZ C 5.235 -2.636 -5.217 1.00 . A A . 5 ARG CZ 1 1 5 590 1 1 5 ARG H H -2.015 -2.250 -2.730 1.00 . A A . 5 ARG H 1 1 5 591 1 1 5 ARG HA H -0.444 -1.515 -5.029 1.00 . A A . 5 ARG HA 1 1 5 592 1 1 5 ARG HB2 H 0.962 -2.914 -3.223 1.00 . A A . 5 ARG HB2 1 1 5 593 1 1 5 ARG HB3 H 0.185 -4.257 -4.071 1.00 . A A . 5 ARG HB3 1 1 5 594 1 1 5 ARG HD2 H 3.036 -2.929 -3.746 1.00 . A A . 5 ARG HD2 1 1 5 595 1 1 5 ARG HD3 H 3.085 -4.461 -4.618 1.00 . A A . 5 ARG HD3 1 1 5 596 1 1 5 ARG HE H 3.724 -2.653 -6.522 1.00 . A A . 5 ARG HE 1 1 5 597 1 1 5 ARG HG2 H 1.321 -3.868 -6.013 1.00 . A A . 5 ARG HG2 1 1 5 598 1 1 5 ARG HG3 H 1.515 -2.145 -5.687 1.00 . A A . 5 ARG HG3 1 1 5 599 1 1 5 ARG HH11 H 4.959 -3.269 -3.316 1.00 . A A . 5 ARG HH11 1 1 5 600 1 1 5 ARG HH12 H 6.561 -2.732 -3.694 1.00 . A A . 5 ARG HH12 1 1 5 601 1 1 5 ARG HH21 H 5.831 -1.947 -7.021 1.00 . A A . 5 ARG HH21 1 1 5 602 1 1 5 ARG HH22 H 7.057 -1.981 -5.797 1.00 . A A . 5 ARG HH22 1 1 5 603 1 1 5 ARG N N -1.241 -1.820 -3.151 1.00 . A A . 5 ARG N 1 1 5 604 1 1 5 ARG NE N 3.979 -2.858 -5.598 1.00 . A A . 5 ARG NE 1 1 5 605 1 1 5 ARG NH1 N 5.616 -2.901 -3.974 1.00 . A A . 5 ARG NH1 1 1 5 606 1 1 5 ARG NH2 N 6.113 -2.148 -6.083 1.00 . A A . 5 ARG NH2 1 1 5 607 1 1 5 ARG O O -1.516 -4.208 -5.714 1.00 . A A . 5 ARG O 1 1 5 608 1 1 6 HIS C C -5.199 -2.336 -6.211 1.00 . A A . 6 HIS C 1 1 5 609 1 1 6 HIS CA C -4.148 -3.341 -5.752 1.00 . A A . 6 HIS CA 1 1 5 610 1 1 6 HIS CB C -4.780 -4.360 -4.803 1.00 . A A . 6 HIS CB 1 1 5 611 1 1 6 HIS CD2 C -5.327 -6.273 -6.468 1.00 . A A . 6 HIS CD2 1 1 5 612 1 1 6 HIS CE1 C -7.452 -6.518 -5.988 1.00 . A A . 6 HIS CE1 1 1 5 613 1 1 6 HIS CG C -5.631 -5.377 -5.499 1.00 . A A . 6 HIS CG 1 1 5 614 1 1 6 HIS H H -3.198 -1.825 -4.620 1.00 . A A . 6 HIS H 1 1 5 615 1 1 6 HIS HA H -3.760 -3.858 -6.616 1.00 . A A . 6 HIS HA 1 1 5 616 1 1 6 HIS HB2 H -3.994 -4.890 -4.278 1.00 . A A . 6 HIS HB2 1 1 5 617 1 1 6 HIS HB3 H -5.403 -3.837 -4.087 1.00 . A A . 6 HIS HB3 1 1 5 618 1 1 6 HIS HD1 H -7.489 -5.052 -4.560 1.00 . A A . 6 HIS HD1 1 1 5 619 1 1 6 HIS HD2 H -4.360 -6.414 -6.931 1.00 . A A . 6 HIS HD2 1 1 5 620 1 1 6 HIS HE1 H -8.472 -6.874 -5.988 1.00 . A A . 6 HIS HE1 1 1 5 621 1 1 6 HIS HE2 H -6.539 -7.743 -7.351 1.00 . A A . 6 HIS HE2 1 1 5 622 1 1 6 HIS N N -3.034 -2.665 -5.098 1.00 . A A . 6 HIS N 1 1 5 623 1 1 6 HIS ND1 N -6.970 -5.555 -5.221 1.00 . A A . 6 HIS ND1 1 1 5 624 1 1 6 HIS NE2 N -6.476 -6.969 -6.754 1.00 . A A . 6 HIS NE2 1 1 5 625 1 1 6 HIS O O -5.022 -1.130 -5.941 1.00 . A A . 6 HIS O 1 1 6 626 1 1 1 HIS C C 2.527 3.193 3.966 1.00 . A A . 1 HIS C 1 1 6 627 1 1 1 HIS CA C 3.579 4.152 4.515 1.00 . A A . 1 HIS CA 1 1 6 628 1 1 1 HIS CB C 4.835 3.379 4.923 1.00 . A A . 1 HIS CB 1 1 6 629 1 1 1 HIS CD2 C 6.851 4.971 4.561 1.00 . A A . 1 HIS CD2 1 1 6 630 1 1 1 HIS CE1 C 7.373 5.310 6.664 1.00 . A A . 1 HIS CE1 1 1 6 631 1 1 1 HIS CG C 5.979 4.262 5.316 1.00 . A A . 1 HIS CG 1 1 6 632 1 1 1 HIS H1 H 3.887 5.302 6.194 1.00 . A A . 1 HIS H1 1 1 6 633 1 1 1 HIS H2 H 2.572 4.205 6.308 1.00 . A A . 1 HIS H2 1 1 6 634 1 1 1 HIS H3 H 2.425 5.629 5.362 1.00 . A A . 1 HIS H3 1 1 6 635 1 1 1 HIS HA H 3.836 4.869 3.749 1.00 . A A . 1 HIS HA 1 1 6 636 1 1 1 HIS HB2 H 4.602 2.744 5.764 1.00 . A A . 1 HIS HB2 1 1 6 637 1 1 1 HIS HB3 H 5.157 2.766 4.094 1.00 . A A . 1 HIS HB3 1 1 6 638 1 1 1 HIS HD1 H 5.888 4.120 7.417 1.00 . A A . 1 HIS HD1 1 1 6 639 1 1 1 HIS HD2 H 6.871 5.023 3.482 1.00 . A A . 1 HIS HD2 1 1 6 640 1 1 1 HIS HE1 H 7.866 5.667 7.556 1.00 . A A . 1 HIS HE1 1 1 6 641 1 1 1 HIS HE2 H 8.415 6.237 5.164 1.00 . A A . 1 HIS HE2 1 1 6 642 1 1 1 HIS N N 3.070 4.888 5.702 1.00 . A A . 1 HIS N 1 1 6 643 1 1 1 HIS ND1 N 6.333 4.495 6.629 1.00 . A A . 1 HIS ND1 1 1 6 644 1 1 1 HIS NE2 N 7.706 5.612 5.423 1.00 . A A . 1 HIS NE2 1 1 6 645 1 1 1 HIS O O 2.859 2.163 3.379 1.00 . A A . 1 HIS O 1 1 6 646 1 1 2 ARG C C 0.049 2.778 2.163 1.00 . A A . 2 ARG C 1 1 6 647 1 1 2 ARG CA C 0.159 2.708 3.683 1.00 . A A . 2 ARG CA 1 1 6 648 1 1 2 ARG CB C -1.157 3.152 4.325 1.00 . A A . 2 ARG CB 1 1 6 649 1 1 2 ARG CD C -3.534 2.535 4.851 1.00 . A A . 2 ARG CD 1 1 6 650 1 1 2 ARG CG C -2.137 2.013 4.552 1.00 . A A . 2 ARG CG 1 1 6 651 1 1 2 ARG CZ C -5.783 1.606 5.238 1.00 . A A . 2 ARG CZ 1 1 6 652 1 1 2 ARG H H 1.057 4.372 4.635 1.00 . A A . 2 ARG H 1 1 6 653 1 1 2 ARG HA H 0.365 1.688 3.971 1.00 . A A . 2 ARG HA 1 1 6 654 1 1 2 ARG HB2 H -0.942 3.609 5.280 1.00 . A A . 2 ARG HB2 1 1 6 655 1 1 2 ARG HB3 H -1.629 3.882 3.685 1.00 . A A . 2 ARG HB3 1 1 6 656 1 1 2 ARG HD2 H -3.477 3.224 5.680 1.00 . A A . 2 ARG HD2 1 1 6 657 1 1 2 ARG HD3 H -3.904 3.053 3.979 1.00 . A A . 2 ARG HD3 1 1 6 658 1 1 2 ARG HE H -4.078 0.580 5.399 1.00 . A A . 2 ARG HE 1 1 6 659 1 1 2 ARG HG2 H -2.176 1.400 3.661 1.00 . A A . 2 ARG HG2 1 1 6 660 1 1 2 ARG HG3 H -1.796 1.419 5.392 1.00 . A A . 2 ARG HG3 1 1 6 661 1 1 2 ARG HH11 H -5.761 3.563 4.725 1.00 . A A . 2 ARG HH11 1 1 6 662 1 1 2 ARG HH12 H -7.330 2.886 5.001 1.00 . A A . 2 ARG HH12 1 1 6 663 1 1 2 ARG HH21 H -6.143 -0.312 5.762 1.00 . A A . 2 ARG HH21 1 1 6 664 1 1 2 ARG HH22 H -7.548 0.687 5.591 1.00 . A A . 2 ARG HH22 1 1 6 665 1 1 2 ARG N N 1.259 3.538 4.160 1.00 . A A . 2 ARG N 1 1 6 666 1 1 2 ARG NE N -4.461 1.459 5.192 1.00 . A A . 2 ARG NE 1 1 6 667 1 1 2 ARG NH1 N -6.336 2.782 4.966 1.00 . A A . 2 ARG NH1 1 1 6 668 1 1 2 ARG NH2 N -6.554 0.576 5.556 1.00 . A A . 2 ARG NH2 1 1 6 669 1 1 2 ARG O O -0.933 3.287 1.622 1.00 . A A . 2 ARG O 1 1 6 670 1 1 3 PHE C C 0.705 0.900 -0.535 1.00 . A A . 3 PHE C 1 1 6 671 1 1 3 PHE CA C 1.086 2.269 0.021 1.00 . A A . 3 PHE CA 1 1 6 672 1 1 3 PHE CB C 2.466 2.680 -0.486 1.00 . A A . 3 PHE CB 1 1 6 673 1 1 3 PHE CD1 C 3.005 5.127 -0.616 1.00 . A A . 3 PHE CD1 1 1 6 674 1 1 3 PHE CD2 C 1.938 4.101 -2.486 1.00 . A A . 3 PHE CD2 1 1 6 675 1 1 3 PHE CE1 C 3.010 6.339 -1.280 1.00 . A A . 3 PHE CE1 1 1 6 676 1 1 3 PHE CE2 C 1.940 5.310 -3.154 1.00 . A A . 3 PHE CE2 1 1 6 677 1 1 3 PHE CG C 2.470 3.996 -1.211 1.00 . A A . 3 PHE CG 1 1 6 678 1 1 3 PHE CZ C 2.476 6.431 -2.551 1.00 . A A . 3 PHE CZ 1 1 6 679 1 1 3 PHE H H 1.821 1.874 1.966 1.00 . A A . 3 PHE H 1 1 6 680 1 1 3 PHE HA H 0.366 2.993 -0.315 1.00 . A A . 3 PHE HA 1 1 6 681 1 1 3 PHE HB2 H 3.135 2.766 0.358 1.00 . A A . 3 PHE HB2 1 1 6 682 1 1 3 PHE HB3 H 2.836 1.923 -1.167 1.00 . A A . 3 PHE HB3 1 1 6 683 1 1 3 PHE HD1 H 3.423 5.056 0.378 1.00 . A A . 3 PHE HD1 1 1 6 684 1 1 3 PHE HD2 H 1.518 3.225 -2.958 1.00 . A A . 3 PHE HD2 1 1 6 685 1 1 3 PHE HE1 H 3.429 7.214 -0.805 1.00 . A A . 3 PHE HE1 1 1 6 686 1 1 3 PHE HE2 H 1.522 5.379 -4.148 1.00 . A A . 3 PHE HE2 1 1 6 687 1 1 3 PHE HZ H 2.479 7.377 -3.071 1.00 . A A . 3 PHE HZ 1 1 6 688 1 1 3 PHE N N 1.066 2.264 1.479 1.00 . A A . 3 PHE N 1 1 6 689 1 1 3 PHE O O 1.569 0.113 -0.923 1.00 . A A . 3 PHE O 1 1 6 690 1 1 4 LEU C C -0.608 -0.903 -2.500 1.00 . A A . 4 LEU C 1 1 6 691 1 1 4 LEU CA C -1.094 -0.650 -1.076 1.00 . A A . 4 LEU CA 1 1 6 692 1 1 4 LEU CB C -2.622 -0.674 -1.034 1.00 . A A . 4 LEU CB 1 1 6 693 1 1 4 LEU CD1 C -3.525 0.964 0.631 1.00 . A A . 4 LEU CD1 1 1 6 694 1 1 4 LEU CD2 C -4.489 -1.339 0.501 1.00 . A A . 4 LEU CD2 1 1 6 695 1 1 4 LEU CG C -3.228 -0.501 0.359 1.00 . A A . 4 LEU CG 1 1 6 696 1 1 4 LEU H H -1.234 1.289 -0.244 1.00 . A A . 4 LEU H 1 1 6 697 1 1 4 LEU HA H -0.715 -1.431 -0.435 1.00 . A A . 4 LEU HA 1 1 6 698 1 1 4 LEU HB2 H -2.991 0.120 -1.667 1.00 . A A . 4 LEU HB2 1 1 6 699 1 1 4 LEU HB3 H -2.959 -1.618 -1.435 1.00 . A A . 4 LEU HB3 1 1 6 700 1 1 4 LEU HD11 H -3.715 1.472 -0.303 1.00 . A A . 4 LEU HD11 1 1 6 701 1 1 4 LEU HD12 H -2.675 1.417 1.120 1.00 . A A . 4 LEU HD12 1 1 6 702 1 1 4 LEU HD13 H -4.392 1.044 1.269 1.00 . A A . 4 LEU HD13 1 1 6 703 1 1 4 LEU HD21 H -4.828 -1.309 1.526 1.00 . A A . 4 LEU HD21 1 1 6 704 1 1 4 LEU HD22 H -4.276 -2.361 0.223 1.00 . A A . 4 LEU HD22 1 1 6 705 1 1 4 LEU HD23 H -5.260 -0.944 -0.144 1.00 . A A . 4 LEU HD23 1 1 6 706 1 1 4 LEU HG H -2.515 -0.837 1.097 1.00 . A A . 4 LEU HG 1 1 6 707 1 1 4 LEU N N -0.595 0.622 -0.569 1.00 . A A . 4 LEU N 1 1 6 708 1 1 4 LEU O O 0.149 -0.109 -3.059 1.00 . A A . 4 LEU O 1 1 6 709 1 1 5 ARG C C -1.806 -3.066 -5.169 1.00 . A A . 5 ARG C 1 1 6 710 1 1 5 ARG CA C -0.660 -2.371 -4.441 1.00 . A A . 5 ARG CA 1 1 6 711 1 1 5 ARG CB C 0.573 -3.278 -4.418 1.00 . A A . 5 ARG CB 1 1 6 712 1 1 5 ARG CD C 2.988 -3.241 -5.108 1.00 . A A . 5 ARG CD 1 1 6 713 1 1 5 ARG CG C 1.553 -2.997 -5.545 1.00 . A A . 5 ARG CG 1 1 6 714 1 1 5 ARG CZ C 4.095 -1.149 -5.794 1.00 . A A . 5 ARG CZ 1 1 6 715 1 1 5 ARG H H -1.650 -2.607 -2.585 1.00 . A A . 5 ARG H 1 1 6 716 1 1 5 ARG HA H -0.415 -1.460 -4.966 1.00 . A A . 5 ARG HA 1 1 6 717 1 1 5 ARG HB2 H 1.090 -3.140 -3.476 1.00 . A A . 5 ARG HB2 1 1 6 718 1 1 5 ARG HB3 H 0.248 -4.310 -4.500 1.00 . A A . 5 ARG HB3 1 1 6 719 1 1 5 ARG HD2 H 3.087 -2.961 -4.069 1.00 . A A . 5 ARG HD2 1 1 6 720 1 1 5 ARG HD3 H 3.211 -4.292 -5.219 1.00 . A A . 5 ARG HD3 1 1 6 721 1 1 5 ARG HE H 4.495 -2.955 -6.545 1.00 . A A . 5 ARG HE 1 1 6 722 1 1 5 ARG HG2 H 1.326 -3.646 -6.377 1.00 . A A . 5 ARG HG2 1 1 6 723 1 1 5 ARG HG3 H 1.449 -1.966 -5.851 1.00 . A A . 5 ARG HG3 1 1 6 724 1 1 5 ARG HH11 H 2.691 -0.922 -4.356 1.00 . A A . 5 ARG HH11 1 1 6 725 1 1 5 ARG HH12 H 3.484 0.534 -4.856 1.00 . A A . 5 ARG HH12 1 1 6 726 1 1 5 ARG HH21 H 5.539 -1.041 -7.204 1.00 . A A . 5 ARG HH21 1 1 6 727 1 1 5 ARG HH22 H 5.100 0.467 -6.473 1.00 . A A . 5 ARG HH22 1 1 6 728 1 1 5 ARG N N -1.049 -2.014 -3.082 1.00 . A A . 5 ARG N 1 1 6 729 1 1 5 ARG NE N 3.941 -2.467 -5.900 1.00 . A A . 5 ARG NE 1 1 6 730 1 1 5 ARG NH1 N 3.363 -0.456 -4.931 1.00 . A A . 5 ARG NH1 1 1 6 731 1 1 5 ARG NH2 N 4.984 -0.523 -6.553 1.00 . A A . 5 ARG NH2 1 1 6 732 1 1 5 ARG O O -1.594 -4.027 -5.909 1.00 . A A . 5 ARG O 1 1 6 733 1 1 6 HIS C C -5.088 -2.052 -6.177 1.00 . A A . 6 HIS C 1 1 6 734 1 1 6 HIS CA C -4.202 -3.145 -5.590 1.00 . A A . 6 HIS CA 1 1 6 735 1 1 6 HIS CB C -4.997 -3.975 -4.581 1.00 . A A . 6 HIS CB 1 1 6 736 1 1 6 HIS CD2 C -5.649 -5.815 -6.290 1.00 . A A . 6 HIS CD2 1 1 6 737 1 1 6 HIS CE1 C -7.643 -6.284 -5.510 1.00 . A A . 6 HIS CE1 1 1 6 738 1 1 6 HIS CG C -5.864 -5.017 -5.217 1.00 . A A . 6 HIS CG 1 1 6 739 1 1 6 HIS H H -3.126 -1.805 -4.354 1.00 . A A . 6 HIS H 1 1 6 740 1 1 6 HIS HA H -3.868 -3.790 -6.389 1.00 . A A . 6 HIS HA 1 1 6 741 1 1 6 HIS HB2 H -4.307 -4.480 -3.916 1.00 . A A . 6 HIS HB2 1 1 6 742 1 1 6 HIS HB3 H -5.636 -3.315 -4.006 1.00 . A A . 6 HIS HB3 1 1 6 743 1 1 6 HIS HD1 H -7.568 -4.927 -3.980 1.00 . A A . 6 HIS HD1 1 1 6 744 1 1 6 HIS HD2 H -4.760 -5.836 -6.905 1.00 . A A . 6 HIS HD2 1 1 6 745 1 1 6 HIS HE1 H -8.618 -6.731 -5.383 1.00 . A A . 6 HIS HE1 1 1 6 746 1 1 6 HIS HE2 H -6.933 -7.208 -7.194 1.00 . A A . 6 HIS HE2 1 1 6 747 1 1 6 HIS N N -3.021 -2.573 -4.954 1.00 . A A . 6 HIS N 1 1 6 748 1 1 6 HIS ND1 N -7.123 -5.335 -4.752 1.00 . A A . 6 HIS ND1 1 1 6 749 1 1 6 HIS NE2 N -6.769 -6.592 -6.450 1.00 . A A . 6 HIS NE2 1 1 6 750 1 1 6 HIS O O -5.647 -1.258 -5.391 1.00 . A A . 6 HIS O 1 1 7 751 1 1 1 HIS C C 2.411 3.719 3.467 1.00 . A A . 1 HIS C 1 1 7 752 1 1 1 HIS CA C 3.062 5.030 3.897 1.00 . A A . 1 HIS CA 1 1 7 753 1 1 1 HIS CB C 4.578 4.951 3.712 1.00 . A A . 1 HIS CB 1 1 7 754 1 1 1 HIS CD2 C 4.751 7.414 2.915 1.00 . A A . 1 HIS CD2 1 1 7 755 1 1 1 HIS CE1 C 6.805 7.818 3.566 1.00 . A A . 1 HIS CE1 1 1 7 756 1 1 1 HIS CG C 5.224 6.284 3.494 1.00 . A A . 1 HIS CG 1 1 7 757 1 1 1 HIS H1 H 1.795 5.676 5.384 1.00 . A A . 1 HIS H1 1 1 7 758 1 1 1 HIS H2 H 3.449 6.057 5.638 1.00 . A A . 1 HIS H2 1 1 7 759 1 1 1 HIS H3 H 2.892 4.450 5.864 1.00 . A A . 1 HIS H3 1 1 7 760 1 1 1 HIS HA H 2.670 5.833 3.291 1.00 . A A . 1 HIS HA 1 1 7 761 1 1 1 HIS HB2 H 5.019 4.509 4.593 1.00 . A A . 1 HIS HB2 1 1 7 762 1 1 1 HIS HB3 H 4.797 4.330 2.856 1.00 . A A . 1 HIS HB3 1 1 7 763 1 1 1 HIS HD1 H 7.123 5.952 4.343 1.00 . A A . 1 HIS HD1 1 1 7 764 1 1 1 HIS HD2 H 3.767 7.552 2.487 1.00 . A A . 1 HIS HD2 1 1 7 765 1 1 1 HIS HE1 H 7.744 8.316 3.753 1.00 . A A . 1 HIS HE1 1 1 7 766 1 1 1 HIS HE2 H 5.670 9.291 2.708 1.00 . A A . 1 HIS HE2 1 1 7 767 1 1 1 HIS N N 2.774 5.330 5.325 1.00 . A A . 1 HIS N 1 1 7 768 1 1 1 HIS ND1 N 6.513 6.571 3.890 1.00 . A A . 1 HIS ND1 1 1 7 769 1 1 1 HIS NE2 N 5.753 8.351 2.973 1.00 . A A . 1 HIS NE2 1 1 7 770 1 1 1 HIS O O 2.915 3.025 2.585 1.00 . A A . 1 HIS O 1 1 7 771 1 1 2 ARG C C 0.004 2.217 2.359 1.00 . A A . 2 ARG C 1 1 7 772 1 1 2 ARG CA C 0.567 2.160 3.775 1.00 . A A . 2 ARG CA 1 1 7 773 1 1 2 ARG CB C -0.565 1.932 4.779 1.00 . A A . 2 ARG CB 1 1 7 774 1 1 2 ARG CD C -0.848 1.958 7.276 1.00 . A A . 2 ARG CD 1 1 7 775 1 1 2 ARG CG C -0.095 1.351 6.103 1.00 . A A . 2 ARG CG 1 1 7 776 1 1 2 ARG CZ C -1.421 0.045 8.720 1.00 . A A . 2 ARG CZ 1 1 7 777 1 1 2 ARG H H 0.934 3.982 4.789 1.00 . A A . 2 ARG H 1 1 7 778 1 1 2 ARG HA H 1.265 1.339 3.840 1.00 . A A . 2 ARG HA 1 1 7 779 1 1 2 ARG HB2 H -1.051 2.876 4.976 1.00 . A A . 2 ARG HB2 1 1 7 780 1 1 2 ARG HB3 H -1.282 1.251 4.346 1.00 . A A . 2 ARG HB3 1 1 7 781 1 1 2 ARG HD2 H -0.455 2.944 7.469 1.00 . A A . 2 ARG HD2 1 1 7 782 1 1 2 ARG HD3 H -1.894 2.033 7.015 1.00 . A A . 2 ARG HD3 1 1 7 783 1 1 2 ARG HE H -0.073 1.448 9.162 1.00 . A A . 2 ARG HE 1 1 7 784 1 1 2 ARG HG2 H -0.262 0.281 6.096 1.00 . A A . 2 ARG HG2 1 1 7 785 1 1 2 ARG HG3 H 0.963 1.557 6.220 1.00 . A A . 2 ARG HG3 1 1 7 786 1 1 2 ARG HH11 H -2.445 0.114 6.977 1.00 . A A . 2 ARG HH11 1 1 7 787 1 1 2 ARG HH12 H -2.829 -1.221 8.011 1.00 . A A . 2 ARG HH12 1 1 7 788 1 1 2 ARG HH21 H -0.577 -0.307 10.523 1.00 . A A . 2 ARG HH21 1 1 7 789 1 1 2 ARG HH22 H -1.770 -1.460 10.024 1.00 . A A . 2 ARG HH22 1 1 7 790 1 1 2 ARG N N 1.287 3.387 4.095 1.00 . A A . 2 ARG N 1 1 7 791 1 1 2 ARG NE N -0.718 1.151 8.487 1.00 . A A . 2 ARG NE 1 1 7 792 1 1 2 ARG NH1 N -2.304 -0.389 7.829 1.00 . A A . 2 ARG NH1 1 1 7 793 1 1 2 ARG NH2 N -1.241 -0.630 9.848 1.00 . A A . 2 ARG NH2 1 1 7 794 1 1 2 ARG O O -1.187 2.457 2.162 1.00 . A A . 2 ARG O 1 1 7 795 1 1 3 PHE C C 0.456 0.625 -0.623 1.00 . A A . 3 PHE C 1 1 7 796 1 1 3 PHE CA C 0.462 2.028 -0.024 1.00 . A A . 3 PHE CA 1 1 7 797 1 1 3 PHE CB C 1.390 2.938 -0.824 1.00 . A A . 3 PHE CB 1 1 7 798 1 1 3 PHE CD1 C 0.963 5.410 -0.769 1.00 . A A . 3 PHE CD1 1 1 7 799 1 1 3 PHE CD2 C -0.167 4.100 -2.411 1.00 . A A . 3 PHE CD2 1 1 7 800 1 1 3 PHE CE1 C 0.344 6.549 -1.247 1.00 . A A . 3 PHE CE1 1 1 7 801 1 1 3 PHE CE2 C -0.790 5.236 -2.893 1.00 . A A . 3 PHE CE2 1 1 7 802 1 1 3 PHE CG C 0.715 4.174 -1.346 1.00 . A A . 3 PHE CG 1 1 7 803 1 1 3 PHE CZ C -0.534 6.462 -2.310 1.00 . A A . 3 PHE CZ 1 1 7 804 1 1 3 PHE H H 1.807 1.815 1.595 1.00 . A A . 3 PHE H 1 1 7 805 1 1 3 PHE HA H -0.535 2.429 -0.068 1.00 . A A . 3 PHE HA 1 1 7 806 1 1 3 PHE HB2 H 2.204 3.250 -0.186 1.00 . A A . 3 PHE HB2 1 1 7 807 1 1 3 PHE HB3 H 1.783 2.388 -1.671 1.00 . A A . 3 PHE HB3 1 1 7 808 1 1 3 PHE HD1 H 1.650 5.479 0.062 1.00 . A A . 3 PHE HD1 1 1 7 809 1 1 3 PHE HD2 H -0.368 3.142 -2.867 1.00 . A A . 3 PHE HD2 1 1 7 810 1 1 3 PHE HE1 H 0.546 7.506 -0.789 1.00 . A A . 3 PHE HE1 1 1 7 811 1 1 3 PHE HE2 H -1.476 5.166 -3.724 1.00 . A A . 3 PHE HE2 1 1 7 812 1 1 3 PHE HZ H -1.019 7.351 -2.685 1.00 . A A . 3 PHE HZ 1 1 7 813 1 1 3 PHE N N 0.870 1.999 1.375 1.00 . A A . 3 PHE N 1 1 7 814 1 1 3 PHE O O 1.426 0.204 -1.253 1.00 . A A . 3 PHE O 1 1 7 815 1 1 4 LEU C C -0.545 -1.490 -2.447 1.00 . A A . 4 LEU C 1 1 7 816 1 1 4 LEU CA C -0.776 -1.453 -0.939 1.00 . A A . 4 LEU CA 1 1 7 817 1 1 4 LEU CB C -2.160 -2.013 -0.610 1.00 . A A . 4 LEU CB 1 1 7 818 1 1 4 LEU CD1 C -3.192 -0.832 1.342 1.00 . A A . 4 LEU CD1 1 1 7 819 1 1 4 LEU CD2 C -3.326 -3.324 1.182 1.00 . A A . 4 LEU CD2 1 1 7 820 1 1 4 LEU CG C -2.482 -2.093 0.883 1.00 . A A . 4 LEU CG 1 1 7 821 1 1 4 LEU H H -1.382 0.293 0.091 1.00 . A A . 4 LEU H 1 1 7 822 1 1 4 LEU HA H -0.029 -2.064 -0.457 1.00 . A A . 4 LEU HA 1 1 7 823 1 1 4 LEU HB2 H -2.901 -1.386 -1.085 1.00 . A A . 4 LEU HB2 1 1 7 824 1 1 4 LEU HB3 H -2.232 -3.007 -1.025 1.00 . A A . 4 LEU HB3 1 1 7 825 1 1 4 LEU HD11 H -3.728 -0.398 0.511 1.00 . A A . 4 LEU HD11 1 1 7 826 1 1 4 LEU HD12 H -2.464 -0.124 1.709 1.00 . A A . 4 LEU HD12 1 1 7 827 1 1 4 LEU HD13 H -3.887 -1.076 2.131 1.00 . A A . 4 LEU HD13 1 1 7 828 1 1 4 LEU HD21 H -4.266 -3.252 0.655 1.00 . A A . 4 LEU HD21 1 1 7 829 1 1 4 LEU HD22 H -3.512 -3.383 2.244 1.00 . A A . 4 LEU HD22 1 1 7 830 1 1 4 LEU HD23 H -2.798 -4.209 0.859 1.00 . A A . 4 LEU HD23 1 1 7 831 1 1 4 LEU HG H -1.559 -2.175 1.438 1.00 . A A . 4 LEU HG 1 1 7 832 1 1 4 LEU N N -0.643 -0.096 -0.421 1.00 . A A . 4 LEU N 1 1 7 833 1 1 4 LEU O O -0.234 -0.471 -3.063 1.00 . A A . 4 LEU O 1 1 7 834 1 1 5 ARG C C -1.850 -2.880 -5.198 1.00 . A A . 5 ARG C 1 1 7 835 1 1 5 ARG CA C -0.509 -2.842 -4.471 1.00 . A A . 5 ARG CA 1 1 7 836 1 1 5 ARG CB C 0.275 -4.125 -4.754 1.00 . A A . 5 ARG CB 1 1 7 837 1 1 5 ARG CD C 0.416 -5.700 -6.709 1.00 . A A . 5 ARG CD 1 1 7 838 1 1 5 ARG CG C 0.671 -4.285 -6.213 1.00 . A A . 5 ARG CG 1 1 7 839 1 1 5 ARG CZ C -1.541 -7.154 -7.069 1.00 . A A . 5 ARG CZ 1 1 7 840 1 1 5 ARG H H -0.949 -3.448 -2.491 1.00 . A A . 5 ARG H 1 1 7 841 1 1 5 ARG HA H 0.058 -1.997 -4.832 1.00 . A A . 5 ARG HA 1 1 7 842 1 1 5 ARG HB2 H 1.179 -4.120 -4.156 1.00 . A A . 5 ARG HB2 1 1 7 843 1 1 5 ARG HB3 H -0.336 -4.976 -4.472 1.00 . A A . 5 ARG HB3 1 1 7 844 1 1 5 ARG HD2 H 0.970 -5.852 -7.624 1.00 . A A . 5 ARG HD2 1 1 7 845 1 1 5 ARG HD3 H 0.760 -6.398 -5.960 1.00 . A A . 5 ARG HD3 1 1 7 846 1 1 5 ARG HE H -1.583 -5.159 -7.073 1.00 . A A . 5 ARG HE 1 1 7 847 1 1 5 ARG HG2 H 0.095 -3.596 -6.810 1.00 . A A . 5 ARG HG2 1 1 7 848 1 1 5 ARG HG3 H 1.723 -4.062 -6.316 1.00 . A A . 5 ARG HG3 1 1 7 849 1 1 5 ARG HH11 H 0.194 -8.146 -6.753 1.00 . A A . 5 ARG HH11 1 1 7 850 1 1 5 ARG HH12 H -1.196 -9.146 -7.009 1.00 . A A . 5 ARG HH12 1 1 7 851 1 1 5 ARG HH21 H -3.412 -6.473 -7.409 1.00 . A A . 5 ARG HH21 1 1 7 852 1 1 5 ARG HH22 H -3.244 -8.196 -7.382 1.00 . A A . 5 ARG HH22 1 1 7 853 1 1 5 ARG N N -0.700 -2.672 -3.036 1.00 . A A . 5 ARG N 1 1 7 854 1 1 5 ARG NE N -1.002 -5.941 -6.968 1.00 . A A . 5 ARG NE 1 1 7 855 1 1 5 ARG NH1 N -0.785 -8.237 -6.932 1.00 . A A . 5 ARG NH1 1 1 7 856 1 1 5 ARG NH2 N -2.839 -7.285 -7.306 1.00 . A A . 5 ARG NH2 1 1 7 857 1 1 5 ARG O O -2.043 -3.662 -6.129 1.00 . A A . 5 ARG O 1 1 7 858 1 1 6 HIS C C -4.616 -0.530 -5.400 1.00 . A A . 6 HIS C 1 1 7 859 1 1 6 HIS CA C -4.099 -1.964 -5.374 1.00 . A A . 6 HIS CA 1 1 7 860 1 1 6 HIS CB C -5.078 -2.859 -4.612 1.00 . A A . 6 HIS CB 1 1 7 861 1 1 6 HIS CD2 C -6.735 -3.640 -6.448 1.00 . A A . 6 HIS CD2 1 1 7 862 1 1 6 HIS CE1 C -8.571 -2.785 -5.607 1.00 . A A . 6 HIS CE1 1 1 7 863 1 1 6 HIS CG C -6.401 -3.013 -5.294 1.00 . A A . 6 HIS CG 1 1 7 864 1 1 6 HIS H H -2.562 -1.430 -4.020 1.00 . A A . 6 HIS H 1 1 7 865 1 1 6 HIS HA H -4.014 -2.322 -6.389 1.00 . A A . 6 HIS HA 1 1 7 866 1 1 6 HIS HB2 H -4.644 -3.845 -4.503 1.00 . A A . 6 HIS HB2 1 1 7 867 1 1 6 HIS HB3 H -5.256 -2.432 -3.631 1.00 . A A . 6 HIS HB3 1 1 7 868 1 1 6 HIS HD1 H -7.661 -1.974 -3.963 1.00 . A A . 6 HIS HD1 1 1 7 869 1 1 6 HIS HD2 H -6.062 -4.165 -7.110 1.00 . A A . 6 HIS HD2 1 1 7 870 1 1 6 HIS HE1 H -9.604 -2.504 -5.468 1.00 . A A . 6 HIS HE1 1 1 7 871 1 1 6 HIS HE2 H -8.626 -3.900 -7.324 1.00 . A A . 6 HIS HE2 1 1 7 872 1 1 6 HIS N N -2.775 -2.029 -4.766 1.00 . A A . 6 HIS N 1 1 7 873 1 1 6 HIS ND1 N -7.573 -2.488 -4.793 1.00 . A A . 6 HIS ND1 1 1 7 874 1 1 6 HIS NE2 N -8.089 -3.482 -6.618 1.00 . A A . 6 HIS NE2 1 1 7 875 1 1 6 HIS O O -4.502 0.121 -6.460 1.00 . A A . 6 HIS O 1 1 8 876 1 1 1 HIS C C 2.813 3.421 3.854 1.00 . A A . 1 HIS C 1 1 8 877 1 1 1 HIS CA C 3.642 4.563 4.434 1.00 . A A . 1 HIS CA 1 1 8 878 1 1 1 HIS CB C 5.132 4.212 4.393 1.00 . A A . 1 HIS CB 1 1 8 879 1 1 1 HIS CD2 C 7.088 4.953 2.858 1.00 . A A . 1 HIS CD2 1 1 8 880 1 1 1 HIS CE1 C 6.504 7.049 2.585 1.00 . A A . 1 HIS CE1 1 1 8 881 1 1 1 HIS CG C 5.944 5.151 3.556 1.00 . A A . 1 HIS CG 1 1 8 882 1 1 1 HIS H1 H 2.362 5.364 5.831 1.00 . A A . 1 HIS H1 1 1 8 883 1 1 1 HIS H2 H 4.020 5.413 6.269 1.00 . A A . 1 HIS H2 1 1 8 884 1 1 1 HIS H3 H 3.158 3.930 6.331 1.00 . A A . 1 HIS H3 1 1 8 885 1 1 1 HIS HA H 3.471 5.454 3.849 1.00 . A A . 1 HIS HA 1 1 8 886 1 1 1 HIS HB2 H 5.528 4.236 5.397 1.00 . A A . 1 HIS HB2 1 1 8 887 1 1 1 HIS HB3 H 5.251 3.217 3.989 1.00 . A A . 1 HIS HB3 1 1 8 888 1 1 1 HIS HD1 H 4.822 6.925 3.744 1.00 . A A . 1 HIS HD1 1 1 8 889 1 1 1 HIS HD2 H 7.640 4.027 2.782 1.00 . A A . 1 HIS HD2 1 1 8 890 1 1 1 HIS HE1 H 6.497 8.080 2.266 1.00 . A A . 1 HIS HE1 1 1 8 891 1 1 1 HIS HE2 H 8.238 6.330 1.767 1.00 . A A . 1 HIS HE2 1 1 8 892 1 1 1 HIS N N 3.261 4.843 5.844 1.00 . A A . 1 HIS N 1 1 8 893 1 1 1 HIS ND1 N 5.606 6.474 3.365 1.00 . A A . 1 HIS ND1 1 1 8 894 1 1 1 HIS NE2 N 7.414 6.148 2.265 1.00 . A A . 1 HIS NE2 1 1 8 895 1 1 1 HIS O O 3.269 2.697 2.969 1.00 . A A . 1 HIS O 1 1 8 896 1 1 2 ARG C C 0.299 2.453 2.433 1.00 . A A . 2 ARG C 1 1 8 897 1 1 2 ARG CA C 0.700 2.213 3.885 1.00 . A A . 2 ARG CA 1 1 8 898 1 1 2 ARG CB C -0.548 2.140 4.767 1.00 . A A . 2 ARG CB 1 1 8 899 1 1 2 ARG CD C -2.796 1.091 5.170 1.00 . A A . 2 ARG CD 1 1 8 900 1 1 2 ARG CG C -1.490 1.006 4.396 1.00 . A A . 2 ARG CG 1 1 8 901 1 1 2 ARG CZ C -3.847 -1.117 4.867 1.00 . A A . 2 ARG CZ 1 1 8 902 1 1 2 ARG H H 1.283 3.875 5.059 1.00 . A A . 2 ARG H 1 1 8 903 1 1 2 ARG HA H 1.231 1.275 3.950 1.00 . A A . 2 ARG HA 1 1 8 904 1 1 2 ARG HB2 H -0.242 2.004 5.794 1.00 . A A . 2 ARG HB2 1 1 8 905 1 1 2 ARG HB3 H -1.090 3.071 4.682 1.00 . A A . 2 ARG HB3 1 1 8 906 1 1 2 ARG HD2 H -2.654 1.739 6.022 1.00 . A A . 2 ARG HD2 1 1 8 907 1 1 2 ARG HD3 H -3.555 1.508 4.524 1.00 . A A . 2 ARG HD3 1 1 8 908 1 1 2 ARG HE H -3.080 -0.440 6.581 1.00 . A A . 2 ARG HE 1 1 8 909 1 1 2 ARG HG2 H -1.707 1.062 3.337 1.00 . A A . 2 ARG HG2 1 1 8 910 1 1 2 ARG HG3 H -1.008 0.062 4.623 1.00 . A A . 2 ARG HG3 1 1 8 911 1 1 2 ARG HH11 H -3.801 0.024 3.198 1.00 . A A . 2 ARG HH11 1 1 8 912 1 1 2 ARG HH12 H -4.536 -1.533 3.013 1.00 . A A . 2 ARG HH12 1 1 8 913 1 1 2 ARG HH21 H -4.046 -2.488 6.339 1.00 . A A . 2 ARG HH21 1 1 8 914 1 1 2 ARG HH22 H -4.675 -2.959 4.796 1.00 . A A . 2 ARG HH22 1 1 8 915 1 1 2 ARG N N 1.592 3.266 4.356 1.00 . A A . 2 ARG N 1 1 8 916 1 1 2 ARG NE N -3.241 -0.219 5.640 1.00 . A A . 2 ARG NE 1 1 8 917 1 1 2 ARG NH1 N -4.080 -0.853 3.588 1.00 . A A . 2 ARG NH1 1 1 8 918 1 1 2 ARG NH2 N -4.220 -2.284 5.376 1.00 . A A . 2 ARG NH2 1 1 8 919 1 1 2 ARG O O -0.801 2.930 2.153 1.00 . A A . 2 ARG O 1 1 8 920 1 1 3 PHE C C 0.341 1.039 -0.519 1.00 . A A . 3 PHE C 1 1 8 921 1 1 3 PHE CA C 0.942 2.301 0.091 1.00 . A A . 3 PHE CA 1 1 8 922 1 1 3 PHE CB C 2.231 2.675 -0.635 1.00 . A A . 3 PHE CB 1 1 8 923 1 1 3 PHE CD1 C 2.243 5.172 -0.383 1.00 . A A . 3 PHE CD1 1 1 8 924 1 1 3 PHE CD2 C 2.166 4.255 -2.584 1.00 . A A . 3 PHE CD2 1 1 8 925 1 1 3 PHE CE1 C 2.226 6.449 -0.911 1.00 . A A . 3 PHE CE1 1 1 8 926 1 1 3 PHE CE2 C 2.148 5.529 -3.118 1.00 . A A . 3 PHE CE2 1 1 8 927 1 1 3 PHE CG C 2.213 4.062 -1.213 1.00 . A A . 3 PHE CG 1 1 8 928 1 1 3 PHE CZ C 2.179 6.628 -2.280 1.00 . A A . 3 PHE CZ 1 1 8 929 1 1 3 PHE H H 2.059 1.746 1.801 1.00 . A A . 3 PHE H 1 1 8 930 1 1 3 PHE HA H 0.239 3.109 -0.016 1.00 . A A . 3 PHE HA 1 1 8 931 1 1 3 PHE HB2 H 3.053 2.620 0.064 1.00 . A A . 3 PHE HB2 1 1 8 932 1 1 3 PHE HB3 H 2.397 1.977 -1.446 1.00 . A A . 3 PHE HB3 1 1 8 933 1 1 3 PHE HD1 H 2.281 5.032 0.687 1.00 . A A . 3 PHE HD1 1 1 8 934 1 1 3 PHE HD2 H 2.142 3.397 -3.239 1.00 . A A . 3 PHE HD2 1 1 8 935 1 1 3 PHE HE1 H 2.250 7.305 -0.255 1.00 . A A . 3 PHE HE1 1 1 8 936 1 1 3 PHE HE2 H 2.111 5.667 -4.188 1.00 . A A . 3 PHE HE2 1 1 8 937 1 1 3 PHE HZ H 2.166 7.625 -2.695 1.00 . A A . 3 PHE HZ 1 1 8 938 1 1 3 PHE N N 1.200 2.121 1.515 1.00 . A A . 3 PHE N 1 1 8 939 1 1 3 PHE O O 1.063 0.167 -1.003 1.00 . A A . 3 PHE O 1 1 8 940 1 1 4 LEU C C -1.289 -0.451 -2.495 1.00 . A A . 4 LEU C 1 1 8 941 1 1 4 LEU CA C -1.685 -0.207 -1.041 1.00 . A A . 4 LEU CA 1 1 8 942 1 1 4 LEU CB C -3.198 -0.008 -0.940 1.00 . A A . 4 LEU CB 1 1 8 943 1 1 4 LEU CD1 C -3.795 1.644 0.845 1.00 . A A . 4 LEU CD1 1 1 8 944 1 1 4 LEU CD2 C -5.097 -0.480 0.628 1.00 . A A . 4 LEU CD2 1 1 8 945 1 1 4 LEU CG C -3.729 0.170 0.483 1.00 . A A . 4 LEU CG 1 1 8 946 1 1 4 LEU H H -1.506 1.675 -0.092 1.00 . A A . 4 LEU H 1 1 8 947 1 1 4 LEU HA H -1.407 -1.069 -0.455 1.00 . A A . 4 LEU HA 1 1 8 948 1 1 4 LEU HB2 H -3.464 0.868 -1.515 1.00 . A A . 4 LEU HB2 1 1 8 949 1 1 4 LEU HB3 H -3.684 -0.867 -1.377 1.00 . A A . 4 LEU HB3 1 1 8 950 1 1 4 LEU HD11 H -3.929 2.229 -0.053 1.00 . A A . 4 LEU HD11 1 1 8 951 1 1 4 LEU HD12 H -2.875 1.935 1.330 1.00 . A A . 4 LEU HD12 1 1 8 952 1 1 4 LEU HD13 H -4.625 1.814 1.514 1.00 . A A . 4 LEU HD13 1 1 8 953 1 1 4 LEU HD21 H -5.517 -0.223 1.589 1.00 . A A . 4 LEU HD21 1 1 8 954 1 1 4 LEU HD22 H -4.996 -1.552 0.554 1.00 . A A . 4 LEU HD22 1 1 8 955 1 1 4 LEU HD23 H -5.749 -0.124 -0.156 1.00 . A A . 4 LEU HD23 1 1 8 956 1 1 4 LEU HG H -3.052 -0.311 1.173 1.00 . A A . 4 LEU HG 1 1 8 957 1 1 4 LEU N N -0.985 0.948 -0.492 1.00 . A A . 4 LEU N 1 1 8 958 1 1 4 LEU O O -1.059 0.492 -3.252 1.00 . A A . 4 LEU O 1 1 8 959 1 1 5 ARG C C -1.804 -3.135 -4.798 1.00 . A A . 5 ARG C 1 1 8 960 1 1 5 ARG CA C -0.846 -2.089 -4.239 1.00 . A A . 5 ARG CA 1 1 8 961 1 1 5 ARG CB C 0.588 -2.621 -4.277 1.00 . A A . 5 ARG CB 1 1 8 962 1 1 5 ARG CD C 2.747 -2.718 -5.559 1.00 . A A . 5 ARG CD 1 1 8 963 1 1 5 ARG CG C 1.245 -2.500 -5.642 1.00 . A A . 5 ARG CG 1 1 8 964 1 1 5 ARG CZ C 4.760 -1.409 -5.006 1.00 . A A . 5 ARG CZ 1 1 8 965 1 1 5 ARG H H -1.409 -2.429 -2.228 1.00 . A A . 5 ARG H 1 1 8 966 1 1 5 ARG HA H -0.906 -1.200 -4.850 1.00 . A A . 5 ARG HA 1 1 8 967 1 1 5 ARG HB2 H 1.185 -2.066 -3.563 1.00 . A A . 5 ARG HB2 1 1 8 968 1 1 5 ARG HB3 H 0.578 -3.669 -3.997 1.00 . A A . 5 ARG HB3 1 1 8 969 1 1 5 ARG HD2 H 2.938 -3.580 -4.938 1.00 . A A . 5 ARG HD2 1 1 8 970 1 1 5 ARG HD3 H 3.126 -2.901 -6.554 1.00 . A A . 5 ARG HD3 1 1 8 971 1 1 5 ARG HE H 2.888 -0.865 -4.579 1.00 . A A . 5 ARG HE 1 1 8 972 1 1 5 ARG HG2 H 0.819 -3.241 -6.303 1.00 . A A . 5 ARG HG2 1 1 8 973 1 1 5 ARG HG3 H 1.054 -1.512 -6.036 1.00 . A A . 5 ARG HG3 1 1 8 974 1 1 5 ARG HH11 H 5.130 -3.152 -5.963 1.00 . A A . 5 ARG HH11 1 1 8 975 1 1 5 ARG HH12 H 6.529 -2.213 -5.563 1.00 . A A . 5 ARG HH12 1 1 8 976 1 1 5 ARG HH21 H 4.726 0.372 -4.052 1.00 . A A . 5 ARG HH21 1 1 8 977 1 1 5 ARG HH22 H 6.300 -0.212 -4.478 1.00 . A A . 5 ARG HH22 1 1 8 978 1 1 5 ARG N N -1.213 -1.721 -2.877 1.00 . A A . 5 ARG N 1 1 8 979 1 1 5 ARG NE N 3.437 -1.563 -4.992 1.00 . A A . 5 ARG NE 1 1 8 980 1 1 5 ARG NH1 N 5.536 -2.334 -5.556 1.00 . A A . 5 ARG NH1 1 1 8 981 1 1 5 ARG NH2 N 5.307 -0.328 -4.468 1.00 . A A . 5 ARG NH2 1 1 8 982 1 1 5 ARG O O -1.589 -4.337 -4.639 1.00 . A A . 5 ARG O 1 1 8 983 1 1 6 HIS C C -4.869 -2.789 -6.868 1.00 . A A . 6 HIS C 1 1 8 984 1 1 6 HIS CA C -3.855 -3.567 -6.035 1.00 . A A . 6 HIS CA 1 1 8 985 1 1 6 HIS CB C -4.574 -4.349 -4.935 1.00 . A A . 6 HIS CB 1 1 8 986 1 1 6 HIS CD2 C -5.069 -6.270 -6.607 1.00 . A A . 6 HIS CD2 1 1 8 987 1 1 6 HIS CE1 C -6.194 -7.585 -5.261 1.00 . A A . 6 HIS CE1 1 1 8 988 1 1 6 HIS CG C -5.127 -5.662 -5.398 1.00 . A A . 6 HIS CG 1 1 8 989 1 1 6 HIS H H -2.981 -1.703 -5.547 1.00 . A A . 6 HIS H 1 1 8 990 1 1 6 HIS HA H -3.337 -4.262 -6.678 1.00 . A A . 6 HIS HA 1 1 8 991 1 1 6 HIS HB2 H -3.878 -4.549 -4.130 1.00 . A A . 6 HIS HB2 1 1 8 992 1 1 6 HIS HB3 H -5.399 -3.754 -4.560 1.00 . A A . 6 HIS HB3 1 1 8 993 1 1 6 HIS HD1 H -6.052 -6.351 -3.635 1.00 . A A . 6 HIS HD1 1 1 8 994 1 1 6 HIS HD2 H -4.585 -5.888 -7.495 1.00 . A A . 6 HIS HD2 1 1 8 995 1 1 6 HIS HE1 H -6.761 -8.420 -4.876 1.00 . A A . 6 HIS HE1 1 1 8 996 1 1 6 HIS HE2 H -5.788 -8.156 -7.185 1.00 . A A . 6 HIS HE2 1 1 8 997 1 1 6 HIS N N -2.863 -2.671 -5.453 1.00 . A A . 6 HIS N 1 1 8 998 1 1 6 HIS ND1 N -5.839 -6.511 -4.578 1.00 . A A . 6 HIS ND1 1 1 8 999 1 1 6 HIS NE2 N -5.740 -7.463 -6.494 1.00 . A A . 6 HIS NE2 1 1 8 1000 1 1 6 HIS O O -5.121 -3.195 -8.022 1.00 . A A . 6 HIS O 1 1 9 1001 1 1 1 HIS C C 2.619 3.896 3.775 1.00 . A A . 1 HIS C 1 1 9 1002 1 1 1 HIS CA C 3.034 5.239 4.368 1.00 . A A . 1 HIS CA 1 1 9 1003 1 1 1 HIS CB C 4.454 5.595 3.926 1.00 . A A . 1 HIS CB 1 1 9 1004 1 1 1 HIS CD2 C 6.053 4.815 5.814 1.00 . A A . 1 HIS CD2 1 1 9 1005 1 1 1 HIS CE1 C 7.019 3.159 4.751 1.00 . A A . 1 HIS CE1 1 1 9 1006 1 1 1 HIS CG C 5.511 4.756 4.574 1.00 . A A . 1 HIS CG 1 1 9 1007 1 1 1 HIS H1 H 1.997 5.238 6.145 1.00 . A A . 1 HIS H1 1 1 9 1008 1 1 1 HIS H2 H 3.515 6.036 6.202 1.00 . A A . 1 HIS H2 1 1 9 1009 1 1 1 HIS H3 H 3.445 4.322 6.163 1.00 . A A . 1 HIS H3 1 1 9 1010 1 1 1 HIS HA H 2.352 6.001 4.022 1.00 . A A . 1 HIS HA 1 1 9 1011 1 1 1 HIS HB2 H 4.535 5.463 2.857 1.00 . A A . 1 HIS HB2 1 1 9 1012 1 1 1 HIS HB3 H 4.651 6.629 4.172 1.00 . A A . 1 HIS HB3 1 1 9 1013 1 1 1 HIS HD1 H 5.964 3.411 3.016 1.00 . A A . 1 HIS HD1 1 1 9 1014 1 1 1 HIS HD2 H 5.798 5.520 6.592 1.00 . A A . 1 HIS HD2 1 1 9 1015 1 1 1 HIS HE1 H 7.658 2.319 4.520 1.00 . A A . 1 HIS HE1 1 1 9 1016 1 1 1 HIS HE2 H 7.603 3.669 6.646 1.00 . A A . 1 HIS HE2 1 1 9 1017 1 1 1 HIS N N 2.994 5.205 5.853 1.00 . A A . 1 HIS N 1 1 9 1018 1 1 1 HIS ND1 N 6.139 3.708 3.933 1.00 . A A . 1 HIS ND1 1 1 9 1019 1 1 1 HIS NE2 N 6.987 3.812 5.897 1.00 . A A . 1 HIS NE2 1 1 9 1020 1 1 1 HIS O O 3.192 3.441 2.785 1.00 . A A . 1 HIS O 1 1 9 1021 1 1 2 ARG C C 0.499 2.113 2.531 1.00 . A A . 2 ARG C 1 1 9 1022 1 1 2 ARG CA C 1.126 1.980 3.914 1.00 . A A . 2 ARG CA 1 1 9 1023 1 1 2 ARG CB C 0.103 1.410 4.899 1.00 . A A . 2 ARG CB 1 1 9 1024 1 1 2 ARG CD C -0.294 -0.703 6.198 1.00 . A A . 2 ARG CD 1 1 9 1025 1 1 2 ARG CG C -0.035 -0.102 4.826 1.00 . A A . 2 ARG CG 1 1 9 1026 1 1 2 ARG CZ C -2.207 -1.687 7.400 1.00 . A A . 2 ARG CZ 1 1 9 1027 1 1 2 ARG H H 1.201 3.683 5.168 1.00 . A A . 2 ARG H 1 1 9 1028 1 1 2 ARG HA H 1.967 1.305 3.852 1.00 . A A . 2 ARG HA 1 1 9 1029 1 1 2 ARG HB2 H 0.400 1.676 5.903 1.00 . A A . 2 ARG HB2 1 1 9 1030 1 1 2 ARG HB3 H -0.862 1.849 4.691 1.00 . A A . 2 ARG HB3 1 1 9 1031 1 1 2 ARG HD2 H 0.196 -1.663 6.255 1.00 . A A . 2 ARG HD2 1 1 9 1032 1 1 2 ARG HD3 H 0.118 -0.045 6.949 1.00 . A A . 2 ARG HD3 1 1 9 1033 1 1 2 ARG HE H -2.349 -0.379 5.899 1.00 . A A . 2 ARG HE 1 1 9 1034 1 1 2 ARG HG2 H -0.864 -0.347 4.175 1.00 . A A . 2 ARG HG2 1 1 9 1035 1 1 2 ARG HG3 H 0.882 -0.518 4.427 1.00 . A A . 2 ARG HG3 1 1 9 1036 1 1 2 ARG HH11 H -0.397 -2.311 8.053 1.00 . A A . 2 ARG HH11 1 1 9 1037 1 1 2 ARG HH12 H -1.759 -2.988 8.881 1.00 . A A . 2 ARG HH12 1 1 9 1038 1 1 2 ARG HH21 H -4.141 -1.268 6.988 1.00 . A A . 2 ARG HH21 1 1 9 1039 1 1 2 ARG HH22 H -3.884 -2.397 8.276 1.00 . A A . 2 ARG HH22 1 1 9 1040 1 1 2 ARG N N 1.619 3.269 4.385 1.00 . A A . 2 ARG N 1 1 9 1041 1 1 2 ARG NE N -1.721 -0.883 6.457 1.00 . A A . 2 ARG NE 1 1 9 1042 1 1 2 ARG NH1 N -1.387 -2.386 8.175 1.00 . A A . 2 ARG NH1 1 1 9 1043 1 1 2 ARG NH2 N -3.518 -1.793 7.568 1.00 . A A . 2 ARG NH2 1 1 9 1044 1 1 2 ARG O O -0.723 2.177 2.395 1.00 . A A . 2 ARG O 1 1 9 1045 1 1 3 PHE C C 0.606 0.921 -0.485 1.00 . A A . 3 PHE C 1 1 9 1046 1 1 3 PHE CA C 0.876 2.289 0.133 1.00 . A A . 3 PHE CA 1 1 9 1047 1 1 3 PHE CB C 1.900 3.052 -0.703 1.00 . A A . 3 PHE CB 1 1 9 1048 1 1 3 PHE CD1 C 1.246 5.425 -0.217 1.00 . A A . 3 PHE CD1 1 1 9 1049 1 1 3 PHE CD2 C 1.157 4.665 -2.476 1.00 . A A . 3 PHE CD2 1 1 9 1050 1 1 3 PHE CE1 C 0.809 6.674 -0.616 1.00 . A A . 3 PHE CE1 1 1 9 1051 1 1 3 PHE CE2 C 0.720 5.912 -2.881 1.00 . A A . 3 PHE CE2 1 1 9 1052 1 1 3 PHE CG C 1.424 4.408 -1.141 1.00 . A A . 3 PHE CG 1 1 9 1053 1 1 3 PHE CZ C 0.545 6.917 -1.950 1.00 . A A . 3 PHE CZ 1 1 9 1054 1 1 3 PHE H H 2.308 2.106 1.679 1.00 . A A . 3 PHE H 1 1 9 1055 1 1 3 PHE HA H -0.042 2.851 0.151 1.00 . A A . 3 PHE HA 1 1 9 1056 1 1 3 PHE HB2 H 2.793 3.191 -0.113 1.00 . A A . 3 PHE HB2 1 1 9 1057 1 1 3 PHE HB3 H 2.136 2.477 -1.590 1.00 . A A . 3 PHE HB3 1 1 9 1058 1 1 3 PHE HD1 H 1.452 5.235 0.827 1.00 . A A . 3 PHE HD1 1 1 9 1059 1 1 3 PHE HD2 H 1.293 3.880 -3.204 1.00 . A A . 3 PHE HD2 1 1 9 1060 1 1 3 PHE HE1 H 0.673 7.458 0.114 1.00 . A A . 3 PHE HE1 1 1 9 1061 1 1 3 PHE HE2 H 0.515 6.100 -3.925 1.00 . A A . 3 PHE HE2 1 1 9 1062 1 1 3 PHE HZ H 0.204 7.893 -2.265 1.00 . A A . 3 PHE HZ 1 1 9 1063 1 1 3 PHE N N 1.345 2.159 1.507 1.00 . A A . 3 PHE N 1 1 9 1064 1 1 3 PHE O O 1.460 0.359 -1.171 1.00 . A A . 3 PHE O 1 1 9 1065 1 1 4 LEU C C -0.820 -0.956 -2.283 1.00 . A A . 4 LEU C 1 1 9 1066 1 1 4 LEU CA C -0.971 -0.914 -0.766 1.00 . A A . 4 LEU CA 1 1 9 1067 1 1 4 LEU CB C -2.413 -1.241 -0.376 1.00 . A A . 4 LEU CB 1 1 9 1068 1 1 4 LEU CD1 C -3.139 0.052 1.642 1.00 . A A . 4 LEU CD1 1 1 9 1069 1 1 4 LEU CD2 C -3.697 -2.379 1.453 1.00 . A A . 4 LEU CD2 1 1 9 1070 1 1 4 LEU CG C -2.673 -1.301 1.129 1.00 . A A . 4 LEU CG 1 1 9 1071 1 1 4 LEU H H -1.224 0.885 0.319 1.00 . A A . 4 LEU H 1 1 9 1072 1 1 4 LEU HA H -0.316 -1.652 -0.329 1.00 . A A . 4 LEU HA 1 1 9 1073 1 1 4 LEU HB2 H -3.059 -0.489 -0.804 1.00 . A A . 4 LEU HB2 1 1 9 1074 1 1 4 LEU HB3 H -2.671 -2.199 -0.802 1.00 . A A . 4 LEU HB3 1 1 9 1075 1 1 4 LEU HD11 H -3.826 -0.091 2.462 1.00 . A A . 4 LEU HD11 1 1 9 1076 1 1 4 LEU HD12 H -3.635 0.586 0.845 1.00 . A A . 4 LEU HD12 1 1 9 1077 1 1 4 LEU HD13 H -2.286 0.620 1.980 1.00 . A A . 4 LEU HD13 1 1 9 1078 1 1 4 LEU HD21 H -4.291 -2.069 2.300 1.00 . A A . 4 LEU HD21 1 1 9 1079 1 1 4 LEU HD22 H -3.187 -3.301 1.689 1.00 . A A . 4 LEU HD22 1 1 9 1080 1 1 4 LEU HD23 H -4.341 -2.532 0.599 1.00 . A A . 4 LEU HD23 1 1 9 1081 1 1 4 LEU HG H -1.752 -1.548 1.636 1.00 . A A . 4 LEU HG 1 1 9 1082 1 1 4 LEU N N -0.587 0.389 -0.236 1.00 . A A . 4 LEU N 1 1 9 1083 1 1 4 LEU O O -0.370 0.010 -2.899 1.00 . A A . 4 LEU O 1 1 9 1084 1 1 5 ARG C C -2.295 -3.037 -4.862 1.00 . A A . 5 ARG C 1 1 9 1085 1 1 5 ARG CA C -1.105 -2.248 -4.326 1.00 . A A . 5 ARG CA 1 1 9 1086 1 1 5 ARG CB C 0.199 -2.958 -4.695 1.00 . A A . 5 ARG CB 1 1 9 1087 1 1 5 ARG CD C 1.504 -3.959 -6.595 1.00 . A A . 5 ARG CD 1 1 9 1088 1 1 5 ARG CG C 0.549 -2.855 -6.171 1.00 . A A . 5 ARG CG 1 1 9 1089 1 1 5 ARG CZ C 3.553 -2.641 -6.964 1.00 . A A . 5 ARG CZ 1 1 9 1090 1 1 5 ARG H H -1.549 -2.817 -2.336 1.00 . A A . 5 ARG H 1 1 9 1091 1 1 5 ARG HA H -1.108 -1.266 -4.773 1.00 . A A . 5 ARG HA 1 1 9 1092 1 1 5 ARG HB2 H 1.009 -2.519 -4.124 1.00 . A A . 5 ARG HB2 1 1 9 1093 1 1 5 ARG HB3 H 0.110 -4.007 -4.440 1.00 . A A . 5 ARG HB3 1 1 9 1094 1 1 5 ARG HD2 H 1.259 -4.859 -6.051 1.00 . A A . 5 ARG HD2 1 1 9 1095 1 1 5 ARG HD3 H 1.383 -4.135 -7.654 1.00 . A A . 5 ARG HD3 1 1 9 1096 1 1 5 ARG HE H 3.369 -4.123 -5.640 1.00 . A A . 5 ARG HE 1 1 9 1097 1 1 5 ARG HG2 H -0.358 -2.935 -6.752 1.00 . A A . 5 ARG HG2 1 1 9 1098 1 1 5 ARG HG3 H 1.014 -1.898 -6.355 1.00 . A A . 5 ARG HG3 1 1 9 1099 1 1 5 ARG HH11 H 1.993 -2.111 -8.137 1.00 . A A . 5 ARG HH11 1 1 9 1100 1 1 5 ARG HH12 H 3.445 -1.199 -8.377 1.00 . A A . 5 ARG HH12 1 1 9 1101 1 1 5 ARG HH21 H 5.280 -2.925 -5.954 1.00 . A A . 5 ARG HH21 1 1 9 1102 1 1 5 ARG HH22 H 5.312 -1.661 -7.138 1.00 . A A . 5 ARG HH22 1 1 9 1103 1 1 5 ARG N N -1.198 -2.082 -2.880 1.00 . A A . 5 ARG N 1 1 9 1104 1 1 5 ARG NE N 2.897 -3.610 -6.329 1.00 . A A . 5 ARG NE 1 1 9 1105 1 1 5 ARG NH1 N 2.947 -1.925 -7.903 1.00 . A A . 5 ARG NH1 1 1 9 1106 1 1 5 ARG NH2 N 4.819 -2.388 -6.660 1.00 . A A . 5 ARG NH2 1 1 9 1107 1 1 5 ARG O O -2.376 -4.253 -4.688 1.00 . A A . 5 ARG O 1 1 9 1108 1 1 6 HIS C C -4.742 -2.379 -7.441 1.00 . A A . 6 HIS C 1 1 9 1109 1 1 6 HIS CA C -4.403 -2.971 -6.077 1.00 . A A . 6 HIS CA 1 1 9 1110 1 1 6 HIS CB C -5.592 -2.808 -5.128 1.00 . A A . 6 HIS CB 1 1 9 1111 1 1 6 HIS CD2 C -7.147 -0.732 -5.138 1.00 . A A . 6 HIS CD2 1 1 9 1112 1 1 6 HIS CE1 C -5.748 0.720 -4.280 1.00 . A A . 6 HIS CE1 1 1 9 1113 1 1 6 HIS CG C -5.983 -1.381 -4.899 1.00 . A A . 6 HIS CG 1 1 9 1114 1 1 6 HIS H H -3.096 -1.370 -5.621 1.00 . A A . 6 HIS H 1 1 9 1115 1 1 6 HIS HA H -4.191 -4.023 -6.197 1.00 . A A . 6 HIS HA 1 1 9 1116 1 1 6 HIS HB2 H -6.449 -3.324 -5.545 1.00 . A A . 6 HIS HB2 1 1 9 1117 1 1 6 HIS HB3 H -5.340 -3.244 -4.168 1.00 . A A . 6 HIS HB3 1 1 9 1118 1 1 6 HIS HD1 H -4.202 -0.606 -4.082 1.00 . A A . 6 HIS HD1 1 1 9 1119 1 1 6 HIS HD2 H -8.046 -1.161 -5.560 1.00 . A A . 6 HIS HD2 1 1 9 1120 1 1 6 HIS HE1 H -5.323 1.637 -3.898 1.00 . A A . 6 HIS HE1 1 1 9 1121 1 1 6 HIS HE2 H -7.675 1.256 -4.717 1.00 . A A . 6 HIS HE2 1 1 9 1122 1 1 6 HIS N N -3.217 -2.336 -5.515 1.00 . A A . 6 HIS N 1 1 9 1123 1 1 6 HIS ND1 N -5.127 -0.443 -4.362 1.00 . A A . 6 HIS ND1 1 1 9 1124 1 1 6 HIS NE2 N -6.974 0.572 -4.745 1.00 . A A . 6 HIS NE2 1 1 9 1125 1 1 6 HIS O O -4.627 -1.145 -7.595 1.00 . A A . 6 HIS O 1 1 10 1126 1 1 1 HIS C C 2.971 3.328 3.811 1.00 . A A . 1 HIS C 1 1 10 1127 1 1 1 HIS CA C 3.866 4.435 4.360 1.00 . A A . 1 HIS CA 1 1 10 1128 1 1 1 HIS CB C 5.341 4.081 4.150 1.00 . A A . 1 HIS CB 1 1 10 1129 1 1 1 HIS CD2 C 5.979 5.288 1.944 1.00 . A A . 1 HIS CD2 1 1 10 1130 1 1 1 HIS CE1 C 7.493 6.652 2.753 1.00 . A A . 1 HIS CE1 1 1 10 1131 1 1 1 HIS CG C 6.070 5.052 3.275 1.00 . A A . 1 HIS CG 1 1 10 1132 1 1 1 HIS H1 H 3.569 3.709 6.262 1.00 . A A . 1 HIS H1 1 1 10 1133 1 1 1 HIS H2 H 2.741 5.172 5.917 1.00 . A A . 1 HIS H2 1 1 10 1134 1 1 1 HIS H3 H 4.435 5.186 6.189 1.00 . A A . 1 HIS H3 1 1 10 1135 1 1 1 HIS HA H 3.645 5.356 3.840 1.00 . A A . 1 HIS HA 1 1 10 1136 1 1 1 HIS HB2 H 5.838 4.060 5.108 1.00 . A A . 1 HIS HB2 1 1 10 1137 1 1 1 HIS HB3 H 5.409 3.104 3.694 1.00 . A A . 1 HIS HB3 1 1 10 1138 1 1 1 HIS HD1 H 7.322 5.996 4.683 1.00 . A A . 1 HIS HD1 1 1 10 1139 1 1 1 HIS HD2 H 5.324 4.784 1.247 1.00 . A A . 1 HIS HD2 1 1 10 1140 1 1 1 HIS HE1 H 8.252 7.417 2.829 1.00 . A A . 1 HIS HE1 1 1 10 1141 1 1 1 HIS HE2 H 7.089 6.607 0.745 1.00 . A A . 1 HIS HE2 1 1 10 1142 1 1 1 HIS N N 3.632 4.644 5.813 1.00 . A A . 1 HIS N 1 1 10 1143 1 1 1 HIS ND1 N 7.028 5.923 3.751 1.00 . A A . 1 HIS ND1 1 1 10 1144 1 1 1 HIS NE2 N 6.873 6.286 1.646 1.00 . A A . 1 HIS NE2 1 1 10 1145 1 1 1 HIS O O 3.340 2.630 2.866 1.00 . A A . 1 HIS O 1 1 10 1146 1 1 2 ARG C C 0.301 2.470 2.590 1.00 . A A . 2 ARG C 1 1 10 1147 1 1 2 ARG CA C 0.847 2.152 3.979 1.00 . A A . 2 ARG CA 1 1 10 1148 1 1 2 ARG CB C -0.304 2.040 4.981 1.00 . A A . 2 ARG CB 1 1 10 1149 1 1 2 ARG CD C -0.526 1.635 7.452 1.00 . A A . 2 ARG CD 1 1 10 1150 1 1 2 ARG CG C -0.021 1.084 6.128 1.00 . A A . 2 ARG CG 1 1 10 1151 1 1 2 ARG CZ C -2.971 1.395 7.260 1.00 . A A . 2 ARG CZ 1 1 10 1152 1 1 2 ARG H H 1.557 3.762 5.156 1.00 . A A . 2 ARG H 1 1 10 1153 1 1 2 ARG HA H 1.371 1.210 3.939 1.00 . A A . 2 ARG HA 1 1 10 1154 1 1 2 ARG HB2 H -0.502 3.018 5.395 1.00 . A A . 2 ARG HB2 1 1 10 1155 1 1 2 ARG HB3 H -1.186 1.695 4.461 1.00 . A A . 2 ARG HB3 1 1 10 1156 1 1 2 ARG HD2 H -0.513 0.843 8.185 1.00 . A A . 2 ARG HD2 1 1 10 1157 1 1 2 ARG HD3 H 0.133 2.430 7.770 1.00 . A A . 2 ARG HD3 1 1 10 1158 1 1 2 ARG HE H -1.995 3.134 7.334 1.00 . A A . 2 ARG HE 1 1 10 1159 1 1 2 ARG HG2 H -0.518 0.142 5.930 1.00 . A A . 2 ARG HG2 1 1 10 1160 1 1 2 ARG HG3 H 1.049 0.926 6.197 1.00 . A A . 2 ARG HG3 1 1 10 1161 1 1 2 ARG HH11 H -1.961 -0.356 7.342 1.00 . A A . 2 ARG HH11 1 1 10 1162 1 1 2 ARG HH12 H -3.681 -0.497 7.207 1.00 . A A . 2 ARG HH12 1 1 10 1163 1 1 2 ARG HH21 H -4.257 2.950 7.156 1.00 . A A . 2 ARG HH21 1 1 10 1164 1 1 2 ARG HH22 H -4.985 1.379 7.100 1.00 . A A . 2 ARG HH22 1 1 10 1165 1 1 2 ARG N N 1.794 3.174 4.409 1.00 . A A . 2 ARG N 1 1 10 1166 1 1 2 ARG NE N -1.885 2.160 7.344 1.00 . A A . 2 ARG NE 1 1 10 1167 1 1 2 ARG NH1 N -2.862 0.072 7.270 1.00 . A A . 2 ARG NH1 1 1 10 1168 1 1 2 ARG NH2 N -4.169 1.954 7.164 1.00 . A A . 2 ARG NH2 1 1 10 1169 1 1 2 ARG O O -0.842 2.906 2.445 1.00 . A A . 2 ARG O 1 1 10 1170 1 1 3 PHE C C 0.147 1.263 -0.457 1.00 . A A . 3 PHE C 1 1 10 1171 1 1 3 PHE CA C 0.727 2.515 0.195 1.00 . A A . 3 PHE CA 1 1 10 1172 1 1 3 PHE CB C 1.919 3.024 -0.611 1.00 . A A . 3 PHE CB 1 1 10 1173 1 1 3 PHE CD1 C 1.813 5.490 -0.164 1.00 . A A . 3 PHE CD1 1 1 10 1174 1 1 3 PHE CD2 C 1.578 4.735 -2.414 1.00 . A A . 3 PHE CD2 1 1 10 1175 1 1 3 PHE CE1 C 1.673 6.799 -0.585 1.00 . A A . 3 PHE CE1 1 1 10 1176 1 1 3 PHE CE2 C 1.437 6.041 -2.841 1.00 . A A . 3 PHE CE2 1 1 10 1177 1 1 3 PHE CG C 1.767 4.445 -1.073 1.00 . A A . 3 PHE CG 1 1 10 1178 1 1 3 PHE CZ C 1.485 7.075 -1.926 1.00 . A A . 3 PHE CZ 1 1 10 1179 1 1 3 PHE H H 2.025 1.904 1.751 1.00 . A A . 3 PHE H 1 1 10 1180 1 1 3 PHE HA H -0.028 3.280 0.212 1.00 . A A . 3 PHE HA 1 1 10 1181 1 1 3 PHE HB2 H 2.804 2.971 0.006 1.00 . A A . 3 PHE HB2 1 1 10 1182 1 1 3 PHE HB3 H 2.049 2.399 -1.486 1.00 . A A . 3 PHE HB3 1 1 10 1183 1 1 3 PHE HD1 H 1.960 5.275 0.884 1.00 . A A . 3 PHE HD1 1 1 10 1184 1 1 3 PHE HD2 H 1.540 3.927 -3.131 1.00 . A A . 3 PHE HD2 1 1 10 1185 1 1 3 PHE HE1 H 1.710 7.605 0.133 1.00 . A A . 3 PHE HE1 1 1 10 1186 1 1 3 PHE HE2 H 1.290 6.254 -3.890 1.00 . A A . 3 PHE HE2 1 1 10 1187 1 1 3 PHE HZ H 1.375 8.097 -2.257 1.00 . A A . 3 PHE HZ 1 1 10 1188 1 1 3 PHE N N 1.126 2.251 1.572 1.00 . A A . 3 PHE N 1 1 10 1189 1 1 3 PHE O O 0.862 0.506 -1.113 1.00 . A A . 3 PHE O 1 1 10 1190 1 1 4 LEU C C -1.625 -0.177 -2.350 1.00 . A A . 4 LEU C 1 1 10 1191 1 1 4 LEU CA C -1.829 -0.108 -0.839 1.00 . A A . 4 LEU CA 1 1 10 1192 1 1 4 LEU CB C -3.323 -0.060 -0.517 1.00 . A A . 4 LEU CB 1 1 10 1193 1 1 4 LEU CD1 C -3.791 1.362 1.490 1.00 . A A . 4 LEU CD1 1 1 10 1194 1 1 4 LEU CD2 C -4.935 -0.846 1.235 1.00 . A A . 4 LEU CD2 1 1 10 1195 1 1 4 LEU CG C -3.659 -0.061 0.975 1.00 . A A . 4 LEU CG 1 1 10 1196 1 1 4 LEU H H -1.668 1.691 0.263 1.00 . A A . 4 LEU H 1 1 10 1197 1 1 4 LEU HA H -1.404 -0.990 -0.389 1.00 . A A . 4 LEU HA 1 1 10 1198 1 1 4 LEU HB2 H -3.737 0.835 -0.959 1.00 . A A . 4 LEU HB2 1 1 10 1199 1 1 4 LEU HB3 H -3.796 -0.918 -0.970 1.00 . A A . 4 LEU HB3 1 1 10 1200 1 1 4 LEU HD11 H -2.837 1.695 1.872 1.00 . A A . 4 LEU HD11 1 1 10 1201 1 1 4 LEU HD12 H -4.526 1.393 2.280 1.00 . A A . 4 LEU HD12 1 1 10 1202 1 1 4 LEU HD13 H -4.101 2.010 0.683 1.00 . A A . 4 LEU HD13 1 1 10 1203 1 1 4 LEU HD21 H -5.055 -1.602 0.473 1.00 . A A . 4 LEU HD21 1 1 10 1204 1 1 4 LEU HD22 H -5.782 -0.176 1.213 1.00 . A A . 4 LEU HD22 1 1 10 1205 1 1 4 LEU HD23 H -4.876 -1.319 2.205 1.00 . A A . 4 LEU HD23 1 1 10 1206 1 1 4 LEU HG H -2.855 -0.536 1.516 1.00 . A A . 4 LEU HG 1 1 10 1207 1 1 4 LEU N N -1.152 1.052 -0.270 1.00 . A A . 4 LEU N 1 1 10 1208 1 1 4 LEU O O -1.579 0.850 -3.027 1.00 . A A . 4 LEU O 1 1 10 1209 1 1 5 ARG C C -1.928 -2.910 -4.757 1.00 . A A . 5 ARG C 1 1 10 1210 1 1 5 ARG CA C -1.304 -1.596 -4.301 1.00 . A A . 5 ARG CA 1 1 10 1211 1 1 5 ARG CB C 0.189 -1.585 -4.635 1.00 . A A . 5 ARG CB 1 1 10 1212 1 1 5 ARG CD C 1.865 -1.876 -6.485 1.00 . A A . 5 ARG CD 1 1 10 1213 1 1 5 ARG CG C 0.479 -1.376 -6.113 1.00 . A A . 5 ARG CG 1 1 10 1214 1 1 5 ARG CZ C 2.625 -0.357 -8.271 1.00 . A A . 5 ARG CZ 1 1 10 1215 1 1 5 ARG H H -1.548 -2.174 -2.279 1.00 . A A . 5 ARG H 1 1 10 1216 1 1 5 ARG HA H -1.786 -0.782 -4.821 1.00 . A A . 5 ARG HA 1 1 10 1217 1 1 5 ARG HB2 H 0.665 -0.784 -4.081 1.00 . A A . 5 ARG HB2 1 1 10 1218 1 1 5 ARG HB3 H 0.621 -2.533 -4.336 1.00 . A A . 5 ARG HB3 1 1 10 1219 1 1 5 ARG HD2 H 2.588 -1.416 -5.829 1.00 . A A . 5 ARG HD2 1 1 10 1220 1 1 5 ARG HD3 H 1.893 -2.948 -6.355 1.00 . A A . 5 ARG HD3 1 1 10 1221 1 1 5 ARG HE H 2.128 -2.273 -8.532 1.00 . A A . 5 ARG HE 1 1 10 1222 1 1 5 ARG HG2 H -0.255 -1.914 -6.693 1.00 . A A . 5 ARG HG2 1 1 10 1223 1 1 5 ARG HG3 H 0.414 -0.321 -6.336 1.00 . A A . 5 ARG HG3 1 1 10 1224 1 1 5 ARG HH11 H 2.527 0.489 -6.436 1.00 . A A . 5 ARG HH11 1 1 10 1225 1 1 5 ARG HH12 H 3.059 1.535 -7.709 1.00 . A A . 5 ARG HH12 1 1 10 1226 1 1 5 ARG HH21 H 2.828 -0.898 -10.207 1.00 . A A . 5 ARG HH21 1 1 10 1227 1 1 5 ARG HH22 H 3.230 0.749 -9.850 1.00 . A A . 5 ARG HH22 1 1 10 1228 1 1 5 ARG N N -1.503 -1.393 -2.870 1.00 . A A . 5 ARG N 1 1 10 1229 1 1 5 ARG NE N 2.210 -1.556 -7.868 1.00 . A A . 5 ARG NE 1 1 10 1230 1 1 5 ARG NH1 N 2.747 0.637 -7.400 1.00 . A A . 5 ARG NH1 1 1 10 1231 1 1 5 ARG NH2 N 2.918 -0.152 -9.547 1.00 . A A . 5 ARG NH2 1 1 10 1232 1 1 5 ARG O O -1.504 -3.988 -4.341 1.00 . A A . 5 ARG O 1 1 10 1233 1 1 6 HIS C C -4.128 -3.756 -7.547 1.00 . A A . 6 HIS C 1 1 10 1234 1 1 6 HIS CA C -3.622 -3.994 -6.128 1.00 . A A . 6 HIS CA 1 1 10 1235 1 1 6 HIS CB C -4.790 -4.372 -5.215 1.00 . A A . 6 HIS CB 1 1 10 1236 1 1 6 HIS CD2 C -7.161 -3.345 -5.449 1.00 . A A . 6 HIS CD2 1 1 10 1237 1 1 6 HIS CE1 C -6.714 -1.334 -4.700 1.00 . A A . 6 HIS CE1 1 1 10 1238 1 1 6 HIS CG C -5.845 -3.314 -5.127 1.00 . A A . 6 HIS CG 1 1 10 1239 1 1 6 HIS H H -3.232 -1.925 -5.910 1.00 . A A . 6 HIS H 1 1 10 1240 1 1 6 HIS HA H -2.912 -4.807 -6.144 1.00 . A A . 6 HIS HA 1 1 10 1241 1 1 6 HIS HB2 H -5.256 -5.274 -5.591 1.00 . A A . 6 HIS HB2 1 1 10 1242 1 1 6 HIS HB3 H -4.412 -4.551 -4.215 1.00 . A A . 6 HIS HB3 1 1 10 1243 1 1 6 HIS HD1 H -4.732 -1.703 -4.349 1.00 . A A . 6 HIS HD1 1 1 10 1244 1 1 6 HIS HD2 H -7.703 -4.191 -5.848 1.00 . A A . 6 HIS HD2 1 1 10 1245 1 1 6 HIS HE1 H -6.820 -0.303 -4.397 1.00 . A A . 6 HIS HE1 1 1 10 1246 1 1 6 HIS HE2 H -8.585 -1.803 -5.388 1.00 . A A . 6 HIS HE2 1 1 10 1247 1 1 6 HIS N N -2.939 -2.813 -5.615 1.00 . A A . 6 HIS N 1 1 10 1248 1 1 6 HIS ND1 N -5.597 -2.039 -4.662 1.00 . A A . 6 HIS ND1 1 1 10 1249 1 1 6 HIS NE2 N -7.676 -2.102 -5.175 1.00 . A A . 6 HIS NE2 1 1 10 1250 1 1 6 HIS O O -4.675 -4.705 -8.147 1.00 . A A . 6 HIS O 1 1 11 1251 1 1 1 HIS C C 2.883 3.373 3.905 1.00 . A A . 1 HIS C 1 1 11 1252 1 1 1 HIS CA C 3.837 4.443 4.429 1.00 . A A . 1 HIS CA 1 1 11 1253 1 1 1 HIS CB C 5.280 3.937 4.374 1.00 . A A . 1 HIS CB 1 1 11 1254 1 1 1 HIS CD2 C 5.680 4.569 1.890 1.00 . A A . 1 HIS CD2 1 1 11 1255 1 1 1 HIS CE1 C 7.756 5.251 2.063 1.00 . A A . 1 HIS CE1 1 1 11 1256 1 1 1 HIS CG C 6.045 4.437 3.188 1.00 . A A . 1 HIS CG 1 1 11 1257 1 1 1 HIS H1 H 3.338 3.929 6.358 1.00 . A A . 1 HIS H1 1 1 11 1258 1 1 1 HIS H2 H 2.673 5.416 5.818 1.00 . A A . 1 HIS H2 1 1 11 1259 1 1 1 HIS H3 H 4.337 5.315 6.225 1.00 . A A . 1 HIS H3 1 1 11 1260 1 1 1 HIS HA H 3.747 5.326 3.815 1.00 . A A . 1 HIS HA 1 1 11 1261 1 1 1 HIS HB2 H 5.801 4.259 5.263 1.00 . A A . 1 HIS HB2 1 1 11 1262 1 1 1 HIS HB3 H 5.276 2.857 4.337 1.00 . A A . 1 HIS HB3 1 1 11 1263 1 1 1 HIS HD1 H 7.900 4.898 4.074 1.00 . A A . 1 HIS HD1 1 1 11 1264 1 1 1 HIS HD2 H 4.716 4.322 1.467 1.00 . A A . 1 HIS HD2 1 1 11 1265 1 1 1 HIS HE1 H 8.735 5.636 1.819 1.00 . A A . 1 HIS HE1 1 1 11 1266 1 1 1 HIS HE2 H 6.820 5.197 0.243 1.00 . A A . 1 HIS HE2 1 1 11 1267 1 1 1 HIS N N 3.518 4.809 5.834 1.00 . A A . 1 HIS N 1 1 11 1268 1 1 1 HIS ND1 N 7.351 4.871 3.262 1.00 . A A . 1 HIS ND1 1 1 11 1269 1 1 1 HIS NE2 N 6.761 5.077 1.213 1.00 . A A . 1 HIS NE2 1 1 11 1270 1 1 1 HIS O O 3.235 2.596 3.018 1.00 . A A . 1 HIS O 1 1 11 1271 1 1 2 ARG C C 0.219 2.638 2.610 1.00 . A A . 2 ARG C 1 1 11 1272 1 1 2 ARG CA C 0.671 2.368 4.041 1.00 . A A . 2 ARG CA 1 1 11 1273 1 1 2 ARG CB C -0.531 2.406 4.985 1.00 . A A . 2 ARG CB 1 1 11 1274 1 1 2 ARG CD C -1.109 2.977 7.362 1.00 . A A . 2 ARG CD 1 1 11 1275 1 1 2 ARG CG C -0.163 2.217 6.447 1.00 . A A . 2 ARG CG 1 1 11 1276 1 1 2 ARG CZ C -2.486 1.228 8.417 1.00 . A A . 2 ARG CZ 1 1 11 1277 1 1 2 ARG H H 1.450 3.988 5.158 1.00 . A A . 2 ARG H 1 1 11 1278 1 1 2 ARG HA H 1.122 1.388 4.085 1.00 . A A . 2 ARG HA 1 1 11 1279 1 1 2 ARG HB2 H -1.025 3.361 4.882 1.00 . A A . 2 ARG HB2 1 1 11 1280 1 1 2 ARG HB3 H -1.219 1.623 4.705 1.00 . A A . 2 ARG HB3 1 1 11 1281 1 1 2 ARG HD2 H -0.623 3.131 8.314 1.00 . A A . 2 ARG HD2 1 1 11 1282 1 1 2 ARG HD3 H -1.331 3.935 6.914 1.00 . A A . 2 ARG HD3 1 1 11 1283 1 1 2 ARG HE H -3.146 2.549 7.075 1.00 . A A . 2 ARG HE 1 1 11 1284 1 1 2 ARG HG2 H -0.215 1.162 6.689 1.00 . A A . 2 ARG HG2 1 1 11 1285 1 1 2 ARG HG3 H 0.846 2.580 6.604 1.00 . A A . 2 ARG HG3 1 1 11 1286 1 1 2 ARG HH11 H -0.555 1.250 9.018 1.00 . A A . 2 ARG HH11 1 1 11 1287 1 1 2 ARG HH12 H -1.544 0.029 9.745 1.00 . A A . 2 ARG HH12 1 1 11 1288 1 1 2 ARG HH21 H -4.449 0.944 8.031 1.00 . A A . 2 ARG HH21 1 1 11 1289 1 1 2 ARG HH22 H -3.755 -0.145 9.185 1.00 . A A . 2 ARG HH22 1 1 11 1290 1 1 2 ARG N N 1.674 3.341 4.457 1.00 . A A . 2 ARG N 1 1 11 1291 1 1 2 ARG NE N -2.360 2.254 7.579 1.00 . A A . 2 ARG NE 1 1 11 1292 1 1 2 ARG NH1 N -1.442 0.801 9.118 1.00 . A A . 2 ARG NH1 1 1 11 1293 1 1 2 ARG NH2 N -3.660 0.626 8.556 1.00 . A A . 2 ARG NH2 1 1 11 1294 1 1 2 ARG O O -0.823 3.252 2.383 1.00 . A A . 2 ARG O 1 1 11 1295 1 1 3 PHE C C 0.197 1.073 -0.393 1.00 . A A . 3 PHE C 1 1 11 1296 1 1 3 PHE CA C 0.694 2.369 0.239 1.00 . A A . 3 PHE CA 1 1 11 1297 1 1 3 PHE CB C 1.919 2.886 -0.510 1.00 . A A . 3 PHE CB 1 1 11 1298 1 1 3 PHE CD1 C 2.432 5.338 -0.368 1.00 . A A . 3 PHE CD1 1 1 11 1299 1 1 3 PHE CD2 C 0.967 4.584 -2.092 1.00 . A A . 3 PHE CD2 1 1 11 1300 1 1 3 PHE CE1 C 2.296 6.638 -0.817 1.00 . A A . 3 PHE CE1 1 1 11 1301 1 1 3 PHE CE2 C 0.827 5.882 -2.546 1.00 . A A . 3 PHE CE2 1 1 11 1302 1 1 3 PHE CG C 1.770 4.297 -1.000 1.00 . A A . 3 PHE CG 1 1 11 1303 1 1 3 PHE CZ C 1.493 6.910 -1.907 1.00 . A A . 3 PHE CZ 1 1 11 1304 1 1 3 PHE H H 1.829 1.695 1.892 1.00 . A A . 3 PHE H 1 1 11 1305 1 1 3 PHE HA H -0.086 3.108 0.175 1.00 . A A . 3 PHE HA 1 1 11 1306 1 1 3 PHE HB2 H 2.769 2.857 0.155 1.00 . A A . 3 PHE HB2 1 1 11 1307 1 1 3 PHE HB3 H 2.106 2.251 -1.368 1.00 . A A . 3 PHE HB3 1 1 11 1308 1 1 3 PHE HD1 H 3.061 5.126 0.484 1.00 . A A . 3 PHE HD1 1 1 11 1309 1 1 3 PHE HD2 H 0.446 3.780 -2.592 1.00 . A A . 3 PHE HD2 1 1 11 1310 1 1 3 PHE HE1 H 2.817 7.440 -0.316 1.00 . A A . 3 PHE HE1 1 1 11 1311 1 1 3 PHE HE2 H 0.198 6.092 -3.398 1.00 . A A . 3 PHE HE2 1 1 11 1312 1 1 3 PHE HZ H 1.385 7.925 -2.260 1.00 . A A . 3 PHE HZ 1 1 11 1313 1 1 3 PHE N N 1.011 2.176 1.648 1.00 . A A . 3 PHE N 1 1 11 1314 1 1 3 PHE O O 0.974 0.147 -0.625 1.00 . A A . 3 PHE O 1 1 11 1315 1 1 4 LEU C C -0.994 -0.551 -2.564 1.00 . A A . 4 LEU C 1 1 11 1316 1 1 4 LEU CA C -1.706 -0.169 -1.270 1.00 . A A . 4 LEU CA 1 1 11 1317 1 1 4 LEU CB C -3.190 0.075 -1.544 1.00 . A A . 4 LEU CB 1 1 11 1318 1 1 4 LEU CD1 C -4.113 1.890 -0.086 1.00 . A A . 4 LEU CD1 1 1 11 1319 1 1 4 LEU CD2 C -5.421 -0.212 -0.436 1.00 . A A . 4 LEU CD2 1 1 11 1320 1 1 4 LEU CG C -4.029 0.389 -0.305 1.00 . A A . 4 LEU CG 1 1 11 1321 1 1 4 LEU H H -1.670 1.783 -0.456 1.00 . A A . 4 LEU H 1 1 11 1322 1 1 4 LEU HA H -1.610 -0.982 -0.566 1.00 . A A . 4 LEU HA 1 1 11 1323 1 1 4 LEU HB2 H -3.276 0.903 -2.233 1.00 . A A . 4 LEU HB2 1 1 11 1324 1 1 4 LEU HB3 H -3.598 -0.807 -2.014 1.00 . A A . 4 LEU HB3 1 1 11 1325 1 1 4 LEU HD11 H -5.066 2.138 0.357 1.00 . A A . 4 LEU HD11 1 1 11 1326 1 1 4 LEU HD12 H -4.013 2.398 -1.034 1.00 . A A . 4 LEU HD12 1 1 11 1327 1 1 4 LEU HD13 H -3.317 2.201 0.574 1.00 . A A . 4 LEU HD13 1 1 11 1328 1 1 4 LEU HD21 H -5.437 -1.186 0.030 1.00 . A A . 4 LEU HD21 1 1 11 1329 1 1 4 LEU HD22 H -5.675 -0.308 -1.481 1.00 . A A . 4 LEU HD22 1 1 11 1330 1 1 4 LEU HD23 H -6.138 0.432 0.051 1.00 . A A . 4 LEU HD23 1 1 11 1331 1 1 4 LEU HG H -3.554 -0.047 0.561 1.00 . A A . 4 LEU HG 1 1 11 1332 1 1 4 LEU N N -1.102 1.014 -0.667 1.00 . A A . 4 LEU N 1 1 11 1333 1 1 4 LEU O O -0.081 0.144 -3.010 1.00 . A A . 4 LEU O 1 1 11 1334 1 1 5 ARG C C -1.757 -3.098 -5.125 1.00 . A A . 5 ARG C 1 1 11 1335 1 1 5 ARG CA C -0.819 -2.135 -4.404 1.00 . A A . 5 ARG CA 1 1 11 1336 1 1 5 ARG CB C 0.519 -2.820 -4.121 1.00 . A A . 5 ARG CB 1 1 11 1337 1 1 5 ARG CD C 2.680 -3.718 -5.036 1.00 . A A . 5 ARG CD 1 1 11 1338 1 1 5 ARG CG C 1.407 -2.948 -5.348 1.00 . A A . 5 ARG CG 1 1 11 1339 1 1 5 ARG CZ C 4.573 -4.729 -6.248 1.00 . A A . 5 ARG CZ 1 1 11 1340 1 1 5 ARG H H -2.148 -2.172 -2.757 1.00 . A A . 5 ARG H 1 1 11 1341 1 1 5 ARG HA H -0.648 -1.277 -5.037 1.00 . A A . 5 ARG HA 1 1 11 1342 1 1 5 ARG HB2 H 1.054 -2.245 -3.374 1.00 . A A . 5 ARG HB2 1 1 11 1343 1 1 5 ARG HB3 H 0.327 -3.815 -3.736 1.00 . A A . 5 ARG HB3 1 1 11 1344 1 1 5 ARG HD2 H 3.290 -3.127 -4.371 1.00 . A A . 5 ARG HD2 1 1 11 1345 1 1 5 ARG HD3 H 2.413 -4.646 -4.551 1.00 . A A . 5 ARG HD3 1 1 11 1346 1 1 5 ARG HE H 3.107 -3.671 -7.094 1.00 . A A . 5 ARG HE 1 1 11 1347 1 1 5 ARG HG2 H 0.863 -3.469 -6.122 1.00 . A A . 5 ARG HG2 1 1 11 1348 1 1 5 ARG HG3 H 1.671 -1.959 -5.694 1.00 . A A . 5 ARG HG3 1 1 11 1349 1 1 5 ARG HH11 H 4.589 -5.048 -4.250 1.00 . A A . 5 ARG HH11 1 1 11 1350 1 1 5 ARG HH12 H 5.910 -5.748 -5.125 1.00 . A A . 5 ARG HH12 1 1 11 1351 1 1 5 ARG HH21 H 4.843 -4.591 -8.246 1.00 . A A . 5 ARG HH21 1 1 11 1352 1 1 5 ARG HH22 H 6.054 -5.489 -7.393 1.00 . A A . 5 ARG HH22 1 1 11 1353 1 1 5 ARG N N -1.417 -1.660 -3.161 1.00 . A A . 5 ARG N 1 1 11 1354 1 1 5 ARG NE N 3.447 -4.018 -6.243 1.00 . A A . 5 ARG NE 1 1 11 1355 1 1 5 ARG NH1 N 5.064 -5.215 -5.114 1.00 . A A . 5 ARG NH1 1 1 11 1356 1 1 5 ARG NH2 N 5.209 -4.955 -7.389 1.00 . A A . 5 ARG NH2 1 1 11 1357 1 1 5 ARG O O -1.320 -4.104 -5.685 1.00 . A A . 5 ARG O 1 1 11 1358 1 1 6 HIS C C -4.436 -3.047 -7.118 1.00 . A A . 6 HIS C 1 1 11 1359 1 1 6 HIS CA C -4.047 -3.621 -5.760 1.00 . A A . 6 HIS CA 1 1 11 1360 1 1 6 HIS CB C -5.289 -3.753 -4.875 1.00 . A A . 6 HIS CB 1 1 11 1361 1 1 6 HIS CD2 C -6.661 -5.855 -4.222 1.00 . A A . 6 HIS CD2 1 1 11 1362 1 1 6 HIS CE1 C -6.949 -6.686 -6.230 1.00 . A A . 6 HIS CE1 1 1 11 1363 1 1 6 HIS CG C -6.049 -5.023 -5.098 1.00 . A A . 6 HIS CG 1 1 11 1364 1 1 6 HIS H H -3.335 -1.969 -4.645 1.00 . A A . 6 HIS H 1 1 11 1365 1 1 6 HIS HA H -3.616 -4.600 -5.906 1.00 . A A . 6 HIS HA 1 1 11 1366 1 1 6 HIS HB2 H -4.986 -3.725 -3.835 1.00 . A A . 6 HIS HB2 1 1 11 1367 1 1 6 HIS HB3 H -5.957 -2.923 -5.079 1.00 . A A . 6 HIS HB3 1 1 11 1368 1 1 6 HIS HD1 H -5.922 -5.201 -7.194 1.00 . A A . 6 HIS HD1 1 1 11 1369 1 1 6 HIS HD2 H -6.707 -5.734 -3.149 1.00 . A A . 6 HIS HD2 1 1 11 1370 1 1 6 HIS HE1 H -7.254 -7.329 -7.043 1.00 . A A . 6 HIS HE1 1 1 11 1371 1 1 6 HIS HE2 H -7.642 -7.677 -4.578 1.00 . A A . 6 HIS HE2 1 1 11 1372 1 1 6 HIS N N -3.048 -2.784 -5.107 1.00 . A A . 6 HIS N 1 1 11 1373 1 1 6 HIS ND1 N -6.247 -5.573 -6.347 1.00 . A A . 6 HIS ND1 1 1 11 1374 1 1 6 HIS NE2 N -7.212 -6.880 -4.951 1.00 . A A . 6 HIS NE2 1 1 11 1375 1 1 6 HIS O O -5.475 -3.473 -7.665 1.00 . A A . 6 HIS O 1 1 12 1376 1 1 1 HIS C C 2.202 4.104 3.981 1.00 . A A . 1 HIS C 1 1 12 1377 1 1 1 HIS CA C 3.637 4.549 4.248 1.00 . A A . 1 HIS CA 1 1 12 1378 1 1 1 HIS CB C 4.622 3.509 3.709 1.00 . A A . 1 HIS CB 1 1 12 1379 1 1 1 HIS CD2 C 6.431 5.343 3.399 1.00 . A A . 1 HIS CD2 1 1 12 1380 1 1 1 HIS CE1 C 8.134 4.039 2.944 1.00 . A A . 1 HIS CE1 1 1 12 1381 1 1 1 HIS CG C 5.985 4.065 3.431 1.00 . A A . 1 HIS CG 1 1 12 1382 1 1 1 HIS H1 H 3.399 5.595 6.003 1.00 . A A . 1 HIS H1 1 1 12 1383 1 1 1 HIS H2 H 4.911 4.800 5.843 1.00 . A A . 1 HIS H2 1 1 12 1384 1 1 1 HIS H3 H 3.496 3.894 6.193 1.00 . A A . 1 HIS H3 1 1 12 1385 1 1 1 HIS HA H 3.810 5.493 3.753 1.00 . A A . 1 HIS HA 1 1 12 1386 1 1 1 HIS HB2 H 4.729 2.716 4.433 1.00 . A A . 1 HIS HB2 1 1 12 1387 1 1 1 HIS HB3 H 4.235 3.100 2.788 1.00 . A A . 1 HIS HB3 1 1 12 1388 1 1 1 HIS HD1 H 7.075 2.294 3.089 1.00 . A A . 1 HIS HD1 1 1 12 1389 1 1 1 HIS HD2 H 5.844 6.232 3.579 1.00 . A A . 1 HIS HD2 1 1 12 1390 1 1 1 HIS HE1 H 9.128 3.693 2.700 1.00 . A A . 1 HIS HE1 1 1 12 1391 1 1 1 HIS HE2 H 8.339 6.076 2.916 1.00 . A A . 1 HIS HE2 1 1 12 1392 1 1 1 HIS N N 3.883 4.725 5.703 1.00 . A A . 1 HIS N 1 1 12 1393 1 1 1 HIS ND1 N 7.076 3.272 3.141 1.00 . A A . 1 HIS ND1 1 1 12 1394 1 1 1 HIS NE2 N 7.769 5.298 3.093 1.00 . A A . 1 HIS NE2 1 1 12 1395 1 1 1 HIS O O 1.367 4.897 3.545 1.00 . A A . 1 HIS O 1 1 12 1396 1 1 2 ARG C C 0.143 2.479 2.585 1.00 . A A . 2 ARG C 1 1 12 1397 1 1 2 ARG CA C 0.588 2.281 4.031 1.00 . A A . 2 ARG CA 1 1 12 1398 1 1 2 ARG CB C -0.415 2.937 4.981 1.00 . A A . 2 ARG CB 1 1 12 1399 1 1 2 ARG CD C -0.005 4.474 6.930 1.00 . A A . 2 ARG CD 1 1 12 1400 1 1 2 ARG CG C 0.086 3.047 6.413 1.00 . A A . 2 ARG CG 1 1 12 1401 1 1 2 ARG CZ C -0.803 5.602 8.970 1.00 . A A . 2 ARG CZ 1 1 12 1402 1 1 2 ARG H H 2.630 2.247 4.589 1.00 . A A . 2 ARG H 1 1 12 1403 1 1 2 ARG HA H 0.629 1.222 4.240 1.00 . A A . 2 ARG HA 1 1 12 1404 1 1 2 ARG HB2 H -0.636 3.931 4.621 1.00 . A A . 2 ARG HB2 1 1 12 1405 1 1 2 ARG HB3 H -1.324 2.355 4.985 1.00 . A A . 2 ARG HB3 1 1 12 1406 1 1 2 ARG HD2 H 0.945 4.962 6.772 1.00 . A A . 2 ARG HD2 1 1 12 1407 1 1 2 ARG HD3 H -0.772 4.995 6.377 1.00 . A A . 2 ARG HD3 1 1 12 1408 1 1 2 ARG HE H -0.191 3.705 8.877 1.00 . A A . 2 ARG HE 1 1 12 1409 1 1 2 ARG HG2 H -0.518 2.407 7.045 1.00 . A A . 2 ARG HG2 1 1 12 1410 1 1 2 ARG HG3 H 1.121 2.725 6.448 1.00 . A A . 2 ARG HG3 1 1 12 1411 1 1 2 ARG HH11 H -0.803 6.765 7.315 1.00 . A A . 2 ARG HH11 1 1 12 1412 1 1 2 ARG HH12 H -1.360 7.535 8.762 1.00 . A A . 2 ARG HH12 1 1 12 1413 1 1 2 ARG HH21 H -0.923 4.716 10.782 1.00 . A A . 2 ARG HH21 1 1 12 1414 1 1 2 ARG HH22 H -1.427 6.372 10.731 1.00 . A A . 2 ARG HH22 1 1 12 1415 1 1 2 ARG N N 1.923 2.831 4.244 1.00 . A A . 2 ARG N 1 1 12 1416 1 1 2 ARG NE N -0.331 4.521 8.353 1.00 . A A . 2 ARG NE 1 1 12 1417 1 1 2 ARG NH1 N -1.005 6.726 8.293 1.00 . A A . 2 ARG NH1 1 1 12 1418 1 1 2 ARG NH2 N -1.073 5.560 10.268 1.00 . A A . 2 ARG NH2 1 1 12 1419 1 1 2 ARG O O -1.019 2.785 2.318 1.00 . A A . 2 ARG O 1 1 12 1420 1 1 3 PHE C C 0.433 1.125 -0.404 1.00 . A A . 3 PHE C 1 1 12 1421 1 1 3 PHE CA C 0.785 2.464 0.238 1.00 . A A . 3 PHE CA 1 1 12 1422 1 1 3 PHE CB C 1.977 3.094 -0.477 1.00 . A A . 3 PHE CB 1 1 12 1423 1 1 3 PHE CD1 C 2.233 5.588 -0.388 1.00 . A A . 3 PHE CD1 1 1 12 1424 1 1 3 PHE CD2 C 0.900 4.647 -2.127 1.00 . A A . 3 PHE CD2 1 1 12 1425 1 1 3 PHE CE1 C 1.977 6.856 -0.875 1.00 . A A . 3 PHE CE1 1 1 12 1426 1 1 3 PHE CE2 C 0.640 5.912 -2.618 1.00 . A A . 3 PHE CE2 1 1 12 1427 1 1 3 PHE CG C 1.697 4.471 -1.008 1.00 . A A . 3 PHE CG 1 1 12 1428 1 1 3 PHE CZ C 1.180 7.019 -1.991 1.00 . A A . 3 PHE CZ 1 1 12 1429 1 1 3 PHE H H 1.985 2.061 1.933 1.00 . A A . 3 PHE H 1 1 12 1430 1 1 3 PHE HA H -0.059 3.125 0.148 1.00 . A A . 3 PHE HA 1 1 12 1431 1 1 3 PHE HB2 H 2.799 3.170 0.219 1.00 . A A . 3 PHE HB2 1 1 12 1432 1 1 3 PHE HB3 H 2.264 2.465 -1.311 1.00 . A A . 3 PHE HB3 1 1 12 1433 1 1 3 PHE HD1 H 2.856 5.462 0.485 1.00 . A A . 3 PHE HD1 1 1 12 1434 1 1 3 PHE HD2 H 0.477 3.782 -2.618 1.00 . A A . 3 PHE HD2 1 1 12 1435 1 1 3 PHE HE1 H 2.400 7.720 -0.382 1.00 . A A . 3 PHE HE1 1 1 12 1436 1 1 3 PHE HE2 H 0.017 6.036 -3.491 1.00 . A A . 3 PHE HE2 1 1 12 1437 1 1 3 PHE HZ H 0.979 8.009 -2.373 1.00 . A A . 3 PHE HZ 1 1 12 1438 1 1 3 PHE N N 1.077 2.303 1.657 1.00 . A A . 3 PHE N 1 1 12 1439 1 1 3 PHE O O 1.284 0.472 -1.008 1.00 . A A . 3 PHE O 1 1 12 1440 1 1 4 LEU C C -1.014 -0.608 -2.330 1.00 . A A . 4 LEU C 1 1 12 1441 1 1 4 LEU CA C -1.293 -0.540 -0.831 1.00 . A A . 4 LEU CA 1 1 12 1442 1 1 4 LEU CB C -2.789 -0.716 -0.570 1.00 . A A . 4 LEU CB 1 1 12 1443 1 1 4 LEU CD1 C -3.555 0.659 1.378 1.00 . A A . 4 LEU CD1 1 1 12 1444 1 1 4 LEU CD2 C -4.338 -1.704 1.137 1.00 . A A . 4 LEU CD2 1 1 12 1445 1 1 4 LEU CG C -3.185 -0.737 0.906 1.00 . A A . 4 LEU CG 1 1 12 1446 1 1 4 LEU H H -1.457 1.285 0.227 1.00 . A A . 4 LEU H 1 1 12 1447 1 1 4 LEU HA H -0.757 -1.338 -0.340 1.00 . A A . 4 LEU HA 1 1 12 1448 1 1 4 LEU HB2 H -3.315 0.096 -1.052 1.00 . A A . 4 LEU HB2 1 1 12 1449 1 1 4 LEU HB3 H -3.105 -1.645 -1.019 1.00 . A A . 4 LEU HB3 1 1 12 1450 1 1 4 LEU HD11 H -2.680 1.141 1.789 1.00 . A A . 4 LEU HD11 1 1 12 1451 1 1 4 LEU HD12 H -4.320 0.592 2.136 1.00 . A A . 4 LEU HD12 1 1 12 1452 1 1 4 LEU HD13 H -3.924 1.235 0.542 1.00 . A A . 4 LEU HD13 1 1 12 1453 1 1 4 LEU HD21 H -5.198 -1.381 0.569 1.00 . A A . 4 LEU HD21 1 1 12 1454 1 1 4 LEU HD22 H -4.587 -1.723 2.187 1.00 . A A . 4 LEU HD22 1 1 12 1455 1 1 4 LEU HD23 H -4.047 -2.694 0.817 1.00 . A A . 4 LEU HD23 1 1 12 1456 1 1 4 LEU HG H -2.342 -1.073 1.492 1.00 . A A . 4 LEU HG 1 1 12 1457 1 1 4 LEU N N -0.826 0.721 -0.267 1.00 . A A . 4 LEU N 1 1 12 1458 1 1 4 LEU O O -0.544 0.360 -2.928 1.00 . A A . 4 LEU O 1 1 12 1459 1 1 5 ARG C C -2.024 -3.021 -4.912 1.00 . A A . 5 ARG C 1 1 12 1460 1 1 5 ARG CA C -1.089 -1.950 -4.358 1.00 . A A . 5 ARG CA 1 1 12 1461 1 1 5 ARG CB C 0.366 -2.340 -4.625 1.00 . A A . 5 ARG CB 1 1 12 1462 1 1 5 ARG CD C 2.206 -2.635 -6.310 1.00 . A A . 5 ARG CD 1 1 12 1463 1 1 5 ARG CG C 0.806 -2.097 -6.059 1.00 . A A . 5 ARG CG 1 1 12 1464 1 1 5 ARG CZ C 3.485 -3.587 -8.189 1.00 . A A . 5 ARG CZ 1 1 12 1465 1 1 5 ARG H H -1.680 -2.492 -2.399 1.00 . A A . 5 ARG H 1 1 12 1466 1 1 5 ARG HA H -1.299 -1.015 -4.855 1.00 . A A . 5 ARG HA 1 1 12 1467 1 1 5 ARG HB2 H 1.007 -1.761 -3.971 1.00 . A A . 5 ARG HB2 1 1 12 1468 1 1 5 ARG HB3 H 0.490 -3.394 -4.405 1.00 . A A . 5 ARG HB3 1 1 12 1469 1 1 5 ARG HD2 H 2.925 -1.909 -5.959 1.00 . A A . 5 ARG HD2 1 1 12 1470 1 1 5 ARG HD3 H 2.328 -3.556 -5.760 1.00 . A A . 5 ARG HD3 1 1 12 1471 1 1 5 ARG HE H 1.802 -2.530 -8.370 1.00 . A A . 5 ARG HE 1 1 12 1472 1 1 5 ARG HG2 H 0.117 -2.593 -6.726 1.00 . A A . 5 ARG HG2 1 1 12 1473 1 1 5 ARG HG3 H 0.798 -1.035 -6.253 1.00 . A A . 5 ARG HG3 1 1 12 1474 1 1 5 ARG HH11 H 4.276 -3.956 -6.364 1.00 . A A . 5 ARG HH11 1 1 12 1475 1 1 5 ARG HH12 H 5.157 -4.615 -7.701 1.00 . A A . 5 ARG HH12 1 1 12 1476 1 1 5 ARG HH21 H 2.958 -3.396 -10.131 1.00 . A A . 5 ARG HH21 1 1 12 1477 1 1 5 ARG HH22 H 4.409 -4.297 -9.840 1.00 . A A . 5 ARG HH22 1 1 12 1478 1 1 5 ARG N N -1.308 -1.756 -2.930 1.00 . A A . 5 ARG N 1 1 12 1479 1 1 5 ARG NE N 2.447 -2.893 -7.728 1.00 . A A . 5 ARG NE 1 1 12 1480 1 1 5 ARG NH1 N 4.379 -4.094 -7.349 1.00 . A A . 5 ARG NH1 1 1 12 1481 1 1 5 ARG NH2 N 3.629 -3.776 -9.493 1.00 . A A . 5 ARG NH2 1 1 12 1482 1 1 5 ARG O O -1.747 -4.215 -4.806 1.00 . A A . 5 ARG O 1 1 12 1483 1 1 6 HIS C C -4.497 -3.080 -7.485 1.00 . A A . 6 HIS C 1 1 12 1484 1 1 6 HIS CA C -4.108 -3.505 -6.073 1.00 . A A . 6 HIS CA 1 1 12 1485 1 1 6 HIS CB C -5.353 -3.575 -5.187 1.00 . A A . 6 HIS CB 1 1 12 1486 1 1 6 HIS CD2 C -7.195 -1.749 -5.253 1.00 . A A . 6 HIS CD2 1 1 12 1487 1 1 6 HIS CE1 C -6.121 -0.173 -4.173 1.00 . A A . 6 HIS CE1 1 1 12 1488 1 1 6 HIS CG C -5.975 -2.239 -4.925 1.00 . A A . 6 HIS CG 1 1 12 1489 1 1 6 HIS H H -3.297 -1.620 -5.556 1.00 . A A . 6 HIS H 1 1 12 1490 1 1 6 HIS HA H -3.653 -4.484 -6.117 1.00 . A A . 6 HIS HA 1 1 12 1491 1 1 6 HIS HB2 H -6.096 -4.198 -5.671 1.00 . A A . 6 HIS HB2 1 1 12 1492 1 1 6 HIS HB3 H -5.082 -4.011 -4.232 1.00 . A A . 6 HIS HB3 1 1 12 1493 1 1 6 HIS HD1 H -4.420 -1.272 -3.881 1.00 . A A . 6 HIS HD1 1 1 12 1494 1 1 6 HIS HD2 H -7.972 -2.273 -5.791 1.00 . A A . 6 HIS HD2 1 1 12 1495 1 1 6 HIS HE1 H -5.879 0.768 -3.699 1.00 . A A . 6 HIS HE1 1 1 12 1496 1 1 6 HIS HE2 H -7.990 0.168 -4.937 1.00 . A A . 6 HIS HE2 1 1 12 1497 1 1 6 HIS N N -3.132 -2.584 -5.502 1.00 . A A . 6 HIS N 1 1 12 1498 1 1 6 HIS ND1 N -5.327 -1.226 -4.250 1.00 . A A . 6 HIS ND1 1 1 12 1499 1 1 6 HIS NE2 N -7.259 -0.464 -4.774 1.00 . A A . 6 HIS NE2 1 1 12 1500 1 1 6 HIS O O -4.085 -1.978 -7.905 1.00 . A A . 6 HIS O 1 1 13 1501 1 1 1 HIS C C 2.741 3.366 3.970 1.00 . A A . 1 HIS C 1 1 13 1502 1 1 1 HIS CA C 3.616 4.422 4.637 1.00 . A A . 1 HIS CA 1 1 13 1503 1 1 1 HIS CB C 5.060 3.925 4.735 1.00 . A A . 1 HIS CB 1 1 13 1504 1 1 1 HIS CD2 C 7.237 4.716 3.567 1.00 . A A . 1 HIS CD2 1 1 13 1505 1 1 1 HIS CE1 C 6.449 4.931 1.533 1.00 . A A . 1 HIS CE1 1 1 13 1506 1 1 1 HIS CG C 5.926 4.377 3.601 1.00 . A A . 1 HIS CG 1 1 13 1507 1 1 1 HIS H1 H 2.899 3.842 6.475 1.00 . A A . 1 HIS H1 1 1 13 1508 1 1 1 HIS H2 H 2.289 5.344 5.910 1.00 . A A . 1 HIS H2 1 1 13 1509 1 1 1 HIS H3 H 3.895 5.236 6.506 1.00 . A A . 1 HIS H3 1 1 13 1510 1 1 1 HIS HA H 3.591 5.325 4.044 1.00 . A A . 1 HIS HA 1 1 13 1511 1 1 1 HIS HB2 H 5.497 4.290 5.652 1.00 . A A . 1 HIS HB2 1 1 13 1512 1 1 1 HIS HB3 H 5.061 2.845 4.746 1.00 . A A . 1 HIS HB3 1 1 13 1513 1 1 1 HIS HD1 H 4.545 4.352 2.009 1.00 . A A . 1 HIS HD1 1 1 13 1514 1 1 1 HIS HD2 H 7.920 4.719 4.405 1.00 . A A . 1 HIS HD2 1 1 13 1515 1 1 1 HIS HE1 H 6.378 5.130 0.473 1.00 . A A . 1 HIS HE1 1 1 13 1516 1 1 1 HIS HE2 H 8.431 5.262 1.929 1.00 . A A . 1 HIS HE2 1 1 13 1517 1 1 1 HIS N N 3.131 4.740 6.005 1.00 . A A . 1 HIS N 1 1 13 1518 1 1 1 HIS ND1 N 5.462 4.523 2.310 1.00 . A A . 1 HIS ND1 1 1 13 1519 1 1 1 HIS NE2 N 7.536 5.057 2.271 1.00 . A A . 1 HIS NE2 1 1 13 1520 1 1 1 HIS O O 3.202 2.618 3.108 1.00 . A A . 1 HIS O 1 1 13 1521 1 1 2 ARG C C 0.350 2.587 2.314 1.00 . A A . 2 ARG C 1 1 13 1522 1 1 2 ARG CA C 0.538 2.346 3.808 1.00 . A A . 2 ARG CA 1 1 13 1523 1 1 2 ARG CB C -0.810 2.432 4.527 1.00 . A A . 2 ARG CB 1 1 13 1524 1 1 2 ARG CD C -2.095 1.805 6.593 1.00 . A A . 2 ARG CD 1 1 13 1525 1 1 2 ARG CG C -0.964 1.421 5.652 1.00 . A A . 2 ARG CG 1 1 13 1526 1 1 2 ARG CZ C -4.513 2.251 6.434 1.00 . A A . 2 ARG CZ 1 1 13 1527 1 1 2 ARG H H 1.163 3.934 5.061 1.00 . A A . 2 ARG H 1 1 13 1528 1 1 2 ARG HA H 0.951 1.359 3.953 1.00 . A A . 2 ARG HA 1 1 13 1529 1 1 2 ARG HB2 H -0.921 3.422 4.944 1.00 . A A . 2 ARG HB2 1 1 13 1530 1 1 2 ARG HB3 H -1.600 2.262 3.810 1.00 . A A . 2 ARG HB3 1 1 13 1531 1 1 2 ARG HD2 H -2.075 1.145 7.447 1.00 . A A . 2 ARG HD2 1 1 13 1532 1 1 2 ARG HD3 H -1.943 2.822 6.921 1.00 . A A . 2 ARG HD3 1 1 13 1533 1 1 2 ARG HE H -3.454 1.202 5.107 1.00 . A A . 2 ARG HE 1 1 13 1534 1 1 2 ARG HG2 H -1.180 0.450 5.224 1.00 . A A . 2 ARG HG2 1 1 13 1535 1 1 2 ARG HG3 H -0.038 1.378 6.213 1.00 . A A . 2 ARG HG3 1 1 13 1536 1 1 2 ARG HH11 H -3.619 3.047 8.065 1.00 . A A . 2 ARG HH11 1 1 13 1537 1 1 2 ARG HH12 H -5.319 3.347 7.930 1.00 . A A . 2 ARG HH12 1 1 13 1538 1 1 2 ARG HH21 H -5.690 1.595 4.928 1.00 . A A . 2 ARG HH21 1 1 13 1539 1 1 2 ARG HH22 H -6.495 2.523 6.149 1.00 . A A . 2 ARG HH22 1 1 13 1540 1 1 2 ARG N N 1.475 3.311 4.372 1.00 . A A . 2 ARG N 1 1 13 1541 1 1 2 ARG NE N -3.402 1.704 5.947 1.00 . A A . 2 ARG NE 1 1 13 1542 1 1 2 ARG NH1 N -4.480 2.938 7.570 1.00 . A A . 2 ARG NH1 1 1 13 1543 1 1 2 ARG NH2 N -5.660 2.112 5.784 1.00 . A A . 2 ARG NH2 1 1 13 1544 1 1 2 ARG O O -0.572 3.289 1.899 1.00 . A A . 2 ARG O 1 1 13 1545 1 1 3 PHE C C 0.435 0.979 -0.577 1.00 . A A . 3 PHE C 1 1 13 1546 1 1 3 PHE CA C 1.167 2.154 0.064 1.00 . A A . 3 PHE CA 1 1 13 1547 1 1 3 PHE CB C 2.574 2.278 -0.516 1.00 . A A . 3 PHE CB 1 1 13 1548 1 1 3 PHE CD1 C 2.983 4.743 -0.281 1.00 . A A . 3 PHE CD1 1 1 13 1549 1 1 3 PHE CD2 C 3.014 3.792 -2.468 1.00 . A A . 3 PHE CD2 1 1 13 1550 1 1 3 PHE CE1 C 3.249 5.989 -0.815 1.00 . A A . 3 PHE CE1 1 1 13 1551 1 1 3 PHE CE2 C 3.280 5.036 -3.008 1.00 . A A . 3 PHE CE2 1 1 13 1552 1 1 3 PHE CG C 2.863 3.632 -1.100 1.00 . A A . 3 PHE CG 1 1 13 1553 1 1 3 PHE CZ C 3.398 6.136 -2.181 1.00 . A A . 3 PHE CZ 1 1 13 1554 1 1 3 PHE H H 1.945 1.456 1.903 1.00 . A A . 3 PHE H 1 1 13 1555 1 1 3 PHE HA H 0.626 3.059 -0.148 1.00 . A A . 3 PHE HA 1 1 13 1556 1 1 3 PHE HB2 H 3.291 2.100 0.272 1.00 . A A . 3 PHE HB2 1 1 13 1557 1 1 3 PHE HB3 H 2.702 1.541 -1.299 1.00 . A A . 3 PHE HB3 1 1 13 1558 1 1 3 PHE HD1 H 2.867 4.629 0.787 1.00 . A A . 3 PHE HD1 1 1 13 1559 1 1 3 PHE HD2 H 2.922 2.933 -3.116 1.00 . A A . 3 PHE HD2 1 1 13 1560 1 1 3 PHE HE1 H 3.340 6.847 -0.166 1.00 . A A . 3 PHE HE1 1 1 13 1561 1 1 3 PHE HE2 H 3.396 5.149 -4.076 1.00 . A A . 3 PHE HE2 1 1 13 1562 1 1 3 PHE HZ H 3.606 7.109 -2.601 1.00 . A A . 3 PHE HZ 1 1 13 1563 1 1 3 PHE N N 1.232 2.002 1.512 1.00 . A A . 3 PHE N 1 1 13 1564 1 1 3 PHE O O 1.031 -0.063 -0.848 1.00 . A A . 3 PHE O 1 1 13 1565 1 1 4 LEU C C -1.071 -0.370 -2.736 1.00 . A A . 4 LEU C 1 1 13 1566 1 1 4 LEU CA C -1.678 0.108 -1.420 1.00 . A A . 4 LEU CA 1 1 13 1567 1 1 4 LEU CB C -3.100 0.616 -1.657 1.00 . A A . 4 LEU CB 1 1 13 1568 1 1 4 LEU CD1 C -3.657 2.537 -0.151 1.00 . A A . 4 LEU CD1 1 1 13 1569 1 1 4 LEU CD2 C -5.326 0.709 -0.505 1.00 . A A . 4 LEU CD2 1 1 13 1570 1 1 4 LEU CG C -3.847 1.050 -0.396 1.00 . A A . 4 LEU CG 1 1 13 1571 1 1 4 LEU H H -1.281 2.006 -0.573 1.00 . A A . 4 LEU H 1 1 13 1572 1 1 4 LEU HA H -1.714 -0.721 -0.731 1.00 . A A . 4 LEU HA 1 1 13 1573 1 1 4 LEU HB2 H -3.052 1.459 -2.332 1.00 . A A . 4 LEU HB2 1 1 13 1574 1 1 4 LEU HB3 H -3.667 -0.171 -2.131 1.00 . A A . 4 LEU HB3 1 1 13 1575 1 1 4 LEU HD11 H -4.545 2.943 0.311 1.00 . A A . 4 LEU HD11 1 1 13 1576 1 1 4 LEU HD12 H -3.480 3.037 -1.091 1.00 . A A . 4 LEU HD12 1 1 13 1577 1 1 4 LEU HD13 H -2.810 2.688 0.502 1.00 . A A . 4 LEU HD13 1 1 13 1578 1 1 4 LEU HD21 H -5.689 0.994 -1.482 1.00 . A A . 4 LEU HD21 1 1 13 1579 1 1 4 LEU HD22 H -5.876 1.245 0.254 1.00 . A A . 4 LEU HD22 1 1 13 1580 1 1 4 LEU HD23 H -5.462 -0.353 -0.366 1.00 . A A . 4 LEU HD23 1 1 13 1581 1 1 4 LEU HG H -3.442 0.519 0.453 1.00 . A A . 4 LEU HG 1 1 13 1582 1 1 4 LEU N N -0.862 1.154 -0.814 1.00 . A A . 4 LEU N 1 1 13 1583 1 1 4 LEU O O -0.412 0.394 -3.441 1.00 . A A . 4 LEU O 1 1 13 1584 1 1 5 ARG C C -1.782 -3.179 -4.911 1.00 . A A . 5 ARG C 1 1 13 1585 1 1 5 ARG CA C -0.772 -2.220 -4.289 1.00 . A A . 5 ARG CA 1 1 13 1586 1 1 5 ARG CB C 0.543 -2.951 -4.012 1.00 . A A . 5 ARG CB 1 1 13 1587 1 1 5 ARG CD C 2.881 -3.233 -4.887 1.00 . A A . 5 ARG CD 1 1 13 1588 1 1 5 ARG CG C 1.408 -3.132 -5.248 1.00 . A A . 5 ARG CG 1 1 13 1589 1 1 5 ARG CZ C 4.052 -2.267 -6.828 1.00 . A A . 5 ARG CZ 1 1 13 1590 1 1 5 ARG H H -1.829 -2.199 -2.455 1.00 . A A . 5 ARG H 1 1 13 1591 1 1 5 ARG HA H -0.586 -1.413 -4.982 1.00 . A A . 5 ARG HA 1 1 13 1592 1 1 5 ARG HB2 H 1.110 -2.385 -3.282 1.00 . A A . 5 ARG HB2 1 1 13 1593 1 1 5 ARG HB3 H 0.318 -3.932 -3.608 1.00 . A A . 5 ARG HB3 1 1 13 1594 1 1 5 ARG HD2 H 3.159 -2.359 -4.316 1.00 . A A . 5 ARG HD2 1 1 13 1595 1 1 5 ARG HD3 H 3.031 -4.117 -4.286 1.00 . A A . 5 ARG HD3 1 1 13 1596 1 1 5 ARG HE H 4.080 -4.196 -6.319 1.00 . A A . 5 ARG HE 1 1 13 1597 1 1 5 ARG HG2 H 1.109 -4.037 -5.756 1.00 . A A . 5 ARG HG2 1 1 13 1598 1 1 5 ARG HG3 H 1.264 -2.285 -5.903 1.00 . A A . 5 ARG HG3 1 1 13 1599 1 1 5 ARG HH11 H 3.012 -0.927 -5.726 1.00 . A A . 5 ARG HH11 1 1 13 1600 1 1 5 ARG HH12 H 3.843 -0.274 -7.098 1.00 . A A . 5 ARG HH12 1 1 13 1601 1 1 5 ARG HH21 H 5.174 -3.339 -8.122 1.00 . A A . 5 ARG HH21 1 1 13 1602 1 1 5 ARG HH22 H 5.070 -1.643 -8.459 1.00 . A A . 5 ARG HH22 1 1 13 1603 1 1 5 ARG N N -1.297 -1.639 -3.059 1.00 . A A . 5 ARG N 1 1 13 1604 1 1 5 ARG NE N 3.730 -3.314 -6.072 1.00 . A A . 5 ARG NE 1 1 13 1605 1 1 5 ARG NH1 N 3.598 -1.057 -6.526 1.00 . A A . 5 ARG NH1 1 1 13 1606 1 1 5 ARG NH2 N 4.829 -2.430 -7.890 1.00 . A A . 5 ARG NH2 1 1 13 1607 1 1 5 ARG O O -1.432 -4.284 -5.328 1.00 . A A . 5 ARG O 1 1 13 1608 1 1 6 HIS C C -4.703 -2.902 -6.772 1.00 . A A . 6 HIS C 1 1 13 1609 1 1 6 HIS CA C -4.101 -3.571 -5.540 1.00 . A A . 6 HIS CA 1 1 13 1610 1 1 6 HIS CB C -5.193 -3.823 -4.499 1.00 . A A . 6 HIS CB 1 1 13 1611 1 1 6 HIS CD2 C -5.683 -1.279 -4.368 1.00 . A A . 6 HIS CD2 1 1 13 1612 1 1 6 HIS CE1 C -7.092 -1.309 -2.689 1.00 . A A . 6 HIS CE1 1 1 13 1613 1 1 6 HIS CG C -5.820 -2.568 -3.976 1.00 . A A . 6 HIS CG 1 1 13 1614 1 1 6 HIS H H -3.257 -1.861 -4.621 1.00 . A A . 6 HIS H 1 1 13 1615 1 1 6 HIS HA H -3.670 -4.516 -5.832 1.00 . A A . 6 HIS HA 1 1 13 1616 1 1 6 HIS HB2 H -5.976 -4.424 -4.946 1.00 . A A . 6 HIS HB2 1 1 13 1617 1 1 6 HIS HB3 H -4.764 -4.357 -3.659 1.00 . A A . 6 HIS HB3 1 1 13 1618 1 1 6 HIS HD1 H -7.015 -3.336 -2.419 1.00 . A A . 6 HIS HD1 1 1 13 1619 1 1 6 HIS HD2 H -5.059 -0.917 -5.174 1.00 . A A . 6 HIS HD2 1 1 13 1620 1 1 6 HIS HE1 H -7.784 -0.994 -1.922 1.00 . A A . 6 HIS HE1 1 1 13 1621 1 1 6 HIS HE2 H -6.520 0.461 -3.545 1.00 . A A . 6 HIS HE2 1 1 13 1622 1 1 6 HIS N N -3.039 -2.750 -4.970 1.00 . A A . 6 HIS N 1 1 13 1623 1 1 6 HIS ND1 N -6.709 -2.552 -2.922 1.00 . A A . 6 HIS ND1 1 1 13 1624 1 1 6 HIS NE2 N -6.483 -0.518 -3.552 1.00 . A A . 6 HIS NE2 1 1 13 1625 1 1 6 HIS O O -5.653 -3.472 -7.349 1.00 . A A . 6 HIS O 1 1 14 1626 1 1 1 HIS C C 3.033 3.132 3.586 1.00 . A A . 1 HIS C 1 1 14 1627 1 1 1 HIS CA C 3.989 4.239 4.019 1.00 . A A . 1 HIS CA 1 1 14 1628 1 1 1 HIS CB C 5.439 3.788 3.831 1.00 . A A . 1 HIS CB 1 1 14 1629 1 1 1 HIS CD2 C 5.582 1.499 5.044 1.00 . A A . 1 HIS CD2 1 1 14 1630 1 1 1 HIS CE1 C 7.007 2.057 6.614 1.00 . A A . 1 HIS CE1 1 1 14 1631 1 1 1 HIS CG C 5.899 2.803 4.861 1.00 . A A . 1 HIS CG 1 1 14 1632 1 1 1 HIS H1 H 2.922 5.177 5.508 1.00 . A A . 1 HIS H1 1 1 14 1633 1 1 1 HIS H2 H 4.620 5.137 5.760 1.00 . A A . 1 HIS H2 1 1 14 1634 1 1 1 HIS H3 H 3.682 3.717 5.985 1.00 . A A . 1 HIS H3 1 1 14 1635 1 1 1 HIS HA H 3.809 5.116 3.414 1.00 . A A . 1 HIS HA 1 1 14 1636 1 1 1 HIS HB2 H 5.542 3.325 2.861 1.00 . A A . 1 HIS HB2 1 1 14 1637 1 1 1 HIS HB3 H 6.087 4.651 3.883 1.00 . A A . 1 HIS HB3 1 1 14 1638 1 1 1 HIS HD1 H 7.209 3.998 6.000 1.00 . A A . 1 HIS HD1 1 1 14 1639 1 1 1 HIS HD2 H 4.904 0.913 4.440 1.00 . A A . 1 HIS HD2 1 1 14 1640 1 1 1 HIS HE1 H 7.660 2.010 7.473 1.00 . A A . 1 HIS HE1 1 1 14 1641 1 1 1 HIS HE2 H 6.322 0.133 6.457 1.00 . A A . 1 HIS HE2 1 1 14 1642 1 1 1 HIS N N 3.785 4.600 5.447 1.00 . A A . 1 HIS N 1 1 14 1643 1 1 1 HIS ND1 N 6.792 3.122 5.862 1.00 . A A . 1 HIS ND1 1 1 14 1644 1 1 1 HIS NE2 N 6.284 1.059 6.139 1.00 . A A . 1 HIS NE2 1 1 14 1645 1 1 1 HIS O O 3.340 2.351 2.685 1.00 . A A . 1 HIS O 1 1 14 1646 1 1 2 ARG C C 0.191 2.379 2.582 1.00 . A A . 2 ARG C 1 1 14 1647 1 1 2 ARG CA C 0.873 2.060 3.909 1.00 . A A . 2 ARG CA 1 1 14 1648 1 1 2 ARG CB C -0.170 1.969 5.025 1.00 . A A . 2 ARG CB 1 1 14 1649 1 1 2 ARG CD C -0.335 1.399 7.466 1.00 . A A . 2 ARG CD 1 1 14 1650 1 1 2 ARG CG C 0.184 0.961 6.106 1.00 . A A . 2 ARG CG 1 1 14 1651 1 1 2 ARG CZ C -1.401 -0.618 8.399 1.00 . A A . 2 ARG CZ 1 1 14 1652 1 1 2 ARG H H 1.684 3.722 4.939 1.00 . A A . 2 ARG H 1 1 14 1653 1 1 2 ARG HA H 1.378 1.110 3.821 1.00 . A A . 2 ARG HA 1 1 14 1654 1 1 2 ARG HB2 H -0.271 2.940 5.488 1.00 . A A . 2 ARG HB2 1 1 14 1655 1 1 2 ARG HB3 H -1.118 1.685 4.595 1.00 . A A . 2 ARG HB3 1 1 14 1656 1 1 2 ARG HD2 H 0.333 2.145 7.869 1.00 . A A . 2 ARG HD2 1 1 14 1657 1 1 2 ARG HD3 H -1.319 1.828 7.341 1.00 . A A . 2 ARG HD3 1 1 14 1658 1 1 2 ARG HE H 0.290 0.200 9.075 1.00 . A A . 2 ARG HE 1 1 14 1659 1 1 2 ARG HG2 H -0.259 0.006 5.854 1.00 . A A . 2 ARG HG2 1 1 14 1660 1 1 2 ARG HG3 H 1.262 0.864 6.156 1.00 . A A . 2 ARG HG3 1 1 14 1661 1 1 2 ARG HH11 H -2.385 0.202 6.834 1.00 . A A . 2 ARG HH11 1 1 14 1662 1 1 2 ARG HH12 H -3.113 -1.217 7.508 1.00 . A A . 2 ARG HH12 1 1 14 1663 1 1 2 ARG HH21 H -0.666 -1.667 9.962 1.00 . A A . 2 ARG HH21 1 1 14 1664 1 1 2 ARG HH22 H -2.138 -2.278 9.284 1.00 . A A . 2 ARG HH22 1 1 14 1665 1 1 2 ARG N N 1.873 3.071 4.231 1.00 . A A . 2 ARG N 1 1 14 1666 1 1 2 ARG NE N -0.420 0.283 8.405 1.00 . A A . 2 ARG NE 1 1 14 1667 1 1 2 ARG NH1 N -2.380 -0.537 7.507 1.00 . A A . 2 ARG NH1 1 1 14 1668 1 1 2 ARG NH2 N -1.402 -1.602 9.288 1.00 . A A . 2 ARG NH2 1 1 14 1669 1 1 2 ARG O O -0.975 2.772 2.548 1.00 . A A . 2 ARG O 1 1 14 1670 1 1 3 PHE C C -0.195 1.223 -0.463 1.00 . A A . 3 PHE C 1 1 14 1671 1 1 3 PHE CA C 0.401 2.482 0.159 1.00 . A A . 3 PHE CA 1 1 14 1672 1 1 3 PHE CB C 1.500 3.044 -0.739 1.00 . A A . 3 PHE CB 1 1 14 1673 1 1 3 PHE CD1 C 2.033 5.489 -0.562 1.00 . A A . 3 PHE CD1 1 1 14 1674 1 1 3 PHE CD2 C 0.315 4.809 -2.070 1.00 . A A . 3 PHE CD2 1 1 14 1675 1 1 3 PHE CE1 C 1.832 6.808 -0.922 1.00 . A A . 3 PHE CE1 1 1 14 1676 1 1 3 PHE CE2 C 0.108 6.127 -2.434 1.00 . A A . 3 PHE CE2 1 1 14 1677 1 1 3 PHE CG C 1.278 4.476 -1.132 1.00 . A A . 3 PHE CG 1 1 14 1678 1 1 3 PHE CZ C 0.868 7.127 -1.859 1.00 . A A . 3 PHE CZ 1 1 14 1679 1 1 3 PHE H H 1.854 1.897 1.582 1.00 . A A . 3 PHE H 1 1 14 1680 1 1 3 PHE HA H -0.374 3.221 0.258 1.00 . A A . 3 PHE HA 1 1 14 1681 1 1 3 PHE HB2 H 2.441 2.989 -0.211 1.00 . A A . 3 PHE HB2 1 1 14 1682 1 1 3 PHE HB3 H 1.557 2.453 -1.645 1.00 . A A . 3 PHE HB3 1 1 14 1683 1 1 3 PHE HD1 H 2.787 5.241 0.170 1.00 . A A . 3 PHE HD1 1 1 14 1684 1 1 3 PHE HD2 H -0.279 4.028 -2.520 1.00 . A A . 3 PHE HD2 1 1 14 1685 1 1 3 PHE HE1 H 2.426 7.589 -0.471 1.00 . A A . 3 PHE HE1 1 1 14 1686 1 1 3 PHE HE2 H -0.646 6.373 -3.166 1.00 . A A . 3 PHE HE2 1 1 14 1687 1 1 3 PHE HZ H 0.708 8.157 -2.142 1.00 . A A . 3 PHE HZ 1 1 14 1688 1 1 3 PHE N N 0.930 2.210 1.490 1.00 . A A . 3 PHE N 1 1 14 1689 1 1 3 PHE O O 0.448 0.553 -1.271 1.00 . A A . 3 PHE O 1 1 14 1690 1 1 4 LEU C C -2.180 -0.242 -2.122 1.00 . A A . 4 LEU C 1 1 14 1691 1 1 4 LEU CA C -2.111 -0.274 -0.599 1.00 . A A . 4 LEU CA 1 1 14 1692 1 1 4 LEU CB C -3.521 -0.369 -0.015 1.00 . A A . 4 LEU CB 1 1 14 1693 1 1 4 LEU CD1 C -3.718 0.910 2.128 1.00 . A A . 4 LEU CD1 1 1 14 1694 1 1 4 LEU CD2 C -4.729 -1.370 1.941 1.00 . A A . 4 LEU CD2 1 1 14 1695 1 1 4 LEU CG C -3.580 -0.470 1.508 1.00 . A A . 4 LEU CG 1 1 14 1696 1 1 4 LEU H H -1.889 1.477 0.569 1.00 . A A . 4 LEU H 1 1 14 1697 1 1 4 LEU HA H -1.548 -1.142 -0.293 1.00 . A A . 4 LEU HA 1 1 14 1698 1 1 4 LEU HB2 H -4.075 0.508 -0.321 1.00 . A A . 4 LEU HB2 1 1 14 1699 1 1 4 LEU HB3 H -4.003 -1.241 -0.431 1.00 . A A . 4 LEU HB3 1 1 14 1700 1 1 4 LEU HD11 H -4.208 1.570 1.428 1.00 . A A . 4 LEU HD11 1 1 14 1701 1 1 4 LEU HD12 H -2.737 1.297 2.361 1.00 . A A . 4 LEU HD12 1 1 14 1702 1 1 4 LEU HD13 H -4.304 0.843 3.032 1.00 . A A . 4 LEU HD13 1 1 14 1703 1 1 4 LEU HD21 H -4.682 -2.301 1.395 1.00 . A A . 4 LEU HD21 1 1 14 1704 1 1 4 LEU HD22 H -5.668 -0.878 1.735 1.00 . A A . 4 LEU HD22 1 1 14 1705 1 1 4 LEU HD23 H -4.652 -1.569 3.000 1.00 . A A . 4 LEU HD23 1 1 14 1706 1 1 4 LEU HG H -2.659 -0.905 1.868 1.00 . A A . 4 LEU HG 1 1 14 1707 1 1 4 LEU N N -1.428 0.905 -0.080 1.00 . A A . 4 LEU N 1 1 14 1708 1 1 4 LEU O O -2.961 0.513 -2.702 1.00 . A A . 4 LEU O 1 1 14 1709 1 1 5 ARG C C -1.642 -2.543 -4.709 1.00 . A A . 5 ARG C 1 1 14 1710 1 1 5 ARG CA C -1.328 -1.132 -4.221 1.00 . A A . 5 ARG CA 1 1 14 1711 1 1 5 ARG CB C 0.041 -0.693 -4.744 1.00 . A A . 5 ARG CB 1 1 14 1712 1 1 5 ARG CD C 1.150 -0.664 -7.000 1.00 . A A . 5 ARG CD 1 1 14 1713 1 1 5 ARG CG C 0.001 -0.135 -6.158 1.00 . A A . 5 ARG CG 1 1 14 1714 1 1 5 ARG CZ C 2.004 1.309 -8.205 1.00 . A A . 5 ARG CZ 1 1 14 1715 1 1 5 ARG H H -0.761 -1.644 -2.247 1.00 . A A . 5 ARG H 1 1 14 1716 1 1 5 ARG HA H -2.081 -0.457 -4.600 1.00 . A A . 5 ARG HA 1 1 14 1717 1 1 5 ARG HB2 H 0.434 0.075 -4.088 1.00 . A A . 5 ARG HB2 1 1 14 1718 1 1 5 ARG HB3 H 0.708 -1.547 -4.734 1.00 . A A . 5 ARG HB3 1 1 14 1719 1 1 5 ARG HD2 H 2.051 -0.652 -6.405 1.00 . A A . 5 ARG HD2 1 1 14 1720 1 1 5 ARG HD3 H 0.927 -1.679 -7.294 1.00 . A A . 5 ARG HD3 1 1 14 1721 1 1 5 ARG HE H 1.014 -0.206 -9.047 1.00 . A A . 5 ARG HE 1 1 14 1722 1 1 5 ARG HG2 H -0.932 -0.421 -6.620 1.00 . A A . 5 ARG HG2 1 1 14 1723 1 1 5 ARG HG3 H 0.066 0.942 -6.111 1.00 . A A . 5 ARG HG3 1 1 14 1724 1 1 5 ARG HH11 H 2.383 1.311 -6.218 1.00 . A A . 5 ARG HH11 1 1 14 1725 1 1 5 ARG HH12 H 2.973 2.688 -7.088 1.00 . A A . 5 ARG HH12 1 1 14 1726 1 1 5 ARG HH21 H 1.788 1.603 -10.193 1.00 . A A . 5 ARG HH21 1 1 14 1727 1 1 5 ARG HH22 H 2.634 2.854 -9.345 1.00 . A A . 5 ARG HH22 1 1 14 1728 1 1 5 ARG N N -1.359 -1.066 -2.765 1.00 . A A . 5 ARG N 1 1 14 1729 1 1 5 ARG NE N 1.365 0.141 -8.200 1.00 . A A . 5 ARG NE 1 1 14 1730 1 1 5 ARG NH1 N 2.493 1.810 -7.078 1.00 . A A . 5 ARG NH1 1 1 14 1731 1 1 5 ARG NH2 N 2.155 1.977 -9.341 1.00 . A A . 5 ARG NH2 1 1 14 1732 1 1 5 ARG O O -0.909 -3.488 -4.419 1.00 . A A . 5 ARG O 1 1 14 1733 1 1 6 HIS C C -3.565 -3.857 -7.440 1.00 . A A . 6 HIS C 1 1 14 1734 1 1 6 HIS CA C -3.148 -3.972 -5.978 1.00 . A A . 6 HIS CA 1 1 14 1735 1 1 6 HIS CB C -4.302 -4.541 -5.149 1.00 . A A . 6 HIS CB 1 1 14 1736 1 1 6 HIS CD2 C -5.799 -2.536 -5.836 1.00 . A A . 6 HIS CD2 1 1 14 1737 1 1 6 HIS CE1 C -7.618 -3.110 -4.755 1.00 . A A . 6 HIS CE1 1 1 14 1738 1 1 6 HIS CG C -5.541 -3.701 -5.196 1.00 . A A . 6 HIS CG 1 1 14 1739 1 1 6 HIS H H -3.281 -1.886 -5.647 1.00 . A A . 6 HIS H 1 1 14 1740 1 1 6 HIS HA H -2.304 -4.641 -5.909 1.00 . A A . 6 HIS HA 1 1 14 1741 1 1 6 HIS HB2 H -4.554 -5.525 -5.523 1.00 . A A . 6 HIS HB2 1 1 14 1742 1 1 6 HIS HB3 H -3.989 -4.617 -4.114 1.00 . A A . 6 HIS HB3 1 1 14 1743 1 1 6 HIS HD1 H -6.833 -4.828 -3.970 1.00 . A A . 6 HIS HD1 1 1 14 1744 1 1 6 HIS HD2 H -5.111 -1.981 -6.459 1.00 . A A . 6 HIS HD2 1 1 14 1745 1 1 6 HIS HE1 H -8.623 -3.106 -4.360 1.00 . A A . 6 HIS HE1 1 1 14 1746 1 1 6 HIS HE2 H -7.533 -1.353 -5.805 1.00 . A A . 6 HIS HE2 1 1 14 1747 1 1 6 HIS N N -2.737 -2.677 -5.450 1.00 . A A . 6 HIS N 1 1 14 1748 1 1 6 HIS ND1 N -6.701 -4.033 -4.527 1.00 . A A . 6 HIS ND1 1 1 14 1749 1 1 6 HIS NE2 N -7.095 -2.190 -5.545 1.00 . A A . 6 HIS NE2 1 1 14 1750 1 1 6 HIS O O -4.227 -4.790 -7.942 1.00 . A A . 6 HIS O 1 1 15 1751 1 1 1 HIS C C 2.657 3.905 3.706 1.00 . A A . 1 HIS C 1 1 15 1752 1 1 1 HIS CA C 3.158 5.200 4.339 1.00 . A A . 1 HIS CA 1 1 15 1753 1 1 1 HIS CB C 4.514 4.969 5.008 1.00 . A A . 1 HIS CB 1 1 15 1754 1 1 1 HIS CD2 C 5.147 6.678 6.854 1.00 . A A . 1 HIS CD2 1 1 15 1755 1 1 1 HIS CE1 C 6.208 8.128 5.598 1.00 . A A . 1 HIS CE1 1 1 15 1756 1 1 1 HIS CG C 5.118 6.213 5.582 1.00 . A A . 1 HIS CG 1 1 15 1757 1 1 1 HIS H1 H 2.429 6.706 5.537 1.00 . A A . 1 HIS H1 1 1 15 1758 1 1 1 HIS H2 H 2.334 5.136 6.223 1.00 . A A . 1 HIS H2 1 1 15 1759 1 1 1 HIS H3 H 1.244 5.599 4.981 1.00 . A A . 1 HIS H3 1 1 15 1760 1 1 1 HIS HA H 3.265 5.949 3.569 1.00 . A A . 1 HIS HA 1 1 15 1761 1 1 1 HIS HB2 H 4.396 4.257 5.811 1.00 . A A . 1 HIS HB2 1 1 15 1762 1 1 1 HIS HB3 H 5.204 4.570 4.278 1.00 . A A . 1 HIS HB3 1 1 15 1763 1 1 1 HIS HD1 H 5.941 7.092 3.853 1.00 . A A . 1 HIS HD1 1 1 15 1764 1 1 1 HIS HD2 H 4.713 6.201 7.722 1.00 . A A . 1 HIS HD2 1 1 15 1765 1 1 1 HIS HE1 H 6.764 8.996 5.275 1.00 . A A . 1 HIS HE1 1 1 15 1766 1 1 1 HIS HE2 H 5.932 8.479 7.596 1.00 . A A . 1 HIS HE2 1 1 15 1767 1 1 1 HIS N N 2.205 5.706 5.362 1.00 . A A . 1 HIS N 1 1 15 1768 1 1 1 HIS ND1 N 5.791 7.144 4.820 1.00 . A A . 1 HIS ND1 1 1 15 1769 1 1 1 HIS NE2 N 5.830 7.869 6.835 1.00 . A A . 1 HIS NE2 1 1 15 1770 1 1 1 HIS O O 3.014 3.579 2.574 1.00 . A A . 1 HIS O 1 1 15 1771 1 1 2 ARG C C 0.559 2.115 2.619 1.00 . A A . 2 ARG C 1 1 15 1772 1 1 2 ARG CA C 1.277 1.912 3.950 1.00 . A A . 2 ARG CA 1 1 15 1773 1 1 2 ARG CB C 0.313 1.316 4.977 1.00 . A A . 2 ARG CB 1 1 15 1774 1 1 2 ARG CD C -1.033 -0.727 5.549 1.00 . A A . 2 ARG CD 1 1 15 1775 1 1 2 ARG CG C 0.266 -0.203 4.957 1.00 . A A . 2 ARG CG 1 1 15 1776 1 1 2 ARG CZ C -0.334 -2.263 7.344 1.00 . A A . 2 ARG CZ 1 1 15 1777 1 1 2 ARG H H 1.578 3.482 5.337 1.00 . A A . 2 ARG H 1 1 15 1778 1 1 2 ARG HA H 2.098 1.227 3.801 1.00 . A A . 2 ARG HA 1 1 15 1779 1 1 2 ARG HB2 H 0.616 1.632 5.964 1.00 . A A . 2 ARG HB2 1 1 15 1780 1 1 2 ARG HB3 H -0.682 1.688 4.778 1.00 . A A . 2 ARG HB3 1 1 15 1781 1 1 2 ARG HD2 H -1.783 0.048 5.480 1.00 . A A . 2 ARG HD2 1 1 15 1782 1 1 2 ARG HD3 H -1.352 -1.587 4.979 1.00 . A A . 2 ARG HD3 1 1 15 1783 1 1 2 ARG HE H -1.201 -0.488 7.630 1.00 . A A . 2 ARG HE 1 1 15 1784 1 1 2 ARG HG2 H 0.345 -0.544 3.932 1.00 . A A . 2 ARG HG2 1 1 15 1785 1 1 2 ARG HG3 H 1.097 -0.587 5.537 1.00 . A A . 2 ARG HG3 1 1 15 1786 1 1 2 ARG HH11 H 0.039 -2.936 5.474 1.00 . A A . 2 ARG HH11 1 1 15 1787 1 1 2 ARG HH12 H 0.521 -3.997 6.754 1.00 . A A . 2 ARG HH12 1 1 15 1788 1 1 2 ARG HH21 H -0.566 -1.882 9.316 1.00 . A A . 2 ARG HH21 1 1 15 1789 1 1 2 ARG HH22 H 0.178 -3.399 8.935 1.00 . A A . 2 ARG HH22 1 1 15 1790 1 1 2 ARG N N 1.827 3.171 4.442 1.00 . A A . 2 ARG N 1 1 15 1791 1 1 2 ARG NE N -0.880 -1.115 6.949 1.00 . A A . 2 ARG NE 1 1 15 1792 1 1 2 ARG NH1 N 0.112 -3.137 6.450 1.00 . A A . 2 ARG NH1 1 1 15 1793 1 1 2 ARG NH2 N -0.232 -2.537 8.638 1.00 . A A . 2 ARG NH2 1 1 15 1794 1 1 2 ARG O O -0.634 2.417 2.585 1.00 . A A . 2 ARG O 1 1 15 1795 1 1 3 PHE C C 0.542 0.768 -0.497 1.00 . A A . 3 PHE C 1 1 15 1796 1 1 3 PHE CA C 0.730 2.117 0.192 1.00 . A A . 3 PHE CA 1 1 15 1797 1 1 3 PHE CB C 1.630 3.017 -0.651 1.00 . A A . 3 PHE CB 1 1 15 1798 1 1 3 PHE CD1 C 1.416 5.500 -0.366 1.00 . A A . 3 PHE CD1 1 1 15 1799 1 1 3 PHE CD2 C -0.001 4.414 -1.948 1.00 . A A . 3 PHE CD2 1 1 15 1800 1 1 3 PHE CE1 C 0.840 6.717 -0.681 1.00 . A A . 3 PHE CE1 1 1 15 1801 1 1 3 PHE CE2 C -0.581 5.628 -2.267 1.00 . A A . 3 PHE CE2 1 1 15 1802 1 1 3 PHE CG C 1.002 4.337 -0.996 1.00 . A A . 3 PHE CG 1 1 15 1803 1 1 3 PHE CZ C -0.159 6.780 -1.633 1.00 . A A . 3 PHE CZ 1 1 15 1804 1 1 3 PHE H H 2.241 1.711 1.617 1.00 . A A . 3 PHE H 1 1 15 1805 1 1 3 PHE HA H -0.229 2.591 0.297 1.00 . A A . 3 PHE HA 1 1 15 1806 1 1 3 PHE HB2 H 2.536 3.217 -0.099 1.00 . A A . 3 PHE HB2 1 1 15 1807 1 1 3 PHE HB3 H 1.873 2.510 -1.577 1.00 . A A . 3 PHE HB3 1 1 15 1808 1 1 3 PHE HD1 H 2.198 5.451 0.377 1.00 . A A . 3 PHE HD1 1 1 15 1809 1 1 3 PHE HD2 H -0.331 3.514 -2.444 1.00 . A A . 3 PHE HD2 1 1 15 1810 1 1 3 PHE HE1 H 1.171 7.616 -0.183 1.00 . A A . 3 PHE HE1 1 1 15 1811 1 1 3 PHE HE2 H -1.362 5.675 -3.011 1.00 . A A . 3 PHE HE2 1 1 15 1812 1 1 3 PHE HZ H -0.611 7.730 -1.880 1.00 . A A . 3 PHE HZ 1 1 15 1813 1 1 3 PHE N N 1.295 1.949 1.525 1.00 . A A . 3 PHE N 1 1 15 1814 1 1 3 PHE O O 1.405 0.319 -1.250 1.00 . A A . 3 PHE O 1 1 15 1815 1 1 4 LEU C C -0.810 -1.115 -2.345 1.00 . A A . 4 LEU C 1 1 15 1816 1 1 4 LEU CA C -0.896 -1.171 -0.823 1.00 . A A . 4 LEU CA 1 1 15 1817 1 1 4 LEU CB C -2.290 -1.634 -0.397 1.00 . A A . 4 LEU CB 1 1 15 1818 1 1 4 LEU CD1 C -3.024 -0.527 1.725 1.00 . A A . 4 LEU CD1 1 1 15 1819 1 1 4 LEU CD2 C -3.398 -2.979 1.407 1.00 . A A . 4 LEU CD2 1 1 15 1820 1 1 4 LEU CG C -2.477 -1.804 1.111 1.00 . A A . 4 LEU CG 1 1 15 1821 1 1 4 LEU H H -1.241 0.536 0.379 1.00 . A A . 4 LEU H 1 1 15 1822 1 1 4 LEU HA H -0.167 -1.878 -0.457 1.00 . A A . 4 LEU HA 1 1 15 1823 1 1 4 LEU HB2 H -3.010 -0.912 -0.751 1.00 . A A . 4 LEU HB2 1 1 15 1824 1 1 4 LEU HB3 H -2.492 -2.583 -0.871 1.00 . A A . 4 LEU HB3 1 1 15 1825 1 1 4 LEU HD11 H -3.598 0.011 0.985 1.00 . A A . 4 LEU HD11 1 1 15 1826 1 1 4 LEU HD12 H -2.204 0.089 2.062 1.00 . A A . 4 LEU HD12 1 1 15 1827 1 1 4 LEU HD13 H -3.659 -0.773 2.564 1.00 . A A . 4 LEU HD13 1 1 15 1828 1 1 4 LEU HD21 H -2.961 -3.886 1.017 1.00 . A A . 4 LEU HD21 1 1 15 1829 1 1 4 LEU HD22 H -4.357 -2.811 0.939 1.00 . A A . 4 LEU HD22 1 1 15 1830 1 1 4 LEU HD23 H -3.530 -3.073 2.474 1.00 . A A . 4 LEU HD23 1 1 15 1831 1 1 4 LEU HG H -1.518 -2.006 1.564 1.00 . A A . 4 LEU HG 1 1 15 1832 1 1 4 LEU N N -0.593 0.127 -0.231 1.00 . A A . 4 LEU N 1 1 15 1833 1 1 4 LEU O O -0.577 -0.054 -2.925 1.00 . A A . 4 LEU O 1 1 15 1834 1 1 5 ARG C C -2.232 -2.933 -5.004 1.00 . A A . 5 ARG C 1 1 15 1835 1 1 5 ARG CA C -0.942 -2.345 -4.441 1.00 . A A . 5 ARG CA 1 1 15 1836 1 1 5 ARG CB C 0.253 -3.195 -4.879 1.00 . A A . 5 ARG CB 1 1 15 1837 1 1 5 ARG CD C 2.001 -3.306 -6.681 1.00 . A A . 5 ARG CD 1 1 15 1838 1 1 5 ARG CG C 0.521 -3.141 -6.374 1.00 . A A . 5 ARG CG 1 1 15 1839 1 1 5 ARG CZ C 1.952 -5.432 -7.926 1.00 . A A . 5 ARG CZ 1 1 15 1840 1 1 5 ARG H H -1.180 -3.076 -2.469 1.00 . A A . 5 ARG H 1 1 15 1841 1 1 5 ARG HA H -0.819 -1.344 -4.825 1.00 . A A . 5 ARG HA 1 1 15 1842 1 1 5 ARG HB2 H 1.138 -2.844 -4.363 1.00 . A A . 5 ARG HB2 1 1 15 1843 1 1 5 ARG HB3 H 0.065 -4.227 -4.605 1.00 . A A . 5 ARG HB3 1 1 15 1844 1 1 5 ARG HD2 H 2.432 -2.330 -6.847 1.00 . A A . 5 ARG HD2 1 1 15 1845 1 1 5 ARG HD3 H 2.482 -3.772 -5.833 1.00 . A A . 5 ARG HD3 1 1 15 1846 1 1 5 ARG HE H 2.600 -3.693 -8.658 1.00 . A A . 5 ARG HE 1 1 15 1847 1 1 5 ARG HG2 H -0.027 -3.935 -6.858 1.00 . A A . 5 ARG HG2 1 1 15 1848 1 1 5 ARG HG3 H 0.187 -2.187 -6.755 1.00 . A A . 5 ARG HG3 1 1 15 1849 1 1 5 ARG HH11 H 1.264 -5.557 -6.028 1.00 . A A . 5 ARG HH11 1 1 15 1850 1 1 5 ARG HH12 H 1.241 -7.038 -6.924 1.00 . A A . 5 ARG HH12 1 1 15 1851 1 1 5 ARG HH21 H 2.569 -5.640 -9.839 1.00 . A A . 5 ARG HH21 1 1 15 1852 1 1 5 ARG HH22 H 1.982 -7.086 -9.087 1.00 . A A . 5 ARG HH22 1 1 15 1853 1 1 5 ARG N N -0.998 -2.264 -2.986 1.00 . A A . 5 ARG N 1 1 15 1854 1 1 5 ARG NE N 2.225 -4.131 -7.866 1.00 . A A . 5 ARG NE 1 1 15 1855 1 1 5 ARG NH1 N 1.444 -6.060 -6.872 1.00 . A A . 5 ARG NH1 1 1 15 1856 1 1 5 ARG NH2 N 2.187 -6.108 -9.042 1.00 . A A . 5 ARG NH2 1 1 15 1857 1 1 5 ARG O O -2.332 -4.140 -5.225 1.00 . A A . 5 ARG O 1 1 15 1858 1 1 6 HIS C C -4.680 -2.027 -7.209 1.00 . A A . 6 HIS C 1 1 15 1859 1 1 6 HIS CA C -4.502 -2.505 -5.771 1.00 . A A . 6 HIS CA 1 1 15 1860 1 1 6 HIS CB C -5.645 -1.980 -4.902 1.00 . A A . 6 HIS CB 1 1 15 1861 1 1 6 HIS CD2 C -5.655 0.535 -5.536 1.00 . A A . 6 HIS CD2 1 1 15 1862 1 1 6 HIS CE1 C -5.427 1.374 -3.524 1.00 . A A . 6 HIS CE1 1 1 15 1863 1 1 6 HIS CG C -5.588 -0.502 -4.668 1.00 . A A . 6 HIS CG 1 1 15 1864 1 1 6 HIS H H -3.077 -1.122 -5.038 1.00 . A A . 6 HIS H 1 1 15 1865 1 1 6 HIS HA H -4.519 -3.585 -5.759 1.00 . A A . 6 HIS HA 1 1 15 1866 1 1 6 HIS HB2 H -6.589 -2.203 -5.386 1.00 . A A . 6 HIS HB2 1 1 15 1867 1 1 6 HIS HB3 H -5.610 -2.472 -3.936 1.00 . A A . 6 HIS HB3 1 1 15 1868 1 1 6 HIS HD1 H -5.368 -0.437 -2.573 1.00 . A A . 6 HIS HD1 1 1 15 1869 1 1 6 HIS HD2 H -5.768 0.467 -6.609 1.00 . A A . 6 HIS HD2 1 1 15 1870 1 1 6 HIS HE1 H -5.326 2.074 -2.707 1.00 . A A . 6 HIS HE1 1 1 15 1871 1 1 6 HIS HE2 H -5.656 2.599 -5.149 1.00 . A A . 6 HIS HE2 1 1 15 1872 1 1 6 HIS N N -3.217 -2.072 -5.234 1.00 . A A . 6 HIS N 1 1 15 1873 1 1 6 HIS ND1 N -5.445 0.057 -3.416 1.00 . A A . 6 HIS ND1 1 1 15 1874 1 1 6 HIS NE2 N -5.552 1.689 -4.799 1.00 . A A . 6 HIS NE2 1 1 15 1875 1 1 6 HIS O O -4.115 -0.967 -7.553 1.00 . A A . 6 HIS O 1 1 16 1876 1 1 1 HIS C C 2.705 3.180 3.638 1.00 . A A . 1 HIS C 1 1 16 1877 1 1 1 HIS CA C 3.744 4.188 4.116 1.00 . A A . 1 HIS CA 1 1 16 1878 1 1 1 HIS CB C 5.151 3.605 3.973 1.00 . A A . 1 HIS CB 1 1 16 1879 1 1 1 HIS CD2 C 6.285 2.499 6.028 1.00 . A A . 1 HIS CD2 1 1 16 1880 1 1 1 HIS CE1 C 5.326 0.532 5.903 1.00 . A A . 1 HIS CE1 1 1 16 1881 1 1 1 HIS CG C 5.453 2.520 4.960 1.00 . A A . 1 HIS CG 1 1 16 1882 1 1 1 HIS H1 H 2.711 5.198 5.582 1.00 . A A . 1 HIS H1 1 1 16 1883 1 1 1 HIS H2 H 4.390 5.015 5.887 1.00 . A A . 1 HIS H2 1 1 16 1884 1 1 1 HIS H3 H 3.332 3.675 6.066 1.00 . A A . 1 HIS H3 1 1 16 1885 1 1 1 HIS HA H 3.668 5.084 3.517 1.00 . A A . 1 HIS HA 1 1 16 1886 1 1 1 HIS HB2 H 5.263 3.192 2.982 1.00 . A A . 1 HIS HB2 1 1 16 1887 1 1 1 HIS HB3 H 5.876 4.393 4.113 1.00 . A A . 1 HIS HB3 1 1 16 1888 1 1 1 HIS HD1 H 4.213 0.973 4.243 1.00 . A A . 1 HIS HD1 1 1 16 1889 1 1 1 HIS HD2 H 6.909 3.313 6.370 1.00 . A A . 1 HIS HD2 1 1 16 1890 1 1 1 HIS HE1 H 5.045 -0.490 6.111 1.00 . A A . 1 HIS HE1 1 1 16 1891 1 1 1 HIS HE2 H 6.608 0.976 7.437 1.00 . A A . 1 HIS HE2 1 1 16 1892 1 1 1 HIS N N 3.525 4.552 5.541 1.00 . A A . 1 HIS N 1 1 16 1893 1 1 1 HIS ND1 N 4.868 1.272 4.908 1.00 . A A . 1 HIS ND1 1 1 16 1894 1 1 1 HIS NE2 N 6.187 1.253 6.596 1.00 . A A . 1 HIS NE2 1 1 16 1895 1 1 1 HIS O O 3.007 2.293 2.840 1.00 . A A . 1 HIS O 1 1 16 1896 1 1 2 ARG C C 0.023 2.618 2.282 1.00 . A A . 2 ARG C 1 1 16 1897 1 1 2 ARG CA C 0.393 2.427 3.750 1.00 . A A . 2 ARG CA 1 1 16 1898 1 1 2 ARG CB C -0.832 2.670 4.636 1.00 . A A . 2 ARG CB 1 1 16 1899 1 1 2 ARG CD C -1.616 2.281 6.991 1.00 . A A . 2 ARG CD 1 1 16 1900 1 1 2 ARG CG C -0.978 1.657 5.760 1.00 . A A . 2 ARG CG 1 1 16 1901 1 1 2 ARG CZ C -2.700 0.394 8.148 1.00 . A A . 2 ARG CZ 1 1 16 1902 1 1 2 ARG H H 1.298 4.052 4.761 1.00 . A A . 2 ARG H 1 1 16 1903 1 1 2 ARG HA H 0.735 1.414 3.893 1.00 . A A . 2 ARG HA 1 1 16 1904 1 1 2 ARG HB2 H -0.754 3.654 5.075 1.00 . A A . 2 ARG HB2 1 1 16 1905 1 1 2 ARG HB3 H -1.721 2.628 4.025 1.00 . A A . 2 ARG HB3 1 1 16 1906 1 1 2 ARG HD2 H -1.002 3.106 7.320 1.00 . A A . 2 ARG HD2 1 1 16 1907 1 1 2 ARG HD3 H -2.597 2.647 6.726 1.00 . A A . 2 ARG HD3 1 1 16 1908 1 1 2 ARG HE H -1.091 1.371 8.812 1.00 . A A . 2 ARG HE 1 1 16 1909 1 1 2 ARG HG2 H -1.603 0.842 5.418 1.00 . A A . 2 ARG HG2 1 1 16 1910 1 1 2 ARG HG3 H 0.003 1.282 6.024 1.00 . A A . 2 ARG HG3 1 1 16 1911 1 1 2 ARG HH11 H -3.577 0.922 6.403 1.00 . A A . 2 ARG HH11 1 1 16 1912 1 1 2 ARG HH12 H -4.319 -0.403 7.236 1.00 . A A . 2 ARG HH12 1 1 16 1913 1 1 2 ARG HH21 H -2.066 -0.371 9.908 1.00 . A A . 2 ARG HH21 1 1 16 1914 1 1 2 ARG HH22 H -3.462 -1.136 9.226 1.00 . A A . 2 ARG HH22 1 1 16 1915 1 1 2 ARG N N 1.478 3.324 4.129 1.00 . A A . 2 ARG N 1 1 16 1916 1 1 2 ARG NE N -1.747 1.322 8.085 1.00 . A A . 2 ARG NE 1 1 16 1917 1 1 2 ARG NH1 N -3.606 0.297 7.183 1.00 . A A . 2 ARG NH1 1 1 16 1918 1 1 2 ARG NH2 N -2.746 -0.439 9.178 1.00 . A A . 2 ARG NH2 1 1 16 1919 1 1 2 ARG O O -1.005 3.215 1.962 1.00 . A A . 2 ARG O 1 1 16 1920 1 1 3 PHE C C 0.083 0.926 -0.611 1.00 . A A . 3 PHE C 1 1 16 1921 1 1 3 PHE CA C 0.639 2.227 -0.040 1.00 . A A . 3 PHE CA 1 1 16 1922 1 1 3 PHE CB C 1.935 2.604 -0.753 1.00 . A A . 3 PHE CB 1 1 16 1923 1 1 3 PHE CD1 C 2.619 5.018 -0.742 1.00 . A A . 3 PHE CD1 1 1 16 1924 1 1 3 PHE CD2 C 1.189 4.253 -2.490 1.00 . A A . 3 PHE CD2 1 1 16 1925 1 1 3 PHE CE1 C 2.603 6.291 -1.280 1.00 . A A . 3 PHE CE1 1 1 16 1926 1 1 3 PHE CE2 C 1.168 5.524 -3.033 1.00 . A A . 3 PHE CE2 1 1 16 1927 1 1 3 PHE CG C 1.914 3.986 -1.340 1.00 . A A . 3 PHE CG 1 1 16 1928 1 1 3 PHE CZ C 1.876 6.544 -2.427 1.00 . A A . 3 PHE CZ 1 1 16 1929 1 1 3 PHE H H 1.675 1.648 1.712 1.00 . A A . 3 PHE H 1 1 16 1930 1 1 3 PHE HA H -0.081 3.011 -0.194 1.00 . A A . 3 PHE HA 1 1 16 1931 1 1 3 PHE HB2 H 2.746 2.561 -0.042 1.00 . A A . 3 PHE HB2 1 1 16 1932 1 1 3 PHE HB3 H 2.117 1.901 -1.557 1.00 . A A . 3 PHE HB3 1 1 16 1933 1 1 3 PHE HD1 H 3.188 4.821 0.155 1.00 . A A . 3 PHE HD1 1 1 16 1934 1 1 3 PHE HD2 H 0.635 3.457 -2.964 1.00 . A A . 3 PHE HD2 1 1 16 1935 1 1 3 PHE HE1 H 3.156 7.086 -0.804 1.00 . A A . 3 PHE HE1 1 1 16 1936 1 1 3 PHE HE2 H 0.599 5.720 -3.930 1.00 . A A . 3 PHE HE2 1 1 16 1937 1 1 3 PHE HZ H 1.861 7.538 -2.850 1.00 . A A . 3 PHE HZ 1 1 16 1938 1 1 3 PHE N N 0.872 2.110 1.394 1.00 . A A . 3 PHE N 1 1 16 1939 1 1 3 PHE O O 0.825 0.108 -1.154 1.00 . A A . 3 PHE O 1 1 16 1940 1 1 4 LEU C C -1.584 -0.674 -2.466 1.00 . A A . 4 LEU C 1 1 16 1941 1 1 4 LEU CA C -1.886 -0.459 -0.986 1.00 . A A . 4 LEU CA 1 1 16 1942 1 1 4 LEU CB C -3.397 -0.364 -0.773 1.00 . A A . 4 LEU CB 1 1 16 1943 1 1 4 LEU CD1 C -3.972 1.242 1.060 1.00 . A A . 4 LEU CD1 1 1 16 1944 1 1 4 LEU CD2 C -5.139 -0.965 0.927 1.00 . A A . 4 LEU CD2 1 1 16 1945 1 1 4 LEU CG C -3.833 -0.224 0.686 1.00 . A A . 4 LEU CG 1 1 16 1946 1 1 4 LEU H H -1.766 1.430 -0.040 1.00 . A A . 4 LEU H 1 1 16 1947 1 1 4 LEU HA H -1.507 -1.300 -0.427 1.00 . A A . 4 LEU HA 1 1 16 1948 1 1 4 LEU HB2 H -3.764 0.492 -1.321 1.00 . A A . 4 LEU HB2 1 1 16 1949 1 1 4 LEU HB3 H -3.854 -1.254 -1.178 1.00 . A A . 4 LEU HB3 1 1 16 1950 1 1 4 LEU HD11 H -4.211 1.817 0.179 1.00 . A A . 4 LEU HD11 1 1 16 1951 1 1 4 LEU HD12 H -3.041 1.595 1.478 1.00 . A A . 4 LEU HD12 1 1 16 1952 1 1 4 LEU HD13 H -4.760 1.355 1.790 1.00 . A A . 4 LEU HD13 1 1 16 1953 1 1 4 LEU HD21 H -5.963 -0.374 0.554 1.00 . A A . 4 LEU HD21 1 1 16 1954 1 1 4 LEU HD22 H -5.267 -1.133 1.987 1.00 . A A . 4 LEU HD22 1 1 16 1955 1 1 4 LEU HD23 H -5.115 -1.914 0.413 1.00 . A A . 4 LEU HD23 1 1 16 1956 1 1 4 LEU HG H -3.076 -0.658 1.323 1.00 . A A . 4 LEU HG 1 1 16 1957 1 1 4 LEU N N -1.228 0.742 -0.484 1.00 . A A . 4 LEU N 1 1 16 1958 1 1 4 LEU O O -2.097 0.042 -3.326 1.00 . A A . 4 LEU O 1 1 16 1959 1 1 5 ARG C C -1.379 -2.939 -4.760 1.00 . A A . 5 ARG C 1 1 16 1960 1 1 5 ARG CA C -0.376 -1.976 -4.132 1.00 . A A . 5 ARG CA 1 1 16 1961 1 1 5 ARG CB C 1.029 -2.578 -4.180 1.00 . A A . 5 ARG CB 1 1 16 1962 1 1 5 ARG CD C 3.138 -2.538 -5.546 1.00 . A A . 5 ARG CD 1 1 16 1963 1 1 5 ARG CG C 1.621 -2.628 -5.579 1.00 . A A . 5 ARG CG 1 1 16 1964 1 1 5 ARG CZ C 3.592 -0.121 -5.699 1.00 . A A . 5 ARG CZ 1 1 16 1965 1 1 5 ARG H H -0.370 -2.202 -2.027 1.00 . A A . 5 ARG H 1 1 16 1966 1 1 5 ARG HA H -0.382 -1.053 -4.692 1.00 . A A . 5 ARG HA 1 1 16 1967 1 1 5 ARG HB2 H 1.686 -1.982 -3.557 1.00 . A A . 5 ARG HB2 1 1 16 1968 1 1 5 ARG HB3 H 0.989 -3.590 -3.792 1.00 . A A . 5 ARG HB3 1 1 16 1969 1 1 5 ARG HD2 H 3.519 -3.336 -4.927 1.00 . A A . 5 ARG HD2 1 1 16 1970 1 1 5 ARG HD3 H 3.514 -2.654 -6.552 1.00 . A A . 5 ARG HD3 1 1 16 1971 1 1 5 ARG HE H 3.931 -1.249 -4.088 1.00 . A A . 5 ARG HE 1 1 16 1972 1 1 5 ARG HG2 H 1.336 -3.559 -6.047 1.00 . A A . 5 ARG HG2 1 1 16 1973 1 1 5 ARG HG3 H 1.232 -1.800 -6.154 1.00 . A A . 5 ARG HG3 1 1 16 1974 1 1 5 ARG HH11 H 2.819 -0.936 -7.382 1.00 . A A . 5 ARG HH11 1 1 16 1975 1 1 5 ARG HH12 H 3.146 0.762 -7.462 1.00 . A A . 5 ARG HH12 1 1 16 1976 1 1 5 ARG HH21 H 4.362 0.984 -4.193 1.00 . A A . 5 ARG HH21 1 1 16 1977 1 1 5 ARG HH22 H 4.023 1.853 -5.652 1.00 . A A . 5 ARG HH22 1 1 16 1978 1 1 5 ARG N N -0.747 -1.666 -2.756 1.00 . A A . 5 ARG N 1 1 16 1979 1 1 5 ARG NE N 3.599 -1.260 -5.010 1.00 . A A . 5 ARG NE 1 1 16 1980 1 1 5 ARG NH1 N 3.149 -0.097 -6.950 1.00 . A A . 5 ARG NH1 1 1 16 1981 1 1 5 ARG NH2 N 4.028 0.997 -5.135 1.00 . A A . 5 ARG NH2 1 1 16 1982 1 1 5 ARG O O -1.081 -4.116 -4.966 1.00 . A A . 5 ARG O 1 1 16 1983 1 1 6 HIS C C -4.696 -2.368 -6.293 1.00 . A A . 6 HIS C 1 1 16 1984 1 1 6 HIS CA C -3.617 -3.245 -5.666 1.00 . A A . 6 HIS CA 1 1 16 1985 1 1 6 HIS CB C -4.240 -4.170 -4.619 1.00 . A A . 6 HIS CB 1 1 16 1986 1 1 6 HIS CD2 C -5.190 -6.045 -6.139 1.00 . A A . 6 HIS CD2 1 1 16 1987 1 1 6 HIS CE1 C -7.262 -6.018 -5.423 1.00 . A A . 6 HIS CE1 1 1 16 1988 1 1 6 HIS CG C -5.276 -5.094 -5.179 1.00 . A A . 6 HIS CG 1 1 16 1989 1 1 6 HIS H H -2.748 -1.486 -4.873 1.00 . A A . 6 HIS H 1 1 16 1990 1 1 6 HIS HA H -3.164 -3.847 -6.440 1.00 . A A . 6 HIS HA 1 1 16 1991 1 1 6 HIS HB2 H -3.460 -4.777 -4.175 1.00 . A A . 6 HIS HB2 1 1 16 1992 1 1 6 HIS HB3 H -4.709 -3.567 -3.850 1.00 . A A . 6 HIS HB3 1 1 16 1993 1 1 6 HIS HD1 H -6.967 -4.523 -4.057 1.00 . A A . 6 HIS HD1 1 1 16 1994 1 1 6 HIS HD2 H -4.305 -6.314 -6.697 1.00 . A A . 6 HIS HD2 1 1 16 1995 1 1 6 HIS HE1 H -8.310 -6.248 -5.300 1.00 . A A . 6 HIS HE1 1 1 16 1996 1 1 6 HIS HE2 H -6.698 -7.260 -6.950 1.00 . A A . 6 HIS HE2 1 1 16 1997 1 1 6 HIS N N -2.569 -2.431 -5.062 1.00 . A A . 6 HIS N 1 1 16 1998 1 1 6 HIS ND1 N -6.587 -5.102 -4.751 1.00 . A A . 6 HIS ND1 1 1 16 1999 1 1 6 HIS NE2 N -6.438 -6.603 -6.271 1.00 . A A . 6 HIS NE2 1 1 16 2000 1 1 6 HIS O O -5.232 -1.492 -5.581 1.00 . A A . 6 HIS O 1 1 17 2001 1 1 1 HIS C C 2.723 3.837 3.707 1.00 . A A . 1 HIS C 1 1 17 2002 1 1 1 HIS CA C 3.200 5.140 4.341 1.00 . A A . 1 HIS CA 1 1 17 2003 1 1 1 HIS CB C 4.510 4.910 5.097 1.00 . A A . 1 HIS CB 1 1 17 2004 1 1 1 HIS CD2 C 4.985 6.355 7.199 1.00 . A A . 1 HIS CD2 1 1 17 2005 1 1 1 HIS CE1 C 5.817 8.117 6.195 1.00 . A A . 1 HIS CE1 1 1 17 2006 1 1 1 HIS CG C 4.973 6.108 5.867 1.00 . A A . 1 HIS CG 1 1 17 2007 1 1 1 HIS H1 H 1.255 5.566 4.857 1.00 . A A . 1 HIS H1 1 1 17 2008 1 1 1 HIS H2 H 2.415 6.681 5.454 1.00 . A A . 1 HIS H2 1 1 17 2009 1 1 1 HIS H3 H 2.263 5.130 6.172 1.00 . A A . 1 HIS H3 1 1 17 2010 1 1 1 HIS HA H 3.362 5.870 3.562 1.00 . A A . 1 HIS HA 1 1 17 2011 1 1 1 HIS HB2 H 4.377 4.098 5.795 1.00 . A A . 1 HIS HB2 1 1 17 2012 1 1 1 HIS HB3 H 5.284 4.649 4.390 1.00 . A A . 1 HIS HB3 1 1 17 2013 1 1 1 HIS HD1 H 5.625 7.361 4.303 1.00 . A A . 1 HIS HD1 1 1 17 2014 1 1 1 HIS HD2 H 4.642 5.688 7.978 1.00 . A A . 1 HIS HD2 1 1 17 2015 1 1 1 HIS HE1 H 6.249 9.091 6.018 1.00 . A A . 1 HIS HE1 1 1 17 2016 1 1 1 HIS HE2 H 5.721 8.024 8.239 1.00 . A A . 1 HIS HE2 1 1 17 2017 1 1 1 HIS N N 2.192 5.678 5.292 1.00 . A A . 1 HIS N 1 1 17 2018 1 1 1 HIS ND1 N 5.500 7.232 5.267 1.00 . A A . 1 HIS ND1 1 1 17 2019 1 1 1 HIS NE2 N 5.514 7.609 7.375 1.00 . A A . 1 HIS NE2 1 1 17 2020 1 1 1 HIS O O 3.117 3.498 2.592 1.00 . A A . 1 HIS O 1 1 17 2021 1 1 2 ARG C C 0.599 2.048 2.611 1.00 . A A . 2 ARG C 1 1 17 2022 1 1 2 ARG CA C 1.339 1.845 3.930 1.00 . A A . 2 ARG CA 1 1 17 2023 1 1 2 ARG CB C 0.400 1.222 4.964 1.00 . A A . 2 ARG CB 1 1 17 2024 1 1 2 ARG CD C 0.061 1.353 7.451 1.00 . A A . 2 ARG CD 1 1 17 2025 1 1 2 ARG CG C 1.039 1.037 6.332 1.00 . A A . 2 ARG CG 1 1 17 2026 1 1 2 ARG CZ C 0.071 -0.653 8.882 1.00 . A A . 2 ARG CZ 1 1 17 2027 1 1 2 ARG H H 1.592 3.433 5.307 1.00 . A A . 2 ARG H 1 1 17 2028 1 1 2 ARG HA H 2.171 1.178 3.763 1.00 . A A . 2 ARG HA 1 1 17 2029 1 1 2 ARG HB2 H -0.465 1.858 5.078 1.00 . A A . 2 ARG HB2 1 1 17 2030 1 1 2 ARG HB3 H 0.081 0.255 4.607 1.00 . A A . 2 ARG HB3 1 1 17 2031 1 1 2 ARG HD2 H 0.587 1.876 8.236 1.00 . A A . 2 ARG HD2 1 1 17 2032 1 1 2 ARG HD3 H -0.722 1.986 7.060 1.00 . A A . 2 ARG HD3 1 1 17 2033 1 1 2 ARG HE H -1.448 -0.085 7.719 1.00 . A A . 2 ARG HE 1 1 17 2034 1 1 2 ARG HG2 H 1.364 0.009 6.431 1.00 . A A . 2 ARG HG2 1 1 17 2035 1 1 2 ARG HG3 H 1.892 1.701 6.412 1.00 . A A . 2 ARG HG3 1 1 17 2036 1 1 2 ARG HH11 H 1.772 0.438 8.957 1.00 . A A . 2 ARG HH11 1 1 17 2037 1 1 2 ARG HH12 H 1.754 -0.978 9.954 1.00 . A A . 2 ARG HH12 1 1 17 2038 1 1 2 ARG HH21 H -1.475 -1.947 9.030 1.00 . A A . 2 ARG HH21 1 1 17 2039 1 1 2 ARG HH22 H -0.089 -2.333 9.995 1.00 . A A . 2 ARG HH22 1 1 17 2040 1 1 2 ARG N N 1.870 3.110 4.425 1.00 . A A . 2 ARG N 1 1 17 2041 1 1 2 ARG NE N -0.541 0.144 8.010 1.00 . A A . 2 ARG NE 1 1 17 2042 1 1 2 ARG NH1 N 1.300 -0.375 9.298 1.00 . A A . 2 ARG NH1 1 1 17 2043 1 1 2 ARG NH2 N -0.548 -1.733 9.340 1.00 . A A . 2 ARG NH2 1 1 17 2044 1 1 2 ARG O O -0.612 2.271 2.595 1.00 . A A . 2 ARG O 1 1 17 2045 1 1 3 PHE C C 0.456 0.806 -0.470 1.00 . A A . 3 PHE C 1 1 17 2046 1 1 3 PHE CA C 0.752 2.152 0.185 1.00 . A A . 3 PHE CA 1 1 17 2047 1 1 3 PHE CB C 1.691 2.972 -0.696 1.00 . A A . 3 PHE CB 1 1 17 2048 1 1 3 PHE CD1 C 1.675 5.465 -0.409 1.00 . A A . 3 PHE CD1 1 1 17 2049 1 1 3 PHE CD2 C 0.142 4.492 -1.955 1.00 . A A . 3 PHE CD2 1 1 17 2050 1 1 3 PHE CE1 C 1.188 6.722 -0.712 1.00 . A A . 3 PHE CE1 1 1 17 2051 1 1 3 PHE CE2 C -0.350 5.746 -2.262 1.00 . A A . 3 PHE CE2 1 1 17 2052 1 1 3 PHE CG C 1.159 4.337 -1.027 1.00 . A A . 3 PHE CG 1 1 17 2053 1 1 3 PHE CZ C 0.174 6.863 -1.639 1.00 . A A . 3 PHE CZ 1 1 17 2054 1 1 3 PHE H H 2.297 1.795 1.587 1.00 . A A . 3 PHE H 1 1 17 2055 1 1 3 PHE HA H -0.170 2.693 0.303 1.00 . A A . 3 PHE HA 1 1 17 2056 1 1 3 PHE HB2 H 2.628 3.101 -0.177 1.00 . A A . 3 PHE HB2 1 1 17 2057 1 1 3 PHE HB3 H 1.860 2.443 -1.626 1.00 . A A . 3 PHE HB3 1 1 17 2058 1 1 3 PHE HD1 H 2.469 5.355 0.316 1.00 . A A . 3 PHE HD1 1 1 17 2059 1 1 3 PHE HD2 H -0.268 3.619 -2.442 1.00 . A A . 3 PHE HD2 1 1 17 2060 1 1 3 PHE HE1 H 1.598 7.593 -0.223 1.00 . A A . 3 PHE HE1 1 1 17 2061 1 1 3 PHE HE2 H -1.143 5.854 -2.987 1.00 . A A . 3 PHE HE2 1 1 17 2062 1 1 3 PHE HZ H -0.209 7.844 -1.877 1.00 . A A . 3 PHE HZ 1 1 17 2063 1 1 3 PHE N N 1.336 1.973 1.509 1.00 . A A . 3 PHE N 1 1 17 2064 1 1 3 PHE O O 1.301 0.245 -1.167 1.00 . A A . 3 PHE O 1 1 17 2065 1 1 4 LEU C C -1.009 -0.989 -2.324 1.00 . A A . 4 LEU C 1 1 17 2066 1 1 4 LEU CA C -1.160 -0.986 -0.805 1.00 . A A . 4 LEU CA 1 1 17 2067 1 1 4 LEU CB C -2.608 -1.293 -0.425 1.00 . A A . 4 LEU CB 1 1 17 2068 1 1 4 LEU CD1 C -3.309 -0.042 1.628 1.00 . A A . 4 LEU CD1 1 1 17 2069 1 1 4 LEU CD2 C -3.917 -2.454 1.371 1.00 . A A . 4 LEU CD2 1 1 17 2070 1 1 4 LEU CG C -2.871 -1.389 1.078 1.00 . A A . 4 LEU CG 1 1 17 2071 1 1 4 LEU H H -1.378 0.789 0.326 1.00 . A A . 4 LEU H 1 1 17 2072 1 1 4 LEU HA H -0.521 -1.749 -0.390 1.00 . A A . 4 LEU HA 1 1 17 2073 1 1 4 LEU HB2 H -3.238 -0.515 -0.832 1.00 . A A . 4 LEU HB2 1 1 17 2074 1 1 4 LEU HB3 H -2.886 -2.233 -0.877 1.00 . A A . 4 LEU HB3 1 1 17 2075 1 1 4 LEU HD11 H -3.794 0.525 0.847 1.00 . A A . 4 LEU HD11 1 1 17 2076 1 1 4 LEU HD12 H -2.443 0.499 1.981 1.00 . A A . 4 LEU HD12 1 1 17 2077 1 1 4 LEU HD13 H -3.998 -0.193 2.446 1.00 . A A . 4 LEU HD13 1 1 17 2078 1 1 4 LEU HD21 H -3.450 -3.427 1.370 1.00 . A A . 4 LEU HD21 1 1 17 2079 1 1 4 LEU HD22 H -4.686 -2.422 0.613 1.00 . A A . 4 LEU HD22 1 1 17 2080 1 1 4 LEU HD23 H -4.359 -2.268 2.339 1.00 . A A . 4 LEU HD23 1 1 17 2081 1 1 4 LEU HG H -1.956 -1.669 1.578 1.00 . A A . 4 LEU HG 1 1 17 2082 1 1 4 LEU N N -0.749 0.294 -0.240 1.00 . A A . 4 LEU N 1 1 17 2083 1 1 4 LEU O O -0.897 0.066 -2.949 1.00 . A A . 4 LEU O 1 1 17 2084 1 1 5 ARG C C -2.093 -3.016 -4.952 1.00 . A A . 5 ARG C 1 1 17 2085 1 1 5 ARG CA C -0.873 -2.322 -4.356 1.00 . A A . 5 ARG CA 1 1 17 2086 1 1 5 ARG CB C 0.393 -3.110 -4.696 1.00 . A A . 5 ARG CB 1 1 17 2087 1 1 5 ARG CD C 1.703 -4.037 -6.631 1.00 . A A . 5 ARG CD 1 1 17 2088 1 1 5 ARG CG C 0.910 -2.852 -6.102 1.00 . A A . 5 ARG CG 1 1 17 2089 1 1 5 ARG CZ C 1.296 -6.356 -7.358 1.00 . A A . 5 ARG CZ 1 1 17 2090 1 1 5 ARG H H -1.102 -2.986 -2.359 1.00 . A A . 5 ARG H 1 1 17 2091 1 1 5 ARG HA H -0.794 -1.332 -4.780 1.00 . A A . 5 ARG HA 1 1 17 2092 1 1 5 ARG HB2 H 1.173 -2.838 -3.994 1.00 . A A . 5 ARG HB2 1 1 17 2093 1 1 5 ARG HB3 H 0.181 -4.169 -4.602 1.00 . A A . 5 ARG HB3 1 1 17 2094 1 1 5 ARG HD2 H 2.150 -3.762 -7.575 1.00 . A A . 5 ARG HD2 1 1 17 2095 1 1 5 ARG HD3 H 2.481 -4.278 -5.922 1.00 . A A . 5 ARG HD3 1 1 17 2096 1 1 5 ARG HE H -0.078 -5.150 -6.557 1.00 . A A . 5 ARG HE 1 1 17 2097 1 1 5 ARG HG2 H 0.070 -2.674 -6.757 1.00 . A A . 5 ARG HG2 1 1 17 2098 1 1 5 ARG HG3 H 1.548 -1.981 -6.086 1.00 . A A . 5 ARG HG3 1 1 17 2099 1 1 5 ARG HH11 H 3.193 -5.711 -7.634 1.00 . A A . 5 ARG HH11 1 1 17 2100 1 1 5 ARG HH12 H 2.882 -7.339 -8.136 1.00 . A A . 5 ARG HH12 1 1 17 2101 1 1 5 ARG HH21 H -0.490 -7.291 -7.217 1.00 . A A . 5 ARG HH21 1 1 17 2102 1 1 5 ARG HH22 H 0.791 -8.236 -7.900 1.00 . A A . 5 ARG HH22 1 1 17 2103 1 1 5 ARG N N -1.009 -2.181 -2.911 1.00 . A A . 5 ARG N 1 1 17 2104 1 1 5 ARG NE N 0.861 -5.214 -6.830 1.00 . A A . 5 ARG NE 1 1 17 2105 1 1 5 ARG NH1 N 2.561 -6.478 -7.741 1.00 . A A . 5 ARG NH1 1 1 17 2106 1 1 5 ARG NH2 N 0.464 -7.378 -7.503 1.00 . A A . 5 ARG NH2 1 1 17 2107 1 1 5 ARG O O -2.136 -4.242 -5.051 1.00 . A A . 5 ARG O 1 1 17 2108 1 1 6 HIS C C -4.807 -1.867 -7.063 1.00 . A A . 6 HIS C 1 1 17 2109 1 1 6 HIS CA C -4.305 -2.762 -5.935 1.00 . A A . 6 HIS CA 1 1 17 2110 1 1 6 HIS CB C -5.388 -2.910 -4.865 1.00 . A A . 6 HIS CB 1 1 17 2111 1 1 6 HIS CD2 C -5.330 -0.358 -4.401 1.00 . A A . 6 HIS CD2 1 1 17 2112 1 1 6 HIS CE1 C -6.489 -0.345 -2.540 1.00 . A A . 6 HIS CE1 1 1 17 2113 1 1 6 HIS CG C -5.675 -1.639 -4.127 1.00 . A A . 6 HIS CG 1 1 17 2114 1 1 6 HIS H H -2.991 -1.254 -5.244 1.00 . A A . 6 HIS H 1 1 17 2115 1 1 6 HIS HA H -4.076 -3.737 -6.340 1.00 . A A . 6 HIS HA 1 1 17 2116 1 1 6 HIS HB2 H -6.308 -3.235 -5.335 1.00 . A A . 6 HIS HB2 1 1 17 2117 1 1 6 HIS HB3 H -5.070 -3.651 -4.141 1.00 . A A . 6 HIS HB3 1 1 17 2118 1 1 6 HIS HD1 H -6.792 -2.368 -2.496 1.00 . A A . 6 HIS HD1 1 1 17 2119 1 1 6 HIS HD2 H -4.753 -0.016 -5.249 1.00 . A A . 6 HIS HD2 1 1 17 2120 1 1 6 HIS HE1 H -6.999 -0.009 -1.649 1.00 . A A . 6 HIS HE1 1 1 17 2121 1 1 6 HIS HE2 H -5.832 1.405 -3.376 1.00 . A A . 6 HIS HE2 1 1 17 2122 1 1 6 HIS N N -3.083 -2.224 -5.349 1.00 . A A . 6 HIS N 1 1 17 2123 1 1 6 HIS ND1 N -6.400 -1.596 -2.955 1.00 . A A . 6 HIS ND1 1 1 17 2124 1 1 6 HIS NE2 N -5.848 0.426 -3.399 1.00 . A A . 6 HIS NE2 1 1 17 2125 1 1 6 HIS O O -3.977 -1.154 -7.666 1.00 . A A . 6 HIS O 1 1 18 2126 1 1 1 HIS C C 2.785 3.213 3.877 1.00 . A A . 1 HIS C 1 1 18 2127 1 1 1 HIS CA C 3.824 4.194 4.409 1.00 . A A . 1 HIS CA 1 1 18 2128 1 1 1 HIS CB C 5.210 3.549 4.402 1.00 . A A . 1 HIS CB 1 1 18 2129 1 1 1 HIS CD2 C 5.251 1.116 5.303 1.00 . A A . 1 HIS CD2 1 1 18 2130 1 1 1 HIS CE1 C 5.759 1.556 7.390 1.00 . A A . 1 HIS CE1 1 1 18 2131 1 1 1 HIS CG C 5.369 2.460 5.419 1.00 . A A . 1 HIS CG 1 1 18 2132 1 1 1 HIS H1 H 4.359 5.042 6.207 1.00 . A A . 1 HIS H1 1 1 18 2133 1 1 1 HIS H2 H 3.217 3.766 6.328 1.00 . A A . 1 HIS H2 1 1 18 2134 1 1 1 HIS H3 H 2.728 5.305 5.750 1.00 . A A . 1 HIS H3 1 1 18 2135 1 1 1 HIS HA H 3.836 5.071 3.779 1.00 . A A . 1 HIS HA 1 1 18 2136 1 1 1 HIS HB2 H 5.396 3.122 3.428 1.00 . A A . 1 HIS HB2 1 1 18 2137 1 1 1 HIS HB3 H 5.953 4.306 4.606 1.00 . A A . 1 HIS HB3 1 1 18 2138 1 1 1 HIS HD1 H 5.838 3.585 7.138 1.00 . A A . 1 HIS HD1 1 1 18 2139 1 1 1 HIS HD2 H 5.008 0.569 4.403 1.00 . A A . 1 HIS HD2 1 1 18 2140 1 1 1 HIS HE1 H 5.990 1.438 8.439 1.00 . A A . 1 HIS HE1 1 1 18 2141 1 1 1 HIS HE2 H 5.396 -0.366 6.783 1.00 . A A . 1 HIS HE2 1 1 18 2142 1 1 1 HIS N N 3.503 4.615 5.799 1.00 . A A . 1 HIS N 1 1 18 2143 1 1 1 HIS ND1 N 5.687 2.703 6.739 1.00 . A A . 1 HIS ND1 1 1 18 2144 1 1 1 HIS NE2 N 5.498 0.578 6.542 1.00 . A A . 1 HIS NE2 1 1 18 2145 1 1 1 HIS O O 3.102 2.329 3.082 1.00 . A A . 1 HIS O 1 1 18 2146 1 1 2 ARG C C 0.137 2.733 2.410 1.00 . A A . 2 ARG C 1 1 18 2147 1 1 2 ARG CA C 0.456 2.506 3.884 1.00 . A A . 2 ARG CA 1 1 18 2148 1 1 2 ARG CB C -0.792 2.750 4.735 1.00 . A A . 2 ARG CB 1 1 18 2149 1 1 2 ARG CD C -0.407 2.515 7.206 1.00 . A A . 2 ARG CD 1 1 18 2150 1 1 2 ARG CG C -0.896 1.830 5.940 1.00 . A A . 2 ARG CG 1 1 18 2151 1 1 2 ARG CZ C -0.943 4.564 8.465 1.00 . A A . 2 ARG CZ 1 1 18 2152 1 1 2 ARG H H 1.350 4.101 4.951 1.00 . A A . 2 ARG H 1 1 18 2153 1 1 2 ARG HA H 0.777 1.484 4.018 1.00 . A A . 2 ARG HA 1 1 18 2154 1 1 2 ARG HB2 H -0.780 3.771 5.088 1.00 . A A . 2 ARG HB2 1 1 18 2155 1 1 2 ARG HB3 H -1.668 2.603 4.120 1.00 . A A . 2 ARG HB3 1 1 18 2156 1 1 2 ARG HD2 H -0.353 1.783 7.998 1.00 . A A . 2 ARG HD2 1 1 18 2157 1 1 2 ARG HD3 H 0.577 2.920 7.023 1.00 . A A . 2 ARG HD3 1 1 18 2158 1 1 2 ARG HE H -2.204 3.604 7.253 1.00 . A A . 2 ARG HE 1 1 18 2159 1 1 2 ARG HG2 H -1.932 1.544 6.075 1.00 . A A . 2 ARG HG2 1 1 18 2160 1 1 2 ARG HG3 H -0.292 0.949 5.761 1.00 . A A . 2 ARG HG3 1 1 18 2161 1 1 2 ARG HH11 H 0.939 3.877 8.743 1.00 . A A . 2 ARG HH11 1 1 18 2162 1 1 2 ARG HH12 H 0.538 5.316 9.618 1.00 . A A . 2 ARG HH12 1 1 18 2163 1 1 2 ARG HH21 H -2.734 5.497 8.402 1.00 . A A . 2 ARG HH21 1 1 18 2164 1 1 2 ARG HH22 H -1.548 6.236 9.425 1.00 . A A . 2 ARG HH22 1 1 18 2165 1 1 2 ARG N N 1.542 3.377 4.319 1.00 . A A . 2 ARG N 1 1 18 2166 1 1 2 ARG NE N -1.296 3.597 7.622 1.00 . A A . 2 ARG NE 1 1 18 2167 1 1 2 ARG NH1 N 0.278 4.587 8.985 1.00 . A A . 2 ARG NH1 1 1 18 2168 1 1 2 ARG NH2 N -1.813 5.510 8.791 1.00 . A A . 2 ARG NH2 1 1 18 2169 1 1 2 ARG O O -0.890 3.320 2.068 1.00 . A A . 2 ARG O 1 1 18 2170 1 1 3 PHE C C 0.327 1.126 -0.523 1.00 . A A . 3 PHE C 1 1 18 2171 1 1 3 PHE CA C 0.843 2.418 0.103 1.00 . A A . 3 PHE CA 1 1 18 2172 1 1 3 PHE CB C 2.155 2.836 -0.555 1.00 . A A . 3 PHE CB 1 1 18 2173 1 1 3 PHE CD1 C 2.784 5.264 -0.498 1.00 . A A . 3 PHE CD1 1 1 18 2174 1 1 3 PHE CD2 C 1.425 4.487 -2.297 1.00 . A A . 3 PHE CD2 1 1 18 2175 1 1 3 PHE CE1 C 2.753 6.542 -1.023 1.00 . A A . 3 PHE CE1 1 1 18 2176 1 1 3 PHE CE2 C 1.391 5.763 -2.827 1.00 . A A . 3 PHE CE2 1 1 18 2177 1 1 3 PHE CG C 2.121 4.223 -1.129 1.00 . A A . 3 PHE CG 1 1 18 2178 1 1 3 PHE CZ C 2.056 6.792 -2.189 1.00 . A A . 3 PHE CZ 1 1 18 2179 1 1 3 PHE H H 1.827 1.808 1.874 1.00 . A A . 3 PHE H 1 1 18 2180 1 1 3 PHE HA H 0.116 3.195 -0.055 1.00 . A A . 3 PHE HA 1 1 18 2181 1 1 3 PHE HB2 H 2.941 2.804 0.185 1.00 . A A . 3 PHE HB2 1 1 18 2182 1 1 3 PHE HB3 H 2.385 2.147 -1.359 1.00 . A A . 3 PHE HB3 1 1 18 2183 1 1 3 PHE HD1 H 3.330 5.069 0.414 1.00 . A A . 3 PHE HD1 1 1 18 2184 1 1 3 PHE HD2 H 0.904 3.683 -2.797 1.00 . A A . 3 PHE HD2 1 1 18 2185 1 1 3 PHE HE1 H 3.274 7.345 -0.522 1.00 . A A . 3 PHE HE1 1 1 18 2186 1 1 3 PHE HE2 H 0.845 5.956 -3.738 1.00 . A A . 3 PHE HE2 1 1 18 2187 1 1 3 PHE HZ H 2.030 7.790 -2.601 1.00 . A A . 3 PHE HZ 1 1 18 2188 1 1 3 PHE N N 1.027 2.266 1.540 1.00 . A A . 3 PHE N 1 1 18 2189 1 1 3 PHE O O 1.103 0.321 -1.038 1.00 . A A . 3 PHE O 1 1 18 2190 1 1 4 LEU C C -1.214 -0.456 -2.491 1.00 . A A . 4 LEU C 1 1 18 2191 1 1 4 LEU CA C -1.613 -0.259 -1.031 1.00 . A A . 4 LEU CA 1 1 18 2192 1 1 4 LEU CB C -3.134 -0.162 -0.912 1.00 . A A . 4 LEU CB 1 1 18 2193 1 1 4 LEU CD1 C -3.828 1.406 0.915 1.00 . A A . 4 LEU CD1 1 1 18 2194 1 1 4 LEU CD2 C -4.978 -0.800 0.664 1.00 . A A . 4 LEU CD2 1 1 18 2195 1 1 4 LEU CG C -3.661 -0.052 0.519 1.00 . A A . 4 LEU CG 1 1 18 2196 1 1 4 LEU H H -1.552 1.613 -0.046 1.00 . A A . 4 LEU H 1 1 18 2197 1 1 4 LEU HA H -1.271 -1.107 -0.458 1.00 . A A . 4 LEU HA 1 1 18 2198 1 1 4 LEU HB2 H -3.463 0.707 -1.464 1.00 . A A . 4 LEU HB2 1 1 18 2199 1 1 4 LEU HB3 H -3.567 -1.041 -1.365 1.00 . A A . 4 LEU HB3 1 1 18 2200 1 1 4 LEU HD11 H -4.648 1.500 1.610 1.00 . A A . 4 LEU HD11 1 1 18 2201 1 1 4 LEU HD12 H -4.032 1.997 0.034 1.00 . A A . 4 LEU HD12 1 1 18 2202 1 1 4 LEU HD13 H -2.919 1.757 1.381 1.00 . A A . 4 LEU HD13 1 1 18 2203 1 1 4 LEU HD21 H -5.381 -0.630 1.652 1.00 . A A . 4 LEU HD21 1 1 18 2204 1 1 4 LEU HD22 H -4.808 -1.857 0.522 1.00 . A A . 4 LEU HD22 1 1 18 2205 1 1 4 LEU HD23 H -5.678 -0.445 -0.077 1.00 . A A . 4 LEU HD23 1 1 18 2206 1 1 4 LEU HG H -2.945 -0.498 1.193 1.00 . A A . 4 LEU HG 1 1 18 2207 1 1 4 LEU N N -0.988 0.935 -0.472 1.00 . A A . 4 LEU N 1 1 18 2208 1 1 4 LEU O O -0.947 0.509 -3.207 1.00 . A A . 4 LEU O 1 1 18 2209 1 1 5 ARG C C -1.720 -3.116 -4.869 1.00 . A A . 5 ARG C 1 1 18 2210 1 1 5 ARG CA C -0.808 -2.035 -4.299 1.00 . A A . 5 ARG CA 1 1 18 2211 1 1 5 ARG CB C 0.648 -2.496 -4.364 1.00 . A A . 5 ARG CB 1 1 18 2212 1 1 5 ARG CD C 1.272 -3.639 -6.518 1.00 . A A . 5 ARG CD 1 1 18 2213 1 1 5 ARG CG C 1.275 -2.332 -5.740 1.00 . A A . 5 ARG CG 1 1 18 2214 1 1 5 ARG CZ C 3.468 -4.686 -6.111 1.00 . A A . 5 ARG CZ 1 1 18 2215 1 1 5 ARG H H -1.398 -2.439 -2.306 1.00 . A A . 5 ARG H 1 1 18 2216 1 1 5 ARG HA H -0.918 -1.138 -4.891 1.00 . A A . 5 ARG HA 1 1 18 2217 1 1 5 ARG HB2 H 1.230 -1.918 -3.656 1.00 . A A . 5 ARG HB2 1 1 18 2218 1 1 5 ARG HB3 H 0.695 -3.545 -4.093 1.00 . A A . 5 ARG HB3 1 1 18 2219 1 1 5 ARG HD2 H 0.841 -4.413 -5.900 1.00 . A A . 5 ARG HD2 1 1 18 2220 1 1 5 ARG HD3 H 0.671 -3.512 -7.406 1.00 . A A . 5 ARG HD3 1 1 18 2221 1 1 5 ARG HE H 2.908 -3.826 -7.824 1.00 . A A . 5 ARG HE 1 1 18 2222 1 1 5 ARG HG2 H 0.713 -1.595 -6.294 1.00 . A A . 5 ARG HG2 1 1 18 2223 1 1 5 ARG HG3 H 2.294 -1.995 -5.622 1.00 . A A . 5 ARG HG3 1 1 18 2224 1 1 5 ARG HH11 H 2.207 -4.751 -4.531 1.00 . A A . 5 ARG HH11 1 1 18 2225 1 1 5 ARG HH12 H 3.756 -5.480 -4.275 1.00 . A A . 5 ARG HH12 1 1 18 2226 1 1 5 ARG HH21 H 4.946 -4.784 -7.486 1.00 . A A . 5 ARG HH21 1 1 18 2227 1 1 5 ARG HH22 H 5.311 -5.499 -5.951 1.00 . A A . 5 ARG HH22 1 1 18 2228 1 1 5 ARG N N -1.175 -1.712 -2.925 1.00 . A A . 5 ARG N 1 1 18 2229 1 1 5 ARG NE N 2.620 -4.044 -6.913 1.00 . A A . 5 ARG NE 1 1 18 2230 1 1 5 ARG NH1 N 3.114 -4.998 -4.870 1.00 . A A . 5 ARG NH1 1 1 18 2231 1 1 5 ARG NH2 N 4.674 -5.017 -6.552 1.00 . A A . 5 ARG NH2 1 1 18 2232 1 1 5 ARG O O -1.370 -4.296 -4.880 1.00 . A A . 5 ARG O 1 1 18 2233 1 1 6 HIS C C -4.800 -2.925 -6.876 1.00 . A A . 6 HIS C 1 1 18 2234 1 1 6 HIS CA C -3.853 -3.639 -5.917 1.00 . A A . 6 HIS CA 1 1 18 2235 1 1 6 HIS CB C -4.653 -4.327 -4.809 1.00 . A A . 6 HIS CB 1 1 18 2236 1 1 6 HIS CD2 C -6.824 -3.331 -3.797 1.00 . A A . 6 HIS CD2 1 1 18 2237 1 1 6 HIS CE1 C -5.923 -1.683 -2.666 1.00 . A A . 6 HIS CE1 1 1 18 2238 1 1 6 HIS CG C -5.485 -3.383 -3.999 1.00 . A A . 6 HIS CG 1 1 18 2239 1 1 6 HIS H H -3.114 -1.752 -5.309 1.00 . A A . 6 HIS H 1 1 18 2240 1 1 6 HIS HA H -3.301 -4.387 -6.467 1.00 . A A . 6 HIS HA 1 1 18 2241 1 1 6 HIS HB2 H -5.318 -5.057 -5.254 1.00 . A A . 6 HIS HB2 1 1 18 2242 1 1 6 HIS HB3 H -3.965 -4.828 -4.137 1.00 . A A . 6 HIS HB3 1 1 18 2243 1 1 6 HIS HD1 H -4.000 -2.108 -3.220 1.00 . A A . 6 HIS HD1 1 1 18 2244 1 1 6 HIS HD2 H -7.561 -4.003 -4.214 1.00 . A A . 6 HIS HD2 1 1 18 2245 1 1 6 HIS HE1 H -5.802 -0.818 -2.031 1.00 . A A . 6 HIS HE1 1 1 18 2246 1 1 6 HIS HE2 H -7.938 -2.038 -2.575 1.00 . A A . 6 HIS HE2 1 1 18 2247 1 1 6 HIS N N -2.892 -2.705 -5.344 1.00 . A A . 6 HIS N 1 1 18 2248 1 1 6 HIS ND1 N -4.951 -2.337 -3.277 1.00 . A A . 6 HIS ND1 1 1 18 2249 1 1 6 HIS NE2 N -7.069 -2.266 -2.966 1.00 . A A . 6 HIS NE2 1 1 18 2250 1 1 6 HIS O O -5.422 -3.612 -7.714 1.00 . A A . 6 HIS O 1 1 19 2251 1 1 1 HIS C C 2.496 2.616 3.947 1.00 . A A . 1 HIS C 1 1 19 2252 1 1 1 HIS CA C 3.818 3.017 4.594 1.00 . A A . 1 HIS CA 1 1 19 2253 1 1 1 HIS CB C 4.746 1.805 4.696 1.00 . A A . 1 HIS CB 1 1 19 2254 1 1 1 HIS CD2 C 4.014 0.784 6.965 1.00 . A A . 1 HIS CD2 1 1 19 2255 1 1 1 HIS CE1 C 3.528 -1.236 6.265 1.00 . A A . 1 HIS CE1 1 1 19 2256 1 1 1 HIS CG C 4.250 0.748 5.632 1.00 . A A . 1 HIS CG 1 1 19 2257 1 1 1 HIS H1 H 4.517 3.552 6.455 1.00 . A A . 1 HIS H1 1 1 19 2258 1 1 1 HIS H2 H 2.907 2.957 6.438 1.00 . A A . 1 HIS H2 1 1 19 2259 1 1 1 HIS H3 H 3.246 4.536 5.859 1.00 . A A . 1 HIS H3 1 1 19 2260 1 1 1 HIS HA H 4.290 3.777 3.990 1.00 . A A . 1 HIS HA 1 1 19 2261 1 1 1 HIS HB2 H 4.852 1.359 3.718 1.00 . A A . 1 HIS HB2 1 1 19 2262 1 1 1 HIS HB3 H 5.715 2.131 5.044 1.00 . A A . 1 HIS HB3 1 1 19 2263 1 1 1 HIS HD1 H 4.002 -0.873 4.308 1.00 . A A . 1 HIS HD1 1 1 19 2264 1 1 1 HIS HD2 H 4.152 1.635 7.618 1.00 . A A . 1 HIS HD2 1 1 19 2265 1 1 1 HIS HE1 H 3.217 -2.270 6.246 1.00 . A A . 1 HIS HE1 1 1 19 2266 1 1 1 HIS HE2 H 3.228 -0.705 8.220 1.00 . A A . 1 HIS HE2 1 1 19 2267 1 1 1 HIS N N 3.603 3.565 5.960 1.00 . A A . 1 HIS N 1 1 19 2268 1 1 1 HIS ND1 N 3.936 -0.532 5.225 1.00 . A A . 1 HIS ND1 1 1 19 2269 1 1 1 HIS NE2 N 3.566 -0.461 7.333 1.00 . A A . 1 HIS NE2 1 1 19 2270 1 1 1 HIS O O 2.388 1.551 3.340 1.00 . A A . 1 HIS O 1 1 19 2271 1 1 2 ARG C C 0.227 3.304 1.982 1.00 . A A . 2 ARG C 1 1 19 2272 1 1 2 ARG CA C 0.179 3.215 3.504 1.00 . A A . 2 ARG CA 1 1 19 2273 1 1 2 ARG CB C -0.850 4.206 4.055 1.00 . A A . 2 ARG CB 1 1 19 2274 1 1 2 ARG CD C -2.079 4.868 6.143 1.00 . A A . 2 ARG CD 1 1 19 2275 1 1 2 ARG CG C -1.565 3.711 5.301 1.00 . A A . 2 ARG CG 1 1 19 2276 1 1 2 ARG CZ C -3.385 5.144 8.214 1.00 . A A . 2 ARG CZ 1 1 19 2277 1 1 2 ARG H H 1.641 4.312 4.572 1.00 . A A . 2 ARG H 1 1 19 2278 1 1 2 ARG HA H -0.111 2.214 3.786 1.00 . A A . 2 ARG HA 1 1 19 2279 1 1 2 ARG HB2 H -0.347 5.131 4.298 1.00 . A A . 2 ARG HB2 1 1 19 2280 1 1 2 ARG HB3 H -1.591 4.398 3.293 1.00 . A A . 2 ARG HB3 1 1 19 2281 1 1 2 ARG HD2 H -1.243 5.330 6.646 1.00 . A A . 2 ARG HD2 1 1 19 2282 1 1 2 ARG HD3 H -2.549 5.589 5.491 1.00 . A A . 2 ARG HD3 1 1 19 2283 1 1 2 ARG HE H -3.472 3.554 7.010 1.00 . A A . 2 ARG HE 1 1 19 2284 1 1 2 ARG HG2 H -2.404 3.095 5.003 1.00 . A A . 2 ARG HG2 1 1 19 2285 1 1 2 ARG HG3 H -0.871 3.126 5.894 1.00 . A A . 2 ARG HG3 1 1 19 2286 1 1 2 ARG HH11 H -2.161 6.695 7.782 1.00 . A A . 2 ARG HH11 1 1 19 2287 1 1 2 ARG HH12 H -3.090 6.864 9.233 1.00 . A A . 2 ARG HH12 1 1 19 2288 1 1 2 ARG HH21 H -4.696 3.776 8.918 1.00 . A A . 2 ARG HH21 1 1 19 2289 1 1 2 ARG HH22 H -4.529 5.207 9.879 1.00 . A A . 2 ARG HH22 1 1 19 2290 1 1 2 ARG N N 1.493 3.479 4.078 1.00 . A A . 2 ARG N 1 1 19 2291 1 1 2 ARG NE N -3.049 4.428 7.143 1.00 . A A . 2 ARG NE 1 1 19 2292 1 1 2 ARG NH1 N -2.833 6.332 8.427 1.00 . A A . 2 ARG NH1 1 1 19 2293 1 1 2 ARG NH2 N -4.276 4.670 9.074 1.00 . A A . 2 ARG NH2 1 1 19 2294 1 1 2 ARG O O -0.368 4.199 1.381 1.00 . A A . 2 ARG O 1 1 19 2295 1 1 3 PHE C C 0.214 1.237 -0.694 1.00 . A A . 3 PHE C 1 1 19 2296 1 1 3 PHE CA C 1.073 2.343 -0.087 1.00 . A A . 3 PHE CA 1 1 19 2297 1 1 3 PHE CB C 2.535 2.151 -0.481 1.00 . A A . 3 PHE CB 1 1 19 2298 1 1 3 PHE CD1 C 4.036 4.161 -0.430 1.00 . A A . 3 PHE CD1 1 1 19 2299 1 1 3 PHE CD2 C 2.826 3.700 -2.433 1.00 . A A . 3 PHE CD2 1 1 19 2300 1 1 3 PHE CE1 C 4.598 5.276 -1.023 1.00 . A A . 3 PHE CE1 1 1 19 2301 1 1 3 PHE CE2 C 3.385 4.814 -3.031 1.00 . A A . 3 PHE CE2 1 1 19 2302 1 1 3 PHE CG C 3.144 3.361 -1.128 1.00 . A A . 3 PHE CG 1 1 19 2303 1 1 3 PHE CZ C 4.272 5.603 -2.325 1.00 . A A . 3 PHE CZ 1 1 19 2304 1 1 3 PHE H H 1.396 1.684 1.897 1.00 . A A . 3 PHE H 1 1 19 2305 1 1 3 PHE HA H 0.736 3.292 -0.465 1.00 . A A . 3 PHE HA 1 1 19 2306 1 1 3 PHE HB2 H 3.106 1.930 0.408 1.00 . A A . 3 PHE HB2 1 1 19 2307 1 1 3 PHE HB3 H 2.611 1.324 -1.178 1.00 . A A . 3 PHE HB3 1 1 19 2308 1 1 3 PHE HD1 H 4.292 3.905 0.588 1.00 . A A . 3 PHE HD1 1 1 19 2309 1 1 3 PHE HD2 H 2.132 3.084 -2.987 1.00 . A A . 3 PHE HD2 1 1 19 2310 1 1 3 PHE HE1 H 5.291 5.891 -0.468 1.00 . A A . 3 PHE HE1 1 1 19 2311 1 1 3 PHE HE2 H 3.128 5.068 -4.049 1.00 . A A . 3 PHE HE2 1 1 19 2312 1 1 3 PHE HZ H 4.710 6.474 -2.789 1.00 . A A . 3 PHE HZ 1 1 19 2313 1 1 3 PHE N N 0.943 2.370 1.364 1.00 . A A . 3 PHE N 1 1 19 2314 1 1 3 PHE O O 0.705 0.147 -0.987 1.00 . A A . 3 PHE O 1 1 19 2315 1 1 4 LEU C C -1.494 0.030 -2.786 1.00 . A A . 4 LEU C 1 1 19 2316 1 1 4 LEU CA C -2.001 0.556 -1.446 1.00 . A A . 4 LEU CA 1 1 19 2317 1 1 4 LEU CB C -3.381 1.189 -1.623 1.00 . A A . 4 LEU CB 1 1 19 2318 1 1 4 LEU CD1 C -3.710 3.144 -0.093 1.00 . A A . 4 LEU CD1 1 1 19 2319 1 1 4 LEU CD2 C -5.540 1.463 -0.378 1.00 . A A . 4 LEU CD2 1 1 19 2320 1 1 4 LEU CG C -4.034 1.678 -0.331 1.00 . A A . 4 LEU CG 1 1 19 2321 1 1 4 LEU H H -1.403 2.410 -0.621 1.00 . A A . 4 LEU H 1 1 19 2322 1 1 4 LEU HA H -2.081 -0.268 -0.755 1.00 . A A . 4 LEU HA 1 1 19 2323 1 1 4 LEU HB2 H -3.285 2.029 -2.296 1.00 . A A . 4 LEU HB2 1 1 19 2324 1 1 4 LEU HB3 H -4.034 0.458 -2.077 1.00 . A A . 4 LEU HB3 1 1 19 2325 1 1 4 LEU HD11 H -2.819 3.220 0.513 1.00 . A A . 4 LEU HD11 1 1 19 2326 1 1 4 LEU HD12 H -4.535 3.617 0.418 1.00 . A A . 4 LEU HD12 1 1 19 2327 1 1 4 LEU HD13 H -3.543 3.633 -1.041 1.00 . A A . 4 LEU HD13 1 1 19 2328 1 1 4 LEU HD21 H -5.952 1.590 0.612 1.00 . A A . 4 LEU HD21 1 1 19 2329 1 1 4 LEU HD22 H -5.750 0.464 -0.730 1.00 . A A . 4 LEU HD22 1 1 19 2330 1 1 4 LEU HD23 H -5.986 2.183 -1.048 1.00 . A A . 4 LEU HD23 1 1 19 2331 1 1 4 LEU HG H -3.639 1.112 0.499 1.00 . A A . 4 LEU HG 1 1 19 2332 1 1 4 LEU N N -1.071 1.525 -0.877 1.00 . A A . 4 LEU N 1 1 19 2333 1 1 4 LEU O O -1.403 0.774 -3.763 1.00 . A A . 4 LEU O 1 1 19 2334 1 1 5 ARG C C -1.491 -3.122 -4.393 1.00 . A A . 5 ARG C 1 1 19 2335 1 1 5 ARG CA C -0.669 -1.885 -4.044 1.00 . A A . 5 ARG CA 1 1 19 2336 1 1 5 ARG CB C 0.804 -2.264 -3.883 1.00 . A A . 5 ARG CB 1 1 19 2337 1 1 5 ARG CD C 3.052 -1.798 -4.904 1.00 . A A . 5 ARG CD 1 1 19 2338 1 1 5 ARG CG C 1.601 -2.162 -5.173 1.00 . A A . 5 ARG CG 1 1 19 2339 1 1 5 ARG CZ C 4.487 0.201 -5.042 1.00 . A A . 5 ARG CZ 1 1 19 2340 1 1 5 ARG H H -1.261 -1.799 -2.013 1.00 . A A . 5 ARG H 1 1 19 2341 1 1 5 ARG HA H -0.762 -1.168 -4.846 1.00 . A A . 5 ARG HA 1 1 19 2342 1 1 5 ARG HB2 H 1.257 -1.604 -3.152 1.00 . A A . 5 ARG HB2 1 1 19 2343 1 1 5 ARG HB3 H 0.864 -3.286 -3.527 1.00 . A A . 5 ARG HB3 1 1 19 2344 1 1 5 ARG HD2 H 3.318 -2.138 -3.914 1.00 . A A . 5 ARG HD2 1 1 19 2345 1 1 5 ARG HD3 H 3.676 -2.293 -5.633 1.00 . A A . 5 ARG HD3 1 1 19 2346 1 1 5 ARG HE H 2.491 0.226 -5.000 1.00 . A A . 5 ARG HE 1 1 19 2347 1 1 5 ARG HG2 H 1.568 -3.114 -5.682 1.00 . A A . 5 ARG HG2 1 1 19 2348 1 1 5 ARG HG3 H 1.158 -1.401 -5.799 1.00 . A A . 5 ARG HG3 1 1 19 2349 1 1 5 ARG HH11 H 5.495 -1.551 -4.970 1.00 . A A . 5 ARG HH11 1 1 19 2350 1 1 5 ARG HH12 H 6.481 -0.130 -5.068 1.00 . A A . 5 ARG HH12 1 1 19 2351 1 1 5 ARG HH21 H 3.786 2.095 -5.129 1.00 . A A . 5 ARG HH21 1 1 19 2352 1 1 5 ARG HH22 H 5.511 1.939 -5.157 1.00 . A A . 5 ARG HH22 1 1 19 2353 1 1 5 ARG N N -1.166 -1.258 -2.824 1.00 . A A . 5 ARG N 1 1 19 2354 1 1 5 ARG NE N 3.279 -0.357 -4.986 1.00 . A A . 5 ARG NE 1 1 19 2355 1 1 5 ARG NH1 N 5.577 -0.556 -5.025 1.00 . A A . 5 ARG NH1 1 1 19 2356 1 1 5 ARG NH2 N 4.604 1.520 -5.115 1.00 . A A . 5 ARG NH2 1 1 19 2357 1 1 5 ARG O O -1.057 -4.252 -4.168 1.00 . A A . 5 ARG O 1 1 19 2358 1 1 6 HIS C C -4.531 -3.561 -6.418 1.00 . A A . 6 HIS C 1 1 19 2359 1 1 6 HIS CA C -3.563 -3.996 -5.323 1.00 . A A . 6 HIS CA 1 1 19 2360 1 1 6 HIS CB C -4.343 -4.495 -4.105 1.00 . A A . 6 HIS CB 1 1 19 2361 1 1 6 HIS CD2 C -4.890 -6.933 -3.408 1.00 . A A . 6 HIS CD2 1 1 19 2362 1 1 6 HIS CE1 C -5.846 -7.592 -5.268 1.00 . A A . 6 HIS CE1 1 1 19 2363 1 1 6 HIS CG C -4.875 -5.885 -4.266 1.00 . A A . 6 HIS CG 1 1 19 2364 1 1 6 HIS H H -2.971 -1.976 -5.097 1.00 . A A . 6 HIS H 1 1 19 2365 1 1 6 HIS HA H -2.949 -4.800 -5.700 1.00 . A A . 6 HIS HA 1 1 19 2366 1 1 6 HIS HB2 H -3.691 -4.487 -3.240 1.00 . A A . 6 HIS HB2 1 1 19 2367 1 1 6 HIS HB3 H -5.184 -3.834 -3.930 1.00 . A A . 6 HIS HB3 1 1 19 2368 1 1 6 HIS HD1 H -5.622 -5.802 -6.235 1.00 . A A . 6 HIS HD1 1 1 19 2369 1 1 6 HIS HD2 H -4.497 -6.943 -2.401 1.00 . A A . 6 HIS HD2 1 1 19 2370 1 1 6 HIS HE1 H -6.343 -8.201 -6.008 1.00 . A A . 6 HIS HE1 1 1 19 2371 1 1 6 HIS HE2 H -5.575 -8.894 -3.711 1.00 . A A . 6 HIS HE2 1 1 19 2372 1 1 6 HIS N N -2.680 -2.900 -4.943 1.00 . A A . 6 HIS N 1 1 19 2373 1 1 6 HIS ND1 N -5.481 -6.331 -5.422 1.00 . A A . 6 HIS ND1 1 1 19 2374 1 1 6 HIS NE2 N -5.499 -7.980 -4.055 1.00 . A A . 6 HIS NE2 1 1 19 2375 1 1 6 HIS O O -5.183 -2.509 -6.247 1.00 . A A . 6 HIS O 1 1 20 2376 1 1 1 HIS C C 2.281 3.994 3.895 1.00 . A A . 1 HIS C 1 1 20 2377 1 1 1 HIS CA C 3.741 4.402 4.064 1.00 . A A . 1 HIS CA 1 1 20 2378 1 1 1 HIS CB C 4.660 3.360 3.425 1.00 . A A . 1 HIS CB 1 1 20 2379 1 1 1 HIS CD2 C 6.552 5.089 3.026 1.00 . A A . 1 HIS CD2 1 1 20 2380 1 1 1 HIS CE1 C 8.253 3.706 3.010 1.00 . A A . 1 HIS CE1 1 1 20 2381 1 1 1 HIS CG C 6.063 3.841 3.222 1.00 . A A . 1 HIS CG 1 1 20 2382 1 1 1 HIS H1 H 4.014 3.590 5.935 1.00 . A A . 1 HIS H1 1 1 20 2383 1 1 1 HIS H2 H 3.437 5.207 5.933 1.00 . A A . 1 HIS H2 1 1 20 2384 1 1 1 HIS H3 H 5.078 4.878 5.554 1.00 . A A . 1 HIS H3 1 1 20 2385 1 1 1 HIS HA H 3.898 5.357 3.584 1.00 . A A . 1 HIS HA 1 1 20 2386 1 1 1 HIS HB2 H 4.698 2.486 4.058 1.00 . A A . 1 HIS HB2 1 1 20 2387 1 1 1 HIS HB3 H 4.261 3.082 2.460 1.00 . A A . 1 HIS HB3 1 1 20 2388 1 1 1 HIS HD1 H 7.128 2.025 3.322 1.00 . A A . 1 HIS HD1 1 1 20 2389 1 1 1 HIS HD2 H 5.977 6.003 2.979 1.00 . A A . 1 HIS HD2 1 1 20 2390 1 1 1 HIS HE1 H 9.256 3.311 2.951 1.00 . A A . 1 HIS HE1 1 1 20 2391 1 1 1 HIS HE2 H 8.544 5.725 2.831 1.00 . A A . 1 HIS HE2 1 1 20 2392 1 1 1 HIS N N 4.100 4.531 5.501 1.00 . A A . 1 HIS N 1 1 20 2393 1 1 1 HIS ND1 N 7.154 2.998 3.206 1.00 . A A . 1 HIS ND1 1 1 20 2394 1 1 1 HIS NE2 N 7.914 4.977 2.897 1.00 . A A . 1 HIS NE2 1 1 20 2395 1 1 1 HIS O O 1.434 4.816 3.543 1.00 . A A . 1 HIS O 1 1 20 2396 1 1 2 ARG C C 0.088 2.450 2.616 1.00 . A A . 2 ARG C 1 1 20 2397 1 1 2 ARG CA C 0.635 2.204 4.019 1.00 . A A . 2 ARG CA 1 1 20 2398 1 1 2 ARG CB C -0.279 2.855 5.059 1.00 . A A . 2 ARG CB 1 1 20 2399 1 1 2 ARG CD C -0.361 3.173 7.552 1.00 . A A . 2 ARG CD 1 1 20 2400 1 1 2 ARG CG C -0.243 2.169 6.415 1.00 . A A . 2 ARG CG 1 1 20 2401 1 1 2 ARG CZ C -0.981 1.816 9.514 1.00 . A A . 2 ARG CZ 1 1 20 2402 1 1 2 ARG H H 2.712 2.114 4.421 1.00 . A A . 2 ARG H 1 1 20 2403 1 1 2 ARG HA H 0.668 1.140 4.198 1.00 . A A . 2 ARG HA 1 1 20 2404 1 1 2 ARG HB2 H 0.022 3.884 5.192 1.00 . A A . 2 ARG HB2 1 1 20 2405 1 1 2 ARG HB3 H -1.295 2.831 4.694 1.00 . A A . 2 ARG HB3 1 1 20 2406 1 1 2 ARG HD2 H 0.614 3.314 7.993 1.00 . A A . 2 ARG HD2 1 1 20 2407 1 1 2 ARG HD3 H -0.714 4.112 7.151 1.00 . A A . 2 ARG HD3 1 1 20 2408 1 1 2 ARG HE H -2.187 3.112 8.591 1.00 . A A . 2 ARG HE 1 1 20 2409 1 1 2 ARG HG2 H -1.070 1.472 6.477 1.00 . A A . 2 ARG HG2 1 1 20 2410 1 1 2 ARG HG3 H 0.695 1.636 6.513 1.00 . A A . 2 ARG HG3 1 1 20 2411 1 1 2 ARG HH11 H 0.911 1.528 8.860 1.00 . A A . 2 ARG HH11 1 1 20 2412 1 1 2 ARG HH12 H 0.451 0.586 10.238 1.00 . A A . 2 ARG HH12 1 1 20 2413 1 1 2 ARG HH21 H -2.794 1.874 10.404 1.00 . A A . 2 ARG HH21 1 1 20 2414 1 1 2 ARG HH22 H -1.653 0.782 11.114 1.00 . A A . 2 ARG HH22 1 1 20 2415 1 1 2 ARG N N 1.994 2.721 4.146 1.00 . A A . 2 ARG N 1 1 20 2416 1 1 2 ARG NE N -1.288 2.721 8.587 1.00 . A A . 2 ARG NE 1 1 20 2417 1 1 2 ARG NH1 N 0.226 1.265 9.539 1.00 . A A . 2 ARG NH1 1 1 20 2418 1 1 2 ARG NH2 N -1.883 1.462 10.418 1.00 . A A . 2 ARG NH2 1 1 20 2419 1 1 2 ARG O O -1.083 2.786 2.444 1.00 . A A . 2 ARG O 1 1 20 2420 1 1 3 PHE C C 0.108 1.174 -0.413 1.00 . A A . 3 PHE C 1 1 20 2421 1 1 3 PHE CA C 0.555 2.485 0.228 1.00 . A A . 3 PHE CA 1 1 20 2422 1 1 3 PHE CB C 1.713 3.088 -0.563 1.00 . A A . 3 PHE CB 1 1 20 2423 1 1 3 PHE CD1 C 2.071 5.568 -0.442 1.00 . A A . 3 PHE CD1 1 1 20 2424 1 1 3 PHE CD2 C 0.574 4.719 -2.093 1.00 . A A . 3 PHE CD2 1 1 20 2425 1 1 3 PHE CE1 C 1.829 6.856 -0.880 1.00 . A A . 3 PHE CE1 1 1 20 2426 1 1 3 PHE CE2 C 0.328 6.004 -2.536 1.00 . A A . 3 PHE CE2 1 1 20 2427 1 1 3 PHE CG C 1.447 4.487 -1.042 1.00 . A A . 3 PHE CG 1 1 20 2428 1 1 3 PHE CZ C 0.956 7.075 -1.929 1.00 . A A . 3 PHE CZ 1 1 20 2429 1 1 3 PHE H H 1.868 2.013 1.819 1.00 . A A . 3 PHE H 1 1 20 2430 1 1 3 PHE HA H -0.268 3.177 0.216 1.00 . A A . 3 PHE HA 1 1 20 2431 1 1 3 PHE HB2 H 2.588 3.117 0.070 1.00 . A A . 3 PHE HB2 1 1 20 2432 1 1 3 PHE HB3 H 1.912 2.470 -1.430 1.00 . A A . 3 PHE HB3 1 1 20 2433 1 1 3 PHE HD1 H 2.753 5.399 0.378 1.00 . A A . 3 PHE HD1 1 1 20 2434 1 1 3 PHE HD2 H 0.083 3.883 -2.568 1.00 . A A . 3 PHE HD2 1 1 20 2435 1 1 3 PHE HE1 H 2.321 7.691 -0.404 1.00 . A A . 3 PHE HE1 1 1 20 2436 1 1 3 PHE HE2 H -0.354 6.172 -3.356 1.00 . A A . 3 PHE HE2 1 1 20 2437 1 1 3 PHE HZ H 0.766 8.080 -2.274 1.00 . A A . 3 PHE HZ 1 1 20 2438 1 1 3 PHE N N 0.947 2.280 1.617 1.00 . A A . 3 PHE N 1 1 20 2439 1 1 3 PHE O O 0.910 0.462 -1.016 1.00 . A A . 3 PHE O 1 1 20 2440 1 1 4 LEU C C -1.456 -0.452 -2.338 1.00 . A A . 4 LEU C 1 1 20 2441 1 1 4 LEU CA C -1.733 -0.363 -0.840 1.00 . A A . 4 LEU CA 1 1 20 2442 1 1 4 LEU CB C -3.238 -0.429 -0.584 1.00 . A A . 4 LEU CB 1 1 20 2443 1 1 4 LEU CD1 C -3.906 1.001 1.360 1.00 . A A . 4 LEU CD1 1 1 20 2444 1 1 4 LEU CD2 C -4.861 -1.298 1.119 1.00 . A A . 4 LEU CD2 1 1 20 2445 1 1 4 LEU CG C -3.640 -0.419 0.891 1.00 . A A . 4 LEU CG 1 1 20 2446 1 1 4 LEU H H -1.766 1.470 0.217 1.00 . A A . 4 LEU H 1 1 20 2447 1 1 4 LEU HA H -1.258 -1.197 -0.347 1.00 . A A . 4 LEU HA 1 1 20 2448 1 1 4 LEU HB2 H -3.703 0.418 -1.069 1.00 . A A . 4 LEU HB2 1 1 20 2449 1 1 4 LEU HB3 H -3.620 -1.334 -1.032 1.00 . A A . 4 LEU HB3 1 1 20 2450 1 1 4 LEU HD11 H -4.682 0.993 2.111 1.00 . A A . 4 LEU HD11 1 1 20 2451 1 1 4 LEU HD12 H -4.223 1.603 0.521 1.00 . A A . 4 LEU HD12 1 1 20 2452 1 1 4 LEU HD13 H -3.002 1.415 1.779 1.00 . A A . 4 LEU HD13 1 1 20 2453 1 1 4 LEU HD21 H -4.722 -2.244 0.617 1.00 . A A . 4 LEU HD21 1 1 20 2454 1 1 4 LEU HD22 H -5.737 -0.806 0.724 1.00 . A A . 4 LEU HD22 1 1 20 2455 1 1 4 LEU HD23 H -4.989 -1.468 2.178 1.00 . A A . 4 LEU HD23 1 1 20 2456 1 1 4 LEU HG H -2.825 -0.816 1.480 1.00 . A A . 4 LEU HG 1 1 20 2457 1 1 4 LEU N N -1.177 0.862 -0.276 1.00 . A A . 4 LEU N 1 1 20 2458 1 1 4 LEU O O -1.518 0.549 -3.052 1.00 . A A . 4 LEU O 1 1 20 2459 1 1 5 ARG C C -1.740 -2.997 -4.783 1.00 . A A . 5 ARG C 1 1 20 2460 1 1 5 ARG CA C -0.866 -1.879 -4.221 1.00 . A A . 5 ARG CA 1 1 20 2461 1 1 5 ARG CB C 0.614 -2.219 -4.416 1.00 . A A . 5 ARG CB 1 1 20 2462 1 1 5 ARG CD C 2.746 -1.668 -5.627 1.00 . A A . 5 ARG CD 1 1 20 2463 1 1 5 ARG CG C 1.383 -1.158 -5.186 1.00 . A A . 5 ARG CG 1 1 20 2464 1 1 5 ARG CZ C 3.766 -2.725 -7.606 1.00 . A A . 5 ARG CZ 1 1 20 2465 1 1 5 ARG H H -1.118 -2.417 -2.189 1.00 . A A . 5 ARG H 1 1 20 2466 1 1 5 ARG HA H -1.089 -0.965 -4.750 1.00 . A A . 5 ARG HA 1 1 20 2467 1 1 5 ARG HB2 H 1.077 -2.333 -3.443 1.00 . A A . 5 ARG HB2 1 1 20 2468 1 1 5 ARG HB3 H 0.691 -3.154 -4.960 1.00 . A A . 5 ARG HB3 1 1 20 2469 1 1 5 ARG HD2 H 3.467 -0.871 -5.518 1.00 . A A . 5 ARG HD2 1 1 20 2470 1 1 5 ARG HD3 H 3.028 -2.497 -4.995 1.00 . A A . 5 ARG HD3 1 1 20 2471 1 1 5 ARG HE H 1.928 -1.949 -7.543 1.00 . A A . 5 ARG HE 1 1 20 2472 1 1 5 ARG HG2 H 0.815 -0.878 -6.060 1.00 . A A . 5 ARG HG2 1 1 20 2473 1 1 5 ARG HG3 H 1.520 -0.295 -4.551 1.00 . A A . 5 ARG HG3 1 1 20 2474 1 1 5 ARG HH11 H 4.955 -2.687 -5.970 1.00 . A A . 5 ARG HH11 1 1 20 2475 1 1 5 ARG HH12 H 5.649 -3.424 -7.375 1.00 . A A . 5 ARG HH12 1 1 20 2476 1 1 5 ARG HH21 H 2.839 -2.919 -9.391 1.00 . A A . 5 ARG HH21 1 1 20 2477 1 1 5 ARG HH22 H 4.448 -3.556 -9.318 1.00 . A A . 5 ARG HH22 1 1 20 2478 1 1 5 ARG N N -1.152 -1.658 -2.808 1.00 . A A . 5 ARG N 1 1 20 2479 1 1 5 ARG NE N 2.740 -2.114 -7.019 1.00 . A A . 5 ARG NE 1 1 20 2480 1 1 5 ARG NH1 N 4.881 -2.964 -6.928 1.00 . A A . 5 ARG NH1 1 1 20 2481 1 1 5 ARG NH2 N 3.677 -3.097 -8.876 1.00 . A A . 5 ARG NH2 1 1 20 2482 1 1 5 ARG O O -1.445 -4.178 -4.603 1.00 . A A . 5 ARG O 1 1 20 2483 1 1 6 HIS C C -4.401 -3.016 -7.298 1.00 . A A . 6 HIS C 1 1 20 2484 1 1 6 HIS CA C -3.732 -3.585 -6.051 1.00 . A A . 6 HIS CA 1 1 20 2485 1 1 6 HIS CB C -4.794 -3.997 -5.031 1.00 . A A . 6 HIS CB 1 1 20 2486 1 1 6 HIS CD2 C -5.645 -1.549 -4.913 1.00 . A A . 6 HIS CD2 1 1 20 2487 1 1 6 HIS CE1 C -7.256 -1.840 -3.455 1.00 . A A . 6 HIS CE1 1 1 20 2488 1 1 6 HIS CG C -5.656 -2.861 -4.575 1.00 . A A . 6 HIS CG 1 1 20 2489 1 1 6 HIS H H -2.997 -1.658 -5.573 1.00 . A A . 6 HIS H 1 1 20 2490 1 1 6 HIS HA H -3.158 -4.456 -6.331 1.00 . A A . 6 HIS HA 1 1 20 2491 1 1 6 HIS HB2 H -5.440 -4.745 -5.475 1.00 . A A . 6 HIS HB2 1 1 20 2492 1 1 6 HIS HB3 H -4.304 -4.415 -4.159 1.00 . A A . 6 HIS HB3 1 1 20 2493 1 1 6 HIS HD1 H -6.938 -3.848 -3.225 1.00 . A A . 6 HIS HD1 1 1 20 2494 1 1 6 HIS HD2 H -4.971 -1.073 -5.612 1.00 . A A . 6 HIS HD2 1 1 20 2495 1 1 6 HIS HE1 H -8.085 -1.653 -2.789 1.00 . A A . 6 HIS HE1 1 1 20 2496 1 1 6 HIS HE2 H -6.822 0.026 -4.178 1.00 . A A . 6 HIS HE2 1 1 20 2497 1 1 6 HIS N N -2.815 -2.615 -5.463 1.00 . A A . 6 HIS N 1 1 20 2498 1 1 6 HIS ND1 N -6.677 -3.009 -3.660 1.00 . A A . 6 HIS ND1 1 1 20 2499 1 1 6 HIS NE2 N -6.648 -0.938 -4.203 1.00 . A A . 6 HIS NE2 1 1 20 2500 1 1 6 HIS O O -5.456 -3.551 -7.699 1.00 . A A . 6 HIS O 1 1 stop_ save_
Contact the webmaster for help, if required. Wednesday, May 15, 2024 10:55:03 PM GMT (wattos1)