NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
371972 | 1d1f | 5216 | cing | 4-filtered-FRED | STAR | entry | full | 59 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1d1f # This FRED archive file contains, for PDB entry <1d1f>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend, # JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with # curated sets of experimental NMR restraints for over 4,000 protein and nucleic # acid PDB entries. (in preparation) save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_1d1f _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1d1f _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 1773.03 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 $C_TERMINAL_ANALOGUE_OF_NEUROPEPTIDE_Y__A_POTENT_Y2_RECEPTOR_AGONIST A . 1 1 stop_ save_ save_C_TERMINAL_ANALOGUE_OF_NEUROPEPTIDE_Y__A_POTENT_Y2_RECEPTOR_AGONIST _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "C TERMINAL ANALOGUE OF NEUROPEPTIDE Y A POTENT Y2 RECEPTOR AGONIST" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code XARHYKNLIERQRYX _Entity.Number_of_monomers 15 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 ACE $ACE 1 1 2 ALA . 1 1 3 ARG . 1 1 4 HIS . 1 1 5 TYR . 1 1 6 LYS . 1 1 7 ASN . 1 1 8 LEU . 1 1 9 ILE . 1 1 10 GLU . 1 1 11 ARG . 1 1 12 GLN . 1 1 13 ARG . 1 1 14 TYR . 1 1 15 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 ACE 1 1 1 1 ALA 2 2 1 1 ARG 3 3 1 1 HIS 4 4 1 1 TYR 5 5 1 1 LYS 6 6 1 1 ASN 7 7 1 1 LEU 8 8 1 1 ILE 9 9 1 1 GLU 10 10 1 1 ARG 11 11 1 1 GLN 12 12 1 1 ARG 13 13 1 1 TYR 14 14 1 1 NH2 15 15 1 1 stop_ save_ save_ACE _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID ACE _Chem_comp.Type non-polymer save_ save_NH2 _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID NH2 _Chem_comp.Type non-polymer save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 2 ALA HA . 25 . HA 1 1 1 1 2 1 1 5 TYR H . 28 . HN 1 1 2 1 1 1 1 2 ALA HA . 25 . HA 1 1 2 1 2 1 1 5 TYR QB . 28 . HB# 1 1 3 1 1 1 1 3 ARG HA . 26 . HA 1 1 3 1 2 1 1 4 HIS H . 27 . HN 1 1 4 1 1 1 1 3 ARG HA . 26 . HA 1 1 4 1 2 1 1 6 LYS H . 29 . HN 1 1 5 1 1 1 1 3 ARG HA . 26 . HA 1 1 5 1 2 1 1 6 LYS QB . 29 . HB# 1 1 6 1 1 1 1 4 HIS H . 27 . HN 1 1 6 1 2 1 1 4 HIS HB2 . 27 . HB2 1 1 7 1 1 1 1 4 HIS H . 27 . HN 1 1 7 1 2 1 1 4 HIS HB3 . 27 . HB1 1 1 8 1 1 1 1 4 HIS H . 27 . HN 1 1 8 1 2 1 1 5 TYR H . 28 . HN 1 1 9 1 1 1 1 4 HIS HA . 27 . HA 1 1 9 1 2 1 1 5 TYR H . 28 . HN 1 1 10 1 1 1 1 4 HIS HA . 27 . HA 1 1 10 1 2 1 1 7 ASN QB . 30 . HB# 1 1 11 1 1 1 1 4 HIS QB . 27 . HB# 1 1 11 1 2 1 1 5 TYR H . 28 . HN 1 1 12 1 1 1 1 4 HIS HB2 . 27 . HB2 1 1 12 1 2 1 1 5 TYR H . 28 . HN 1 1 13 1 1 1 1 4 HIS HB3 . 27 . HB1 1 1 13 1 2 1 1 5 TYR H . 28 . HN 1 1 14 1 1 1 1 4 HIS HD1 . 27 . HD# 1 1 14 1 1 1 1 4 HIS HD2 . 27 . HD# 1 1 14 1 2 1 1 5 TYR H . 28 . HN 1 1 15 1 1 1 1 5 TYR H . 28 . HN 1 1 15 1 2 1 1 5 TYR HB2 . 28 . HB2 1 1 16 1 1 1 1 5 TYR H . 28 . HN 1 1 16 1 2 1 1 5 TYR HB3 . 28 . HB1 1 1 17 1 1 1 1 5 TYR H . 28 . HN 1 1 17 1 2 1 1 6 LYS H . 29 . HN 1 1 18 1 1 1 1 5 TYR HA . 28 . HA 1 1 18 1 2 1 1 5 TYR HD1 . 28 . HD1 1 1 19 1 1 1 1 5 TYR HA . 28 . HA 1 1 19 1 2 1 1 5 TYR HD2 . 28 . HD2 1 1 20 1 1 1 1 5 TYR HA . 28 . HA 1 1 20 1 2 1 1 6 LYS H . 29 . HN 1 1 21 1 1 1 1 5 TYR HA . 28 . HA 1 1 21 1 2 1 1 8 LEU H . 31 . HN 1 1 22 1 1 1 1 5 TYR QB . 28 . HB# 1 1 22 1 2 1 1 6 LYS H . 29 . HN 1 1 23 1 1 1 1 5 TYR HB2 . 28 . HB2 1 1 23 1 2 1 1 6 LYS H . 29 . HN 1 1 24 1 1 1 1 5 TYR HB3 . 28 . HB1 1 1 24 1 2 1 1 6 LYS H . 29 . HN 1 1 25 1 1 1 1 6 LYS H . 29 . HN 1 1 25 1 2 1 1 6 LYS HA . 29 . HA 1 1 26 1 1 1 1 6 LYS HA . 29 . HA 1 1 26 1 2 1 1 9 ILE HB . 32 . HB# 1 1 27 1 1 1 1 7 ASN H . 30 . HN 1 1 27 1 2 1 1 8 LEU H . 31 . HN 1 1 28 1 1 1 1 7 ASN HA . 30 . HA 1 1 28 1 2 1 1 10 GLU QB . 33 . HB2 1 1 29 1 1 1 1 8 LEU HA . 31 . HA 1 1 29 1 2 1 1 9 ILE H . 32 . HN 1 1 30 1 1 1 1 8 LEU HA . 31 . HA 1 1 30 1 2 1 1 11 ARG H . 34 . HN 1 1 31 1 1 1 1 8 LEU HA . 31 . HA 1 1 31 1 2 1 1 11 ARG QB . 34 . HB# 1 1 32 1 1 1 1 8 LEU HA . 31 . HA 1 1 32 1 2 1 1 11 ARG HG2 . 34 . HG2 1 1 33 1 1 1 1 8 LEU HA . 31 . HA 1 1 33 1 2 1 1 11 ARG QG . 34 . HG# 1 1 34 1 1 1 1 8 LEU HA . 31 . HA 1 1 34 1 2 1 1 11 ARG HG3 . 34 . HG1 1 1 35 1 1 1 1 9 ILE HA . 32 . HA 1 1 35 1 2 1 1 10 GLU H . 33 . HN 1 1 36 1 1 1 1 9 ILE QG . 32 . HG# 1 1 36 1 1 1 1 9 ILE MG . 32 . HG# 1 1 36 1 2 1 1 10 GLU H . 33 . HN 1 1 37 1 1 1 1 10 GLU H . 33 . HN 1 1 37 1 2 1 1 10 GLU QB . 33 . HB2 1 1 38 1 1 1 1 10 GLU H . 33 . HN 1 1 38 1 2 1 1 11 ARG H . 34 . HN 1 1 39 1 1 1 1 10 GLU HA . 33 . HA 1 1 39 1 2 1 1 11 ARG H . 34 . HN 1 1 40 1 1 1 1 10 GLU HA . 33 . HA 1 1 40 1 2 1 1 13 ARG H . 36 . HN 1 1 41 1 1 1 1 10 GLU QB . 33 . HB2 1 1 41 1 2 1 1 11 ARG H . 34 . HN 1 1 42 1 1 1 1 10 GLU QG . 33 . HG# 1 1 42 1 2 1 1 11 ARG H . 34 . HN 1 1 43 1 1 1 1 11 ARG H . 34 . HN 1 1 43 1 2 1 1 12 GLN H . 35 . HN 1 1 44 1 1 1 1 12 GLN H . 35 . HN 1 1 44 1 2 1 1 12 GLN HA . 35 . HA 1 1 45 1 1 1 1 12 GLN H . 35 . HN 1 1 45 1 2 1 1 12 GLN HB2 . 35 . HB2 1 1 46 1 1 1 1 12 GLN H . 35 . HN 1 1 46 1 2 1 1 12 GLN QB . 35 . HB# 1 1 47 1 1 1 1 12 GLN H . 35 . HN 1 1 47 1 2 1 1 12 GLN HB3 . 35 . HB1 1 1 48 1 1 1 1 12 GLN H . 35 . HN 1 1 48 1 2 1 1 13 ARG H . 36 . HN 1 1 49 1 1 1 1 12 GLN HA . 35 . HA 1 1 49 1 2 1 1 13 ARG H . 36 . HN 1 1 50 1 1 1 1 13 ARG H . 36 . HN 1 1 50 1 2 1 1 13 ARG HA . 36 . HA 1 1 51 1 1 1 1 13 ARG H . 36 . HN 1 1 51 1 2 1 1 13 ARG QB . 36 . HB# 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 . . . . . 0.0 0.0 4.2 1 1 2 1 . . . . . 0.0 0.0 5.38 1 1 3 1 . . . . . 0.0 0.0 3.2 1 1 4 1 . . . . . 0.0 0.0 4.6 1 1 5 1 . . . . . 0.0 0.0 5.7 1 1 6 1 . . . . . 0.0 0.0 3.6 1 1 7 1 . . . . . 0.0 0.0 3.6 1 1 8 1 . . . . . 0.0 0.0 3.3 1 1 9 1 . . . . . 0.0 0.0 3.0 1 1 10 1 . . . . . 0.0 0.0 5.7 1 1 11 1 . . . . . 0.0 0.0 3.9 1 1 12 1 . . . . . 0.0 0.0 4.1 1 1 13 1 . . . . . 0.0 0.0 4.1 1 1 14 1 . . . . . 0.0 0.0 9.1 1 1 15 1 . . . . . 0.0 0.0 3.5 1 1 16 1 . . . . . 0.0 0.0 3.5 1 1 17 1 . . . . . 0.0 0.0 3.2 1 1 18 1 . . . . . 0.0 0.0 4.6 1 1 19 1 . . . . . 0.0 0.0 4.6 1 1 20 1 . . . . . 0.0 0.0 3.5 1 1 21 1 . . . . . 0.0 0.0 4.2 1 1 22 1 . . . . . 0.0 0.0 3.65 1 1 23 1 . . . . . 0.0 0.0 4.0 1 1 24 1 . . . . . 0.0 0.0 4.0 1 1 25 1 . . . . . 0.0 0.0 2.9 1 1 26 1 . . . . . 0.0 0.0 5.1 1 1 27 1 . . . . . 0.0 0.0 3.3 1 1 28 1 . . . . . 0.0 0.0 3.8 1 1 29 1 . . . . . 0.0 0.0 3.3 1 1 30 1 . . . . . 0.0 0.0 4.0 1 1 31 1 . . . . . 0.0 0.0 5.3 1 1 32 1 . . . . . 0.0 0.0 7.4 1 1 33 1 . . . . . 0.0 0.0 7.2 1 1 34 1 . . . . . 0.0 0.0 7.4 1 1 35 1 . . . . . 0.0 0.0 3.1 1 1 36 1 . . . . . 0.0 0.0 8.0 1 1 37 1 . . . . . 0.0 0.0 3.6 1 1 38 1 . . . . . 0.0 0.0 3.0 1 1 39 1 . . . . . 0.0 0.0 3.4 1 1 40 1 . . . . . 0.0 0.0 4.6 1 1 41 1 . . . . . 0.0 0.0 4.06 1 1 42 1 . . . . . 0.0 0.0 7.8 1 1 43 1 . . . . . 0.0 0.0 3.5 1 1 44 1 . . . . . 0.0 0.0 2.9 1 1 45 1 . . . . . 0.0 0.0 3.9 1 1 46 1 . . . . . 0.0 0.0 3.65 1 1 47 1 . . . . . 0.0 0.0 3.9 1 1 48 1 . . . . . 0.0 0.0 3.2 1 1 49 1 . . . . . 0.0 0.0 3.3 1 1 50 1 . . . . . 0.0 0.0 2.9 1 1 51 1 . . . . . 0.0 0.0 3.84 1 1 stop_ save_ save_CNS/XPLOR_dihedral_4 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 1 1 1 ACE C 1 1 2 ALA N 1 1 2 ALA CA 1 1 2 ALA C -100.0 -20.0 . 24 . C . 25 . N . 25 . CA . 25 . C 1 1 2 . 1 1 4 HIS C 1 1 5 TYR N 1 1 5 TYR CA 1 1 5 TYR C -89.99999 -30.0 . 27 . C . 28 . N . 28 . CA . 28 . C 1 1 3 . 1 1 5 TYR C 1 1 6 LYS N 1 1 6 LYS CA 1 1 6 LYS C -89.99999 -30.0 . 28 . C . 29 . N . 29 . CA . 29 . C 1 1 4 . 1 1 7 ASN C 1 1 8 LEU N 1 1 8 LEU CA 1 1 8 LEU C -100.0 -20.0 . 30 . C . 31 . N . 31 . CA . 31 . C 1 1 5 . 1 1 9 ILE C 1 1 10 GLU N 1 1 10 GLU CA 1 1 10 GLU C -100.0 -20.0 . 32 . C . 33 . N . 33 . CA . 33 . C 1 1 6 . 1 1 10 GLU C 1 1 11 ARG N 1 1 11 ARG CA 1 1 11 ARG C -89.99999 -30.0 . 33 . C . 34 . N . 34 . CA . 34 . C 1 1 7 . 1 1 11 ARG C 1 1 12 GLN N 1 1 12 GLN CA 1 1 12 GLN C -89.99999 -30.0 . 34 . C . 35 . N . 35 . CA . 35 . C 1 1 8 . 1 1 12 GLN C 1 1 13 ARG N 1 1 13 ARG CA 1 1 13 ARG C -160.0 -80.0 . 35 . C . 36 . N . 36 . CA . 36 . C 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 ACE C C 1.713 1.600 -1.597 1.00 . A A . 23 ACE C 1 1 1 2 1 1 1 ACE CH3 C 0.990 0.263 -1.665 1.00 . A A . 23 ACE CH3 1 1 1 3 1 1 1 ACE H1 H 1.399 -0.316 -2.481 1.00 . A A . 23 ACE H1 1 1 1 4 1 1 1 ACE H2 H -0.061 0.440 -1.840 1.00 . A A . 23 ACE H2 1 1 1 5 1 1 1 ACE H3 H 1.113 -0.276 -0.739 1.00 . A A . 23 ACE H3 1 1 1 6 1 1 1 ACE O O 1.670 2.369 -2.537 1.00 . A A . 23 ACE O 1 1 1 7 1 1 2 ALA C C 4.486 3.052 -1.076 1.00 . A A . 24 ALA C 1 1 1 8 1 1 2 ALA CA C 3.113 3.174 -0.397 1.00 . A A . 24 ALA CA 1 1 1 9 1 1 2 ALA CB C 3.268 3.514 1.100 1.00 . A A . 24 ALA CB 1 1 1 10 1 1 2 ALA H H 2.424 1.220 0.224 1.00 . A A . 24 ALA H 1 1 1 11 1 1 2 ALA HA H 2.551 3.951 -0.890 1.00 . A A . 24 ALA HA 1 1 1 12 1 1 2 ALA HB1 H 2.304 3.595 1.585 1.00 . A A . 24 ALA HB1 1 1 1 13 1 1 2 ALA HB2 H 3.795 4.452 1.201 1.00 . A A . 24 ALA HB2 1 1 1 14 1 1 2 ALA HB3 H 3.850 2.748 1.591 1.00 . A A . 24 ALA HB3 1 1 1 15 1 1 2 ALA N N 2.389 1.868 -0.509 1.00 . A A . 24 ALA N 1 1 1 16 1 1 2 ALA O O 5.507 3.337 -0.488 1.00 . A A . 24 ALA O 1 1 1 17 1 1 3 ARG C C 6.941 3.266 -2.757 1.00 . A A . 25 ARG C 1 1 1 18 1 1 3 ARG CA C 5.697 2.436 -3.143 1.00 . A A . 25 ARG CA 1 1 1 19 1 1 3 ARG CB C 5.278 2.685 -4.640 1.00 . A A . 25 ARG CB 1 1 1 20 1 1 3 ARG CD C 5.569 5.110 -5.469 1.00 . A A . 25 ARG CD 1 1 1 21 1 1 3 ARG CG C 4.561 4.049 -4.944 1.00 . A A . 25 ARG CG 1 1 1 22 1 1 3 ARG CZ C 4.949 6.708 -7.295 1.00 . A A . 25 ARG CZ 1 1 1 23 1 1 3 ARG H H 3.581 2.416 -2.700 1.00 . A A . 25 ARG H 1 1 1 24 1 1 3 ARG HA H 5.986 1.397 -3.057 1.00 . A A . 25 ARG HA 1 1 1 25 1 1 3 ARG HB2 H 6.157 2.582 -5.259 1.00 . A A . 25 ARG HB2 1 1 1 26 1 1 3 ARG HB3 H 4.610 1.883 -4.921 1.00 . A A . 25 ARG HB3 1 1 1 27 1 1 3 ARG HD2 H 6.179 5.508 -4.673 1.00 . A A . 25 ARG HD2 1 1 1 28 1 1 3 ARG HD3 H 6.223 4.644 -6.185 1.00 . A A . 25 ARG HD3 1 1 1 29 1 1 3 ARG HE H 4.080 6.648 -5.513 1.00 . A A . 25 ARG HE 1 1 1 30 1 1 3 ARG HG2 H 3.798 3.878 -5.693 1.00 . A A . 25 ARG HG2 1 1 1 31 1 1 3 ARG HG3 H 4.068 4.409 -4.052 1.00 . A A . 25 ARG HG3 1 1 1 32 1 1 3 ARG HH11 H 6.439 5.451 -7.743 1.00 . A A . 25 ARG HH11 1 1 1 33 1 1 3 ARG HH12 H 6.024 6.540 -8.994 1.00 . A A . 25 ARG HH12 1 1 1 34 1 1 3 ARG HH21 H 3.490 8.070 -7.088 1.00 . A A . 25 ARG HH21 1 1 1 35 1 1 3 ARG HH22 H 4.266 8.085 -8.613 1.00 . A A . 25 ARG HH22 1 1 1 36 1 1 3 ARG N N 4.460 2.622 -2.310 1.00 . A A . 25 ARG N 1 1 1 37 1 1 3 ARG NE N 4.774 6.243 -6.077 1.00 . A A . 25 ARG NE 1 1 1 38 1 1 3 ARG NH1 N 5.868 6.199 -8.068 1.00 . A A . 25 ARG NH1 1 1 1 39 1 1 3 ARG NH2 N 4.185 7.688 -7.697 1.00 . A A . 25 ARG NH2 1 1 1 40 1 1 3 ARG O O 8.024 2.732 -2.632 1.00 . A A . 25 ARG O 1 1 1 41 1 1 4 HIS C C 8.769 4.881 -0.993 1.00 . A A . 26 HIS C 1 1 1 42 1 1 4 HIS CA C 7.973 5.402 -2.192 1.00 . A A . 26 HIS CA 1 1 1 43 1 1 4 HIS CB C 7.496 6.829 -1.876 1.00 . A A . 26 HIS CB 1 1 1 44 1 1 4 HIS CD2 C 5.768 7.983 -3.449 1.00 . A A . 26 HIS CD2 1 1 1 45 1 1 4 HIS CE1 C 7.012 8.234 -5.041 1.00 . A A . 26 HIS CE1 1 1 1 46 1 1 4 HIS CG C 7.015 7.490 -3.166 1.00 . A A . 26 HIS CG 1 1 1 47 1 1 4 HIS H H 5.901 4.944 -2.672 1.00 . A A . 26 HIS H 1 1 1 48 1 1 4 HIS HA H 8.645 5.391 -3.024 1.00 . A A . 26 HIS HA 1 1 1 49 1 1 4 HIS HB2 H 6.686 6.807 -1.161 1.00 . A A . 26 HIS HB2 1 1 1 50 1 1 4 HIS HB3 H 8.305 7.417 -1.464 1.00 . A A . 26 HIS HB3 1 1 1 51 1 1 4 HIS HD1 H 8.753 7.405 -4.277 1.00 . A A . 26 HIS HD1 1 1 1 52 1 1 4 HIS HD2 H 4.920 7.981 -2.780 1.00 . A A . 26 HIS HD2 1 1 1 53 1 1 4 HIS HE1 H 7.360 8.520 -6.024 1.00 . A A . 26 HIS HE1 1 1 1 54 1 1 4 HIS N N 6.791 4.549 -2.570 1.00 . A A . 26 HIS N 1 1 1 55 1 1 4 HIS ND1 N 7.807 7.651 -4.183 1.00 . A A . 26 HIS ND1 1 1 1 56 1 1 4 HIS NE2 N 5.778 8.462 -4.665 1.00 . A A . 26 HIS NE2 1 1 1 57 1 1 4 HIS O O 9.960 5.094 -0.859 1.00 . A A . 26 HIS O 1 1 1 58 1 1 5 TYR C C 9.208 2.227 0.920 1.00 . A A . 27 TYR C 1 1 1 59 1 1 5 TYR CA C 8.560 3.583 1.081 1.00 . A A . 27 TYR CA 1 1 1 60 1 1 5 TYR CB C 7.382 3.492 2.086 1.00 . A A . 27 TYR CB 1 1 1 61 1 1 5 TYR CD1 C 7.874 5.817 2.938 1.00 . A A . 27 TYR CD1 1 1 1 62 1 1 5 TYR CD2 C 7.530 4.081 4.530 1.00 . A A . 27 TYR CD2 1 1 1 63 1 1 5 TYR CE1 C 8.074 6.713 3.958 1.00 . A A . 27 TYR CE1 1 1 1 64 1 1 5 TYR CE2 C 7.730 4.980 5.552 1.00 . A A . 27 TYR CE2 1 1 1 65 1 1 5 TYR CG C 7.601 4.494 3.216 1.00 . A A . 27 TYR CG 1 1 1 66 1 1 5 TYR CZ C 8.004 6.302 5.267 1.00 . A A . 27 TYR CZ 1 1 1 67 1 1 5 TYR H H 7.103 4.098 -0.437 1.00 . A A . 27 TYR H 1 1 1 68 1 1 5 TYR HA H 9.350 4.219 1.423 1.00 . A A . 27 TYR HA 1 1 1 69 1 1 5 TYR HB2 H 6.436 3.721 1.613 1.00 . A A . 27 TYR HB2 1 1 1 70 1 1 5 TYR HB3 H 7.316 2.496 2.503 1.00 . A A . 27 TYR HB3 1 1 1 71 1 1 5 TYR HD1 H 7.933 6.157 1.916 1.00 . A A . 27 TYR HD1 1 1 1 72 1 1 5 TYR HD2 H 7.315 3.047 4.761 1.00 . A A . 27 TYR HD2 1 1 1 73 1 1 5 TYR HE1 H 8.290 7.746 3.733 1.00 . A A . 27 TYR HE1 1 1 1 74 1 1 5 TYR HE2 H 7.672 4.640 6.576 1.00 . A A . 27 TYR HE2 1 1 1 75 1 1 5 TYR HH H 7.611 7.034 6.992 1.00 . A A . 27 TYR HH 1 1 1 76 1 1 5 TYR N N 8.037 4.196 -0.176 1.00 . A A . 27 TYR N 1 1 1 77 1 1 5 TYR O O 9.696 1.641 1.870 1.00 . A A . 27 TYR O 1 1 1 78 1 1 5 TYR OH O 8.214 7.221 6.268 1.00 . A A . 27 TYR OH 1 1 1 79 1 1 6 LYS C C 11.321 0.698 -0.312 1.00 . A A . 28 LYS C 1 1 1 80 1 1 6 LYS CA C 9.823 0.447 -0.581 1.00 . A A . 28 LYS CA 1 1 1 81 1 1 6 LYS CB C 9.556 0.069 -2.061 1.00 . A A . 28 LYS CB 1 1 1 82 1 1 6 LYS CD C 9.259 -1.964 -3.585 1.00 . A A . 28 LYS CD 1 1 1 83 1 1 6 LYS CE C 10.695 -1.819 -4.113 1.00 . A A . 28 LYS CE 1 1 1 84 1 1 6 LYS CG C 9.189 -1.433 -2.135 1.00 . A A . 28 LYS CG 1 1 1 85 1 1 6 LYS H H 8.798 2.344 -0.977 1.00 . A A . 28 LYS H 1 1 1 86 1 1 6 LYS HA H 9.445 -0.289 0.115 1.00 . A A . 28 LYS HA 1 1 1 87 1 1 6 LYS HB2 H 8.727 0.625 -2.464 1.00 . A A . 28 LYS HB2 1 1 1 88 1 1 6 LYS HB3 H 10.420 0.274 -2.674 1.00 . A A . 28 LYS HB3 1 1 1 89 1 1 6 LYS HD2 H 8.978 -3.008 -3.586 1.00 . A A . 28 LYS HD2 1 1 1 90 1 1 6 LYS HD3 H 8.570 -1.431 -4.224 1.00 . A A . 28 LYS HD3 1 1 1 91 1 1 6 LYS HE2 H 10.828 -2.476 -4.958 1.00 . A A . 28 LYS HE2 1 1 1 92 1 1 6 LYS HE3 H 10.925 -0.802 -4.409 1.00 . A A . 28 LYS HE3 1 1 1 93 1 1 6 LYS HG2 H 9.835 -2.024 -1.504 1.00 . A A . 28 LYS HG2 1 1 1 94 1 1 6 LYS HG3 H 8.178 -1.572 -1.792 1.00 . A A . 28 LYS HG3 1 1 1 95 1 1 6 LYS HZ1 H 11.497 -3.196 -2.676 1.00 . A A . 28 LYS HZ1 1 1 1 96 1 1 6 LYS N N 9.207 1.777 -0.293 1.00 . A A . 28 LYS N 1 1 1 97 1 1 6 LYS NZ N 11.589 -2.275 -3.000 1.00 . A A . 28 LYS NZ 1 1 1 98 1 1 6 LYS O O 12.013 -0.089 0.308 1.00 . A A . 28 LYS O 1 1 1 99 1 1 7 ASN C C 13.757 1.958 0.686 1.00 . A A . 29 ASN C 1 1 1 100 1 1 7 ASN CA C 13.167 2.301 -0.690 1.00 . A A . 29 ASN CA 1 1 1 101 1 1 7 ASN CB C 13.220 3.834 -0.882 1.00 . A A . 29 ASN CB 1 1 1 102 1 1 7 ASN CG C 13.100 4.202 -2.358 1.00 . A A . 29 ASN CG 1 1 1 103 1 1 7 ASN H H 11.097 2.365 -1.314 1.00 . A A . 29 ASN H 1 1 1 104 1 1 7 ASN HA H 13.766 1.824 -1.455 1.00 . A A . 29 ASN HA 1 1 1 105 1 1 7 ASN HB2 H 12.426 4.318 -0.334 1.00 . A A . 29 ASN HB2 1 1 1 106 1 1 7 ASN HB3 H 14.164 4.215 -0.523 1.00 . A A . 29 ASN HB3 1 1 1 107 1 1 7 ASN HD21 H 11.331 5.098 -2.169 1.00 . A A . 29 ASN HD21 1 1 1 108 1 1 7 ASN HD22 H 12.011 5.066 -3.735 1.00 . A A . 29 ASN HD22 1 1 1 109 1 1 7 ASN N N 11.751 1.825 -0.824 1.00 . A A . 29 ASN N 1 1 1 110 1 1 7 ASN ND2 N 12.056 4.843 -2.784 1.00 . A A . 29 ASN ND2 1 1 1 111 1 1 7 ASN O O 14.742 1.258 0.805 1.00 . A A . 29 ASN O 1 1 1 112 1 1 7 ASN OD1 O 13.972 3.904 -3.145 1.00 . A A . 29 ASN OD1 1 1 1 113 1 1 8 LEU C C 13.807 0.761 3.406 1.00 . A A . 30 LEU C 1 1 1 114 1 1 8 LEU CA C 13.554 2.244 3.108 1.00 . A A . 30 LEU CA 1 1 1 115 1 1 8 LEU CB C 12.465 2.799 4.050 1.00 . A A . 30 LEU CB 1 1 1 116 1 1 8 LEU CD1 C 11.072 4.771 4.686 1.00 . A A . 30 LEU CD1 1 1 1 117 1 1 8 LEU CD2 C 13.421 5.170 3.938 1.00 . A A . 30 LEU CD2 1 1 1 118 1 1 8 LEU CG C 12.168 4.293 3.735 1.00 . A A . 30 LEU CG 1 1 1 119 1 1 8 LEU H H 12.318 3.016 1.516 1.00 . A A . 30 LEU H 1 1 1 120 1 1 8 LEU HA H 14.485 2.765 3.262 1.00 . A A . 30 LEU HA 1 1 1 121 1 1 8 LEU HB2 H 11.555 2.225 3.931 1.00 . A A . 30 LEU HB2 1 1 1 122 1 1 8 LEU HB3 H 12.798 2.689 5.072 1.00 . A A . 30 LEU HB3 1 1 1 123 1 1 8 LEU HD11 H 11.379 4.689 5.719 1.00 . A A . 30 LEU HD11 1 1 1 124 1 1 8 LEU HD12 H 10.182 4.177 4.551 1.00 . A A . 30 LEU HD12 1 1 1 125 1 1 8 LEU HD13 H 10.820 5.802 4.485 1.00 . A A . 30 LEU HD13 1 1 1 126 1 1 8 LEU HD21 H 14.205 4.875 3.260 1.00 . A A . 30 LEU HD21 1 1 1 127 1 1 8 LEU HD22 H 13.781 5.086 4.955 1.00 . A A . 30 LEU HD22 1 1 1 128 1 1 8 LEU HD23 H 13.180 6.206 3.743 1.00 . A A . 30 LEU HD23 1 1 1 129 1 1 8 LEU HG H 11.807 4.405 2.722 1.00 . A A . 30 LEU HG 1 1 1 130 1 1 8 LEU N N 13.112 2.474 1.697 1.00 . A A . 30 LEU N 1 1 1 131 1 1 8 LEU O O 14.896 0.360 3.778 1.00 . A A . 30 LEU O 1 1 1 132 1 1 9 ILE C C 13.880 -2.094 2.484 1.00 . A A . 31 ILE C 1 1 1 133 1 1 9 ILE CA C 12.872 -1.481 3.467 1.00 . A A . 31 ILE CA 1 1 1 134 1 1 9 ILE CB C 11.443 -2.096 3.295 1.00 . A A . 31 ILE CB 1 1 1 135 1 1 9 ILE CD1 C 10.738 -1.438 5.713 1.00 . A A . 31 ILE CD1 1 1 1 136 1 1 9 ILE CG1 C 10.385 -1.365 4.201 1.00 . A A . 31 ILE CG1 1 1 1 137 1 1 9 ILE CG2 C 11.466 -3.603 3.657 1.00 . A A . 31 ILE CG2 1 1 1 138 1 1 9 ILE H H 11.932 0.374 2.898 1.00 . A A . 31 ILE H 1 1 1 139 1 1 9 ILE HA H 13.255 -1.630 4.459 1.00 . A A . 31 ILE HA 1 1 1 140 1 1 9 ILE HB H 11.144 -1.989 2.260 1.00 . A A . 31 ILE HB 1 1 1 141 1 1 9 ILE HD11 H 10.777 -2.463 6.048 1.00 . A A . 31 ILE HD11 1 1 1 142 1 1 9 ILE HD12 H 9.978 -0.925 6.285 1.00 . A A . 31 ILE HD12 1 1 1 143 1 1 9 ILE HD13 H 11.695 -0.976 5.915 1.00 . A A . 31 ILE HD13 1 1 1 144 1 1 9 ILE HG12 H 10.303 -0.328 3.909 1.00 . A A . 31 ILE HG12 1 1 1 145 1 1 9 ILE HG13 H 9.415 -1.819 4.051 1.00 . A A . 31 ILE HG13 1 1 1 146 1 1 9 ILE HG21 H 10.477 -4.023 3.546 1.00 . A A . 31 ILE HG21 1 1 1 147 1 1 9 ILE HG22 H 11.800 -3.751 4.674 1.00 . A A . 31 ILE HG22 1 1 1 148 1 1 9 ILE HG23 H 12.137 -4.137 3.000 1.00 . A A . 31 ILE HG23 1 1 1 149 1 1 9 ILE N N 12.775 -0.013 3.214 1.00 . A A . 31 ILE N 1 1 1 150 1 1 9 ILE O O 14.449 -3.143 2.709 1.00 . A A . 31 ILE O 1 1 1 151 1 1 10 GLU C C 16.425 -1.308 0.551 1.00 . A A . 32 GLU C 1 1 1 152 1 1 10 GLU CA C 15.031 -1.853 0.347 1.00 . A A . 32 GLU CA 1 1 1 153 1 1 10 GLU CB C 14.530 -1.403 -1.014 1.00 . A A . 32 GLU CB 1 1 1 154 1 1 10 GLU CD C 12.483 -1.495 -2.448 1.00 . A A . 32 GLU CD 1 1 1 155 1 1 10 GLU CG C 13.262 -2.175 -1.337 1.00 . A A . 32 GLU CG 1 1 1 156 1 1 10 GLU H H 13.588 -0.545 1.311 1.00 . A A . 32 GLU H 1 1 1 157 1 1 10 GLU HA H 15.112 -2.929 0.406 1.00 . A A . 32 GLU HA 1 1 1 158 1 1 10 GLU HB2 H 14.337 -0.341 -1.003 1.00 . A A . 32 GLU HB2 1 1 1 159 1 1 10 GLU HB3 H 15.278 -1.606 -1.767 1.00 . A A . 32 GLU HB3 1 1 1 160 1 1 10 GLU HG2 H 13.513 -3.171 -1.670 1.00 . A A . 32 GLU HG2 1 1 1 161 1 1 10 GLU HG3 H 12.615 -2.249 -0.476 1.00 . A A . 32 GLU HG3 1 1 1 162 1 1 10 GLU N N 14.080 -1.391 1.405 1.00 . A A . 32 GLU N 1 1 1 163 1 1 10 GLU O O 17.276 -1.510 -0.289 1.00 . A A . 32 GLU O 1 1 1 164 1 1 10 GLU OE1 O 12.685 -0.333 -2.760 1.00 . A A . 32 GLU OE1 1 1 1 165 1 1 11 ARG C C 18.604 -1.057 2.911 1.00 . A A . 33 ARG C 1 1 1 166 1 1 11 ARG CA C 17.967 -0.080 1.931 1.00 . A A . 33 ARG CA 1 1 1 167 1 1 11 ARG CB C 17.844 1.340 2.561 1.00 . A A . 33 ARG CB 1 1 1 168 1 1 11 ARG CD C 19.240 3.225 3.584 1.00 . A A . 33 ARG CD 1 1 1 169 1 1 11 ARG CG C 19.248 1.777 3.072 1.00 . A A . 33 ARG CG 1 1 1 170 1 1 11 ARG CZ C 18.256 5.071 2.212 1.00 . A A . 33 ARG CZ 1 1 1 171 1 1 11 ARG H H 15.857 -0.511 2.256 1.00 . A A . 33 ARG H 1 1 1 172 1 1 11 ARG HA H 18.548 -0.061 1.027 1.00 . A A . 33 ARG HA 1 1 1 173 1 1 11 ARG HB2 H 17.499 2.026 1.801 1.00 . A A . 33 ARG HB2 1 1 1 174 1 1 11 ARG HB3 H 17.130 1.325 3.372 1.00 . A A . 33 ARG HB3 1 1 1 175 1 1 11 ARG HD2 H 18.424 3.370 4.270 1.00 . A A . 33 ARG HD2 1 1 1 176 1 1 11 ARG HD3 H 20.162 3.401 4.123 1.00 . A A . 33 ARG HD3 1 1 1 177 1 1 11 ARG HE H 19.919 4.070 1.755 1.00 . A A . 33 ARG HE 1 1 1 178 1 1 11 ARG HG2 H 19.545 1.132 3.889 1.00 . A A . 33 ARG HG2 1 1 1 179 1 1 11 ARG HG3 H 19.980 1.658 2.284 1.00 . A A . 33 ARG HG3 1 1 1 180 1 1 11 ARG HH11 H 17.222 4.604 3.858 1.00 . A A . 33 ARG HH11 1 1 1 181 1 1 11 ARG HH12 H 16.554 5.884 2.944 1.00 . A A . 33 ARG HH12 1 1 1 182 1 1 11 ARG HH21 H 19.087 5.727 0.496 1.00 . A A . 33 ARG HH21 1 1 1 183 1 1 11 ARG HH22 H 17.665 6.543 0.963 1.00 . A A . 33 ARG HH22 1 1 1 184 1 1 11 ARG N N 16.616 -0.639 1.647 1.00 . A A . 33 ARG N 1 1 1 185 1 1 11 ARG NE N 19.186 4.163 2.404 1.00 . A A . 33 ARG NE 1 1 1 186 1 1 11 ARG NH1 N 17.274 5.200 3.060 1.00 . A A . 33 ARG NH1 1 1 1 187 1 1 11 ARG NH2 N 18.341 5.831 1.154 1.00 . A A . 33 ARG NH2 1 1 1 188 1 1 11 ARG O O 19.755 -1.414 2.783 1.00 . A A . 33 ARG O 1 1 1 189 1 1 12 GLN C C 19.373 -3.405 4.428 1.00 . A A . 34 GLN C 1 1 1 190 1 1 12 GLN CA C 18.281 -2.425 4.923 1.00 . A A . 34 GLN CA 1 1 1 191 1 1 12 GLN CB C 17.045 -3.215 5.443 1.00 . A A . 34 GLN CB 1 1 1 192 1 1 12 GLN CD C 14.829 -2.911 6.694 1.00 . A A . 34 GLN CD 1 1 1 193 1 1 12 GLN CG C 15.977 -2.205 5.968 1.00 . A A . 34 GLN CG 1 1 1 194 1 1 12 GLN H H 16.908 -1.102 3.867 1.00 . A A . 34 GLN H 1 1 1 195 1 1 12 GLN HA H 18.714 -1.854 5.733 1.00 . A A . 34 GLN HA 1 1 1 196 1 1 12 GLN HB2 H 16.604 -3.804 4.650 1.00 . A A . 34 GLN HB2 1 1 1 197 1 1 12 GLN HB3 H 17.368 -3.879 6.232 1.00 . A A . 34 GLN HB3 1 1 1 198 1 1 12 GLN HE21 H 15.901 -4.434 7.393 1.00 . A A . 34 GLN HE21 1 1 1 199 1 1 12 GLN HE22 H 14.250 -4.424 7.792 1.00 . A A . 34 GLN HE22 1 1 1 200 1 1 12 GLN HG2 H 16.420 -1.495 6.651 1.00 . A A . 34 GLN HG2 1 1 1 201 1 1 12 GLN HG3 H 15.541 -1.661 5.145 1.00 . A A . 34 GLN HG3 1 1 1 202 1 1 12 GLN N N 17.818 -1.460 3.868 1.00 . A A . 34 GLN N 1 1 1 203 1 1 12 GLN NE2 N 15.020 -4.016 7.344 1.00 . A A . 34 GLN NE2 1 1 1 204 1 1 12 GLN O O 20.491 -3.342 4.892 1.00 . A A . 34 GLN O 1 1 1 205 1 1 12 GLN OE1 O 13.708 -2.450 6.683 1.00 . A A . 34 GLN OE1 1 1 1 206 1 1 13 ARG C C 20.800 -4.706 1.751 1.00 . A A . 35 ARG C 1 1 1 207 1 1 13 ARG CA C 20.075 -5.255 3.004 1.00 . A A . 35 ARG CA 1 1 1 208 1 1 13 ARG CB C 19.369 -6.606 2.679 1.00 . A A . 35 ARG CB 1 1 1 209 1 1 13 ARG CD C 19.714 -9.111 2.404 1.00 . A A . 35 ARG CD 1 1 1 210 1 1 13 ARG CG C 20.422 -7.759 2.655 1.00 . A A . 35 ARG CG 1 1 1 211 1 1 13 ARG CZ C 21.184 -10.944 1.577 1.00 . A A . 35 ARG CZ 1 1 1 212 1 1 13 ARG H H 18.134 -4.310 3.170 1.00 . A A . 35 ARG H 1 1 1 213 1 1 13 ARG HA H 20.804 -5.395 3.784 1.00 . A A . 35 ARG HA 1 1 1 214 1 1 13 ARG HB2 H 18.617 -6.807 3.428 1.00 . A A . 35 ARG HB2 1 1 1 215 1 1 13 ARG HB3 H 18.885 -6.528 1.715 1.00 . A A . 35 ARG HB3 1 1 1 216 1 1 13 ARG HD2 H 18.943 -9.240 3.155 1.00 . A A . 35 ARG HD2 1 1 1 217 1 1 13 ARG HD3 H 19.230 -9.139 1.442 1.00 . A A . 35 ARG HD3 1 1 1 218 1 1 13 ARG HE H 21.018 -10.398 3.492 1.00 . A A . 35 ARG HE 1 1 1 219 1 1 13 ARG HG2 H 21.152 -7.572 1.878 1.00 . A A . 35 ARG HG2 1 1 1 220 1 1 13 ARG HG3 H 20.939 -7.785 3.604 1.00 . A A . 35 ARG HG3 1 1 1 221 1 1 13 ARG HH11 H 20.174 -9.949 0.171 1.00 . A A . 35 ARG HH11 1 1 1 222 1 1 13 ARG HH12 H 21.118 -11.251 -0.417 1.00 . A A . 35 ARG HH12 1 1 1 223 1 1 13 ARG HH21 H 22.332 -12.077 2.781 1.00 . A A . 35 ARG HH21 1 1 1 224 1 1 13 ARG HH22 H 22.417 -12.466 1.119 1.00 . A A . 35 ARG HH22 1 1 1 225 1 1 13 ARG N N 19.045 -4.286 3.514 1.00 . A A . 35 ARG N 1 1 1 226 1 1 13 ARG NE N 20.722 -10.223 2.571 1.00 . A A . 35 ARG NE 1 1 1 227 1 1 13 ARG NH1 N 20.800 -10.702 0.357 1.00 . A A . 35 ARG NH1 1 1 1 228 1 1 13 ARG NH2 N 22.035 -11.893 1.845 1.00 . A A . 35 ARG NH2 1 1 1 229 1 1 13 ARG O O 21.718 -5.314 1.239 1.00 . A A . 35 ARG O 1 1 1 230 1 1 14 TYR C C 21.183 -1.402 0.406 1.00 . A A . 36 TYR C 1 1 1 231 1 1 14 TYR CA C 20.925 -2.887 0.092 1.00 . A A . 36 TYR CA 1 1 1 232 1 1 14 TYR CB C 19.920 -3.042 -1.091 1.00 . A A . 36 TYR CB 1 1 1 233 1 1 14 TYR CD1 C 21.515 -4.002 -2.789 1.00 . A A . 36 TYR CD1 1 1 1 234 1 1 14 TYR CD2 C 19.632 -5.327 -2.200 1.00 . A A . 36 TYR CD2 1 1 1 235 1 1 14 TYR CE1 C 21.934 -4.981 -3.664 1.00 . A A . 36 TYR CE1 1 1 1 236 1 1 14 TYR CE2 C 20.053 -6.306 -3.076 1.00 . A A . 36 TYR CE2 1 1 1 237 1 1 14 TYR CG C 20.361 -4.162 -2.048 1.00 . A A . 36 TYR CG 1 1 1 238 1 1 14 TYR CZ C 21.204 -6.140 -3.814 1.00 . A A . 36 TYR CZ 1 1 1 239 1 1 14 TYR H H 19.626 -3.120 1.757 1.00 . A A . 36 TYR H 1 1 1 240 1 1 14 TYR HA H 21.868 -3.352 -0.140 1.00 . A A . 36 TYR HA 1 1 1 241 1 1 14 TYR HB2 H 18.933 -3.264 -0.715 1.00 . A A . 36 TYR HB2 1 1 1 242 1 1 14 TYR HB3 H 19.858 -2.122 -1.657 1.00 . A A . 36 TYR HB3 1 1 1 243 1 1 14 TYR HD1 H 22.099 -3.098 -2.683 1.00 . A A . 36 TYR HD1 1 1 1 244 1 1 14 TYR HD2 H 18.726 -5.476 -1.632 1.00 . A A . 36 TYR HD2 1 1 1 245 1 1 14 TYR HE1 H 22.841 -4.833 -4.231 1.00 . A A . 36 TYR HE1 1 1 1 246 1 1 14 TYR HE2 H 19.477 -7.212 -3.190 1.00 . A A . 36 TYR HE2 1 1 1 247 1 1 14 TYR HH H 21.741 -6.744 -5.561 1.00 . A A . 36 TYR HH 1 1 1 248 1 1 14 TYR N N 20.357 -3.568 1.293 1.00 . A A . 36 TYR N 1 1 1 249 1 1 14 TYR O O 20.518 -0.509 -0.077 1.00 . A A . 36 TYR O 1 1 1 250 1 1 14 TYR OH O 21.605 -7.129 -4.689 1.00 . A A . 36 TYR OH 1 1 1 251 1 1 15 NH2 HN1 H 22.701 -1.778 1.630 1.00 . A A . 37 NH2 HN1 1 1 1 252 1 1 15 NH2 HN2 H 22.298 -0.139 1.418 1.00 . A A . 37 NH2 HN2 1 1 1 253 1 1 15 NH2 N N 22.143 -1.084 1.221 1.00 . A A . 37 NH2 N 1 1 2 254 1 1 1 ACE C C 2.749 4.694 -2.769 1.00 . A A . 23 ACE C 1 1 2 255 1 1 1 ACE CH3 C 1.754 5.407 -3.681 1.00 . A A . 23 ACE CH3 1 1 2 256 1 1 1 ACE H1 H 2.130 5.398 -4.693 1.00 . A A . 23 ACE H1 1 1 2 257 1 1 1 ACE H2 H 1.639 6.428 -3.349 1.00 . A A . 23 ACE H2 1 1 2 258 1 1 1 ACE H3 H 0.795 4.912 -3.648 1.00 . A A . 23 ACE H3 1 1 2 259 1 1 1 ACE O O 3.883 5.124 -2.675 1.00 . A A . 23 ACE O 1 1 2 260 1 1 2 ALA C C 4.626 2.836 -1.564 1.00 . A A . 24 ALA C 1 1 2 261 1 1 2 ALA CA C 3.143 2.815 -1.200 1.00 . A A . 24 ALA CA 1 1 2 262 1 1 2 ALA CB C 2.622 1.359 -1.205 1.00 . A A . 24 ALA CB 1 1 2 263 1 1 2 ALA H H 1.365 3.371 -2.283 1.00 . A A . 24 ALA H 1 1 2 264 1 1 2 ALA HA H 3.050 3.233 -0.214 1.00 . A A . 24 ALA HA 1 1 2 265 1 1 2 ALA HB1 H 1.592 1.321 -0.879 1.00 . A A . 24 ALA HB1 1 1 2 266 1 1 2 ALA HB2 H 3.215 0.761 -0.527 1.00 . A A . 24 ALA HB2 1 1 2 267 1 1 2 ALA HB3 H 2.691 0.924 -2.192 1.00 . A A . 24 ALA HB3 1 1 2 268 1 1 2 ALA N N 2.296 3.635 -2.137 1.00 . A A . 24 ALA N 1 1 2 269 1 1 2 ALA O O 5.461 3.151 -0.744 1.00 . A A . 24 ALA O 1 1 2 270 1 1 3 ARG C C 7.301 3.377 -2.717 1.00 . A A . 25 ARG C 1 1 2 271 1 1 3 ARG CA C 6.266 2.437 -3.373 1.00 . A A . 25 ARG CA 1 1 2 272 1 1 3 ARG CB C 6.170 2.744 -4.900 1.00 . A A . 25 ARG CB 1 1 2 273 1 1 3 ARG CD C 5.245 4.278 -6.686 1.00 . A A . 25 ARG CD 1 1 2 274 1 1 3 ARG CG C 5.269 3.980 -5.179 1.00 . A A . 25 ARG CG 1 1 2 275 1 1 3 ARG CZ C 6.729 5.917 -7.814 1.00 . A A . 25 ARG CZ 1 1 2 276 1 1 3 ARG H H 4.105 2.242 -3.337 1.00 . A A . 25 ARG H 1 1 2 277 1 1 3 ARG HA H 6.632 1.427 -3.251 1.00 . A A . 25 ARG HA 1 1 2 278 1 1 3 ARG HB2 H 7.167 2.904 -5.282 1.00 . A A . 25 ARG HB2 1 1 2 279 1 1 3 ARG HB3 H 5.761 1.879 -5.404 1.00 . A A . 25 ARG HB3 1 1 2 280 1 1 3 ARG HD2 H 5.066 3.380 -7.267 1.00 . A A . 25 ARG HD2 1 1 2 281 1 1 3 ARG HD3 H 4.444 4.975 -6.865 1.00 . A A . 25 ARG HD3 1 1 2 282 1 1 3 ARG HE H 7.374 4.405 -6.680 1.00 . A A . 25 ARG HE 1 1 2 283 1 1 3 ARG HG2 H 4.263 3.779 -4.848 1.00 . A A . 25 ARG HG2 1 1 2 284 1 1 3 ARG HG3 H 5.637 4.844 -4.643 1.00 . A A . 25 ARG HG3 1 1 2 285 1 1 3 ARG HH11 H 4.772 6.176 -8.144 1.00 . A A . 25 ARG HH11 1 1 2 286 1 1 3 ARG HH12 H 5.777 7.326 -8.900 1.00 . A A . 25 ARG HH12 1 1 2 287 1 1 3 ARG HH21 H 8.740 5.903 -7.674 1.00 . A A . 25 ARG HH21 1 1 2 288 1 1 3 ARG HH22 H 8.081 7.155 -8.627 1.00 . A A . 25 ARG HH22 1 1 2 289 1 1 3 ARG N N 4.879 2.483 -2.793 1.00 . A A . 25 ARG N 1 1 2 290 1 1 3 ARG NE N 6.585 4.856 -7.053 1.00 . A A . 25 ARG NE 1 1 2 291 1 1 3 ARG NH1 N 5.689 6.516 -8.322 1.00 . A A . 25 ARG NH1 1 1 2 292 1 1 3 ARG NH2 N 7.931 6.353 -8.054 1.00 . A A . 25 ARG NH2 1 1 2 293 1 1 3 ARG O O 8.443 3.002 -2.521 1.00 . A A . 25 ARG O 1 1 2 294 1 1 4 HIS C C 8.376 5.069 -0.380 1.00 . A A . 26 HIS C 1 1 2 295 1 1 4 HIS CA C 7.840 5.549 -1.745 1.00 . A A . 26 HIS CA 1 1 2 296 1 1 4 HIS CB C 7.118 6.901 -1.578 1.00 . A A . 26 HIS CB 1 1 2 297 1 1 4 HIS CD2 C 7.373 8.046 -3.903 1.00 . A A . 26 HIS CD2 1 1 2 298 1 1 4 HIS CE1 C 5.487 7.687 -4.581 1.00 . A A . 26 HIS CE1 1 1 2 299 1 1 4 HIS CG C 6.645 7.367 -2.958 1.00 . A A . 26 HIS CG 1 1 2 300 1 1 4 HIS H H 5.952 4.822 -2.558 1.00 . A A . 26 HIS H 1 1 2 301 1 1 4 HIS HA H 8.696 5.654 -2.394 1.00 . A A . 26 HIS HA 1 1 2 302 1 1 4 HIS HB2 H 6.265 6.809 -0.920 1.00 . A A . 26 HIS HB2 1 1 2 303 1 1 4 HIS HB3 H 7.799 7.637 -1.170 1.00 . A A . 26 HIS HB3 1 1 2 304 1 1 4 HIS HD1 H 4.696 6.675 -2.942 1.00 . A A . 26 HIS HD1 1 1 2 305 1 1 4 HIS HD2 H 8.401 8.360 -3.799 1.00 . A A . 26 HIS HD2 1 1 2 306 1 1 4 HIS HE1 H 4.628 7.684 -5.238 1.00 . A A . 26 HIS HE1 1 1 2 307 1 1 4 HIS N N 6.889 4.573 -2.387 1.00 . A A . 26 HIS N 1 1 2 308 1 1 4 HIS ND1 N 5.442 7.139 -3.393 1.00 . A A . 26 HIS ND1 1 1 2 309 1 1 4 HIS NE2 N 6.613 8.247 -4.948 1.00 . A A . 26 HIS NE2 1 1 2 310 1 1 4 HIS O O 9.211 5.699 0.239 1.00 . A A . 26 HIS O 1 1 2 311 1 1 5 TYR C C 8.905 1.956 1.016 1.00 . A A . 27 TYR C 1 1 2 312 1 1 5 TYR CA C 8.239 3.300 1.328 1.00 . A A . 27 TYR CA 1 1 2 313 1 1 5 TYR CB C 6.971 3.086 2.175 1.00 . A A . 27 TYR CB 1 1 2 314 1 1 5 TYR CD1 C 6.987 5.460 3.068 1.00 . A A . 27 TYR CD1 1 1 2 315 1 1 5 TYR CD2 C 6.885 3.659 4.622 1.00 . A A . 27 TYR CD2 1 1 2 316 1 1 5 TYR CE1 C 6.969 6.358 4.114 1.00 . A A . 27 TYR CE1 1 1 2 317 1 1 5 TYR CE2 C 6.866 4.558 5.665 1.00 . A A . 27 TYR CE2 1 1 2 318 1 1 5 TYR CG C 6.945 4.103 3.318 1.00 . A A . 27 TYR CG 1 1 2 319 1 1 5 TYR CZ C 6.908 5.913 5.414 1.00 . A A . 27 TYR CZ 1 1 2 320 1 1 5 TYR H H 7.184 3.523 -0.522 1.00 . A A . 27 TYR H 1 1 2 321 1 1 5 TYR HA H 8.958 3.921 1.841 1.00 . A A . 27 TYR HA 1 1 2 322 1 1 5 TYR HB2 H 6.084 3.211 1.570 1.00 . A A . 27 TYR HB2 1 1 2 323 1 1 5 TYR HB3 H 6.975 2.083 2.580 1.00 . A A . 27 TYR HB3 1 1 2 324 1 1 5 TYR HD1 H 7.036 5.824 2.052 1.00 . A A . 27 TYR HD1 1 1 2 325 1 1 5 TYR HD2 H 6.854 2.600 4.830 1.00 . A A . 27 TYR HD2 1 1 2 326 1 1 5 TYR HE1 H 7.002 7.419 3.917 1.00 . A A . 27 TYR HE1 1 1 2 327 1 1 5 TYR HE2 H 6.821 4.192 6.679 1.00 . A A . 27 TYR HE2 1 1 2 328 1 1 5 TYR HH H 6.244 6.554 7.095 1.00 . A A . 27 TYR HH 1 1 2 329 1 1 5 TYR N N 7.860 3.950 0.038 1.00 . A A . 27 TYR N 1 1 2 330 1 1 5 TYR O O 9.030 1.093 1.864 1.00 . A A . 27 TYR O 1 1 2 331 1 1 5 TYR OH O 6.895 6.827 6.444 1.00 . A A . 27 TYR OH 1 1 2 332 1 1 6 LYS C C 11.462 0.743 -0.278 1.00 . A A . 28 LYS C 1 1 2 333 1 1 6 LYS CA C 9.989 0.570 -0.657 1.00 . A A . 28 LYS CA 1 1 2 334 1 1 6 LYS CB C 9.837 0.406 -2.191 1.00 . A A . 28 LYS CB 1 1 2 335 1 1 6 LYS CD C 10.955 -0.758 -4.128 1.00 . A A . 28 LYS CD 1 1 2 336 1 1 6 LYS CE C 11.736 -2.021 -4.578 1.00 . A A . 28 LYS CE 1 1 2 337 1 1 6 LYS CG C 10.562 -0.885 -2.644 1.00 . A A . 28 LYS CG 1 1 2 338 1 1 6 LYS H H 9.167 2.567 -0.837 1.00 . A A . 28 LYS H 1 1 2 339 1 1 6 LYS HA H 9.579 -0.278 -0.134 1.00 . A A . 28 LYS HA 1 1 2 340 1 1 6 LYS HB2 H 8.788 0.316 -2.435 1.00 . A A . 28 LYS HB2 1 1 2 341 1 1 6 LYS HB3 H 10.229 1.268 -2.711 1.00 . A A . 28 LYS HB3 1 1 2 342 1 1 6 LYS HD2 H 10.053 -0.660 -4.715 1.00 . A A . 28 LYS HD2 1 1 2 343 1 1 6 LYS HD3 H 11.557 0.127 -4.274 1.00 . A A . 28 LYS HD3 1 1 2 344 1 1 6 LYS HE2 H 11.068 -2.862 -4.721 1.00 . A A . 28 LYS HE2 1 1 2 345 1 1 6 LYS HE3 H 12.265 -1.829 -5.504 1.00 . A A . 28 LYS HE3 1 1 2 346 1 1 6 LYS HG2 H 11.451 -1.045 -2.057 1.00 . A A . 28 LYS HG2 1 1 2 347 1 1 6 LYS HG3 H 9.917 -1.744 -2.520 1.00 . A A . 28 LYS HG3 1 1 2 348 1 1 6 LYS HZ1 H 12.355 -2.615 -2.624 1.00 . A A . 28 LYS HZ1 1 1 2 349 1 1 6 LYS N N 9.318 1.825 -0.213 1.00 . A A . 28 LYS N 1 1 2 350 1 1 6 LYS NZ N 12.716 -2.342 -3.492 1.00 . A A . 28 LYS NZ 1 1 2 351 1 1 6 LYS O O 11.955 0.047 0.588 1.00 . A A . 28 LYS O 1 1 2 352 1 1 7 ASN C C 13.906 1.750 0.795 1.00 . A A . 29 ASN C 1 1 2 353 1 1 7 ASN CA C 13.569 1.963 -0.683 1.00 . A A . 29 ASN CA 1 1 2 354 1 1 7 ASN CB C 13.864 3.419 -1.095 1.00 . A A . 29 ASN CB 1 1 2 355 1 1 7 ASN CG C 15.366 3.657 -0.950 1.00 . A A . 29 ASN CG 1 1 2 356 1 1 7 ASN H H 11.618 2.166 -1.618 1.00 . A A . 29 ASN H 1 1 2 357 1 1 7 ASN HA H 14.172 1.286 -1.269 1.00 . A A . 29 ASN HA 1 1 2 358 1 1 7 ASN HB2 H 13.576 3.589 -2.119 1.00 . A A . 29 ASN HB2 1 1 2 359 1 1 7 ASN HB3 H 13.338 4.121 -0.464 1.00 . A A . 29 ASN HB3 1 1 2 360 1 1 7 ASN HD21 H 15.719 3.702 -2.907 1.00 . A A . 29 ASN HD21 1 1 2 361 1 1 7 ASN HD22 H 17.079 3.885 -1.915 1.00 . A A . 29 ASN HD22 1 1 2 362 1 1 7 ASN N N 12.116 1.668 -0.940 1.00 . A A . 29 ASN N 1 1 2 363 1 1 7 ASN ND2 N 16.113 3.757 -2.010 1.00 . A A . 29 ASN ND2 1 1 2 364 1 1 7 ASN O O 14.758 0.959 1.135 1.00 . A A . 29 ASN O 1 1 2 365 1 1 7 ASN OD1 O 15.887 3.758 0.142 1.00 . A A . 29 ASN OD1 1 1 2 366 1 1 8 LEU C C 13.677 1.014 3.611 1.00 . A A . 30 LEU C 1 1 2 367 1 1 8 LEU CA C 13.364 2.426 3.100 1.00 . A A . 30 LEU CA 1 1 2 368 1 1 8 LEU CB C 12.073 2.905 3.794 1.00 . A A . 30 LEU CB 1 1 2 369 1 1 8 LEU CD1 C 10.441 4.724 4.293 1.00 . A A . 30 LEU CD1 1 1 2 370 1 1 8 LEU CD2 C 12.810 5.360 3.820 1.00 . A A . 30 LEU CD2 1 1 2 371 1 1 8 LEU CG C 11.681 4.370 3.451 1.00 . A A . 30 LEU CG 1 1 2 372 1 1 8 LEU H H 12.536 3.090 1.232 1.00 . A A . 30 LEU H 1 1 2 373 1 1 8 LEU HA H 14.198 3.055 3.370 1.00 . A A . 30 LEU HA 1 1 2 374 1 1 8 LEU HB2 H 11.261 2.251 3.502 1.00 . A A . 30 LEU HB2 1 1 2 375 1 1 8 LEU HB3 H 12.200 2.806 4.864 1.00 . A A . 30 LEU HB3 1 1 2 376 1 1 8 LEU HD11 H 9.621 4.055 4.073 1.00 . A A . 30 LEU HD11 1 1 2 377 1 1 8 LEU HD12 H 10.119 5.733 4.079 1.00 . A A . 30 LEU HD12 1 1 2 378 1 1 8 LEU HD13 H 10.666 4.651 5.349 1.00 . A A . 30 LEU HD13 1 1 2 379 1 1 8 LEU HD21 H 13.706 5.160 3.253 1.00 . A A . 30 LEU HD21 1 1 2 380 1 1 8 LEU HD22 H 13.045 5.291 4.872 1.00 . A A . 30 LEU HD22 1 1 2 381 1 1 8 LEU HD23 H 12.497 6.371 3.603 1.00 . A A . 30 LEU HD23 1 1 2 382 1 1 8 LEU HG H 11.432 4.469 2.403 1.00 . A A . 30 LEU HG 1 1 2 383 1 1 8 LEU N N 13.199 2.483 1.614 1.00 . A A . 30 LEU N 1 1 2 384 1 1 8 LEU O O 14.580 0.814 4.402 1.00 . A A . 30 LEU O 1 1 2 385 1 1 9 ILE C C 13.889 -2.112 2.474 1.00 . A A . 31 ILE C 1 1 2 386 1 1 9 ILE CA C 13.044 -1.351 3.493 1.00 . A A . 31 ILE CA 1 1 2 387 1 1 9 ILE CB C 11.621 -1.975 3.591 1.00 . A A . 31 ILE CB 1 1 2 388 1 1 9 ILE CD1 C 9.298 -1.625 4.581 1.00 . A A . 31 ILE CD1 1 1 2 389 1 1 9 ILE CG1 C 10.727 -1.064 4.487 1.00 . A A . 31 ILE CG1 1 1 2 390 1 1 9 ILE CG2 C 11.731 -3.395 4.224 1.00 . A A . 31 ILE CG2 1 1 2 391 1 1 9 ILE H H 12.210 0.345 2.462 1.00 . A A . 31 ILE H 1 1 2 392 1 1 9 ILE HA H 13.555 -1.396 4.437 1.00 . A A . 31 ILE HA 1 1 2 393 1 1 9 ILE HB H 11.185 -2.050 2.603 1.00 . A A . 31 ILE HB 1 1 2 394 1 1 9 ILE HD11 H 9.289 -2.599 5.045 1.00 . A A . 31 ILE HD11 1 1 2 395 1 1 9 ILE HD12 H 8.859 -1.701 3.598 1.00 . A A . 31 ILE HD12 1 1 2 396 1 1 9 ILE HD13 H 8.687 -0.961 5.173 1.00 . A A . 31 ILE HD13 1 1 2 397 1 1 9 ILE HG12 H 11.155 -0.976 5.477 1.00 . A A . 31 ILE HG12 1 1 2 398 1 1 9 ILE HG13 H 10.662 -0.075 4.058 1.00 . A A . 31 ILE HG13 1 1 2 399 1 1 9 ILE HG21 H 10.765 -3.869 4.284 1.00 . A A . 31 ILE HG21 1 1 2 400 1 1 9 ILE HG22 H 12.159 -3.338 5.215 1.00 . A A . 31 ILE HG22 1 1 2 401 1 1 9 ILE HG23 H 12.365 -4.028 3.620 1.00 . A A . 31 ILE HG23 1 1 2 402 1 1 9 ILE N N 12.903 0.087 3.111 1.00 . A A . 31 ILE N 1 1 2 403 1 1 9 ILE O O 14.412 -3.172 2.754 1.00 . A A . 31 ILE O 1 1 2 404 1 1 10 GLU C C 16.239 -1.603 0.271 1.00 . A A . 32 GLU C 1 1 2 405 1 1 10 GLU CA C 14.827 -2.204 0.225 1.00 . A A . 32 GLU CA 1 1 2 406 1 1 10 GLU CB C 14.131 -1.918 -1.128 1.00 . A A . 32 GLU CB 1 1 2 407 1 1 10 GLU CD C 14.020 -2.288 -3.632 1.00 . A A . 32 GLU CD 1 1 2 408 1 1 10 GLU CG C 14.792 -2.664 -2.349 1.00 . A A . 32 GLU CG 1 1 2 409 1 1 10 GLU H H 13.573 -0.687 1.172 1.00 . A A . 32 GLU H 1 1 2 410 1 1 10 GLU HA H 14.896 -3.265 0.417 1.00 . A A . 32 GLU HA 1 1 2 411 1 1 10 GLU HB2 H 13.095 -2.213 -1.042 1.00 . A A . 32 GLU HB2 1 1 2 412 1 1 10 GLU HB3 H 14.150 -0.859 -1.329 1.00 . A A . 32 GLU HB3 1 1 2 413 1 1 10 GLU HG2 H 15.823 -2.379 -2.482 1.00 . A A . 32 GLU HG2 1 1 2 414 1 1 10 GLU HG3 H 14.725 -3.733 -2.224 1.00 . A A . 32 GLU HG3 1 1 2 415 1 1 10 GLU N N 14.020 -1.551 1.308 1.00 . A A . 32 GLU N 1 1 2 416 1 1 10 GLU O O 17.030 -1.799 -0.630 1.00 . A A . 32 GLU O 1 1 2 417 1 1 10 GLU OE1 O 14.593 -1.985 -4.662 1.00 . A A . 32 GLU OE1 1 1 2 418 1 1 11 ARG C C 18.557 -1.051 2.605 1.00 . A A . 33 ARG C 1 1 2 419 1 1 11 ARG CA C 17.780 -0.207 1.607 1.00 . A A . 33 ARG CA 1 1 2 420 1 1 11 ARG CB C 17.440 1.195 2.149 1.00 . A A . 33 ARG CB 1 1 2 421 1 1 11 ARG CD C 18.181 3.276 3.290 1.00 . A A . 33 ARG CD 1 1 2 422 1 1 11 ARG CG C 18.662 1.917 2.763 1.00 . A A . 33 ARG CG 1 1 2 423 1 1 11 ARG CZ C 18.223 5.076 1.583 1.00 . A A . 33 ARG CZ 1 1 2 424 1 1 11 ARG H H 15.750 -0.779 1.977 1.00 . A A . 33 ARG H 1 1 2 425 1 1 11 ARG HA H 18.350 -0.148 0.699 1.00 . A A . 33 ARG HA 1 1 2 426 1 1 11 ARG HB2 H 17.083 1.766 1.303 1.00 . A A . 33 ARG HB2 1 1 2 427 1 1 11 ARG HB3 H 16.633 1.135 2.866 1.00 . A A . 33 ARG HB3 1 1 2 428 1 1 11 ARG HD2 H 17.377 3.122 3.999 1.00 . A A . 33 ARG HD2 1 1 2 429 1 1 11 ARG HD3 H 18.962 3.808 3.810 1.00 . A A . 33 ARG HD3 1 1 2 430 1 1 11 ARG HE H 16.773 3.734 1.728 1.00 . A A . 33 ARG HE 1 1 2 431 1 1 11 ARG HG2 H 19.076 1.350 3.586 1.00 . A A . 33 ARG HG2 1 1 2 432 1 1 11 ARG HG3 H 19.428 2.047 2.010 1.00 . A A . 33 ARG HG3 1 1 2 433 1 1 11 ARG HH11 H 19.788 5.019 2.813 1.00 . A A . 33 ARG HH11 1 1 2 434 1 1 11 ARG HH12 H 19.824 6.299 1.677 1.00 . A A . 33 ARG HH12 1 1 2 435 1 1 11 ARG HH21 H 16.764 5.283 0.248 1.00 . A A . 33 ARG HH21 1 1 2 436 1 1 11 ARG HH22 H 18.033 6.446 0.116 1.00 . A A . 33 ARG HH22 1 1 2 437 1 1 11 ARG N N 16.480 -0.885 1.334 1.00 . A A . 33 ARG N 1 1 2 438 1 1 11 ARG NE N 17.634 4.038 2.113 1.00 . A A . 33 ARG NE 1 1 2 439 1 1 11 ARG NH1 N 19.359 5.500 2.054 1.00 . A A . 33 ARG NH1 1 1 2 440 1 1 11 ARG NH2 N 17.638 5.649 0.575 1.00 . A A . 33 ARG NH2 1 1 2 441 1 1 11 ARG O O 19.586 -1.607 2.296 1.00 . A A . 33 ARG O 1 1 2 442 1 1 12 GLN C C 19.336 -3.197 4.530 1.00 . A A . 34 GLN C 1 1 2 443 1 1 12 GLN CA C 18.620 -1.884 4.928 1.00 . A A . 34 GLN CA 1 1 2 444 1 1 12 GLN CB C 17.475 -2.167 5.931 1.00 . A A . 34 GLN CB 1 1 2 445 1 1 12 GLN CD C 15.126 -2.951 6.225 1.00 . A A . 34 GLN CD 1 1 2 446 1 1 12 GLN CG C 16.305 -2.923 5.254 1.00 . A A . 34 GLN CG 1 1 2 447 1 1 12 GLN H H 17.200 -0.599 3.917 1.00 . A A . 34 GLN H 1 1 2 448 1 1 12 GLN HA H 19.355 -1.255 5.410 1.00 . A A . 34 GLN HA 1 1 2 449 1 1 12 GLN HB2 H 17.862 -2.753 6.755 1.00 . A A . 34 GLN HB2 1 1 2 450 1 1 12 GLN HB3 H 17.106 -1.233 6.334 1.00 . A A . 34 GLN HB3 1 1 2 451 1 1 12 GLN HE21 H 15.184 -4.918 6.493 1.00 . A A . 34 GLN HE21 1 1 2 452 1 1 12 GLN HE22 H 13.986 -4.080 7.358 1.00 . A A . 34 GLN HE22 1 1 2 453 1 1 12 GLN HG2 H 15.983 -2.414 4.360 1.00 . A A . 34 GLN HG2 1 1 2 454 1 1 12 GLN HG3 H 16.579 -3.936 5.006 1.00 . A A . 34 GLN HG3 1 1 2 455 1 1 12 GLN N N 18.027 -1.106 3.791 1.00 . A A . 34 GLN N 1 1 2 456 1 1 12 GLN NE2 N 14.736 -4.081 6.730 1.00 . A A . 34 GLN NE2 1 1 2 457 1 1 12 GLN O O 20.320 -3.580 5.122 1.00 . A A . 34 GLN O 1 1 2 458 1 1 12 GLN OE1 O 14.550 -1.928 6.530 1.00 . A A . 34 GLN OE1 1 1 2 459 1 1 13 ARG C C 20.474 -4.889 1.931 1.00 . A A . 35 ARG C 1 1 2 460 1 1 13 ARG CA C 19.405 -5.139 3.033 1.00 . A A . 35 ARG CA 1 1 2 461 1 1 13 ARG CB C 18.190 -5.984 2.522 1.00 . A A . 35 ARG CB 1 1 2 462 1 1 13 ARG CD C 17.343 -8.114 1.471 1.00 . A A . 35 ARG CD 1 1 2 463 1 1 13 ARG CG C 18.581 -7.418 2.066 1.00 . A A . 35 ARG CG 1 1 2 464 1 1 13 ARG CZ C 17.555 -10.567 1.045 1.00 . A A . 35 ARG CZ 1 1 2 465 1 1 13 ARG H H 18.039 -3.473 3.083 1.00 . A A . 35 ARG H 1 1 2 466 1 1 13 ARG HA H 19.878 -5.631 3.867 1.00 . A A . 35 ARG HA 1 1 2 467 1 1 13 ARG HB2 H 17.455 -6.050 3.313 1.00 . A A . 35 ARG HB2 1 1 2 468 1 1 13 ARG HB3 H 17.742 -5.459 1.690 1.00 . A A . 35 ARG HB3 1 1 2 469 1 1 13 ARG HD2 H 16.617 -8.346 2.232 1.00 . A A . 35 ARG HD2 1 1 2 470 1 1 13 ARG HD3 H 16.870 -7.455 0.753 1.00 . A A . 35 ARG HD3 1 1 2 471 1 1 13 ARG HE H 18.414 -9.136 -0.044 1.00 . A A . 35 ARG HE 1 1 2 472 1 1 13 ARG HG2 H 19.347 -7.380 1.308 1.00 . A A . 35 ARG HG2 1 1 2 473 1 1 13 ARG HG3 H 18.964 -7.981 2.906 1.00 . A A . 35 ARG HG3 1 1 2 474 1 1 13 ARG HH11 H 16.438 -10.098 2.633 1.00 . A A . 35 ARG HH11 1 1 2 475 1 1 13 ARG HH12 H 16.560 -11.775 2.318 1.00 . A A . 35 ARG HH12 1 1 2 476 1 1 13 ARG HH21 H 18.638 -11.296 -0.478 1.00 . A A . 35 ARG HH21 1 1 2 477 1 1 13 ARG HH22 H 17.872 -12.480 0.492 1.00 . A A . 35 ARG HH22 1 1 2 478 1 1 13 ARG N N 18.821 -3.850 3.523 1.00 . A A . 35 ARG N 1 1 2 479 1 1 13 ARG NE N 17.838 -9.325 0.731 1.00 . A A . 35 ARG NE 1 1 2 480 1 1 13 ARG NH1 N 16.797 -10.836 2.070 1.00 . A A . 35 ARG NH1 1 1 2 481 1 1 13 ARG NH2 N 18.056 -11.515 0.303 1.00 . A A . 35 ARG NH2 1 1 2 482 1 1 13 ARG O O 20.788 -5.757 1.140 1.00 . A A . 35 ARG O 1 1 2 483 1 1 14 TYR C C 23.345 -2.964 1.667 1.00 . A A . 36 TYR C 1 1 2 484 1 1 14 TYR CA C 22.055 -3.325 0.910 1.00 . A A . 36 TYR CA 1 1 2 485 1 1 14 TYR CB C 21.523 -2.121 0.101 1.00 . A A . 36 TYR CB 1 1 2 486 1 1 14 TYR CD1 C 21.154 -3.128 -2.171 1.00 . A A . 36 TYR CD1 1 1 2 487 1 1 14 TYR CD2 C 22.942 -1.576 -1.932 1.00 . A A . 36 TYR CD2 1 1 2 488 1 1 14 TYR CE1 C 21.464 -3.286 -3.502 1.00 . A A . 36 TYR CE1 1 1 2 489 1 1 14 TYR CE2 C 23.251 -1.736 -3.267 1.00 . A A . 36 TYR CE2 1 1 2 490 1 1 14 TYR CG C 21.889 -2.274 -1.375 1.00 . A A . 36 TYR CG 1 1 2 491 1 1 14 TYR CZ C 22.513 -2.592 -4.061 1.00 . A A . 36 TYR CZ 1 1 2 492 1 1 14 TYR H H 20.742 -3.033 2.564 1.00 . A A . 36 TYR H 1 1 2 493 1 1 14 TYR HA H 22.251 -4.171 0.280 1.00 . A A . 36 TYR HA 1 1 2 494 1 1 14 TYR HB2 H 20.447 -2.065 0.175 1.00 . A A . 36 TYR HB2 1 1 2 495 1 1 14 TYR HB3 H 21.932 -1.193 0.479 1.00 . A A . 36 TYR HB3 1 1 2 496 1 1 14 TYR HD1 H 20.326 -3.680 -1.750 1.00 . A A . 36 TYR HD1 1 1 2 497 1 1 14 TYR HD2 H 23.530 -0.907 -1.319 1.00 . A A . 36 TYR HD2 1 1 2 498 1 1 14 TYR HE1 H 20.879 -3.957 -4.113 1.00 . A A . 36 TYR HE1 1 1 2 499 1 1 14 TYR HE2 H 24.076 -1.181 -3.688 1.00 . A A . 36 TYR HE2 1 1 2 500 1 1 14 TYR HH H 23.757 -2.712 -5.530 1.00 . A A . 36 TYR HH 1 1 2 501 1 1 14 TYR N N 21.018 -3.703 1.912 1.00 . A A . 36 TYR N 1 1 2 502 1 1 14 TYR O O 24.016 -1.987 1.399 1.00 . A A . 36 TYR O 1 1 2 503 1 1 14 TYR OH O 22.805 -2.765 -5.397 1.00 . A A . 36 TYR OH 1 1 2 504 1 1 15 NH2 HN1 H 23.173 -4.542 2.843 1.00 . A A . 37 NH2 HN1 1 1 2 505 1 1 15 NH2 HN2 H 24.533 -3.555 3.124 1.00 . A A . 37 NH2 HN2 1 1 2 506 1 1 15 NH2 N N 23.714 -3.755 2.627 1.00 . A A . 37 NH2 N 1 1 3 507 1 1 1 ACE C C 2.177 3.080 -0.746 1.00 . A A . 23 ACE C 1 1 3 508 1 1 1 ACE CH3 C 0.802 3.469 -1.289 1.00 . A A . 23 ACE CH3 1 1 3 509 1 1 1 ACE H1 H 0.930 4.122 -2.139 1.00 . A A . 23 ACE H1 1 1 3 510 1 1 1 ACE H2 H 0.257 3.992 -0.517 1.00 . A A . 23 ACE H2 1 1 3 511 1 1 1 ACE H3 H 0.255 2.587 -1.586 1.00 . A A . 23 ACE H3 1 1 3 512 1 1 1 ACE O O 2.963 3.934 -0.387 1.00 . A A . 23 ACE O 1 1 3 513 1 1 2 ALA C C 4.851 1.352 -1.294 1.00 . A A . 24 ALA C 1 1 3 514 1 1 2 ALA CA C 3.802 1.368 -0.176 1.00 . A A . 24 ALA CA 1 1 3 515 1 1 2 ALA CB C 3.650 -0.038 0.425 1.00 . A A . 24 ALA CB 1 1 3 516 1 1 2 ALA H H 1.822 1.142 -1.024 1.00 . A A . 24 ALA H 1 1 3 517 1 1 2 ALA HA H 4.128 2.056 0.594 1.00 . A A . 24 ALA HA 1 1 3 518 1 1 2 ALA HB1 H 3.339 -0.743 -0.334 1.00 . A A . 24 ALA HB1 1 1 3 519 1 1 2 ALA HB2 H 2.924 -0.031 1.225 1.00 . A A . 24 ALA HB2 1 1 3 520 1 1 2 ALA HB3 H 4.605 -0.362 0.820 1.00 . A A . 24 ALA HB3 1 1 3 521 1 1 2 ALA N N 2.468 1.805 -0.708 1.00 . A A . 24 ALA N 1 1 3 522 1 1 2 ALA O O 5.590 0.400 -1.466 1.00 . A A . 24 ALA O 1 1 3 523 1 1 3 ARG C C 7.045 3.386 -2.674 1.00 . A A . 25 ARG C 1 1 3 524 1 1 3 ARG CA C 5.870 2.542 -3.154 1.00 . A A . 25 ARG CA 1 1 3 525 1 1 3 ARG CB C 5.162 3.196 -4.383 1.00 . A A . 25 ARG CB 1 1 3 526 1 1 3 ARG CD C 5.546 3.887 -6.816 1.00 . A A . 25 ARG CD 1 1 3 527 1 1 3 ARG CG C 6.215 3.445 -5.505 1.00 . A A . 25 ARG CG 1 1 3 528 1 1 3 ARG CZ C 5.537 2.232 -8.677 1.00 . A A . 25 ARG CZ 1 1 3 529 1 1 3 ARG H H 4.268 3.162 -1.811 1.00 . A A . 25 ARG H 1 1 3 530 1 1 3 ARG HA H 6.236 1.556 -3.409 1.00 . A A . 25 ARG HA 1 1 3 531 1 1 3 ARG HB2 H 4.382 2.535 -4.734 1.00 . A A . 25 ARG HB2 1 1 3 532 1 1 3 ARG HB3 H 4.712 4.134 -4.092 1.00 . A A . 25 ARG HB3 1 1 3 533 1 1 3 ARG HD2 H 4.696 4.523 -6.596 1.00 . A A . 25 ARG HD2 1 1 3 534 1 1 3 ARG HD3 H 6.223 4.473 -7.414 1.00 . A A . 25 ARG HD3 1 1 3 535 1 1 3 ARG HE H 4.305 2.175 -7.106 1.00 . A A . 25 ARG HE 1 1 3 536 1 1 3 ARG HG2 H 6.904 4.216 -5.195 1.00 . A A . 25 ARG HG2 1 1 3 537 1 1 3 ARG HG3 H 6.785 2.541 -5.677 1.00 . A A . 25 ARG HG3 1 1 3 538 1 1 3 ARG HH11 H 6.949 3.646 -8.770 1.00 . A A . 25 ARG HH11 1 1 3 539 1 1 3 ARG HH12 H 6.900 2.597 -10.121 1.00 . A A . 25 ARG HH12 1 1 3 540 1 1 3 ARG HH21 H 4.258 0.683 -8.796 1.00 . A A . 25 ARG HH21 1 1 3 541 1 1 3 ARG HH22 H 5.362 0.811 -10.096 1.00 . A A . 25 ARG HH22 1 1 3 542 1 1 3 ARG N N 4.889 2.433 -2.027 1.00 . A A . 25 ARG N 1 1 3 543 1 1 3 ARG NE N 5.046 2.657 -7.532 1.00 . A A . 25 ARG NE 1 1 3 544 1 1 3 ARG NH1 N 6.532 2.869 -9.230 1.00 . A A . 25 ARG NH1 1 1 3 545 1 1 3 ARG NH2 N 5.017 1.170 -9.228 1.00 . A A . 25 ARG NH2 1 1 3 546 1 1 3 ARG O O 8.170 2.924 -2.647 1.00 . A A . 25 ARG O 1 1 3 547 1 1 4 HIS C C 8.436 5.042 -0.430 1.00 . A A . 26 HIS C 1 1 3 548 1 1 4 HIS CA C 7.880 5.498 -1.789 1.00 . A A . 26 HIS CA 1 1 3 549 1 1 4 HIS CB C 7.309 6.940 -1.697 1.00 . A A . 26 HIS CB 1 1 3 550 1 1 4 HIS CD2 C 7.125 6.916 -4.314 1.00 . A A . 26 HIS CD2 1 1 3 551 1 1 4 HIS CE1 C 5.869 8.503 -4.501 1.00 . A A . 26 HIS CE1 1 1 3 552 1 1 4 HIS CG C 6.818 7.430 -3.074 1.00 . A A . 26 HIS CG 1 1 3 553 1 1 4 HIS H H 5.852 4.923 -2.303 1.00 . A A . 26 HIS H 1 1 3 554 1 1 4 HIS HA H 8.713 5.451 -2.483 1.00 . A A . 26 HIS HA 1 1 3 555 1 1 4 HIS HB2 H 6.488 6.977 -0.996 1.00 . A A . 26 HIS HB2 1 1 3 556 1 1 4 HIS HB3 H 8.087 7.606 -1.351 1.00 . A A . 26 HIS HB3 1 1 3 557 1 1 4 HIS HD1 H 5.620 9.017 -2.507 1.00 . A A . 26 HIS HD1 1 1 3 558 1 1 4 HIS HD2 H 7.775 6.075 -4.506 1.00 . A A . 26 HIS HD2 1 1 3 559 1 1 4 HIS HE1 H 5.248 9.254 -4.967 1.00 . A A . 26 HIS HE1 1 1 3 560 1 1 4 HIS N N 6.776 4.600 -2.277 1.00 . A A . 26 HIS N 1 1 3 561 1 1 4 HIS ND1 N 6.013 8.446 -3.203 1.00 . A A . 26 HIS ND1 1 1 3 562 1 1 4 HIS NE2 N 6.506 7.617 -5.224 1.00 . A A . 26 HIS NE2 1 1 3 563 1 1 4 HIS O O 9.102 5.784 0.261 1.00 . A A . 26 HIS O 1 1 3 564 1 1 5 TYR C C 9.347 1.916 0.871 1.00 . A A . 27 TYR C 1 1 3 565 1 1 5 TYR CA C 8.600 3.205 1.190 1.00 . A A . 27 TYR CA 1 1 3 566 1 1 5 TYR CB C 7.377 2.912 2.094 1.00 . A A . 27 TYR CB 1 1 3 567 1 1 5 TYR CD1 C 7.237 5.311 2.928 1.00 . A A . 27 TYR CD1 1 1 3 568 1 1 5 TYR CD2 C 7.265 3.558 4.536 1.00 . A A . 27 TYR CD2 1 1 3 569 1 1 5 TYR CE1 C 7.162 6.238 3.945 1.00 . A A . 27 TYR CE1 1 1 3 570 1 1 5 TYR CE2 C 7.190 4.489 5.551 1.00 . A A . 27 TYR CE2 1 1 3 571 1 1 5 TYR CG C 7.290 3.961 3.214 1.00 . A A . 27 TYR CG 1 1 3 572 1 1 5 TYR CZ C 7.140 5.831 5.258 1.00 . A A . 27 TYR CZ 1 1 3 573 1 1 5 TYR H H 7.585 3.279 -0.683 1.00 . A A . 27 TYR H 1 1 3 574 1 1 5 TYR HA H 9.317 3.866 1.636 1.00 . A A . 27 TYR HA 1 1 3 575 1 1 5 TYR HB2 H 6.464 2.941 1.519 1.00 . A A . 27 TYR HB2 1 1 3 576 1 1 5 TYR HB3 H 7.473 1.930 2.539 1.00 . A A . 27 TYR HB3 1 1 3 577 1 1 5 TYR HD1 H 7.256 5.649 1.902 1.00 . A A . 27 TYR HD1 1 1 3 578 1 1 5 TYR HD2 H 7.305 2.508 4.784 1.00 . A A . 27 TYR HD2 1 1 3 579 1 1 5 TYR HE1 H 7.121 7.292 3.713 1.00 . A A . 27 TYR HE1 1 1 3 580 1 1 5 TYR HE2 H 7.168 4.159 6.581 1.00 . A A . 27 TYR HE2 1 1 3 581 1 1 5 TYR HH H 7.762 6.559 6.899 1.00 . A A . 27 TYR HH 1 1 3 582 1 1 5 TYR N N 8.136 3.817 -0.087 1.00 . A A . 27 TYR N 1 1 3 583 1 1 5 TYR O O 9.780 1.199 1.752 1.00 . A A . 27 TYR O 1 1 3 584 1 1 5 TYR OH O 7.070 6.764 6.266 1.00 . A A . 27 TYR OH 1 1 3 585 1 1 6 LYS C C 11.649 0.690 -0.438 1.00 . A A . 28 LYS C 1 1 3 586 1 1 6 LYS CA C 10.198 0.442 -0.850 1.00 . A A . 28 LYS CA 1 1 3 587 1 1 6 LYS CB C 10.064 0.287 -2.392 1.00 . A A . 28 LYS CB 1 1 3 588 1 1 6 LYS CD C 11.090 -0.961 -4.338 1.00 . A A . 28 LYS CD 1 1 3 589 1 1 6 LYS CE C 12.052 -2.114 -4.703 1.00 . A A . 28 LYS CE 1 1 3 590 1 1 6 LYS CG C 10.825 -0.989 -2.824 1.00 . A A . 28 LYS CG 1 1 3 591 1 1 6 LYS H H 9.122 2.326 -1.037 1.00 . A A . 28 LYS H 1 1 3 592 1 1 6 LYS HA H 9.814 -0.421 -0.333 1.00 . A A . 28 LYS HA 1 1 3 593 1 1 6 LYS HB2 H 9.019 0.176 -2.647 1.00 . A A . 28 LYS HB2 1 1 3 594 1 1 6 LYS HB3 H 10.447 1.151 -2.915 1.00 . A A . 28 LYS HB3 1 1 3 595 1 1 6 LYS HD2 H 10.159 -1.081 -4.877 1.00 . A A . 28 LYS HD2 1 1 3 596 1 1 6 LYS HD3 H 11.526 -0.011 -4.604 1.00 . A A . 28 LYS HD3 1 1 3 597 1 1 6 LYS HE2 H 11.552 -3.074 -4.655 1.00 . A A . 28 LYS HE2 1 1 3 598 1 1 6 LYS HE3 H 12.450 -1.973 -5.700 1.00 . A A . 28 LYS HE3 1 1 3 599 1 1 6 LYS HG2 H 11.767 -1.040 -2.304 1.00 . A A . 28 LYS HG2 1 1 3 600 1 1 6 LYS HG3 H 10.249 -1.869 -2.575 1.00 . A A . 28 LYS HG3 1 1 3 601 1 1 6 LYS HZ1 H 13.689 -1.235 -3.618 1.00 . A A . 28 LYS HZ1 1 1 3 602 1 1 6 LYS N N 9.486 1.676 -0.403 1.00 . A A . 28 LYS N 1 1 3 603 1 1 6 LYS NZ N 13.188 -2.070 -3.715 1.00 . A A . 28 LYS NZ 1 1 3 604 1 1 6 LYS O O 12.156 0.061 0.467 1.00 . A A . 28 LYS O 1 1 3 605 1 1 7 ASN C C 14.105 1.826 0.600 1.00 . A A . 29 ASN C 1 1 3 606 1 1 7 ASN CA C 13.696 2.002 -0.864 1.00 . A A . 29 ASN CA 1 1 3 607 1 1 7 ASN CB C 13.875 3.469 -1.278 1.00 . A A . 29 ASN CB 1 1 3 608 1 1 7 ASN CG C 13.614 3.581 -2.773 1.00 . A A . 29 ASN CG 1 1 3 609 1 1 7 ASN H H 11.779 2.062 -1.843 1.00 . A A . 29 ASN H 1 1 3 610 1 1 7 ASN HA H 14.335 1.378 -1.474 1.00 . A A . 29 ASN HA 1 1 3 611 1 1 7 ASN HB2 H 13.159 4.102 -0.775 1.00 . A A . 29 ASN HB2 1 1 3 612 1 1 7 ASN HB3 H 14.872 3.817 -1.059 1.00 . A A . 29 ASN HB3 1 1 3 613 1 1 7 ASN HD21 H 15.459 4.170 -3.244 1.00 . A A . 29 ASN HD21 1 1 3 614 1 1 7 ASN HD22 H 14.352 4.042 -4.532 1.00 . A A . 29 ASN HD22 1 1 3 615 1 1 7 ASN N N 12.272 1.609 -1.121 1.00 . A A . 29 ASN N 1 1 3 616 1 1 7 ASN ND2 N 14.561 3.964 -3.578 1.00 . A A . 29 ASN ND2 1 1 3 617 1 1 7 ASN O O 15.083 1.185 0.911 1.00 . A A . 29 ASN O 1 1 3 618 1 1 7 ASN OD1 O 12.520 3.309 -3.220 1.00 . A A . 29 ASN OD1 1 1 3 619 1 1 8 LEU C C 13.661 0.909 3.420 1.00 . A A . 30 LEU C 1 1 3 620 1 1 8 LEU CA C 13.550 2.356 2.928 1.00 . A A . 30 LEU CA 1 1 3 621 1 1 8 LEU CB C 12.383 3.082 3.650 1.00 . A A . 30 LEU CB 1 1 3 622 1 1 8 LEU CD1 C 12.373 5.108 2.016 1.00 . A A . 30 LEU CD1 1 1 3 623 1 1 8 LEU CD2 C 11.316 5.288 4.284 1.00 . A A . 30 LEU CD2 1 1 3 624 1 1 8 LEU CG C 12.466 4.638 3.490 1.00 . A A . 30 LEU CG 1 1 3 625 1 1 8 LEU H H 12.530 2.898 1.111 1.00 . A A . 30 LEU H 1 1 3 626 1 1 8 LEU HA H 14.484 2.854 3.142 1.00 . A A . 30 LEU HA 1 1 3 627 1 1 8 LEU HB2 H 11.442 2.716 3.260 1.00 . A A . 30 LEU HB2 1 1 3 628 1 1 8 LEU HB3 H 12.420 2.836 4.703 1.00 . A A . 30 LEU HB3 1 1 3 629 1 1 8 LEU HD11 H 12.402 6.188 1.982 1.00 . A A . 30 LEU HD11 1 1 3 630 1 1 8 LEU HD12 H 11.447 4.787 1.561 1.00 . A A . 30 LEU HD12 1 1 3 631 1 1 8 LEU HD13 H 13.206 4.740 1.442 1.00 . A A . 30 LEU HD13 1 1 3 632 1 1 8 LEU HD21 H 11.404 5.052 5.335 1.00 . A A . 30 LEU HD21 1 1 3 633 1 1 8 LEU HD22 H 10.357 4.934 3.932 1.00 . A A . 30 LEU HD22 1 1 3 634 1 1 8 LEU HD23 H 11.344 6.363 4.177 1.00 . A A . 30 LEU HD23 1 1 3 635 1 1 8 LEU HG H 13.400 4.989 3.908 1.00 . A A . 30 LEU HG 1 1 3 636 1 1 8 LEU N N 13.310 2.414 1.452 1.00 . A A . 30 LEU N 1 1 3 637 1 1 8 LEU O O 14.612 0.538 4.083 1.00 . A A . 30 LEU O 1 1 3 638 1 1 9 ILE C C 13.528 -2.116 2.509 1.00 . A A . 31 ILE C 1 1 3 639 1 1 9 ILE CA C 12.620 -1.309 3.451 1.00 . A A . 31 ILE CA 1 1 3 640 1 1 9 ILE CB C 11.130 -1.760 3.345 1.00 . A A . 31 ILE CB 1 1 3 641 1 1 9 ILE CD1 C 10.545 -0.907 5.713 1.00 . A A . 31 ILE CD1 1 1 3 642 1 1 9 ILE CG1 C 10.189 -0.859 4.208 1.00 . A A . 31 ILE CG1 1 1 3 643 1 1 9 ILE CG2 C 10.943 -3.237 3.755 1.00 . A A . 31 ILE CG2 1 1 3 644 1 1 9 ILE H H 11.953 0.501 2.495 1.00 . A A . 31 ILE H 1 1 3 645 1 1 9 ILE HA H 12.997 -1.417 4.456 1.00 . A A . 31 ILE HA 1 1 3 646 1 1 9 ILE HB H 10.835 -1.655 2.309 1.00 . A A . 31 ILE HB 1 1 3 647 1 1 9 ILE HD11 H 10.456 -1.910 6.101 1.00 . A A . 31 ILE HD11 1 1 3 648 1 1 9 ILE HD12 H 9.866 -0.269 6.262 1.00 . A A . 31 ILE HD12 1 1 3 649 1 1 9 ILE HD13 H 11.552 -0.557 5.882 1.00 . A A . 31 ILE HD13 1 1 3 650 1 1 9 ILE HG12 H 10.246 0.164 3.861 1.00 . A A . 31 ILE HG12 1 1 3 651 1 1 9 ILE HG13 H 9.168 -1.188 4.075 1.00 . A A . 31 ILE HG13 1 1 3 652 1 1 9 ILE HG21 H 9.900 -3.513 3.689 1.00 . A A . 31 ILE HG21 1 1 3 653 1 1 9 ILE HG22 H 11.285 -3.397 4.765 1.00 . A A . 31 ILE HG22 1 1 3 654 1 1 9 ILE HG23 H 11.509 -3.882 3.100 1.00 . A A . 31 ILE HG23 1 1 3 655 1 1 9 ILE N N 12.677 0.135 3.054 1.00 . A A . 31 ILE N 1 1 3 656 1 1 9 ILE O O 13.829 -3.275 2.735 1.00 . A A . 31 ILE O 1 1 3 657 1 1 10 GLU C C 16.267 -1.558 0.550 1.00 . A A . 32 GLU C 1 1 3 658 1 1 10 GLU CA C 14.849 -2.131 0.464 1.00 . A A . 32 GLU CA 1 1 3 659 1 1 10 GLU CB C 14.177 -1.902 -0.912 1.00 . A A . 32 GLU CB 1 1 3 660 1 1 10 GLU CD C 13.530 -3.105 -2.982 1.00 . A A . 32 GLU CD 1 1 3 661 1 1 10 GLU CG C 14.708 -2.859 -2.023 1.00 . A A . 32 GLU CG 1 1 3 662 1 1 10 GLU H H 13.689 -0.528 1.346 1.00 . A A . 32 GLU H 1 1 3 663 1 1 10 GLU HA H 14.903 -3.189 0.683 1.00 . A A . 32 GLU HA 1 1 3 664 1 1 10 GLU HB2 H 13.111 -2.036 -0.797 1.00 . A A . 32 GLU HB2 1 1 3 665 1 1 10 GLU HB3 H 14.350 -0.884 -1.232 1.00 . A A . 32 GLU HB3 1 1 3 666 1 1 10 GLU HG2 H 15.525 -2.415 -2.572 1.00 . A A . 32 GLU HG2 1 1 3 667 1 1 10 GLU HG3 H 15.024 -3.805 -1.614 1.00 . A A . 32 GLU HG3 1 1 3 668 1 1 10 GLU N N 13.962 -1.467 1.464 1.00 . A A . 32 GLU N 1 1 3 669 1 1 10 GLU O O 17.087 -1.835 -0.299 1.00 . A A . 32 GLU O 1 1 3 670 1 1 10 GLU OE1 O 12.980 -4.190 -3.016 1.00 . A A . 32 GLU OE1 1 1 3 671 1 1 11 ARG C C 18.514 -0.971 2.898 1.00 . A A . 33 ARG C 1 1 3 672 1 1 11 ARG CA C 17.830 -0.142 1.826 1.00 . A A . 33 ARG CA 1 1 3 673 1 1 11 ARG CB C 17.626 1.340 2.284 1.00 . A A . 33 ARG CB 1 1 3 674 1 1 11 ARG CD C 18.928 3.460 2.849 1.00 . A A . 33 ARG CD 1 1 3 675 1 1 11 ARG CG C 18.903 1.919 2.972 1.00 . A A . 33 ARG CG 1 1 3 676 1 1 11 ARG CZ C 20.490 4.775 1.441 1.00 . A A . 33 ARG CZ 1 1 3 677 1 1 11 ARG H H 15.745 -0.605 2.186 1.00 . A A . 33 ARG H 1 1 3 678 1 1 11 ARG HA H 18.419 -0.199 0.929 1.00 . A A . 33 ARG HA 1 1 3 679 1 1 11 ARG HB2 H 17.364 1.929 1.416 1.00 . A A . 33 ARG HB2 1 1 3 680 1 1 11 ARG HB3 H 16.796 1.387 2.973 1.00 . A A . 33 ARG HB3 1 1 3 681 1 1 11 ARG HD2 H 17.929 3.880 2.813 1.00 . A A . 33 ARG HD2 1 1 3 682 1 1 11 ARG HD3 H 19.458 3.842 3.710 1.00 . A A . 33 ARG HD3 1 1 3 683 1 1 11 ARG HE H 19.533 3.142 0.831 1.00 . A A . 33 ARG HE 1 1 3 684 1 1 11 ARG HG2 H 18.889 1.651 4.019 1.00 . A A . 33 ARG HG2 1 1 3 685 1 1 11 ARG HG3 H 19.799 1.493 2.539 1.00 . A A . 33 ARG HG3 1 1 3 686 1 1 11 ARG HH11 H 20.166 5.507 3.275 1.00 . A A . 33 ARG HH11 1 1 3 687 1 1 11 ARG HH12 H 21.288 6.404 2.346 1.00 . A A . 33 ARG HH12 1 1 3 688 1 1 11 ARG HH21 H 20.970 4.242 -0.430 1.00 . A A . 33 ARG HH21 1 1 3 689 1 1 11 ARG HH22 H 21.740 5.664 0.131 1.00 . A A . 33 ARG HH22 1 1 3 690 1 1 11 ARG N N 16.495 -0.778 1.577 1.00 . A A . 33 ARG N 1 1 3 691 1 1 11 ARG NE N 19.667 3.764 1.577 1.00 . A A . 33 ARG NE 1 1 3 692 1 1 11 ARG NH1 N 20.664 5.623 2.418 1.00 . A A . 33 ARG NH1 1 1 3 693 1 1 11 ARG NH2 N 21.110 4.906 0.304 1.00 . A A . 33 ARG NH2 1 1 3 694 1 1 11 ARG O O 19.683 -1.283 2.802 1.00 . A A . 33 ARG O 1 1 3 695 1 1 12 GLN C C 19.216 -3.239 4.508 1.00 . A A . 34 GLN C 1 1 3 696 1 1 12 GLN CA C 18.290 -2.119 5.042 1.00 . A A . 34 GLN CA 1 1 3 697 1 1 12 GLN CB C 17.080 -2.721 5.830 1.00 . A A . 34 GLN CB 1 1 3 698 1 1 12 GLN CD C 14.951 -4.083 5.709 1.00 . A A . 34 GLN CD 1 1 3 699 1 1 12 GLN CG C 16.043 -3.399 4.886 1.00 . A A . 34 GLN CG 1 1 3 700 1 1 12 GLN H H 16.834 -0.965 3.897 1.00 . A A . 34 GLN H 1 1 3 701 1 1 12 GLN HA H 18.876 -1.484 5.690 1.00 . A A . 34 GLN HA 1 1 3 702 1 1 12 GLN HB2 H 17.449 -3.444 6.545 1.00 . A A . 34 GLN HB2 1 1 3 703 1 1 12 GLN HB3 H 16.592 -1.929 6.383 1.00 . A A . 34 GLN HB3 1 1 3 704 1 1 12 GLN HE21 H 15.728 -5.914 5.606 1.00 . A A . 34 GLN HE21 1 1 3 705 1 1 12 GLN HE22 H 14.270 -5.756 6.464 1.00 . A A . 34 GLN HE22 1 1 3 706 1 1 12 GLN HG2 H 15.558 -2.648 4.284 1.00 . A A . 34 GLN HG2 1 1 3 707 1 1 12 GLN HG3 H 16.482 -4.122 4.230 1.00 . A A . 34 GLN HG3 1 1 3 708 1 1 12 GLN N N 17.757 -1.290 3.908 1.00 . A A . 34 GLN N 1 1 3 709 1 1 12 GLN NE2 N 14.997 -5.361 5.939 1.00 . A A . 34 GLN NE2 1 1 3 710 1 1 12 GLN O O 20.277 -3.523 5.026 1.00 . A A . 34 GLN O 1 1 3 711 1 1 12 GLN OE1 O 14.026 -3.457 6.173 1.00 . A A . 34 GLN OE1 1 1 3 712 1 1 13 ARG C C 20.415 -4.383 1.686 1.00 . A A . 35 ARG C 1 1 3 713 1 1 13 ARG CA C 19.492 -4.954 2.774 1.00 . A A . 35 ARG CA 1 1 3 714 1 1 13 ARG CB C 18.452 -5.934 2.158 1.00 . A A . 35 ARG CB 1 1 3 715 1 1 13 ARG CD C 16.362 -7.279 2.699 1.00 . A A . 35 ARG CD 1 1 3 716 1 1 13 ARG CG C 17.618 -6.592 3.287 1.00 . A A . 35 ARG CG 1 1 3 717 1 1 13 ARG CZ C 16.122 -9.721 2.339 1.00 . A A . 35 ARG CZ 1 1 3 718 1 1 13 ARG H H 17.915 -3.542 3.074 1.00 . A A . 35 ARG H 1 1 3 719 1 1 13 ARG HA H 20.097 -5.455 3.513 1.00 . A A . 35 ARG HA 1 1 3 720 1 1 13 ARG HB2 H 17.824 -5.386 1.469 1.00 . A A . 35 ARG HB2 1 1 3 721 1 1 13 ARG HB3 H 18.986 -6.687 1.595 1.00 . A A . 35 ARG HB3 1 1 3 722 1 1 13 ARG HD2 H 15.661 -7.400 3.507 1.00 . A A . 35 ARG HD2 1 1 3 723 1 1 13 ARG HD3 H 15.905 -6.664 1.930 1.00 . A A . 35 ARG HD3 1 1 3 724 1 1 13 ARG HE H 17.572 -8.604 1.543 1.00 . A A . 35 ARG HE 1 1 3 725 1 1 13 ARG HG2 H 18.232 -7.332 3.781 1.00 . A A . 35 ARG HG2 1 1 3 726 1 1 13 ARG HG3 H 17.338 -5.866 4.031 1.00 . A A . 35 ARG HG3 1 1 3 727 1 1 13 ARG HH11 H 14.696 -8.859 3.458 1.00 . A A . 35 ARG HH11 1 1 3 728 1 1 13 ARG HH12 H 14.550 -10.551 3.287 1.00 . A A . 35 ARG HH12 1 1 3 729 1 1 13 ARG HH21 H 17.402 -10.829 1.245 1.00 . A A . 35 ARG HH21 1 1 3 730 1 1 13 ARG HH22 H 16.098 -11.687 1.935 1.00 . A A . 35 ARG HH22 1 1 3 731 1 1 13 ARG N N 18.759 -3.844 3.444 1.00 . A A . 35 ARG N 1 1 3 732 1 1 13 ARG NE N 16.770 -8.606 2.109 1.00 . A A . 35 ARG NE 1 1 3 733 1 1 13 ARG NH1 N 15.048 -9.710 3.080 1.00 . A A . 35 ARG NH1 1 1 3 734 1 1 13 ARG NH2 N 16.572 -10.819 1.802 1.00 . A A . 35 ARG NH2 1 1 3 735 1 1 13 ARG O O 20.399 -4.822 0.553 1.00 . A A . 35 ARG O 1 1 3 736 1 1 14 TYR C C 23.575 -2.834 1.678 1.00 . A A . 36 TYR C 1 1 3 737 1 1 14 TYR CA C 22.146 -2.756 1.132 1.00 . A A . 36 TYR CA 1 1 3 738 1 1 14 TYR CB C 21.734 -1.285 0.938 1.00 . A A . 36 TYR CB 1 1 3 739 1 1 14 TYR CD1 C 22.371 -1.041 -1.492 1.00 . A A . 36 TYR CD1 1 1 3 740 1 1 14 TYR CD2 C 23.424 0.404 0.082 1.00 . A A . 36 TYR CD2 1 1 3 741 1 1 14 TYR CE1 C 23.079 -0.445 -2.513 1.00 . A A . 36 TYR CE1 1 1 3 742 1 1 14 TYR CE2 C 24.131 0.998 -0.942 1.00 . A A . 36 TYR CE2 1 1 3 743 1 1 14 TYR CG C 22.537 -0.621 -0.186 1.00 . A A . 36 TYR CG 1 1 3 744 1 1 14 TYR CZ C 23.962 0.578 -2.241 1.00 . A A . 36 TYR CZ 1 1 3 745 1 1 14 TYR H H 21.120 -3.109 2.999 1.00 . A A . 36 TYR H 1 1 3 746 1 1 14 TYR HA H 22.109 -3.294 0.207 1.00 . A A . 36 TYR HA 1 1 3 747 1 1 14 TYR HB2 H 20.691 -1.248 0.666 1.00 . A A . 36 TYR HB2 1 1 3 748 1 1 14 TYR HB3 H 21.864 -0.732 1.857 1.00 . A A . 36 TYR HB3 1 1 3 749 1 1 14 TYR HD1 H 21.681 -1.842 -1.716 1.00 . A A . 36 TYR HD1 1 1 3 750 1 1 14 TYR HD2 H 23.570 0.742 1.098 1.00 . A A . 36 TYR HD2 1 1 3 751 1 1 14 TYR HE1 H 22.940 -0.784 -3.530 1.00 . A A . 36 TYR HE1 1 1 3 752 1 1 14 TYR HE2 H 24.826 1.798 -0.730 1.00 . A A . 36 TYR HE2 1 1 3 753 1 1 14 TYR HH H 25.122 0.497 -3.750 1.00 . A A . 36 TYR HH 1 1 3 754 1 1 14 TYR N N 21.189 -3.409 2.074 1.00 . A A . 36 TYR N 1 1 3 755 1 1 14 TYR O O 24.508 -3.181 0.986 1.00 . A A . 36 TYR O 1 1 3 756 1 1 14 TYR OH O 24.670 1.183 -3.254 1.00 . A A . 36 TYR OH 1 1 3 757 1 1 15 NH2 HN1 H 23.074 -2.233 3.500 1.00 . A A . 37 NH2 HN1 1 1 3 758 1 1 15 NH2 HN2 H 24.726 -2.571 3.251 1.00 . A A . 37 NH2 HN2 1 1 3 759 1 1 15 NH2 N N 23.807 -2.517 2.917 1.00 . A A . 37 NH2 N 1 1 4 760 1 1 1 ACE C C 2.430 3.647 -2.850 1.00 . A A . 23 ACE C 1 1 4 761 1 1 1 ACE CH3 C 1.383 3.878 -3.937 1.00 . A A . 23 ACE CH3 1 1 4 762 1 1 1 ACE H1 H 1.883 4.050 -4.879 1.00 . A A . 23 ACE H1 1 1 4 763 1 1 1 ACE H2 H 0.798 4.748 -3.679 1.00 . A A . 23 ACE H2 1 1 4 764 1 1 1 ACE H3 H 0.737 3.018 -4.021 1.00 . A A . 23 ACE H3 1 1 4 765 1 1 1 ACE O O 3.267 4.496 -2.608 1.00 . A A . 23 ACE O 1 1 4 766 1 1 2 ALA C C 4.709 1.719 -1.754 1.00 . A A . 24 ALA C 1 1 4 767 1 1 2 ALA CA C 3.394 2.220 -1.135 1.00 . A A . 24 ALA CA 1 1 4 768 1 1 2 ALA CB C 2.792 1.156 -0.195 1.00 . A A . 24 ALA CB 1 1 4 769 1 1 2 ALA H H 1.726 1.833 -2.448 1.00 . A A . 24 ALA H 1 1 4 770 1 1 2 ALA HA H 3.592 3.129 -0.581 1.00 . A A . 24 ALA HA 1 1 4 771 1 1 2 ALA HB1 H 2.614 0.238 -0.735 1.00 . A A . 24 ALA HB1 1 1 4 772 1 1 2 ALA HB2 H 1.861 1.503 0.232 1.00 . A A . 24 ALA HB2 1 1 4 773 1 1 2 ALA HB3 H 3.485 0.950 0.608 1.00 . A A . 24 ALA HB3 1 1 4 774 1 1 2 ALA N N 2.398 2.504 -2.215 1.00 . A A . 24 ALA N 1 1 4 775 1 1 2 ALA O O 5.308 0.757 -1.315 1.00 . A A . 24 ALA O 1 1 4 776 1 1 3 ARG C C 7.450 3.015 -2.974 1.00 . A A . 25 ARG C 1 1 4 777 1 1 3 ARG CA C 6.392 2.045 -3.486 1.00 . A A . 25 ARG CA 1 1 4 778 1 1 3 ARG CB C 6.229 2.212 -5.021 1.00 . A A . 25 ARG CB 1 1 4 779 1 1 3 ARG CD C 7.245 0.010 -5.719 1.00 . A A . 25 ARG CD 1 1 4 780 1 1 3 ARG CG C 7.440 1.543 -5.726 1.00 . A A . 25 ARG CG 1 1 4 781 1 1 3 ARG CZ C 9.070 -1.404 -6.670 1.00 . A A . 25 ARG CZ 1 1 4 782 1 1 3 ARG H H 4.585 3.177 -3.072 1.00 . A A . 25 ARG H 1 1 4 783 1 1 3 ARG HA H 6.682 1.041 -3.206 1.00 . A A . 25 ARG HA 1 1 4 784 1 1 3 ARG HB2 H 5.304 1.758 -5.345 1.00 . A A . 25 ARG HB2 1 1 4 785 1 1 3 ARG HB3 H 6.199 3.262 -5.282 1.00 . A A . 25 ARG HB3 1 1 4 786 1 1 3 ARG HD2 H 6.709 -0.320 -4.838 1.00 . A A . 25 ARG HD2 1 1 4 787 1 1 3 ARG HD3 H 6.661 -0.288 -6.573 1.00 . A A . 25 ARG HD3 1 1 4 788 1 1 3 ARG HE H 9.148 -0.476 -4.918 1.00 . A A . 25 ARG HE 1 1 4 789 1 1 3 ARG HG2 H 7.488 1.895 -6.748 1.00 . A A . 25 ARG HG2 1 1 4 790 1 1 3 ARG HG3 H 8.364 1.819 -5.233 1.00 . A A . 25 ARG HG3 1 1 4 791 1 1 3 ARG HH11 H 7.475 -1.224 -7.883 1.00 . A A . 25 ARG HH11 1 1 4 792 1 1 3 ARG HH12 H 8.728 -2.215 -8.479 1.00 . A A . 25 ARG HH12 1 1 4 793 1 1 3 ARG HH21 H 10.774 -1.759 -5.654 1.00 . A A . 25 ARG HH21 1 1 4 794 1 1 3 ARG HH22 H 10.696 -2.495 -7.193 1.00 . A A . 25 ARG HH22 1 1 4 795 1 1 3 ARG N N 5.125 2.411 -2.779 1.00 . A A . 25 ARG N 1 1 4 796 1 1 3 ARG NE N 8.598 -0.638 -5.715 1.00 . A A . 25 ARG NE 1 1 4 797 1 1 3 ARG NH1 N 8.375 -1.629 -7.751 1.00 . A A . 25 ARG NH1 1 1 4 798 1 1 3 ARG NH2 N 10.255 -1.920 -6.503 1.00 . A A . 25 ARG NH2 1 1 4 799 1 1 3 ARG O O 8.557 2.650 -2.627 1.00 . A A . 25 ARG O 1 1 4 800 1 1 4 HIS C C 8.454 5.076 -1.018 1.00 . A A . 26 HIS C 1 1 4 801 1 1 4 HIS CA C 7.976 5.341 -2.460 1.00 . A A . 26 HIS CA 1 1 4 802 1 1 4 HIS CB C 7.207 6.680 -2.565 1.00 . A A . 26 HIS CB 1 1 4 803 1 1 4 HIS CD2 C 8.216 8.861 -3.564 1.00 . A A . 26 HIS CD2 1 1 4 804 1 1 4 HIS CE1 C 9.704 9.122 -2.201 1.00 . A A . 26 HIS CE1 1 1 4 805 1 1 4 HIS CG C 8.190 7.856 -2.629 1.00 . A A . 26 HIS CG 1 1 4 806 1 1 4 HIS H H 6.146 4.485 -3.226 1.00 . A A . 26 HIS H 1 1 4 807 1 1 4 HIS HA H 8.852 5.328 -3.085 1.00 . A A . 26 HIS HA 1 1 4 808 1 1 4 HIS HB2 H 6.603 6.698 -3.462 1.00 . A A . 26 HIS HB2 1 1 4 809 1 1 4 HIS HB3 H 6.556 6.825 -1.713 1.00 . A A . 26 HIS HB3 1 1 4 810 1 1 4 HIS HD1 H 9.373 7.462 -0.987 1.00 . A A . 26 HIS HD1 1 1 4 811 1 1 4 HIS HD2 H 7.541 8.968 -4.399 1.00 . A A . 26 HIS HD2 1 1 4 812 1 1 4 HIS HE1 H 10.556 9.562 -1.700 1.00 . A A . 26 HIS HE1 1 1 4 813 1 1 4 HIS N N 7.055 4.260 -2.937 1.00 . A A . 26 HIS N 1 1 4 814 1 1 4 HIS ND1 N 9.141 8.026 -1.762 1.00 . A A . 26 HIS ND1 1 1 4 815 1 1 4 HIS NE2 N 9.199 9.673 -3.276 1.00 . A A . 26 HIS NE2 1 1 4 816 1 1 4 HIS O O 9.348 5.726 -0.507 1.00 . A A . 26 HIS O 1 1 4 817 1 1 5 TYR C C 8.792 2.311 1.012 1.00 . A A . 27 TYR C 1 1 4 818 1 1 5 TYR CA C 8.150 3.706 0.994 1.00 . A A . 27 TYR CA 1 1 4 819 1 1 5 TYR CB C 6.838 3.721 1.795 1.00 . A A . 27 TYR CB 1 1 4 820 1 1 5 TYR CD1 C 7.274 6.069 2.649 1.00 . A A . 27 TYR CD1 1 1 4 821 1 1 5 TYR CD2 C 6.687 4.397 4.236 1.00 . A A . 27 TYR CD2 1 1 4 822 1 1 5 TYR CE1 C 7.366 6.999 3.661 1.00 . A A . 27 TYR CE1 1 1 4 823 1 1 5 TYR CE2 C 6.779 5.330 5.247 1.00 . A A . 27 TYR CE2 1 1 4 824 1 1 5 TYR CG C 6.935 4.757 2.927 1.00 . A A . 27 TYR CG 1 1 4 825 1 1 5 TYR CZ C 7.119 6.635 4.965 1.00 . A A . 27 TYR CZ 1 1 4 826 1 1 5 TYR H H 7.124 3.654 -0.904 1.00 . A A . 27 TYR H 1 1 4 827 1 1 5 TYR HA H 8.864 4.402 1.413 1.00 . A A . 27 TYR HA 1 1 4 828 1 1 5 TYR HB2 H 6.010 3.977 1.153 1.00 . A A . 27 TYR HB2 1 1 4 829 1 1 5 TYR HB3 H 6.661 2.739 2.212 1.00 . A A . 27 TYR HB3 1 1 4 830 1 1 5 TYR HD1 H 7.471 6.376 1.631 1.00 . A A . 27 TYR HD1 1 1 4 831 1 1 5 TYR HD2 H 6.420 3.377 4.475 1.00 . A A . 27 TYR HD2 1 1 4 832 1 1 5 TYR HE1 H 7.635 8.018 3.426 1.00 . A A . 27 TYR HE1 1 1 4 833 1 1 5 TYR HE2 H 6.581 5.042 6.270 1.00 . A A . 27 TYR HE2 1 1 4 834 1 1 5 TYR HH H 6.627 8.293 5.757 1.00 . A A . 27 TYR HH 1 1 4 835 1 1 5 TYR N N 7.827 4.111 -0.407 1.00 . A A . 27 TYR N 1 1 4 836 1 1 5 TYR O O 8.822 1.640 2.022 1.00 . A A . 27 TYR O 1 1 4 837 1 1 5 TYR OH O 7.211 7.563 5.978 1.00 . A A . 27 TYR OH 1 1 4 838 1 1 6 LYS C C 11.430 0.760 0.139 1.00 . A A . 28 LYS C 1 1 4 839 1 1 6 LYS CA C 9.966 0.600 -0.281 1.00 . A A . 28 LYS CA 1 1 4 840 1 1 6 LYS CB C 9.854 0.163 -1.760 1.00 . A A . 28 LYS CB 1 1 4 841 1 1 6 LYS CD C 10.709 -1.325 -3.570 1.00 . A A . 28 LYS CD 1 1 4 842 1 1 6 LYS CE C 11.741 -2.394 -4.033 1.00 . A A . 28 LYS CE 1 1 4 843 1 1 6 LYS CG C 10.691 -1.112 -2.050 1.00 . A A . 28 LYS CG 1 1 4 844 1 1 6 LYS H H 9.211 2.544 -0.889 1.00 . A A . 28 LYS H 1 1 4 845 1 1 6 LYS HA H 9.488 -0.125 0.358 1.00 . A A . 28 LYS HA 1 1 4 846 1 1 6 LYS HB2 H 8.813 -0.038 -1.974 1.00 . A A . 28 LYS HB2 1 1 4 847 1 1 6 LYS HB3 H 10.180 0.968 -2.402 1.00 . A A . 28 LYS HB3 1 1 4 848 1 1 6 LYS HD2 H 9.727 -1.701 -3.817 1.00 . A A . 28 LYS HD2 1 1 4 849 1 1 6 LYS HD3 H 10.893 -0.372 -4.046 1.00 . A A . 28 LYS HD3 1 1 4 850 1 1 6 LYS HE2 H 11.262 -3.341 -4.248 1.00 . A A . 28 LYS HE2 1 1 4 851 1 1 6 LYS HE3 H 12.304 -2.074 -4.902 1.00 . A A . 28 LYS HE3 1 1 4 852 1 1 6 LYS HG2 H 11.701 -0.974 -1.702 1.00 . A A . 28 LYS HG2 1 1 4 853 1 1 6 LYS HG3 H 10.266 -1.978 -1.559 1.00 . A A . 28 LYS HG3 1 1 4 854 1 1 6 LYS HZ1 H 12.396 -2.971 -2.084 1.00 . A A . 28 LYS HZ1 1 1 4 855 1 1 6 LYS N N 9.298 1.931 -0.128 1.00 . A A . 28 LYS N 1 1 4 856 1 1 6 LYS NZ N 12.729 -2.609 -2.932 1.00 . A A . 28 LYS NZ 1 1 4 857 1 1 6 LYS O O 11.893 0.072 1.029 1.00 . A A . 28 LYS O 1 1 4 858 1 1 7 ASN C C 13.866 1.781 1.273 1.00 . A A . 29 ASN C 1 1 4 859 1 1 7 ASN CA C 13.575 1.947 -0.236 1.00 . A A . 29 ASN CA 1 1 4 860 1 1 7 ASN CB C 13.877 3.396 -0.725 1.00 . A A . 29 ASN CB 1 1 4 861 1 1 7 ASN CG C 15.346 3.768 -0.470 1.00 . A A . 29 ASN CG 1 1 4 862 1 1 7 ASN H H 11.646 2.145 -1.235 1.00 . A A . 29 ASN H 1 1 4 863 1 1 7 ASN HA H 14.187 1.241 -0.776 1.00 . A A . 29 ASN HA 1 1 4 864 1 1 7 ASN HB2 H 13.685 3.470 -1.785 1.00 . A A . 29 ASN HB2 1 1 4 865 1 1 7 ASN HB3 H 13.254 4.117 -0.216 1.00 . A A . 29 ASN HB3 1 1 4 866 1 1 7 ASN HD21 H 15.858 3.991 -2.381 1.00 . A A . 29 ASN HD21 1 1 4 867 1 1 7 ASN HD22 H 17.087 4.276 -1.251 1.00 . A A . 29 ASN HD22 1 1 4 868 1 1 7 ASN N N 12.119 1.657 -0.527 1.00 . A A . 29 ASN N 1 1 4 869 1 1 7 ASN ND2 N 16.160 4.032 -1.450 1.00 . A A . 29 ASN ND2 1 1 4 870 1 1 7 ASN O O 14.725 1.032 1.691 1.00 . A A . 29 ASN O 1 1 4 871 1 1 7 ASN OD1 O 15.792 3.831 0.657 1.00 . A A . 29 ASN OD1 1 1 4 872 1 1 8 LEU C C 13.521 1.168 4.117 1.00 . A A . 30 LEU C 1 1 4 873 1 1 8 LEU CA C 13.164 2.545 3.530 1.00 . A A . 30 LEU CA 1 1 4 874 1 1 8 LEU CB C 11.795 3.006 4.068 1.00 . A A . 30 LEU CB 1 1 4 875 1 1 8 LEU CD1 C 12.403 5.394 4.760 1.00 . A A . 30 LEU CD1 1 1 4 876 1 1 8 LEU CD2 C 11.682 4.993 2.387 1.00 . A A . 30 LEU CD2 1 1 4 877 1 1 8 LEU CG C 11.502 4.528 3.853 1.00 . A A . 30 LEU CG 1 1 4 878 1 1 8 LEU H H 12.440 3.083 1.580 1.00 . A A . 30 LEU H 1 1 4 879 1 1 8 LEU HA H 13.929 3.242 3.820 1.00 . A A . 30 LEU HA 1 1 4 880 1 1 8 LEU HB2 H 11.013 2.429 3.591 1.00 . A A . 30 LEU HB2 1 1 4 881 1 1 8 LEU HB3 H 11.742 2.792 5.127 1.00 . A A . 30 LEU HB3 1 1 4 882 1 1 8 LEU HD11 H 13.447 5.237 4.551 1.00 . A A . 30 LEU HD11 1 1 4 883 1 1 8 LEU HD12 H 12.217 5.155 5.799 1.00 . A A . 30 LEU HD12 1 1 4 884 1 1 8 LEU HD13 H 12.174 6.442 4.614 1.00 . A A . 30 LEU HD13 1 1 4 885 1 1 8 LEU HD21 H 12.707 4.894 2.063 1.00 . A A . 30 LEU HD21 1 1 4 886 1 1 8 LEU HD22 H 11.411 6.038 2.310 1.00 . A A . 30 LEU HD22 1 1 4 887 1 1 8 LEU HD23 H 11.035 4.438 1.726 1.00 . A A . 30 LEU HD23 1 1 4 888 1 1 8 LEU HG H 10.481 4.692 4.146 1.00 . A A . 30 LEU HG 1 1 4 889 1 1 8 LEU N N 13.098 2.520 2.031 1.00 . A A . 30 LEU N 1 1 4 890 1 1 8 LEU O O 14.304 1.021 5.039 1.00 . A A . 30 LEU O 1 1 4 891 1 1 9 ILE C C 14.178 -1.822 3.056 1.00 . A A . 31 ILE C 1 1 4 892 1 1 9 ILE CA C 13.104 -1.217 3.943 1.00 . A A . 31 ILE CA 1 1 4 893 1 1 9 ILE CB C 11.771 -2.004 3.783 1.00 . A A . 31 ILE CB 1 1 4 894 1 1 9 ILE CD1 C 9.287 -2.001 4.382 1.00 . A A . 31 ILE CD1 1 1 4 895 1 1 9 ILE CG1 C 10.636 -1.268 4.557 1.00 . A A . 31 ILE CG1 1 1 4 896 1 1 9 ILE CG2 C 11.968 -3.431 4.362 1.00 . A A . 31 ILE CG2 1 1 4 897 1 1 9 ILE H H 12.282 0.410 2.785 1.00 . A A . 31 ILE H 1 1 4 898 1 1 9 ILE HA H 13.452 -1.245 4.948 1.00 . A A . 31 ILE HA 1 1 4 899 1 1 9 ILE HB H 11.497 -2.070 2.738 1.00 . A A . 31 ILE HB 1 1 4 900 1 1 9 ILE HD11 H 9.332 -3.004 4.780 1.00 . A A . 31 ILE HD11 1 1 4 901 1 1 9 ILE HD12 H 9.014 -2.051 3.338 1.00 . A A . 31 ILE HD12 1 1 4 902 1 1 9 ILE HD13 H 8.513 -1.464 4.912 1.00 . A A . 31 ILE HD13 1 1 4 903 1 1 9 ILE HG12 H 10.879 -1.192 5.607 1.00 . A A . 31 ILE HG12 1 1 4 904 1 1 9 ILE HG13 H 10.524 -0.267 4.168 1.00 . A A . 31 ILE HG13 1 1 4 905 1 1 9 ILE HG21 H 12.766 -3.950 3.851 1.00 . A A . 31 ILE HG21 1 1 4 906 1 1 9 ILE HG22 H 11.066 -4.009 4.236 1.00 . A A . 31 ILE HG22 1 1 4 907 1 1 9 ILE HG23 H 12.205 -3.388 5.414 1.00 . A A . 31 ILE HG23 1 1 4 908 1 1 9 ILE N N 12.896 0.193 3.522 1.00 . A A . 31 ILE N 1 1 4 909 1 1 9 ILE O O 15.187 -2.344 3.486 1.00 . A A . 31 ILE O 1 1 4 910 1 1 10 GLU C C 16.229 -1.659 0.716 1.00 . A A . 32 GLU C 1 1 4 911 1 1 10 GLU CA C 14.817 -2.233 0.733 1.00 . A A . 32 GLU CA 1 1 4 912 1 1 10 GLU CB C 14.113 -1.986 -0.597 1.00 . A A . 32 GLU CB 1 1 4 913 1 1 10 GLU CD C 14.011 -2.342 -3.048 1.00 . A A . 32 GLU CD 1 1 4 914 1 1 10 GLU CG C 14.849 -2.632 -1.804 1.00 . A A . 32 GLU CG 1 1 4 915 1 1 10 GLU H H 13.075 -1.233 1.594 1.00 . A A . 32 GLU H 1 1 4 916 1 1 10 GLU HA H 14.932 -3.280 0.931 1.00 . A A . 32 GLU HA 1 1 4 917 1 1 10 GLU HB2 H 13.111 -2.385 -0.533 1.00 . A A . 32 GLU HB2 1 1 4 918 1 1 10 GLU HB3 H 14.038 -0.924 -0.769 1.00 . A A . 32 GLU HB3 1 1 4 919 1 1 10 GLU HG2 H 15.830 -2.214 -1.961 1.00 . A A . 32 GLU HG2 1 1 4 920 1 1 10 GLU HG3 H 14.927 -3.702 -1.689 1.00 . A A . 32 GLU HG3 1 1 4 921 1 1 10 GLU N N 13.911 -1.702 1.797 1.00 . A A . 32 GLU N 1 1 4 922 1 1 10 GLU O O 17.041 -2.077 -0.082 1.00 . A A . 32 GLU O 1 1 4 923 1 1 10 GLU OE1 O 14.537 -1.904 -4.054 1.00 . A A . 32 GLU OE1 1 1 4 924 1 1 11 ARG C C 18.618 -0.855 2.742 1.00 . A A . 33 ARG C 1 1 4 925 1 1 11 ARG CA C 17.821 -0.078 1.694 1.00 . A A . 33 ARG CA 1 1 4 926 1 1 11 ARG CB C 17.633 1.406 2.133 1.00 . A A . 33 ARG CB 1 1 4 927 1 1 11 ARG CD C 18.795 3.659 2.170 1.00 . A A . 33 ARG CD 1 1 4 928 1 1 11 ARG CG C 18.994 2.144 2.014 1.00 . A A . 33 ARG CG 1 1 4 929 1 1 11 ARG CZ C 17.313 4.497 3.991 1.00 . A A . 33 ARG CZ 1 1 4 930 1 1 11 ARG H H 15.738 -0.477 2.172 1.00 . A A . 33 ARG H 1 1 4 931 1 1 11 ARG HA H 18.333 -0.149 0.743 1.00 . A A . 33 ARG HA 1 1 4 932 1 1 11 ARG HB2 H 16.900 1.882 1.498 1.00 . A A . 33 ARG HB2 1 1 4 933 1 1 11 ARG HB3 H 17.265 1.454 3.150 1.00 . A A . 33 ARG HB3 1 1 4 934 1 1 11 ARG HD2 H 19.723 4.156 1.913 1.00 . A A . 33 ARG HD2 1 1 4 935 1 1 11 ARG HD3 H 18.043 4.005 1.481 1.00 . A A . 33 ARG HD3 1 1 4 936 1 1 11 ARG HE H 19.183 3.848 4.257 1.00 . A A . 33 ARG HE 1 1 4 937 1 1 11 ARG HG2 H 19.681 1.779 2.767 1.00 . A A . 33 ARG HG2 1 1 4 938 1 1 11 ARG HG3 H 19.433 1.947 1.044 1.00 . A A . 33 ARG HG3 1 1 4 939 1 1 11 ARG HH11 H 16.454 4.406 2.175 1.00 . A A . 33 ARG HH11 1 1 4 940 1 1 11 ARG HH12 H 15.487 5.101 3.388 1.00 . A A . 33 ARG HH12 1 1 4 941 1 1 11 ARG HH21 H 17.889 4.637 5.912 1.00 . A A . 33 ARG HH21 1 1 4 942 1 1 11 ARG HH22 H 16.289 5.173 5.588 1.00 . A A . 33 ARG HH22 1 1 4 943 1 1 11 ARG N N 16.480 -0.736 1.587 1.00 . A A . 33 ARG N 1 1 4 944 1 1 11 ARG NE N 18.463 3.999 3.603 1.00 . A A . 33 ARG NE 1 1 4 945 1 1 11 ARG NH1 N 16.353 4.683 3.133 1.00 . A A . 33 ARG NH1 1 1 4 946 1 1 11 ARG NH2 N 17.151 4.791 5.253 1.00 . A A . 33 ARG NH2 1 1 4 947 1 1 11 ARG O O 19.827 -0.797 2.806 1.00 . A A . 33 ARG O 1 1 4 948 1 1 12 GLN C C 19.223 -3.588 3.939 1.00 . A A . 34 GLN C 1 1 4 949 1 1 12 GLN CA C 18.531 -2.395 4.617 1.00 . A A . 34 GLN CA 1 1 4 950 1 1 12 GLN CB C 17.407 -2.811 5.565 1.00 . A A . 34 GLN CB 1 1 4 951 1 1 12 GLN CD C 15.515 -1.941 6.967 1.00 . A A . 34 GLN CD 1 1 4 952 1 1 12 GLN CG C 16.706 -1.537 6.103 1.00 . A A . 34 GLN CG 1 1 4 953 1 1 12 GLN H H 16.922 -1.600 3.442 1.00 . A A . 34 GLN H 1 1 4 954 1 1 12 GLN HA H 19.281 -1.799 5.122 1.00 . A A . 34 GLN HA 1 1 4 955 1 1 12 GLN HB2 H 16.694 -3.456 5.070 1.00 . A A . 34 GLN HB2 1 1 4 956 1 1 12 GLN HB3 H 17.820 -3.325 6.416 1.00 . A A . 34 GLN HB3 1 1 4 957 1 1 12 GLN HE21 H 14.462 -0.304 6.535 1.00 . A A . 34 GLN HE21 1 1 4 958 1 1 12 GLN HE22 H 13.734 -1.414 7.609 1.00 . A A . 34 GLN HE22 1 1 4 959 1 1 12 GLN HG2 H 17.382 -0.952 6.709 1.00 . A A . 34 GLN HG2 1 1 4 960 1 1 12 GLN HG3 H 16.338 -0.921 5.295 1.00 . A A . 34 GLN HG3 1 1 4 961 1 1 12 GLN N N 17.898 -1.583 3.545 1.00 . A A . 34 GLN N 1 1 4 962 1 1 12 GLN NE2 N 14.486 -1.151 7.039 1.00 . A A . 34 GLN NE2 1 1 4 963 1 1 12 GLN O O 20.094 -4.227 4.496 1.00 . A A . 34 GLN O 1 1 4 964 1 1 12 GLN OE1 O 15.507 -2.980 7.594 1.00 . A A . 34 GLN OE1 1 1 4 965 1 1 13 ARG C C 20.470 -4.425 1.046 1.00 . A A . 35 ARG C 1 1 4 966 1 1 13 ARG CA C 19.360 -5.002 1.954 1.00 . A A . 35 ARG CA 1 1 4 967 1 1 13 ARG CB C 18.209 -5.639 1.152 1.00 . A A . 35 ARG CB 1 1 4 968 1 1 13 ARG CD C 17.329 -6.986 3.225 1.00 . A A . 35 ARG CD 1 1 4 969 1 1 13 ARG CG C 16.983 -5.990 2.075 1.00 . A A . 35 ARG CG 1 1 4 970 1 1 13 ARG CZ C 17.725 -6.101 5.535 1.00 . A A . 35 ARG CZ 1 1 4 971 1 1 13 ARG H H 18.055 -3.370 2.366 1.00 . A A . 35 ARG H 1 1 4 972 1 1 13 ARG HA H 19.829 -5.720 2.593 1.00 . A A . 35 ARG HA 1 1 4 973 1 1 13 ARG HB2 H 17.902 -4.957 0.370 1.00 . A A . 35 ARG HB2 1 1 4 974 1 1 13 ARG HB3 H 18.578 -6.534 0.671 1.00 . A A . 35 ARG HB3 1 1 4 975 1 1 13 ARG HD2 H 16.428 -7.431 3.615 1.00 . A A . 35 ARG HD2 1 1 4 976 1 1 13 ARG HD3 H 17.932 -7.785 2.815 1.00 . A A . 35 ARG HD3 1 1 4 977 1 1 13 ARG HE H 19.019 -5.948 4.082 1.00 . A A . 35 ARG HE 1 1 4 978 1 1 13 ARG HG2 H 16.574 -5.085 2.499 1.00 . A A . 35 ARG HG2 1 1 4 979 1 1 13 ARG HG3 H 16.214 -6.431 1.456 1.00 . A A . 35 ARG HG3 1 1 4 980 1 1 13 ARG HH11 H 15.940 -6.992 5.328 1.00 . A A . 35 ARG HH11 1 1 4 981 1 1 13 ARG HH12 H 16.246 -6.357 6.884 1.00 . A A . 35 ARG HH12 1 1 4 982 1 1 13 ARG HH21 H 19.448 -5.157 5.980 1.00 . A A . 35 ARG HH21 1 1 4 983 1 1 13 ARG HH22 H 18.337 -5.314 7.282 1.00 . A A . 35 ARG HH22 1 1 4 984 1 1 13 ARG N N 18.783 -3.888 2.750 1.00 . A A . 35 ARG N 1 1 4 985 1 1 13 ARG NE N 18.126 -6.290 4.304 1.00 . A A . 35 ARG NE 1 1 4 986 1 1 13 ARG NH1 N 16.556 -6.512 5.945 1.00 . A A . 35 ARG NH1 1 1 4 987 1 1 13 ARG NH2 N 18.556 -5.482 6.322 1.00 . A A . 35 ARG NH2 1 1 4 988 1 1 13 ARG O O 20.723 -4.940 -0.024 1.00 . A A . 35 ARG O 1 1 4 989 1 1 14 TYR C C 23.455 -2.737 1.614 1.00 . A A . 36 TYR C 1 1 4 990 1 1 14 TYR CA C 22.193 -2.703 0.738 1.00 . A A . 36 TYR CA 1 1 4 991 1 1 14 TYR CB C 21.768 -1.249 0.434 1.00 . A A . 36 TYR CB 1 1 4 992 1 1 14 TYR CD1 C 22.859 -0.799 -1.824 1.00 . A A . 36 TYR CD1 1 1 4 993 1 1 14 TYR CD2 C 23.700 0.345 0.084 1.00 . A A . 36 TYR CD2 1 1 4 994 1 1 14 TYR CE1 C 23.795 -0.160 -2.614 1.00 . A A . 36 TYR CE1 1 1 4 995 1 1 14 TYR CE2 C 24.632 0.982 -0.706 1.00 . A A . 36 TYR CE2 1 1 4 996 1 1 14 TYR CG C 22.804 -0.551 -0.465 1.00 . A A . 36 TYR CG 1 1 4 997 1 1 14 TYR CZ C 24.686 0.735 -2.058 1.00 . A A . 36 TYR CZ 1 1 4 998 1 1 14 TYR H H 20.854 -2.993 2.363 1.00 . A A . 36 TYR H 1 1 4 999 1 1 14 TYR HA H 22.371 -3.254 -0.166 1.00 . A A . 36 TYR HA 1 1 4 1000 1 1 14 TYR HB2 H 20.811 -1.240 -0.065 1.00 . A A . 36 TYR HB2 1 1 4 1001 1 1 14 TYR HB3 H 21.680 -0.692 1.356 1.00 . A A . 36 TYR HB3 1 1 4 1002 1 1 14 TYR HD1 H 22.170 -1.498 -2.276 1.00 . A A . 36 TYR HD1 1 1 4 1003 1 1 14 TYR HD2 H 23.673 0.543 1.147 1.00 . A A . 36 TYR HD2 1 1 4 1004 1 1 14 TYR HE1 H 23.825 -0.362 -3.674 1.00 . A A . 36 TYR HE1 1 1 4 1005 1 1 14 TYR HE2 H 25.326 1.681 -0.267 1.00 . A A . 36 TYR HE2 1 1 4 1006 1 1 14 TYR HH H 26.140 0.718 -3.302 1.00 . A A . 36 TYR HH 1 1 4 1007 1 1 14 TYR N N 21.099 -3.371 1.501 1.00 . A A . 36 TYR N 1 1 4 1008 1 1 14 TYR O O 23.851 -1.760 2.215 1.00 . A A . 36 TYR O 1 1 4 1009 1 1 14 TYR OH O 25.625 1.380 -2.834 1.00 . A A . 36 TYR OH 1 1 4 1010 1 1 15 NH2 HN1 H 23.820 -4.656 1.261 1.00 . A A . 37 NH2 HN1 1 1 4 1011 1 1 15 NH2 HN2 H 24.909 -3.869 2.302 1.00 . A A . 37 NH2 HN2 1 1 4 1012 1 1 15 NH2 N N 24.114 -3.851 1.733 1.00 . A A . 37 NH2 N 1 1 5 1013 1 1 1 ACE C C 2.696 5.760 -0.611 1.00 . A A . 23 ACE C 1 1 5 1014 1 1 1 ACE CH3 C 2.260 7.218 -0.679 1.00 . A A . 23 ACE CH3 1 1 5 1015 1 1 1 ACE H1 H 2.710 7.749 0.147 1.00 . A A . 23 ACE H1 1 1 5 1016 1 1 1 ACE H2 H 1.185 7.294 -0.617 1.00 . A A . 23 ACE H2 1 1 5 1017 1 1 1 ACE H3 H 2.603 7.648 -1.609 1.00 . A A . 23 ACE H3 1 1 5 1018 1 1 1 ACE O O 3.874 5.480 -0.660 1.00 . A A . 23 ACE O 1 1 5 1019 1 1 2 ALA C C 3.198 2.788 -1.113 1.00 . A A . 24 ALA C 1 1 5 1020 1 1 2 ALA CA C 1.956 3.391 -0.428 1.00 . A A . 24 ALA CA 1 1 5 1021 1 1 2 ALA CB C 0.709 2.694 -0.992 1.00 . A A . 24 ALA CB 1 1 5 1022 1 1 2 ALA H H 0.814 5.210 -0.479 1.00 . A A . 24 ALA H 1 1 5 1023 1 1 2 ALA HA H 2.042 3.147 0.618 1.00 . A A . 24 ALA HA 1 1 5 1024 1 1 2 ALA HB1 H 0.841 1.621 -0.939 1.00 . A A . 24 ALA HB1 1 1 5 1025 1 1 2 ALA HB2 H 0.548 2.973 -2.023 1.00 . A A . 24 ALA HB2 1 1 5 1026 1 1 2 ALA HB3 H -0.165 2.958 -0.414 1.00 . A A . 24 ALA HB3 1 1 5 1027 1 1 2 ALA N N 1.734 4.879 -0.509 1.00 . A A . 24 ALA N 1 1 5 1028 1 1 2 ALA O O 3.723 1.794 -0.656 1.00 . A A . 24 ALA O 1 1 5 1029 1 1 3 ARG C C 6.105 3.669 -2.586 1.00 . A A . 25 ARG C 1 1 5 1030 1 1 3 ARG CA C 4.830 2.884 -2.925 1.00 . A A . 25 ARG CA 1 1 5 1031 1 1 3 ARG CB C 4.563 2.974 -4.444 1.00 . A A . 25 ARG CB 1 1 5 1032 1 1 3 ARG CD C 3.215 2.084 -6.367 1.00 . A A . 25 ARG CD 1 1 5 1033 1 1 3 ARG CG C 3.420 2.005 -4.840 1.00 . A A . 25 ARG CG 1 1 5 1034 1 1 3 ARG CZ C 1.049 1.241 -7.283 1.00 . A A . 25 ARG CZ 1 1 5 1035 1 1 3 ARG H H 3.145 4.189 -2.465 1.00 . A A . 25 ARG H 1 1 5 1036 1 1 3 ARG HA H 4.998 1.852 -2.648 1.00 . A A . 25 ARG HA 1 1 5 1037 1 1 3 ARG HB2 H 4.320 3.991 -4.712 1.00 . A A . 25 ARG HB2 1 1 5 1038 1 1 3 ARG HB3 H 5.471 2.696 -4.965 1.00 . A A . 25 ARG HB3 1 1 5 1039 1 1 3 ARG HD2 H 2.896 3.069 -6.667 1.00 . A A . 25 ARG HD2 1 1 5 1040 1 1 3 ARG HD3 H 4.160 1.886 -6.857 1.00 . A A . 25 ARG HD3 1 1 5 1041 1 1 3 ARG HE H 2.548 0.084 -6.683 1.00 . A A . 25 ARG HE 1 1 5 1042 1 1 3 ARG HG2 H 3.692 0.997 -4.551 1.00 . A A . 25 ARG HG2 1 1 5 1043 1 1 3 ARG HG3 H 2.511 2.274 -4.324 1.00 . A A . 25 ARG HG3 1 1 5 1044 1 1 3 ARG HH11 H 1.191 3.228 -7.130 1.00 . A A . 25 ARG HH11 1 1 5 1045 1 1 3 ARG HH12 H -0.279 2.667 -7.799 1.00 . A A . 25 ARG HH12 1 1 5 1046 1 1 3 ARG HH21 H 0.657 -0.720 -7.517 1.00 . A A . 25 ARG HH21 1 1 5 1047 1 1 3 ARG HH22 H -0.597 0.324 -8.015 1.00 . A A . 25 ARG HH22 1 1 5 1048 1 1 3 ARG N N 3.630 3.394 -2.181 1.00 . A A . 25 ARG N 1 1 5 1049 1 1 3 ARG NE N 2.242 1.012 -6.785 1.00 . A A . 25 ARG NE 1 1 5 1050 1 1 3 ARG NH1 N 0.621 2.464 -7.414 1.00 . A A . 25 ARG NH1 1 1 5 1051 1 1 3 ARG NH2 N 0.320 0.215 -7.628 1.00 . A A . 25 ARG NH2 1 1 5 1052 1 1 3 ARG O O 7.199 3.147 -2.689 1.00 . A A . 25 ARG O 1 1 5 1053 1 1 4 HIS C C 7.738 5.277 -0.464 1.00 . A A . 26 HIS C 1 1 5 1054 1 1 4 HIS CA C 7.168 5.709 -1.832 1.00 . A A . 26 HIS CA 1 1 5 1055 1 1 4 HIS CB C 6.753 7.210 -1.825 1.00 . A A . 26 HIS CB 1 1 5 1056 1 1 4 HIS CD2 C 8.175 8.966 -0.519 1.00 . A A . 26 HIS CD2 1 1 5 1057 1 1 4 HIS CE1 C 9.765 9.030 -1.786 1.00 . A A . 26 HIS CE1 1 1 5 1058 1 1 4 HIS CG C 7.975 8.112 -1.577 1.00 . A A . 26 HIS CG 1 1 5 1059 1 1 4 HIS H H 5.059 5.281 -2.063 1.00 . A A . 26 HIS H 1 1 5 1060 1 1 4 HIS HA H 7.926 5.529 -2.581 1.00 . A A . 26 HIS HA 1 1 5 1061 1 1 4 HIS HB2 H 6.312 7.490 -2.768 1.00 . A A . 26 HIS HB2 1 1 5 1062 1 1 4 HIS HB3 H 6.029 7.383 -1.041 1.00 . A A . 26 HIS HB3 1 1 5 1063 1 1 4 HIS HD1 H 9.154 7.677 -3.224 1.00 . A A . 26 HIS HD1 1 1 5 1064 1 1 4 HIS HD2 H 7.489 9.123 0.301 1.00 . A A . 26 HIS HD2 1 1 5 1065 1 1 4 HIS HE1 H 10.725 9.314 -2.196 1.00 . A A . 26 HIS HE1 1 1 5 1066 1 1 4 HIS N N 5.955 4.898 -2.168 1.00 . A A . 26 HIS N 1 1 5 1067 1 1 4 HIS ND1 N 8.994 8.158 -2.385 1.00 . A A . 26 HIS ND1 1 1 5 1068 1 1 4 HIS NE2 N 9.333 9.551 -0.664 1.00 . A A . 26 HIS NE2 1 1 5 1069 1 1 4 HIS O O 8.327 6.054 0.260 1.00 . A A . 26 HIS O 1 1 5 1070 1 1 5 TYR C C 8.728 2.146 0.847 1.00 . A A . 27 TYR C 1 1 5 1071 1 1 5 TYR CA C 8.060 3.490 1.156 1.00 . A A . 27 TYR CA 1 1 5 1072 1 1 5 TYR CB C 6.888 3.303 2.139 1.00 . A A . 27 TYR CB 1 1 5 1073 1 1 5 TYR CD1 C 8.418 3.221 4.171 1.00 . A A . 27 TYR CD1 1 1 5 1074 1 1 5 TYR CD2 C 6.752 4.920 4.103 1.00 . A A . 27 TYR CD2 1 1 5 1075 1 1 5 TYR CE1 C 8.860 3.698 5.386 1.00 . A A . 27 TYR CE1 1 1 5 1076 1 1 5 TYR CE2 C 7.198 5.395 5.322 1.00 . A A . 27 TYR CE2 1 1 5 1077 1 1 5 TYR CG C 7.360 3.827 3.514 1.00 . A A . 27 TYR CG 1 1 5 1078 1 1 5 TYR CZ C 8.255 4.786 5.965 1.00 . A A . 27 TYR CZ 1 1 5 1079 1 1 5 TYR H H 7.050 3.440 -0.739 1.00 . A A . 27 TYR H 1 1 5 1080 1 1 5 TYR HA H 8.810 4.163 1.552 1.00 . A A . 27 TYR HA 1 1 5 1081 1 1 5 TYR HB2 H 6.034 3.857 1.786 1.00 . A A . 27 TYR HB2 1 1 5 1082 1 1 5 TYR HB3 H 6.629 2.255 2.227 1.00 . A A . 27 TYR HB3 1 1 5 1083 1 1 5 TYR HD1 H 8.907 2.364 3.735 1.00 . A A . 27 TYR HD1 1 1 5 1084 1 1 5 TYR HD2 H 5.923 5.409 3.612 1.00 . A A . 27 TYR HD2 1 1 5 1085 1 1 5 TYR HE1 H 9.688 3.218 5.888 1.00 . A A . 27 TYR HE1 1 1 5 1086 1 1 5 TYR HE2 H 6.711 6.249 5.772 1.00 . A A . 27 TYR HE2 1 1 5 1087 1 1 5 TYR HH H 8.792 6.207 7.106 1.00 . A A . 27 TYR HH 1 1 5 1088 1 1 5 TYR N N 7.543 4.027 -0.135 1.00 . A A . 27 TYR N 1 1 5 1089 1 1 5 TYR O O 8.960 1.338 1.721 1.00 . A A . 27 TYR O 1 1 5 1090 1 1 5 TYR OH O 8.722 5.252 7.174 1.00 . A A . 27 TYR OH 1 1 5 1091 1 1 6 LYS C C 11.202 0.847 -0.757 1.00 . A A . 28 LYS C 1 1 5 1092 1 1 6 LYS CA C 9.686 0.679 -0.848 1.00 . A A . 28 LYS CA 1 1 5 1093 1 1 6 LYS CB C 9.245 0.347 -2.313 1.00 . A A . 28 LYS CB 1 1 5 1094 1 1 6 LYS CD C 11.191 -0.531 -3.733 1.00 . A A . 28 LYS CD 1 1 5 1095 1 1 6 LYS CE C 12.040 -1.773 -4.071 1.00 . A A . 28 LYS CE 1 1 5 1096 1 1 6 LYS CG C 10.002 -0.931 -2.823 1.00 . A A . 28 LYS CG 1 1 5 1097 1 1 6 LYS H H 8.785 2.659 -1.044 1.00 . A A . 28 LYS H 1 1 5 1098 1 1 6 LYS HA H 9.390 -0.133 -0.207 1.00 . A A . 28 LYS HA 1 1 5 1099 1 1 6 LYS HB2 H 8.179 0.159 -2.334 1.00 . A A . 28 LYS HB2 1 1 5 1100 1 1 6 LYS HB3 H 9.444 1.184 -2.966 1.00 . A A . 28 LYS HB3 1 1 5 1101 1 1 6 LYS HD2 H 10.792 -0.088 -4.629 1.00 . A A . 28 LYS HD2 1 1 5 1102 1 1 6 LYS HD3 H 11.831 0.192 -3.260 1.00 . A A . 28 LYS HD3 1 1 5 1103 1 1 6 LYS HE2 H 11.415 -2.601 -4.383 1.00 . A A . 28 LYS HE2 1 1 5 1104 1 1 6 LYS HE3 H 12.743 -1.547 -4.864 1.00 . A A . 28 LYS HE3 1 1 5 1105 1 1 6 LYS HG2 H 10.368 -1.524 -1.999 1.00 . A A . 28 LYS HG2 1 1 5 1106 1 1 6 LYS HG3 H 9.324 -1.550 -3.393 1.00 . A A . 28 LYS HG3 1 1 5 1107 1 1 6 LYS HZ1 H 12.256 -2.263 -2.001 1.00 . A A . 28 LYS HZ1 1 1 5 1108 1 1 6 LYS N N 9.025 1.951 -0.410 1.00 . A A . 28 LYS N 1 1 5 1109 1 1 6 LYS NZ N 12.775 -2.146 -2.825 1.00 . A A . 28 LYS NZ 1 1 5 1110 1 1 6 LYS O O 11.841 0.170 0.025 1.00 . A A . 28 LYS O 1 1 5 1111 1 1 7 ASN C C 13.881 1.768 -0.216 1.00 . A A . 29 ASN C 1 1 5 1112 1 1 7 ASN CA C 13.209 2.023 -1.576 1.00 . A A . 29 ASN CA 1 1 5 1113 1 1 7 ASN CB C 13.438 3.492 -1.997 1.00 . A A . 29 ASN CB 1 1 5 1114 1 1 7 ASN CG C 14.935 3.695 -2.248 1.00 . A A . 29 ASN CG 1 1 5 1115 1 1 7 ASN H H 11.123 2.234 -2.142 1.00 . A A . 29 ASN H 1 1 5 1116 1 1 7 ASN HA H 13.669 1.363 -2.302 1.00 . A A . 29 ASN HA 1 1 5 1117 1 1 7 ASN HB2 H 12.919 3.693 -2.923 1.00 . A A . 29 ASN HB2 1 1 5 1118 1 1 7 ASN HB3 H 13.093 4.190 -1.249 1.00 . A A . 29 ASN HB3 1 1 5 1119 1 1 7 ASN HD21 H 15.227 5.006 -0.779 1.00 . A A . 29 ASN HD21 1 1 5 1120 1 1 7 ASN HD22 H 16.586 4.595 -1.712 1.00 . A A . 29 ASN HD22 1 1 5 1121 1 1 7 ASN N N 11.730 1.744 -1.551 1.00 . A A . 29 ASN N 1 1 5 1122 1 1 7 ASN ND2 N 15.634 4.504 -1.511 1.00 . A A . 29 ASN ND2 1 1 5 1123 1 1 7 ASN O O 14.792 0.977 -0.096 1.00 . A A . 29 ASN O 1 1 5 1124 1 1 7 ASN OD1 O 15.500 3.106 -3.142 1.00 . A A . 29 ASN OD1 1 1 5 1125 1 1 8 LEU C C 14.104 0.882 2.629 1.00 . A A . 30 LEU C 1 1 5 1126 1 1 8 LEU CA C 13.917 2.345 2.172 1.00 . A A . 30 LEU CA 1 1 5 1127 1 1 8 LEU CB C 12.936 3.068 3.130 1.00 . A A . 30 LEU CB 1 1 5 1128 1 1 8 LEU CD1 C 11.790 5.217 3.778 1.00 . A A . 30 LEU CD1 1 1 5 1129 1 1 8 LEU CD2 C 14.019 5.341 2.627 1.00 . A A . 30 LEU CD2 1 1 5 1130 1 1 8 LEU CG C 12.693 4.556 2.717 1.00 . A A . 30 LEU CG 1 1 5 1131 1 1 8 LEU H H 12.649 3.072 0.585 1.00 . A A . 30 LEU H 1 1 5 1132 1 1 8 LEU HA H 14.887 2.815 2.209 1.00 . A A . 30 LEU HA 1 1 5 1133 1 1 8 LEU HB2 H 11.992 2.539 3.137 1.00 . A A . 30 LEU HB2 1 1 5 1134 1 1 8 LEU HB3 H 13.341 3.029 4.131 1.00 . A A . 30 LEU HB3 1 1 5 1135 1 1 8 LEU HD11 H 10.846 4.694 3.836 1.00 . A A . 30 LEU HD11 1 1 5 1136 1 1 8 LEU HD12 H 11.586 6.245 3.512 1.00 . A A . 30 LEU HD12 1 1 5 1137 1 1 8 LEU HD13 H 12.250 5.202 4.756 1.00 . A A . 30 LEU HD13 1 1 5 1138 1 1 8 LEU HD21 H 14.524 5.328 3.582 1.00 . A A . 30 LEU HD21 1 1 5 1139 1 1 8 LEU HD22 H 13.815 6.368 2.359 1.00 . A A . 30 LEU HD22 1 1 5 1140 1 1 8 LEU HD23 H 14.661 4.917 1.871 1.00 . A A . 30 LEU HD23 1 1 5 1141 1 1 8 LEU HG H 12.176 4.603 1.768 1.00 . A A . 30 LEU HG 1 1 5 1142 1 1 8 LEU N N 13.390 2.462 0.774 1.00 . A A . 30 LEU N 1 1 5 1143 1 1 8 LEU O O 15.119 0.504 3.180 1.00 . A A . 30 LEU O 1 1 5 1144 1 1 9 ILE C C 14.316 -2.084 2.129 1.00 . A A . 31 ILE C 1 1 5 1145 1 1 9 ILE CA C 13.118 -1.358 2.757 1.00 . A A . 31 ILE CA 1 1 5 1146 1 1 9 ILE CB C 11.777 -2.018 2.288 1.00 . A A . 31 ILE CB 1 1 5 1147 1 1 9 ILE CD1 C 10.333 -0.978 4.185 1.00 . A A . 31 ILE CD1 1 1 5 1148 1 1 9 ILE CG1 C 10.520 -1.160 2.661 1.00 . A A . 31 ILE CG1 1 1 5 1149 1 1 9 ILE CG2 C 11.622 -3.423 2.924 1.00 . A A . 31 ILE CG2 1 1 5 1150 1 1 9 ILE H H 12.320 0.458 1.903 1.00 . A A . 31 ILE H 1 1 5 1151 1 1 9 ILE HA H 13.263 -1.415 3.826 1.00 . A A . 31 ILE HA 1 1 5 1152 1 1 9 ILE HB H 11.799 -2.119 1.210 1.00 . A A . 31 ILE HB 1 1 5 1153 1 1 9 ILE HD11 H 10.199 -1.931 4.673 1.00 . A A . 31 ILE HD11 1 1 5 1154 1 1 9 ILE HD12 H 9.449 -0.383 4.371 1.00 . A A . 31 ILE HD12 1 1 5 1155 1 1 9 ILE HD13 H 11.185 -0.473 4.616 1.00 . A A . 31 ILE HD13 1 1 5 1156 1 1 9 ILE HG12 H 10.595 -0.187 2.204 1.00 . A A . 31 ILE HG12 1 1 5 1157 1 1 9 ILE HG13 H 9.634 -1.629 2.253 1.00 . A A . 31 ILE HG13 1 1 5 1158 1 1 9 ILE HG21 H 11.621 -3.357 4.002 1.00 . A A . 31 ILE HG21 1 1 5 1159 1 1 9 ILE HG22 H 12.428 -4.076 2.624 1.00 . A A . 31 ILE HG22 1 1 5 1160 1 1 9 ILE HG23 H 10.688 -3.866 2.607 1.00 . A A . 31 ILE HG23 1 1 5 1161 1 1 9 ILE N N 13.100 0.091 2.372 1.00 . A A . 31 ILE N 1 1 5 1162 1 1 9 ILE O O 14.675 -3.177 2.519 1.00 . A A . 31 ILE O 1 1 5 1163 1 1 10 GLU C C 17.390 -1.397 0.955 1.00 . A A . 32 GLU C 1 1 5 1164 1 1 10 GLU CA C 16.100 -2.059 0.470 1.00 . A A . 32 GLU CA 1 1 5 1165 1 1 10 GLU CB C 15.870 -1.868 -1.042 1.00 . A A . 32 GLU CB 1 1 5 1166 1 1 10 GLU CD C 14.076 -2.317 -2.796 1.00 . A A . 32 GLU CD 1 1 5 1167 1 1 10 GLU CG C 14.609 -2.692 -1.421 1.00 . A A . 32 GLU CG 1 1 5 1168 1 1 10 GLU H H 14.585 -0.566 0.904 1.00 . A A . 32 GLU H 1 1 5 1169 1 1 10 GLU HA H 16.163 -3.111 0.712 1.00 . A A . 32 GLU HA 1 1 5 1170 1 1 10 GLU HB2 H 15.713 -0.823 -1.278 1.00 . A A . 32 GLU HB2 1 1 5 1171 1 1 10 GLU HB3 H 16.735 -2.214 -1.591 1.00 . A A . 32 GLU HB3 1 1 5 1172 1 1 10 GLU HG2 H 14.848 -3.743 -1.441 1.00 . A A . 32 GLU HG2 1 1 5 1173 1 1 10 GLU HG3 H 13.815 -2.533 -0.706 1.00 . A A . 32 GLU HG3 1 1 5 1174 1 1 10 GLU N N 14.921 -1.453 1.164 1.00 . A A . 32 GLU N 1 1 5 1175 1 1 10 GLU O O 18.387 -1.344 0.264 1.00 . A A . 32 GLU O 1 1 5 1176 1 1 10 GLU OE1 O 14.818 -2.220 -3.755 1.00 . A A . 32 GLU OE1 1 1 5 1177 1 1 11 ARG C C 19.048 -1.269 3.786 1.00 . A A . 33 ARG C 1 1 5 1178 1 1 11 ARG CA C 18.442 -0.234 2.834 1.00 . A A . 33 ARG CA 1 1 5 1179 1 1 11 ARG CB C 17.935 0.978 3.639 1.00 . A A . 33 ARG CB 1 1 5 1180 1 1 11 ARG CD C 19.711 2.687 3.127 1.00 . A A . 33 ARG CD 1 1 5 1181 1 1 11 ARG CG C 19.129 1.777 4.211 1.00 . A A . 33 ARG CG 1 1 5 1182 1 1 11 ARG CZ C 18.875 5.022 3.060 1.00 . A A . 33 ARG CZ 1 1 5 1183 1 1 11 ARG H H 16.433 -0.991 2.634 1.00 . A A . 33 ARG H 1 1 5 1184 1 1 11 ARG HA H 19.180 0.034 2.097 1.00 . A A . 33 ARG HA 1 1 5 1185 1 1 11 ARG HB2 H 17.313 1.582 2.997 1.00 . A A . 33 ARG HB2 1 1 5 1186 1 1 11 ARG HB3 H 17.321 0.646 4.465 1.00 . A A . 33 ARG HB3 1 1 5 1187 1 1 11 ARG HD2 H 20.646 3.095 3.472 1.00 . A A . 33 ARG HD2 1 1 5 1188 1 1 11 ARG HD3 H 19.896 2.138 2.213 1.00 . A A . 33 ARG HD3 1 1 5 1189 1 1 11 ARG HE H 17.797 3.417 2.565 1.00 . A A . 33 ARG HE 1 1 5 1190 1 1 11 ARG HG2 H 18.800 2.363 5.059 1.00 . A A . 33 ARG HG2 1 1 5 1191 1 1 11 ARG HG3 H 19.900 1.103 4.562 1.00 . A A . 33 ARG HG3 1 1 5 1192 1 1 11 ARG HH11 H 20.785 4.826 3.644 1.00 . A A . 33 ARG HH11 1 1 5 1193 1 1 11 ARG HH12 H 20.203 6.427 3.613 1.00 . A A . 33 ARG HH12 1 1 5 1194 1 1 11 ARG HH21 H 17.001 5.530 2.527 1.00 . A A . 33 ARG HH21 1 1 5 1195 1 1 11 ARG HH22 H 18.021 6.838 2.940 1.00 . A A . 33 ARG HH22 1 1 5 1196 1 1 11 ARG N N 17.293 -0.912 2.165 1.00 . A A . 33 ARG N 1 1 5 1197 1 1 11 ARG NE N 18.668 3.742 2.876 1.00 . A A . 33 ARG NE 1 1 5 1198 1 1 11 ARG NH1 N 20.033 5.455 3.467 1.00 . A A . 33 ARG NH1 1 1 5 1199 1 1 11 ARG NH2 N 17.897 5.852 2.825 1.00 . A A . 33 ARG NH2 1 1 5 1200 1 1 11 ARG O O 20.224 -1.568 3.771 1.00 . A A . 33 ARG O 1 1 5 1201 1 1 12 GLN C C 19.420 -3.901 5.057 1.00 . A A . 34 GLN C 1 1 5 1202 1 1 12 GLN CA C 18.508 -2.798 5.630 1.00 . A A . 34 GLN CA 1 1 5 1203 1 1 12 GLN CB C 17.186 -3.416 6.167 1.00 . A A . 34 GLN CB 1 1 5 1204 1 1 12 GLN CD C 17.598 -3.177 8.658 1.00 . A A . 34 GLN CD 1 1 5 1205 1 1 12 GLN CG C 17.450 -4.180 7.501 1.00 . A A . 34 GLN CG 1 1 5 1206 1 1 12 GLN H H 17.241 -1.437 4.522 1.00 . A A . 34 GLN H 1 1 5 1207 1 1 12 GLN HA H 19.054 -2.305 6.423 1.00 . A A . 34 GLN HA 1 1 5 1208 1 1 12 GLN HB2 H 16.470 -2.626 6.355 1.00 . A A . 34 GLN HB2 1 1 5 1209 1 1 12 GLN HB3 H 16.763 -4.095 5.441 1.00 . A A . 34 GLN HB3 1 1 5 1210 1 1 12 GLN HE21 H 16.091 -3.938 9.690 1.00 . A A . 34 GLN HE21 1 1 5 1211 1 1 12 GLN HE22 H 16.873 -2.602 10.400 1.00 . A A . 34 GLN HE22 1 1 5 1212 1 1 12 GLN HG2 H 16.637 -4.853 7.723 1.00 . A A . 34 GLN HG2 1 1 5 1213 1 1 12 GLN HG3 H 18.365 -4.755 7.442 1.00 . A A . 34 GLN HG3 1 1 5 1214 1 1 12 GLN N N 18.162 -1.768 4.604 1.00 . A A . 34 GLN N 1 1 5 1215 1 1 12 GLN NE2 N 16.784 -3.246 9.667 1.00 . A A . 34 GLN NE2 1 1 5 1216 1 1 12 GLN O O 20.437 -4.241 5.622 1.00 . A A . 34 GLN O 1 1 5 1217 1 1 12 GLN OE1 O 18.450 -2.315 8.663 1.00 . A A . 34 GLN OE1 1 1 5 1218 1 1 13 ARG C C 20.980 -4.910 2.439 1.00 . A A . 35 ARG C 1 1 5 1219 1 1 13 ARG CA C 19.843 -5.516 3.284 1.00 . A A . 35 ARG CA 1 1 5 1220 1 1 13 ARG CB C 18.878 -6.381 2.397 1.00 . A A . 35 ARG CB 1 1 5 1221 1 1 13 ARG CD C 18.657 -8.554 1.032 1.00 . A A . 35 ARG CD 1 1 5 1222 1 1 13 ARG CG C 19.563 -7.727 1.982 1.00 . A A . 35 ARG CG 1 1 5 1223 1 1 13 ARG CZ C 16.194 -8.858 0.996 1.00 . A A . 35 ARG CZ 1 1 5 1224 1 1 13 ARG H H 18.222 -4.117 3.500 1.00 . A A . 35 ARG H 1 1 5 1225 1 1 13 ARG HA H 20.279 -6.119 4.064 1.00 . A A . 35 ARG HA 1 1 5 1226 1 1 13 ARG HB2 H 17.974 -6.577 2.951 1.00 . A A . 35 ARG HB2 1 1 5 1227 1 1 13 ARG HB3 H 18.622 -5.823 1.507 1.00 . A A . 35 ARG HB3 1 1 5 1228 1 1 13 ARG HD2 H 18.601 -8.031 0.088 1.00 . A A . 35 ARG HD2 1 1 5 1229 1 1 13 ARG HD3 H 19.075 -9.543 0.882 1.00 . A A . 35 ARG HD3 1 1 5 1230 1 1 13 ARG HE H 17.271 -8.556 2.639 1.00 . A A . 35 ARG HE 1 1 5 1231 1 1 13 ARG HG2 H 20.494 -7.520 1.471 1.00 . A A . 35 ARG HG2 1 1 5 1232 1 1 13 ARG HG3 H 19.802 -8.311 2.862 1.00 . A A . 35 ARG HG3 1 1 5 1233 1 1 13 ARG HH11 H 17.113 -8.978 -0.775 1.00 . A A . 35 ARG HH11 1 1 5 1234 1 1 13 ARG HH12 H 15.413 -9.173 -0.840 1.00 . A A . 35 ARG HH12 1 1 5 1235 1 1 13 ARG HH21 H 15.065 -8.791 2.661 1.00 . A A . 35 ARG HH21 1 1 5 1236 1 1 13 ARG HH22 H 14.199 -9.043 1.206 1.00 . A A . 35 ARG HH22 1 1 5 1237 1 1 13 ARG N N 19.038 -4.433 3.925 1.00 . A A . 35 ARG N 1 1 5 1238 1 1 13 ARG NE N 17.300 -8.661 1.666 1.00 . A A . 35 ARG NE 1 1 5 1239 1 1 13 ARG NH1 N 16.237 -9.013 -0.298 1.00 . A A . 35 ARG NH1 1 1 5 1240 1 1 13 ARG NH2 N 15.077 -8.901 1.666 1.00 . A A . 35 ARG NH2 1 1 5 1241 1 1 13 ARG O O 21.253 -5.344 1.335 1.00 . A A . 35 ARG O 1 1 5 1242 1 1 14 TYR C C 23.813 -2.942 3.345 1.00 . A A . 36 TYR C 1 1 5 1243 1 1 14 TYR CA C 22.737 -3.236 2.291 1.00 . A A . 36 TYR CA 1 1 5 1244 1 1 14 TYR CB C 22.244 -1.920 1.633 1.00 . A A . 36 TYR CB 1 1 5 1245 1 1 14 TYR CD1 C 23.692 -2.175 -0.427 1.00 . A A . 36 TYR CD1 1 1 5 1246 1 1 14 TYR CD2 C 23.989 -0.219 0.896 1.00 . A A . 36 TYR CD2 1 1 5 1247 1 1 14 TYR CE1 C 24.678 -1.744 -1.287 1.00 . A A . 36 TYR CE1 1 1 5 1248 1 1 14 TYR CE2 C 24.976 0.209 0.032 1.00 . A A . 36 TYR CE2 1 1 5 1249 1 1 14 TYR CG C 23.337 -1.417 0.674 1.00 . A A . 36 TYR CG 1 1 5 1250 1 1 14 TYR CZ C 25.326 -0.550 -1.062 1.00 . A A . 36 TYR CZ 1 1 5 1251 1 1 14 TYR H H 21.360 -3.583 3.880 1.00 . A A . 36 TYR H 1 1 5 1252 1 1 14 TYR HA H 23.146 -3.923 1.572 1.00 . A A . 36 TYR HA 1 1 5 1253 1 1 14 TYR HB2 H 21.335 -2.093 1.076 1.00 . A A . 36 TYR HB2 1 1 5 1254 1 1 14 TYR HB3 H 22.058 -1.168 2.386 1.00 . A A . 36 TYR HB3 1 1 5 1255 1 1 14 TYR HD1 H 23.195 -3.116 -0.620 1.00 . A A . 36 TYR HD1 1 1 5 1256 1 1 14 TYR HD2 H 23.724 0.390 1.749 1.00 . A A . 36 TYR HD2 1 1 5 1257 1 1 14 TYR HE1 H 24.937 -2.353 -2.140 1.00 . A A . 36 TYR HE1 1 1 5 1258 1 1 14 TYR HE2 H 25.485 1.147 0.209 1.00 . A A . 36 TYR HE2 1 1 5 1259 1 1 14 TYR HH H 26.716 -0.846 -2.357 1.00 . A A . 36 TYR HH 1 1 5 1260 1 1 14 TYR N N 21.612 -3.909 2.990 1.00 . A A . 36 TYR N 1 1 5 1261 1 1 14 TYR O O 23.708 -3.312 4.496 1.00 . A A . 36 TYR O 1 1 5 1262 1 1 14 TYR OH O 26.316 -0.100 -1.907 1.00 . A A . 36 TYR OH 1 1 5 1263 1 1 15 NH2 HN1 H 24.993 -1.968 2.092 1.00 . A A . 37 NH2 HN1 1 1 5 1264 1 1 15 NH2 HN2 H 25.558 -2.099 3.691 1.00 . A A . 37 NH2 HN2 1 1 5 1265 1 1 15 NH2 N N 24.877 -2.279 3.012 1.00 . A A . 37 NH2 N 1 1 6 1266 1 1 1 ACE C C 2.930 3.868 -2.005 1.00 . A A . 23 ACE C 1 1 6 1267 1 1 1 ACE CH3 C 1.787 4.686 -2.601 1.00 . A A . 23 ACE CH3 1 1 6 1268 1 1 1 ACE H1 H 0.852 4.161 -2.485 1.00 . A A . 23 ACE H1 1 1 6 1269 1 1 1 ACE H2 H 1.978 4.852 -3.647 1.00 . A A . 23 ACE H2 1 1 6 1270 1 1 1 ACE H3 H 1.732 5.635 -2.086 1.00 . A A . 23 ACE H3 1 1 6 1271 1 1 1 ACE O O 4.070 4.281 -2.093 1.00 . A A . 23 ACE O 1 1 6 1272 1 1 2 ALA C C 4.978 1.831 -1.367 1.00 . A A . 24 ALA C 1 1 6 1273 1 1 2 ALA CA C 3.561 1.792 -0.785 1.00 . A A . 24 ALA CA 1 1 6 1274 1 1 2 ALA CB C 2.984 0.358 -0.899 1.00 . A A . 24 ALA CB 1 1 6 1275 1 1 2 ALA H H 1.633 2.497 -1.438 1.00 . A A . 24 ALA H 1 1 6 1276 1 1 2 ALA HA H 3.640 2.064 0.253 1.00 . A A . 24 ALA HA 1 1 6 1277 1 1 2 ALA HB1 H 2.031 0.287 -0.393 1.00 . A A . 24 ALA HB1 1 1 6 1278 1 1 2 ALA HB2 H 3.665 -0.341 -0.436 1.00 . A A . 24 ALA HB2 1 1 6 1279 1 1 2 ALA HB3 H 2.851 0.072 -1.930 1.00 . A A . 24 ALA HB3 1 1 6 1280 1 1 2 ALA N N 2.582 2.736 -1.436 1.00 . A A . 24 ALA N 1 1 6 1281 1 1 2 ALA O O 5.941 2.056 -0.661 1.00 . A A . 24 ALA O 1 1 6 1282 1 1 3 ARG C C 7.231 2.793 -2.982 1.00 . A A . 25 ARG C 1 1 6 1283 1 1 3 ARG CA C 6.340 1.596 -3.403 1.00 . A A . 25 ARG CA 1 1 6 1284 1 1 3 ARG CB C 6.027 1.658 -4.940 1.00 . A A . 25 ARG CB 1 1 6 1285 1 1 3 ARG CD C 4.816 0.479 -6.925 1.00 . A A . 25 ARG CD 1 1 6 1286 1 1 3 ARG CG C 5.264 0.361 -5.417 1.00 . A A . 25 ARG CG 1 1 6 1287 1 1 3 ARG CZ C 4.099 -1.350 -8.495 1.00 . A A . 25 ARG CZ 1 1 6 1288 1 1 3 ARG H H 4.195 1.419 -3.089 1.00 . A A . 25 ARG H 1 1 6 1289 1 1 3 ARG HA H 6.872 0.686 -3.166 1.00 . A A . 25 ARG HA 1 1 6 1290 1 1 3 ARG HB2 H 5.444 2.544 -5.149 1.00 . A A . 25 ARG HB2 1 1 6 1291 1 1 3 ARG HB3 H 6.962 1.741 -5.477 1.00 . A A . 25 ARG HB3 1 1 6 1292 1 1 3 ARG HD2 H 4.182 1.345 -7.074 1.00 . A A . 25 ARG HD2 1 1 6 1293 1 1 3 ARG HD3 H 5.706 0.580 -7.531 1.00 . A A . 25 ARG HD3 1 1 6 1294 1 1 3 ARG HE H 3.476 -1.159 -6.614 1.00 . A A . 25 ARG HE 1 1 6 1295 1 1 3 ARG HG2 H 5.926 -0.487 -5.302 1.00 . A A . 25 ARG HG2 1 1 6 1296 1 1 3 ARG HG3 H 4.404 0.204 -4.783 1.00 . A A . 25 ARG HG3 1 1 6 1297 1 1 3 ARG HH11 H 5.356 -0.011 -9.283 1.00 . A A . 25 ARG HH11 1 1 6 1298 1 1 3 ARG HH12 H 4.902 -1.266 -10.343 1.00 . A A . 25 ARG HH12 1 1 6 1299 1 1 3 ARG HH21 H 2.840 -2.804 -7.945 1.00 . A A . 25 ARG HH21 1 1 6 1300 1 1 3 ARG HH22 H 3.379 -2.920 -9.570 1.00 . A A . 25 ARG HH22 1 1 6 1301 1 1 3 ARG N N 5.043 1.595 -2.646 1.00 . A A . 25 ARG N 1 1 6 1302 1 1 3 ARG NE N 4.044 -0.767 -7.312 1.00 . A A . 25 ARG NE 1 1 6 1303 1 1 3 ARG NH1 N 4.836 -0.843 -9.442 1.00 . A A . 25 ARG NH1 1 1 6 1304 1 1 3 ARG NH2 N 3.392 -2.434 -8.691 1.00 . A A . 25 ARG NH2 1 1 6 1305 1 1 3 ARG O O 8.413 2.644 -2.735 1.00 . A A . 25 ARG O 1 1 6 1306 1 1 4 HIS C C 7.939 5.162 -1.083 1.00 . A A . 26 HIS C 1 1 6 1307 1 1 4 HIS CA C 7.381 5.188 -2.509 1.00 . A A . 26 HIS CA 1 1 6 1308 1 1 4 HIS CB C 6.465 6.411 -2.660 1.00 . A A . 26 HIS CB 1 1 6 1309 1 1 4 HIS CD2 C 6.804 7.376 -5.044 1.00 . A A . 26 HIS CD2 1 1 6 1310 1 1 4 HIS CE1 C 5.178 6.524 -5.922 1.00 . A A . 26 HIS CE1 1 1 6 1311 1 1 4 HIS CG C 6.107 6.619 -4.134 1.00 . A A . 26 HIS CG 1 1 6 1312 1 1 4 HIS H H 5.661 4.005 -3.084 1.00 . A A . 26 HIS H 1 1 6 1313 1 1 4 HIS HA H 8.230 5.276 -3.172 1.00 . A A . 26 HIS HA 1 1 6 1314 1 1 4 HIS HB2 H 5.555 6.279 -2.090 1.00 . A A . 26 HIS HB2 1 1 6 1315 1 1 4 HIS HB3 H 6.971 7.294 -2.297 1.00 . A A . 26 HIS HB3 1 1 6 1316 1 1 4 HIS HD1 H 4.387 5.491 -4.298 1.00 . A A . 26 HIS HD1 1 1 6 1317 1 1 4 HIS HD2 H 7.705 7.936 -4.840 1.00 . A A . 26 HIS HD2 1 1 6 1318 1 1 4 HIS HE1 H 4.463 6.270 -6.692 1.00 . A A . 26 HIS HE1 1 1 6 1319 1 1 4 HIS N N 6.623 3.950 -2.900 1.00 . A A . 26 HIS N 1 1 6 1320 1 1 4 HIS ND1 N 5.069 6.075 -4.696 1.00 . A A . 26 HIS ND1 1 1 6 1321 1 1 4 HIS NE2 N 6.193 7.307 -6.196 1.00 . A A . 26 HIS NE2 1 1 6 1322 1 1 4 HIS O O 8.617 6.077 -0.662 1.00 . A A . 26 HIS O 1 1 6 1323 1 1 5 TYR C C 8.821 2.556 1.075 1.00 . A A . 27 TYR C 1 1 6 1324 1 1 5 TYR CA C 8.058 3.884 1.017 1.00 . A A . 27 TYR CA 1 1 6 1325 1 1 5 TYR CB C 6.843 3.806 1.942 1.00 . A A . 27 TYR CB 1 1 6 1326 1 1 5 TYR CD1 C 6.037 6.204 1.630 1.00 . A A . 27 TYR CD1 1 1 6 1327 1 1 5 TYR CD2 C 6.539 5.452 3.827 1.00 . A A . 27 TYR CD2 1 1 6 1328 1 1 5 TYR CE1 C 5.699 7.444 2.137 1.00 . A A . 27 TYR CE1 1 1 6 1329 1 1 5 TYR CE2 C 6.203 6.690 4.332 1.00 . A A . 27 TYR CE2 1 1 6 1330 1 1 5 TYR CG C 6.461 5.196 2.473 1.00 . A A . 27 TYR CG 1 1 6 1331 1 1 5 TYR CZ C 5.780 7.697 3.489 1.00 . A A . 27 TYR CZ 1 1 6 1332 1 1 5 TYR H H 7.040 3.448 -0.820 1.00 . A A . 27 TYR H 1 1 6 1333 1 1 5 TYR HA H 8.732 4.675 1.314 1.00 . A A . 27 TYR HA 1 1 6 1334 1 1 5 TYR HB2 H 6.005 3.381 1.412 1.00 . A A . 27 TYR HB2 1 1 6 1335 1 1 5 TYR HB3 H 7.088 3.146 2.757 1.00 . A A . 27 TYR HB3 1 1 6 1336 1 1 5 TYR HD1 H 5.969 6.026 0.568 1.00 . A A . 27 TYR HD1 1 1 6 1337 1 1 5 TYR HD2 H 6.872 4.677 4.503 1.00 . A A . 27 TYR HD2 1 1 6 1338 1 1 5 TYR HE1 H 5.370 8.229 1.472 1.00 . A A . 27 TYR HE1 1 1 6 1339 1 1 5 TYR HE2 H 6.273 6.864 5.394 1.00 . A A . 27 TYR HE2 1 1 6 1340 1 1 5 TYR HH H 5.175 8.864 4.899 1.00 . A A . 27 TYR HH 1 1 6 1341 1 1 5 TYR N N 7.613 4.112 -0.390 1.00 . A A . 27 TYR N 1 1 6 1342 1 1 5 TYR O O 9.029 1.997 2.132 1.00 . A A . 27 TYR O 1 1 6 1343 1 1 5 TYR OH O 5.439 8.941 3.978 1.00 . A A . 27 TYR OH 1 1 6 1344 1 1 6 LYS C C 11.457 1.097 0.129 1.00 . A A . 28 LYS C 1 1 6 1345 1 1 6 LYS CA C 9.982 0.806 -0.160 1.00 . A A . 28 LYS CA 1 1 6 1346 1 1 6 LYS CB C 9.813 0.202 -1.578 1.00 . A A . 28 LYS CB 1 1 6 1347 1 1 6 LYS CD C 10.519 -1.695 -3.107 1.00 . A A . 28 LYS CD 1 1 6 1348 1 1 6 LYS CE C 11.605 -2.793 -3.292 1.00 . A A . 28 LYS CE 1 1 6 1349 1 1 6 LYS CG C 10.636 -1.114 -1.688 1.00 . A A . 28 LYS CG 1 1 6 1350 1 1 6 LYS H H 9.008 2.620 -0.874 1.00 . A A . 28 LYS H 1 1 6 1351 1 1 6 LYS HA H 9.601 0.110 0.573 1.00 . A A . 28 LYS HA 1 1 6 1352 1 1 6 LYS HB2 H 8.769 -0.014 -1.751 1.00 . A A . 28 LYS HB2 1 1 6 1353 1 1 6 LYS HB3 H 10.147 0.904 -2.329 1.00 . A A . 28 LYS HB3 1 1 6 1354 1 1 6 LYS HD2 H 9.536 -2.122 -3.253 1.00 . A A . 28 LYS HD2 1 1 6 1355 1 1 6 LYS HD3 H 10.659 -0.901 -3.824 1.00 . A A . 28 LYS HD3 1 1 6 1356 1 1 6 LYS HE2 H 11.470 -3.597 -2.579 1.00 . A A . 28 LYS HE2 1 1 6 1357 1 1 6 LYS HE3 H 11.567 -3.201 -4.295 1.00 . A A . 28 LYS HE3 1 1 6 1358 1 1 6 LYS HG2 H 11.674 -0.918 -1.478 1.00 . A A . 28 LYS HG2 1 1 6 1359 1 1 6 LYS HG3 H 10.283 -1.847 -0.976 1.00 . A A . 28 LYS HG3 1 1 6 1360 1 1 6 LYS HZ1 H 13.160 -1.343 -3.610 1.00 . A A . 28 LYS HZ1 1 1 6 1361 1 1 6 LYS N N 9.225 2.096 -0.075 1.00 . A A . 28 LYS N 1 1 6 1362 1 1 6 LYS NZ N 12.937 -2.131 -3.070 1.00 . A A . 28 LYS NZ 1 1 6 1363 1 1 6 LYS O O 12.064 0.425 0.941 1.00 . A A . 28 LYS O 1 1 6 1364 1 1 7 ASN C C 13.959 2.241 1.029 1.00 . A A . 29 ASN C 1 1 6 1365 1 1 7 ASN CA C 13.417 2.515 -0.388 1.00 . A A . 29 ASN CA 1 1 6 1366 1 1 7 ASN CB C 13.538 4.026 -0.692 1.00 . A A . 29 ASN CB 1 1 6 1367 1 1 7 ASN CG C 14.993 4.468 -0.479 1.00 . A A . 29 ASN CG 1 1 6 1368 1 1 7 ASN H H 11.389 2.556 -1.182 1.00 . A A . 29 ASN H 1 1 6 1369 1 1 7 ASN HA H 14.025 1.970 -1.097 1.00 . A A . 29 ASN HA 1 1 6 1370 1 1 7 ASN HB2 H 13.276 4.226 -1.720 1.00 . A A . 29 ASN HB2 1 1 6 1371 1 1 7 ASN HB3 H 12.893 4.608 -0.050 1.00 . A A . 29 ASN HB3 1 1 6 1372 1 1 7 ASN HD21 H 14.608 5.608 1.096 1.00 . A A . 29 ASN HD21 1 1 6 1373 1 1 7 ASN HD22 H 16.234 5.556 0.588 1.00 . A A . 29 ASN HD22 1 1 6 1374 1 1 7 ASN N N 11.977 2.090 -0.549 1.00 . A A . 29 ASN N 1 1 6 1375 1 1 7 ASN ND2 N 15.300 5.282 0.487 1.00 . A A . 29 ASN ND2 1 1 6 1376 1 1 7 ASN O O 14.918 1.517 1.224 1.00 . A A . 29 ASN O 1 1 6 1377 1 1 7 ASN OD1 O 15.888 4.071 -1.195 1.00 . A A . 29 ASN OD1 1 1 6 1378 1 1 8 LEU C C 13.977 1.343 3.844 1.00 . A A . 30 LEU C 1 1 6 1379 1 1 8 LEU CA C 13.611 2.767 3.416 1.00 . A A . 30 LEU CA 1 1 6 1380 1 1 8 LEU CB C 12.390 3.253 4.222 1.00 . A A . 30 LEU CB 1 1 6 1381 1 1 8 LEU CD1 C 10.738 5.084 4.640 1.00 . A A . 30 LEU CD1 1 1 6 1382 1 1 8 LEU CD2 C 13.150 5.679 4.283 1.00 . A A . 30 LEU CD2 1 1 6 1383 1 1 8 LEU CG C 12.012 4.714 3.855 1.00 . A A . 30 LEU CG 1 1 6 1384 1 1 8 LEU H H 12.526 3.414 1.677 1.00 . A A . 30 LEU H 1 1 6 1385 1 1 8 LEU HA H 14.467 3.392 3.619 1.00 . A A . 30 LEU HA 1 1 6 1386 1 1 8 LEU HB2 H 11.546 2.606 4.030 1.00 . A A . 30 LEU HB2 1 1 6 1387 1 1 8 LEU HB3 H 12.624 3.189 5.278 1.00 . A A . 30 LEU HB3 1 1 6 1388 1 1 8 LEU HD11 H 10.907 5.009 5.706 1.00 . A A . 30 LEU HD11 1 1 6 1389 1 1 8 LEU HD12 H 9.922 4.424 4.376 1.00 . A A . 30 LEU HD12 1 1 6 1390 1 1 8 LEU HD13 H 10.443 6.098 4.409 1.00 . A A . 30 LEU HD13 1 1 6 1391 1 1 8 LEU HD21 H 13.309 5.615 5.351 1.00 . A A . 30 LEU HD21 1 1 6 1392 1 1 8 LEU HD22 H 12.876 6.695 4.038 1.00 . A A . 30 LEU HD22 1 1 6 1393 1 1 8 LEU HD23 H 14.077 5.445 3.783 1.00 . A A . 30 LEU HD23 1 1 6 1394 1 1 8 LEU HG H 11.808 4.818 2.795 1.00 . A A . 30 LEU HG 1 1 6 1395 1 1 8 LEU N N 13.286 2.865 1.958 1.00 . A A . 30 LEU N 1 1 6 1396 1 1 8 LEU O O 14.949 1.110 4.540 1.00 . A A . 30 LEU O 1 1 6 1397 1 1 9 ILE C C 14.367 -1.592 2.748 1.00 . A A . 31 ILE C 1 1 6 1398 1 1 9 ILE CA C 13.352 -1.001 3.704 1.00 . A A . 31 ILE CA 1 1 6 1399 1 1 9 ILE CB C 11.979 -1.729 3.584 1.00 . A A . 31 ILE CB 1 1 6 1400 1 1 9 ILE CD1 C 9.541 -1.577 4.319 1.00 . A A . 31 ILE CD1 1 1 6 1401 1 1 9 ILE CG1 C 10.949 -0.969 4.478 1.00 . A A . 31 ILE CG1 1 1 6 1402 1 1 9 ILE CG2 C 12.124 -3.193 4.104 1.00 . A A . 31 ILE CG2 1 1 6 1403 1 1 9 ILE H H 12.407 0.716 2.810 1.00 . A A . 31 ILE H 1 1 6 1404 1 1 9 ILE HA H 13.758 -1.073 4.689 1.00 . A A . 31 ILE HA 1 1 6 1405 1 1 9 ILE HB H 11.645 -1.733 2.555 1.00 . A A . 31 ILE HB 1 1 6 1406 1 1 9 ILE HD11 H 8.841 -1.028 4.931 1.00 . A A . 31 ILE HD11 1 1 6 1407 1 1 9 ILE HD12 H 9.515 -2.612 4.627 1.00 . A A . 31 ILE HD12 1 1 6 1408 1 1 9 ILE HD13 H 9.218 -1.506 3.290 1.00 . A A . 31 ILE HD13 1 1 6 1409 1 1 9 ILE HG12 H 11.254 -1.005 5.516 1.00 . A A . 31 ILE HG12 1 1 6 1410 1 1 9 ILE HG13 H 10.897 0.065 4.182 1.00 . A A . 31 ILE HG13 1 1 6 1411 1 1 9 ILE HG21 H 12.420 -3.207 5.145 1.00 . A A . 31 ILE HG21 1 1 6 1412 1 1 9 ILE HG22 H 12.864 -3.733 3.531 1.00 . A A . 31 ILE HG22 1 1 6 1413 1 1 9 ILE HG23 H 11.183 -3.713 4.010 1.00 . A A . 31 ILE HG23 1 1 6 1414 1 1 9 ILE N N 13.158 0.439 3.381 1.00 . A A . 31 ILE N 1 1 6 1415 1 1 9 ILE O O 15.221 -2.366 3.131 1.00 . A A . 31 ILE O 1 1 6 1416 1 1 10 GLU C C 16.625 -1.647 0.963 1.00 . A A . 32 GLU C 1 1 6 1417 1 1 10 GLU CA C 15.185 -1.704 0.455 1.00 . A A . 32 GLU CA 1 1 6 1418 1 1 10 GLU CB C 15.045 -0.839 -0.838 1.00 . A A . 32 GLU CB 1 1 6 1419 1 1 10 GLU CD C 13.808 -2.564 -2.190 1.00 . A A . 32 GLU CD 1 1 6 1420 1 1 10 GLU CG C 15.123 -1.761 -2.093 1.00 . A A . 32 GLU CG 1 1 6 1421 1 1 10 GLU H H 13.521 -0.567 1.351 1.00 . A A . 32 GLU H 1 1 6 1422 1 1 10 GLU HA H 14.964 -2.732 0.316 1.00 . A A . 32 GLU HA 1 1 6 1423 1 1 10 GLU HB2 H 14.093 -0.326 -0.841 1.00 . A A . 32 GLU HB2 1 1 6 1424 1 1 10 GLU HB3 H 15.828 -0.093 -0.886 1.00 . A A . 32 GLU HB3 1 1 6 1425 1 1 10 GLU HG2 H 15.247 -1.178 -2.995 1.00 . A A . 32 GLU HG2 1 1 6 1426 1 1 10 GLU HG3 H 15.943 -2.457 -2.017 1.00 . A A . 32 GLU HG3 1 1 6 1427 1 1 10 GLU N N 14.249 -1.203 1.517 1.00 . A A . 32 GLU N 1 1 6 1428 1 1 10 GLU O O 17.442 -2.531 0.794 1.00 . A A . 32 GLU O 1 1 6 1429 1 1 10 GLU OE1 O 13.639 -3.521 -1.459 1.00 . A A . 32 GLU OE1 1 1 6 1430 1 1 11 ARG C C 18.692 -1.235 3.119 1.00 . A A . 33 ARG C 1 1 6 1431 1 1 11 ARG CA C 18.128 -0.126 2.214 1.00 . A A . 33 ARG CA 1 1 6 1432 1 1 11 ARG CB C 17.837 1.180 3.011 1.00 . A A . 33 ARG CB 1 1 6 1433 1 1 11 ARG CD C 19.790 2.601 2.192 1.00 . A A . 33 ARG CD 1 1 6 1434 1 1 11 ARG CG C 19.100 1.979 3.435 1.00 . A A . 33 ARG CG 1 1 6 1435 1 1 11 ARG CZ C 22.135 3.290 2.646 1.00 . A A . 33 ARG CZ 1 1 6 1436 1 1 11 ARG H H 16.028 0.043 1.594 1.00 . A A . 33 ARG H 1 1 6 1437 1 1 11 ARG HA H 18.866 -0.009 1.436 1.00 . A A . 33 ARG HA 1 1 6 1438 1 1 11 ARG HB2 H 17.181 1.814 2.432 1.00 . A A . 33 ARG HB2 1 1 6 1439 1 1 11 ARG HB3 H 17.303 0.911 3.912 1.00 . A A . 33 ARG HB3 1 1 6 1440 1 1 11 ARG HD2 H 20.193 1.854 1.526 1.00 . A A . 33 ARG HD2 1 1 6 1441 1 1 11 ARG HD3 H 19.054 3.170 1.633 1.00 . A A . 33 ARG HD3 1 1 6 1442 1 1 11 ARG HE H 20.538 4.421 3.025 1.00 . A A . 33 ARG HE 1 1 6 1443 1 1 11 ARG HG2 H 18.802 2.757 4.124 1.00 . A A . 33 ARG HG2 1 1 6 1444 1 1 11 ARG HG3 H 19.786 1.322 3.954 1.00 . A A . 33 ARG HG3 1 1 6 1445 1 1 11 ARG HH11 H 21.934 1.448 1.872 1.00 . A A . 33 ARG HH11 1 1 6 1446 1 1 11 ARG HH12 H 23.544 1.921 2.158 1.00 . A A . 33 ARG HH12 1 1 6 1447 1 1 11 ARG HH21 H 22.631 5.083 3.430 1.00 . A A . 33 ARG HH21 1 1 6 1448 1 1 11 ARG HH22 H 23.939 4.045 3.080 1.00 . A A . 33 ARG HH22 1 1 6 1449 1 1 11 ARG N N 16.828 -0.531 1.578 1.00 . A A . 33 ARG N 1 1 6 1450 1 1 11 ARG NE N 20.851 3.556 2.678 1.00 . A A . 33 ARG NE 1 1 6 1451 1 1 11 ARG NH1 N 22.569 2.142 2.194 1.00 . A A . 33 ARG NH1 1 1 6 1452 1 1 11 ARG NH2 N 22.953 4.202 3.081 1.00 . A A . 33 ARG NH2 1 1 6 1453 1 1 11 ARG O O 19.889 -1.445 3.196 1.00 . A A . 33 ARG O 1 1 6 1454 1 1 12 GLN C C 18.763 -4.182 3.963 1.00 . A A . 34 GLN C 1 1 6 1455 1 1 12 GLN CA C 18.128 -3.004 4.705 1.00 . A A . 34 GLN CA 1 1 6 1456 1 1 12 GLN CB C 16.843 -3.478 5.424 1.00 . A A . 34 GLN CB 1 1 6 1457 1 1 12 GLN CD C 14.809 -2.698 6.748 1.00 . A A . 34 GLN CD 1 1 6 1458 1 1 12 GLN CG C 16.150 -2.278 6.127 1.00 . A A . 34 GLN CG 1 1 6 1459 1 1 12 GLN H H 16.845 -1.649 3.634 1.00 . A A . 34 GLN H 1 1 6 1460 1 1 12 GLN HA H 18.843 -2.639 5.431 1.00 . A A . 34 GLN HA 1 1 6 1461 1 1 12 GLN HB2 H 16.159 -3.914 4.706 1.00 . A A . 34 GLN HB2 1 1 6 1462 1 1 12 GLN HB3 H 17.108 -4.233 6.151 1.00 . A A . 34 GLN HB3 1 1 6 1463 1 1 12 GLN HE21 H 15.282 -4.609 7.051 1.00 . A A . 34 GLN HE21 1 1 6 1464 1 1 12 GLN HE22 H 13.723 -4.131 7.528 1.00 . A A . 34 GLN HE22 1 1 6 1465 1 1 12 GLN HG2 H 16.781 -1.888 6.916 1.00 . A A . 34 GLN HG2 1 1 6 1466 1 1 12 GLN HG3 H 15.954 -1.481 5.424 1.00 . A A . 34 GLN HG3 1 1 6 1467 1 1 12 GLN N N 17.784 -1.895 3.772 1.00 . A A . 34 GLN N 1 1 6 1468 1 1 12 GLN NE2 N 14.596 -3.919 7.137 1.00 . A A . 34 GLN NE2 1 1 6 1469 1 1 12 GLN O O 19.416 -4.994 4.580 1.00 . A A . 34 GLN O 1 1 6 1470 1 1 12 GLN OE1 O 13.909 -1.900 6.898 1.00 . A A . 34 GLN OE1 1 1 6 1471 1 1 13 ARG C C 20.608 -5.095 1.409 1.00 . A A . 35 ARG C 1 1 6 1472 1 1 13 ARG CA C 19.187 -5.414 1.919 1.00 . A A . 35 ARG CA 1 1 6 1473 1 1 13 ARG CB C 18.196 -5.755 0.755 1.00 . A A . 35 ARG CB 1 1 6 1474 1 1 13 ARG CD C 17.607 -7.625 -0.868 1.00 . A A . 35 ARG CD 1 1 6 1475 1 1 13 ARG CG C 18.742 -6.903 -0.142 1.00 . A A . 35 ARG CG 1 1 6 1476 1 1 13 ARG CZ C 17.015 -9.596 0.491 1.00 . A A . 35 ARG CZ 1 1 6 1477 1 1 13 ARG H H 18.062 -3.595 2.196 1.00 . A A . 35 ARG H 1 1 6 1478 1 1 13 ARG HA H 19.247 -6.257 2.587 1.00 . A A . 35 ARG HA 1 1 6 1479 1 1 13 ARG HB2 H 17.244 -6.019 1.185 1.00 . A A . 35 ARG HB2 1 1 6 1480 1 1 13 ARG HB3 H 18.064 -4.869 0.148 1.00 . A A . 35 ARG HB3 1 1 6 1481 1 1 13 ARG HD2 H 16.970 -6.895 -1.355 1.00 . A A . 35 ARG HD2 1 1 6 1482 1 1 13 ARG HD3 H 17.959 -8.295 -1.640 1.00 . A A . 35 ARG HD3 1 1 6 1483 1 1 13 ARG HE H 16.062 -7.834 0.588 1.00 . A A . 35 ARG HE 1 1 6 1484 1 1 13 ARG HG2 H 19.393 -6.470 -0.892 1.00 . A A . 35 ARG HG2 1 1 6 1485 1 1 13 ARG HG3 H 19.329 -7.600 0.440 1.00 . A A . 35 ARG HG3 1 1 6 1486 1 1 13 ARG HH11 H 18.594 -9.731 -0.718 1.00 . A A . 35 ARG HH11 1 1 6 1487 1 1 13 ARG HH12 H 18.216 -11.177 0.121 1.00 . A A . 35 ARG HH12 1 1 6 1488 1 1 13 ARG HH21 H 15.492 -9.666 1.791 1.00 . A A . 35 ARG HH21 1 1 6 1489 1 1 13 ARG HH22 H 16.383 -11.127 1.653 1.00 . A A . 35 ARG HH22 1 1 6 1490 1 1 13 ARG N N 18.586 -4.272 2.671 1.00 . A A . 35 ARG N 1 1 6 1491 1 1 13 ARG NE N 16.792 -8.343 0.172 1.00 . A A . 35 ARG NE 1 1 6 1492 1 1 13 ARG NH1 N 18.009 -10.217 -0.072 1.00 . A A . 35 ARG NH1 1 1 6 1493 1 1 13 ARG NH2 N 16.246 -10.173 1.373 1.00 . A A . 35 ARG NH2 1 1 6 1494 1 1 13 ARG O O 21.047 -5.574 0.379 1.00 . A A . 35 ARG O 1 1 6 1495 1 1 14 TYR C C 23.658 -4.910 2.462 1.00 . A A . 36 TYR C 1 1 6 1496 1 1 14 TYR CA C 22.701 -3.949 1.721 1.00 . A A . 36 TYR CA 1 1 6 1497 1 1 14 TYR CB C 22.981 -2.480 2.098 1.00 . A A . 36 TYR CB 1 1 6 1498 1 1 14 TYR CD1 C 23.674 -1.767 -0.213 1.00 . A A . 36 TYR CD1 1 1 6 1499 1 1 14 TYR CD2 C 25.277 -1.518 1.527 1.00 . A A . 36 TYR CD2 1 1 6 1500 1 1 14 TYR CE1 C 24.572 -1.256 -1.122 1.00 . A A . 36 TYR CE1 1 1 6 1501 1 1 14 TYR CE2 C 26.176 -1.006 0.613 1.00 . A A . 36 TYR CE2 1 1 6 1502 1 1 14 TYR CG C 24.015 -1.902 1.119 1.00 . A A . 36 TYR CG 1 1 6 1503 1 1 14 TYR CZ C 25.829 -0.873 -0.714 1.00 . A A . 36 TYR CZ 1 1 6 1504 1 1 14 TYR H H 20.946 -3.906 2.968 1.00 . A A . 36 TYR H 1 1 6 1505 1 1 14 TYR HA H 22.778 -4.122 0.663 1.00 . A A . 36 TYR HA 1 1 6 1506 1 1 14 TYR HB2 H 22.074 -1.897 2.034 1.00 . A A . 36 TYR HB2 1 1 6 1507 1 1 14 TYR HB3 H 23.358 -2.415 3.109 1.00 . A A . 36 TYR HB3 1 1 6 1508 1 1 14 TYR HD1 H 22.690 -2.063 -0.546 1.00 . A A . 36 TYR HD1 1 1 6 1509 1 1 14 TYR HD2 H 25.568 -1.615 2.563 1.00 . A A . 36 TYR HD2 1 1 6 1510 1 1 14 TYR HE1 H 24.289 -1.157 -2.161 1.00 . A A . 36 TYR HE1 1 1 6 1511 1 1 14 TYR HE2 H 27.164 -0.708 0.936 1.00 . A A . 36 TYR HE2 1 1 6 1512 1 1 14 TYR HH H 27.011 -1.064 -2.208 1.00 . A A . 36 TYR HH 1 1 6 1513 1 1 14 TYR N N 21.318 -4.289 2.152 1.00 . A A . 36 TYR N 1 1 6 1514 1 1 14 TYR O O 23.271 -5.630 3.359 1.00 . A A . 36 TYR O 1 1 6 1515 1 1 14 TYR OH O 26.730 -0.359 -1.619 1.00 . A A . 36 TYR OH 1 1 6 1516 1 1 15 NH2 HN1 H 25.252 -4.400 1.415 1.00 . A A . 37 NH2 HN1 1 1 6 1517 1 1 15 NH2 HN2 H 25.501 -5.589 2.615 1.00 . A A . 37 NH2 HN2 1 1 6 1518 1 1 15 NH2 N N 24.912 -4.971 2.135 1.00 . A A . 37 NH2 N 1 1 7 1519 1 1 1 ACE C C 1.603 1.189 -1.369 1.00 . A A . 23 ACE C 1 1 7 1520 1 1 1 ACE CH3 C 0.937 -0.128 -1.763 1.00 . A A . 23 ACE CH3 1 1 7 1521 1 1 1 ACE H1 H 1.301 -0.927 -1.135 1.00 . A A . 23 ACE H1 1 1 7 1522 1 1 1 ACE H2 H 1.156 -0.347 -2.798 1.00 . A A . 23 ACE H2 1 1 7 1523 1 1 1 ACE H3 H -0.132 -0.029 -1.637 1.00 . A A . 23 ACE H3 1 1 7 1524 1 1 1 ACE O O 1.385 2.204 -2.001 1.00 . A A . 23 ACE O 1 1 7 1525 1 1 2 ALA C C 4.400 2.628 -0.681 1.00 . A A . 24 ALA C 1 1 7 1526 1 1 2 ALA CA C 3.117 2.399 0.124 1.00 . A A . 24 ALA CA 1 1 7 1527 1 1 2 ALA CB C 3.426 2.223 1.623 1.00 . A A . 24 ALA CB 1 1 7 1528 1 1 2 ALA H H 2.587 0.310 0.118 1.00 . A A . 24 ALA H 1 1 7 1529 1 1 2 ALA HA H 2.476 3.256 -0.011 1.00 . A A . 24 ALA HA 1 1 7 1530 1 1 2 ALA HB1 H 3.937 3.099 1.994 1.00 . A A . 24 ALA HB1 1 1 7 1531 1 1 2 ALA HB2 H 4.067 1.365 1.779 1.00 . A A . 24 ALA HB2 1 1 7 1532 1 1 2 ALA HB3 H 2.509 2.090 2.175 1.00 . A A . 24 ALA HB3 1 1 7 1533 1 1 2 ALA N N 2.421 1.156 -0.347 1.00 . A A . 24 ALA N 1 1 7 1534 1 1 2 ALA O O 5.472 2.788 -0.130 1.00 . A A . 24 ALA O 1 1 7 1535 1 1 3 ARG C C 6.581 3.485 -2.462 1.00 . A A . 25 ARG C 1 1 7 1536 1 1 3 ARG CA C 5.287 2.845 -2.995 1.00 . A A . 25 ARG CA 1 1 7 1537 1 1 3 ARG CB C 4.694 3.725 -4.146 1.00 . A A . 25 ARG CB 1 1 7 1538 1 1 3 ARG CD C 5.198 5.147 -6.176 1.00 . A A . 25 ARG CD 1 1 7 1539 1 1 3 ARG CG C 5.792 4.137 -5.178 1.00 . A A . 25 ARG CG 1 1 7 1540 1 1 3 ARG CZ C 4.098 4.450 -8.297 1.00 . A A . 25 ARG CZ 1 1 7 1541 1 1 3 ARG H H 3.278 2.511 -2.284 1.00 . A A . 25 ARG H 1 1 7 1542 1 1 3 ARG HA H 5.546 1.876 -3.395 1.00 . A A . 25 ARG HA 1 1 7 1543 1 1 3 ARG HB2 H 3.928 3.151 -4.644 1.00 . A A . 25 ARG HB2 1 1 7 1544 1 1 3 ARG HB3 H 4.233 4.607 -3.720 1.00 . A A . 25 ARG HB3 1 1 7 1545 1 1 3 ARG HD2 H 4.731 5.971 -5.648 1.00 . A A . 25 ARG HD2 1 1 7 1546 1 1 3 ARG HD3 H 5.997 5.541 -6.783 1.00 . A A . 25 ARG HD3 1 1 7 1547 1 1 3 ARG HE H 3.491 3.915 -6.483 1.00 . A A . 25 ARG HE 1 1 7 1548 1 1 3 ARG HG2 H 6.634 4.606 -4.689 1.00 . A A . 25 ARG HG2 1 1 7 1549 1 1 3 ARG HG3 H 6.155 3.262 -5.701 1.00 . A A . 25 ARG HG3 1 1 7 1550 1 1 3 ARG HH11 H 5.692 5.639 -8.551 1.00 . A A . 25 ARG HH11 1 1 7 1551 1 1 3 ARG HH12 H 4.916 5.157 -9.997 1.00 . A A . 25 ARG HH12 1 1 7 1552 1 1 3 ARG HH21 H 2.475 3.252 -8.356 1.00 . A A . 25 ARG HH21 1 1 7 1553 1 1 3 ARG HH22 H 3.057 3.760 -9.876 1.00 . A A . 25 ARG HH22 1 1 7 1554 1 1 3 ARG N N 4.202 2.642 -1.975 1.00 . A A . 25 ARG N 1 1 7 1555 1 1 3 ARG NE N 4.156 4.429 -6.986 1.00 . A A . 25 ARG NE 1 1 7 1556 1 1 3 ARG NH1 N 4.962 5.130 -8.998 1.00 . A A . 25 ARG NH1 1 1 7 1557 1 1 3 ARG NH2 N 3.147 3.776 -8.879 1.00 . A A . 25 ARG NH2 1 1 7 1558 1 1 3 ARG O O 7.602 2.837 -2.324 1.00 . A A . 25 ARG O 1 1 7 1559 1 1 4 HIS C C 8.365 5.014 -0.421 1.00 . A A . 26 HIS C 1 1 7 1560 1 1 4 HIS CA C 7.637 5.547 -1.656 1.00 . A A . 26 HIS CA 1 1 7 1561 1 1 4 HIS CB C 7.111 6.972 -1.401 1.00 . A A . 26 HIS CB 1 1 7 1562 1 1 4 HIS CD2 C 5.334 7.779 -3.146 1.00 . A A . 26 HIS CD2 1 1 7 1563 1 1 4 HIS CE1 C 6.641 8.152 -4.663 1.00 . A A . 26 HIS CE1 1 1 7 1564 1 1 4 HIS CG C 6.620 7.504 -2.753 1.00 . A A . 26 HIS CG 1 1 7 1565 1 1 4 HIS H H 5.618 5.192 -2.315 1.00 . A A . 26 HIS H 1 1 7 1566 1 1 4 HIS HA H 8.384 5.574 -2.437 1.00 . A A . 26 HIS HA 1 1 7 1567 1 1 4 HIS HB2 H 6.298 6.976 -0.688 1.00 . A A . 26 HIS HB2 1 1 7 1568 1 1 4 HIS HB3 H 7.903 7.609 -1.033 1.00 . A A . 26 HIS HB3 1 1 7 1569 1 1 4 HIS HD1 H 8.426 7.645 -3.740 1.00 . A A . 26 HIS HD1 1 1 7 1570 1 1 4 HIS HD2 H 4.446 7.673 -2.536 1.00 . A A . 26 HIS HD2 1 1 7 1571 1 1 4 HIS HE1 H 7.013 8.445 -5.635 1.00 . A A . 26 HIS HE1 1 1 7 1572 1 1 4 HIS N N 6.481 4.753 -2.177 1.00 . A A . 26 HIS N 1 1 7 1573 1 1 4 HIS ND1 N 7.449 7.743 -3.723 1.00 . A A . 26 HIS ND1 1 1 7 1574 1 1 4 HIS NE2 N 5.361 8.197 -4.382 1.00 . A A . 26 HIS NE2 1 1 7 1575 1 1 4 HIS O O 9.270 5.667 0.062 1.00 . A A . 26 HIS O 1 1 7 1576 1 1 5 TYR C C 9.415 2.007 0.910 1.00 . A A . 27 TYR C 1 1 7 1577 1 1 5 TYR CA C 8.638 3.278 1.265 1.00 . A A . 27 TYR CA 1 1 7 1578 1 1 5 TYR CB C 7.535 2.992 2.340 1.00 . A A . 27 TYR CB 1 1 7 1579 1 1 5 TYR CD1 C 8.441 4.425 4.237 1.00 . A A . 27 TYR CD1 1 1 7 1580 1 1 5 TYR CD2 C 6.288 4.963 3.388 1.00 . A A . 27 TYR CD2 1 1 7 1581 1 1 5 TYR CE1 C 8.346 5.465 5.143 1.00 . A A . 27 TYR CE1 1 1 7 1582 1 1 5 TYR CE2 C 6.196 6.003 4.297 1.00 . A A . 27 TYR CE2 1 1 7 1583 1 1 5 TYR CG C 7.415 4.159 3.347 1.00 . A A . 27 TYR CG 1 1 7 1584 1 1 5 TYR CZ C 7.221 6.264 5.181 1.00 . A A . 27 TYR CZ 1 1 7 1585 1 1 5 TYR H H 7.228 3.400 -0.370 1.00 . A A . 27 TYR H 1 1 7 1586 1 1 5 TYR HA H 9.373 3.976 1.600 1.00 . A A . 27 TYR HA 1 1 7 1587 1 1 5 TYR HB2 H 6.579 2.857 1.852 1.00 . A A . 27 TYR HB2 1 1 7 1588 1 1 5 TYR HB3 H 7.755 2.082 2.880 1.00 . A A . 27 TYR HB3 1 1 7 1589 1 1 5 TYR HD1 H 9.331 3.811 4.226 1.00 . A A . 27 TYR HD1 1 1 7 1590 1 1 5 TYR HD2 H 5.470 4.781 2.707 1.00 . A A . 27 TYR HD2 1 1 7 1591 1 1 5 TYR HE1 H 9.164 5.649 5.826 1.00 . A A . 27 TYR HE1 1 1 7 1592 1 1 5 TYR HE2 H 5.312 6.622 4.318 1.00 . A A . 27 TYR HE2 1 1 7 1593 1 1 5 TYR HH H 7.733 7.205 6.791 1.00 . A A . 27 TYR HH 1 1 7 1594 1 1 5 TYR N N 7.974 3.868 0.065 1.00 . A A . 27 TYR N 1 1 7 1595 1 1 5 TYR O O 10.065 1.403 1.746 1.00 . A A . 27 TYR O 1 1 7 1596 1 1 5 TYR OH O 7.098 7.308 6.077 1.00 . A A . 27 TYR OH 1 1 7 1597 1 1 6 LYS C C 11.543 0.644 -0.593 1.00 . A A . 28 LYS C 1 1 7 1598 1 1 6 LYS CA C 10.043 0.421 -0.823 1.00 . A A . 28 LYS CA 1 1 7 1599 1 1 6 LYS CB C 9.774 0.188 -2.329 1.00 . A A . 28 LYS CB 1 1 7 1600 1 1 6 LYS CD C 11.222 -1.047 -4.008 1.00 . A A . 28 LYS CD 1 1 7 1601 1 1 6 LYS CE C 11.950 -2.374 -4.325 1.00 . A A . 28 LYS CE 1 1 7 1602 1 1 6 LYS CG C 10.397 -1.194 -2.722 1.00 . A A . 28 LYS CG 1 1 7 1603 1 1 6 LYS H H 8.794 2.236 -0.922 1.00 . A A . 28 LYS H 1 1 7 1604 1 1 6 LYS HA H 9.718 -0.436 -0.259 1.00 . A A . 28 LYS HA 1 1 7 1605 1 1 6 LYS HB2 H 8.708 0.153 -2.495 1.00 . A A . 28 LYS HB2 1 1 7 1606 1 1 6 LYS HB3 H 10.184 0.987 -2.931 1.00 . A A . 28 LYS HB3 1 1 7 1607 1 1 6 LYS HD2 H 10.542 -0.794 -4.807 1.00 . A A . 28 LYS HD2 1 1 7 1608 1 1 6 LYS HD3 H 11.948 -0.252 -3.906 1.00 . A A . 28 LYS HD3 1 1 7 1609 1 1 6 LYS HE2 H 11.241 -3.175 -4.470 1.00 . A A . 28 LYS HE2 1 1 7 1610 1 1 6 LYS HE3 H 12.553 -2.271 -5.218 1.00 . A A . 28 LYS HE3 1 1 7 1611 1 1 6 LYS HG2 H 11.016 -1.606 -1.938 1.00 . A A . 28 LYS HG2 1 1 7 1612 1 1 6 LYS HG3 H 9.600 -1.898 -2.918 1.00 . A A . 28 LYS HG3 1 1 7 1613 1 1 6 LYS HZ1 H 12.388 -2.899 -2.301 1.00 . A A . 28 LYS HZ1 1 1 7 1614 1 1 6 LYS N N 9.330 1.654 -0.341 1.00 . A A . 28 LYS N 1 1 7 1615 1 1 6 LYS NZ N 12.821 -2.691 -3.154 1.00 . A A . 28 LYS NZ 1 1 7 1616 1 1 6 LYS O O 12.196 -0.104 0.112 1.00 . A A . 28 LYS O 1 1 7 1617 1 1 7 ASN C C 14.069 1.760 0.255 1.00 . A A . 29 ASN C 1 1 7 1618 1 1 7 ASN CA C 13.475 2.075 -1.122 1.00 . A A . 29 ASN CA 1 1 7 1619 1 1 7 ASN CB C 13.608 3.583 -1.398 1.00 . A A . 29 ASN CB 1 1 7 1620 1 1 7 ASN CG C 13.442 3.831 -2.891 1.00 . A A . 29 ASN CG 1 1 7 1621 1 1 7 ASN H H 11.426 2.211 -1.787 1.00 . A A . 29 ASN H 1 1 7 1622 1 1 7 ASN HA H 14.025 1.519 -1.869 1.00 . A A . 29 ASN HA 1 1 7 1623 1 1 7 ASN HB2 H 12.827 4.133 -0.891 1.00 . A A . 29 ASN HB2 1 1 7 1624 1 1 7 ASN HB3 H 14.563 3.966 -1.077 1.00 . A A . 29 ASN HB3 1 1 7 1625 1 1 7 ASN HD21 H 15.392 4.105 -3.193 1.00 . A A . 29 ASN HD21 1 1 7 1626 1 1 7 ASN HD22 H 14.396 4.264 -4.563 1.00 . A A . 29 ASN HD22 1 1 7 1627 1 1 7 ASN N N 12.031 1.682 -1.225 1.00 . A A . 29 ASN N 1 1 7 1628 1 1 7 ASN ND2 N 14.502 4.088 -3.603 1.00 . A A . 29 ASN ND2 1 1 7 1629 1 1 7 ASN O O 15.100 1.130 0.374 1.00 . A A . 29 ASN O 1 1 7 1630 1 1 7 ASN OD1 O 12.351 3.790 -3.421 1.00 . A A . 29 ASN OD1 1 1 7 1631 1 1 8 LEU C C 13.972 0.530 2.965 1.00 . A A . 30 LEU C 1 1 7 1632 1 1 8 LEU CA C 13.805 2.011 2.665 1.00 . A A . 30 LEU CA 1 1 7 1633 1 1 8 LEU CB C 12.769 2.620 3.640 1.00 . A A . 30 LEU CB 1 1 7 1634 1 1 8 LEU CD1 C 14.223 4.593 4.374 1.00 . A A . 30 LEU CD1 1 1 7 1635 1 1 8 LEU CD2 C 12.777 4.820 2.316 1.00 . A A . 30 LEU CD2 1 1 7 1636 1 1 8 LEU CG C 12.876 4.174 3.717 1.00 . A A . 30 LEU CG 1 1 7 1637 1 1 8 LEU H H 12.534 2.713 1.070 1.00 . A A . 30 LEU H 1 1 7 1638 1 1 8 LEU HA H 14.757 2.495 2.796 1.00 . A A . 30 LEU HA 1 1 7 1639 1 1 8 LEU HB2 H 11.770 2.334 3.337 1.00 . A A . 30 LEU HB2 1 1 7 1640 1 1 8 LEU HB3 H 12.940 2.210 4.628 1.00 . A A . 30 LEU HB3 1 1 7 1641 1 1 8 LEU HD11 H 14.263 5.670 4.457 1.00 . A A . 30 LEU HD11 1 1 7 1642 1 1 8 LEU HD12 H 15.078 4.267 3.801 1.00 . A A . 30 LEU HD12 1 1 7 1643 1 1 8 LEU HD13 H 14.298 4.176 5.370 1.00 . A A . 30 LEU HD13 1 1 7 1644 1 1 8 LEU HD21 H 11.837 4.564 1.851 1.00 . A A . 30 LEU HD21 1 1 7 1645 1 1 8 LEU HD22 H 13.590 4.506 1.677 1.00 . A A . 30 LEU HD22 1 1 7 1646 1 1 8 LEU HD23 H 12.825 5.897 2.406 1.00 . A A . 30 LEU HD23 1 1 7 1647 1 1 8 LEU HG H 12.067 4.539 4.334 1.00 . A A . 30 LEU HG 1 1 7 1648 1 1 8 LEU N N 13.365 2.226 1.255 1.00 . A A . 30 LEU N 1 1 7 1649 1 1 8 LEU O O 14.975 0.134 3.526 1.00 . A A . 30 LEU O 1 1 7 1650 1 1 9 ILE C C 14.344 -2.231 2.148 1.00 . A A . 31 ILE C 1 1 7 1651 1 1 9 ILE CA C 13.077 -1.719 2.837 1.00 . A A . 31 ILE CA 1 1 7 1652 1 1 9 ILE CB C 11.814 -2.429 2.258 1.00 . A A . 31 ILE CB 1 1 7 1653 1 1 9 ILE CD1 C 10.434 -1.745 4.333 1.00 . A A . 31 ILE CD1 1 1 7 1654 1 1 9 ILE CG1 C 10.487 -1.796 2.788 1.00 . A A . 31 ILE CG1 1 1 7 1655 1 1 9 ILE CG2 C 11.843 -3.936 2.635 1.00 . A A . 31 ILE CG2 1 1 7 1656 1 1 9 ILE H H 12.211 0.133 2.120 1.00 . A A . 31 ILE H 1 1 7 1657 1 1 9 ILE HA H 13.189 -1.870 3.892 1.00 . A A . 31 ILE HA 1 1 7 1658 1 1 9 ILE HB H 11.827 -2.337 1.178 1.00 . A A . 31 ILE HB 1 1 7 1659 1 1 9 ILE HD11 H 11.231 -1.127 4.722 1.00 . A A . 31 ILE HD11 1 1 7 1660 1 1 9 ILE HD12 H 10.526 -2.737 4.750 1.00 . A A . 31 ILE HD12 1 1 7 1661 1 1 9 ILE HD13 H 9.489 -1.325 4.649 1.00 . A A . 31 ILE HD13 1 1 7 1662 1 1 9 ILE HG12 H 10.385 -0.797 2.395 1.00 . A A . 31 ILE HG12 1 1 7 1663 1 1 9 ILE HG13 H 9.643 -2.374 2.433 1.00 . A A . 31 ILE HG13 1 1 7 1664 1 1 9 ILE HG21 H 10.969 -4.432 2.239 1.00 . A A . 31 ILE HG21 1 1 7 1665 1 1 9 ILE HG22 H 11.857 -4.058 3.708 1.00 . A A . 31 ILE HG22 1 1 7 1666 1 1 9 ILE HG23 H 12.722 -4.415 2.230 1.00 . A A . 31 ILE HG23 1 1 7 1667 1 1 9 ILE N N 12.995 -0.248 2.582 1.00 . A A . 31 ILE N 1 1 7 1668 1 1 9 ILE O O 15.069 -3.085 2.629 1.00 . A A . 31 ILE O 1 1 7 1669 1 1 10 GLU C C 17.005 -1.222 0.571 1.00 . A A . 32 GLU C 1 1 7 1670 1 1 10 GLU CA C 15.766 -2.022 0.186 1.00 . A A . 32 GLU CA 1 1 7 1671 1 1 10 GLU CB C 15.450 -1.791 -1.311 1.00 . A A . 32 GLU CB 1 1 7 1672 1 1 10 GLU CD C 14.126 -2.701 -3.232 1.00 . A A . 32 GLU CD 1 1 7 1673 1 1 10 GLU CG C 14.790 -3.050 -1.912 1.00 . A A . 32 GLU CG 1 1 7 1674 1 1 10 GLU H H 13.923 -0.959 0.735 1.00 . A A . 32 GLU H 1 1 7 1675 1 1 10 GLU HA H 15.987 -3.059 0.383 1.00 . A A . 32 GLU HA 1 1 7 1676 1 1 10 GLU HB2 H 14.787 -0.942 -1.418 1.00 . A A . 32 GLU HB2 1 1 7 1677 1 1 10 GLU HB3 H 16.356 -1.577 -1.861 1.00 . A A . 32 GLU HB3 1 1 7 1678 1 1 10 GLU HG2 H 15.531 -3.802 -2.127 1.00 . A A . 32 GLU HG2 1 1 7 1679 1 1 10 GLU HG3 H 14.045 -3.460 -1.246 1.00 . A A . 32 GLU HG3 1 1 7 1680 1 1 10 GLU N N 14.571 -1.649 1.006 1.00 . A A . 32 GLU N 1 1 7 1681 1 1 10 GLU O O 18.018 -1.313 -0.090 1.00 . A A . 32 GLU O 1 1 7 1682 1 1 10 GLU OE1 O 14.769 -2.452 -4.235 1.00 . A A . 32 GLU OE1 1 1 7 1683 1 1 11 ARG C C 18.707 -0.367 3.286 1.00 . A A . 33 ARG C 1 1 7 1684 1 1 11 ARG CA C 18.045 0.359 2.109 1.00 . A A . 33 ARG CA 1 1 7 1685 1 1 11 ARG CB C 17.533 1.766 2.564 1.00 . A A . 33 ARG CB 1 1 7 1686 1 1 11 ARG CD C 19.556 3.158 1.775 1.00 . A A . 33 ARG CD 1 1 7 1687 1 1 11 ARG CG C 18.727 2.684 3.001 1.00 . A A . 33 ARG CG 1 1 7 1688 1 1 11 ARG CZ C 21.531 4.637 2.203 1.00 . A A . 33 ARG CZ 1 1 7 1689 1 1 11 ARG H H 16.028 -0.449 2.093 1.00 . A A . 33 ARG H 1 1 7 1690 1 1 11 ARG HA H 18.768 0.436 1.314 1.00 . A A . 33 ARG HA 1 1 7 1691 1 1 11 ARG HB2 H 16.979 2.220 1.754 1.00 . A A . 33 ARG HB2 1 1 7 1692 1 1 11 ARG HB3 H 16.860 1.649 3.401 1.00 . A A . 33 ARG HB3 1 1 7 1693 1 1 11 ARG HD2 H 19.604 2.385 1.019 1.00 . A A . 33 ARG HD2 1 1 7 1694 1 1 11 ARG HD3 H 19.088 4.024 1.335 1.00 . A A . 33 ARG HD3 1 1 7 1695 1 1 11 ARG HE H 21.462 2.682 2.592 1.00 . A A . 33 ARG HE 1 1 7 1696 1 1 11 ARG HG2 H 18.326 3.548 3.514 1.00 . A A . 33 ARG HG2 1 1 7 1697 1 1 11 ARG HG3 H 19.355 2.153 3.701 1.00 . A A . 33 ARG HG3 1 1 7 1698 1 1 11 ARG HH11 H 19.945 5.600 1.429 1.00 . A A . 33 ARG HH11 1 1 7 1699 1 1 11 ARG HH12 H 21.317 6.576 1.722 1.00 . A A . 33 ARG HH12 1 1 7 1700 1 1 11 ARG HH21 H 23.257 3.958 2.976 1.00 . A A . 33 ARG HH21 1 1 7 1701 1 1 11 ARG HH22 H 23.243 5.629 2.619 1.00 . A A . 33 ARG HH22 1 1 7 1702 1 1 11 ARG N N 16.891 -0.468 1.628 1.00 . A A . 33 ARG N 1 1 7 1703 1 1 11 ARG NE N 20.959 3.455 2.244 1.00 . A A . 33 ARG NE 1 1 7 1704 1 1 11 ARG NH1 N 20.883 5.675 1.752 1.00 . A A . 33 ARG NH1 1 1 7 1705 1 1 11 ARG NH2 N 22.759 4.753 2.627 1.00 . A A . 33 ARG NH2 1 1 7 1706 1 1 11 ARG O O 19.896 -0.248 3.498 1.00 . A A . 33 ARG O 1 1 7 1707 1 1 12 GLN C C 18.886 -3.289 4.818 1.00 . A A . 34 GLN C 1 1 7 1708 1 1 12 GLN CA C 18.436 -1.858 5.207 1.00 . A A . 34 GLN CA 1 1 7 1709 1 1 12 GLN CB C 17.309 -1.921 6.306 1.00 . A A . 34 GLN CB 1 1 7 1710 1 1 12 GLN CD C 18.933 -2.600 8.215 1.00 . A A . 34 GLN CD 1 1 7 1711 1 1 12 GLN CG C 17.842 -1.621 7.756 1.00 . A A . 34 GLN CG 1 1 7 1712 1 1 12 GLN H H 16.956 -1.124 3.765 1.00 . A A . 34 GLN H 1 1 7 1713 1 1 12 GLN HA H 19.303 -1.339 5.594 1.00 . A A . 34 GLN HA 1 1 7 1714 1 1 12 GLN HB2 H 16.553 -1.181 6.082 1.00 . A A . 34 GLN HB2 1 1 7 1715 1 1 12 GLN HB3 H 16.834 -2.892 6.306 1.00 . A A . 34 GLN HB3 1 1 7 1716 1 1 12 GLN HE21 H 17.783 -3.617 9.483 1.00 . A A . 34 GLN HE21 1 1 7 1717 1 1 12 GLN HE22 H 19.405 -4.121 9.365 1.00 . A A . 34 GLN HE22 1 1 7 1718 1 1 12 GLN HG2 H 18.268 -0.627 7.780 1.00 . A A . 34 GLN HG2 1 1 7 1719 1 1 12 GLN HG3 H 17.032 -1.646 8.470 1.00 . A A . 34 GLN HG3 1 1 7 1720 1 1 12 GLN N N 17.905 -1.096 4.017 1.00 . A A . 34 GLN N 1 1 7 1721 1 1 12 GLN NE2 N 18.677 -3.522 9.097 1.00 . A A . 34 GLN NE2 1 1 7 1722 1 1 12 GLN O O 19.758 -3.866 5.431 1.00 . A A . 34 GLN O 1 1 7 1723 1 1 12 GLN OE1 O 20.058 -2.539 7.773 1.00 . A A . 34 GLN OE1 1 1 7 1724 1 1 13 ARG C C 19.785 -5.333 2.335 1.00 . A A . 35 ARG C 1 1 7 1725 1 1 13 ARG CA C 18.670 -5.248 3.381 1.00 . A A . 35 ARG CA 1 1 7 1726 1 1 13 ARG CB C 17.364 -5.959 2.875 1.00 . A A . 35 ARG CB 1 1 7 1727 1 1 13 ARG CD C 18.006 -8.464 3.376 1.00 . A A . 35 ARG CD 1 1 7 1728 1 1 13 ARG CG C 17.521 -7.426 2.305 1.00 . A A . 35 ARG CG 1 1 7 1729 1 1 13 ARG CZ C 20.363 -9.272 3.648 1.00 . A A . 35 ARG CZ 1 1 7 1730 1 1 13 ARG H H 17.580 -3.363 3.324 1.00 . A A . 35 ARG H 1 1 7 1731 1 1 13 ARG HA H 19.038 -5.726 4.258 1.00 . A A . 35 ARG HA 1 1 7 1732 1 1 13 ARG HB2 H 16.670 -6.006 3.705 1.00 . A A . 35 ARG HB2 1 1 7 1733 1 1 13 ARG HB3 H 16.908 -5.346 2.112 1.00 . A A . 35 ARG HB3 1 1 7 1734 1 1 13 ARG HD2 H 17.544 -8.290 4.338 1.00 . A A . 35 ARG HD2 1 1 7 1735 1 1 13 ARG HD3 H 17.753 -9.454 3.020 1.00 . A A . 35 ARG HD3 1 1 7 1736 1 1 13 ARG HE H 19.844 -7.411 3.393 1.00 . A A . 35 ARG HE 1 1 7 1737 1 1 13 ARG HG2 H 16.563 -7.741 1.911 1.00 . A A . 35 ARG HG2 1 1 7 1738 1 1 13 ARG HG3 H 18.215 -7.411 1.475 1.00 . A A . 35 ARG HG3 1 1 7 1739 1 1 13 ARG HH11 H 19.000 -10.727 3.787 1.00 . A A . 35 ARG HH11 1 1 7 1740 1 1 13 ARG HH12 H 20.626 -11.248 3.931 1.00 . A A . 35 ARG HH12 1 1 7 1741 1 1 13 ARG HH21 H 21.878 -7.958 3.526 1.00 . A A . 35 ARG HH21 1 1 7 1742 1 1 13 ARG HH22 H 22.350 -9.576 3.812 1.00 . A A . 35 ARG HH22 1 1 7 1743 1 1 13 ARG N N 18.280 -3.854 3.799 1.00 . A A . 35 ARG N 1 1 7 1744 1 1 13 ARG NE N 19.492 -8.315 3.482 1.00 . A A . 35 ARG NE 1 1 7 1745 1 1 13 ARG NH1 N 19.971 -10.505 3.799 1.00 . A A . 35 ARG NH1 1 1 7 1746 1 1 13 ARG NH2 N 21.617 -8.917 3.665 1.00 . A A . 35 ARG NH2 1 1 7 1747 1 1 13 ARG O O 20.526 -6.298 2.289 1.00 . A A . 35 ARG O 1 1 7 1748 1 1 14 TYR C C 22.048 -3.347 0.858 1.00 . A A . 36 TYR C 1 1 7 1749 1 1 14 TYR CA C 20.942 -4.324 0.478 1.00 . A A . 36 TYR CA 1 1 7 1750 1 1 14 TYR CB C 20.315 -3.903 -0.875 1.00 . A A . 36 TYR CB 1 1 7 1751 1 1 14 TYR CD1 C 17.931 -4.721 -0.461 1.00 . A A . 36 TYR CD1 1 1 7 1752 1 1 14 TYR CD2 C 19.071 -5.545 -2.369 1.00 . A A . 36 TYR CD2 1 1 7 1753 1 1 14 TYR CE1 C 16.823 -5.468 -0.794 1.00 . A A . 36 TYR CE1 1 1 7 1754 1 1 14 TYR CE2 C 17.960 -6.290 -2.703 1.00 . A A . 36 TYR CE2 1 1 7 1755 1 1 14 TYR CG C 19.071 -4.748 -1.241 1.00 . A A . 36 TYR CG 1 1 7 1756 1 1 14 TYR CZ C 16.829 -6.254 -1.917 1.00 . A A . 36 TYR CZ 1 1 7 1757 1 1 14 TYR H H 19.299 -3.573 1.656 1.00 . A A . 36 TYR H 1 1 7 1758 1 1 14 TYR HA H 21.354 -5.314 0.406 1.00 . A A . 36 TYR HA 1 1 7 1759 1 1 14 TYR HB2 H 20.033 -2.860 -0.860 1.00 . A A . 36 TYR HB2 1 1 7 1760 1 1 14 TYR HB3 H 21.059 -4.035 -1.647 1.00 . A A . 36 TYR HB3 1 1 7 1761 1 1 14 TYR HD1 H 17.899 -4.107 0.422 1.00 . A A . 36 TYR HD1 1 1 7 1762 1 1 14 TYR HD2 H 19.948 -5.591 -3.001 1.00 . A A . 36 TYR HD2 1 1 7 1763 1 1 14 TYR HE1 H 15.941 -5.440 -0.169 1.00 . A A . 36 TYR HE1 1 1 7 1764 1 1 14 TYR HE2 H 17.983 -6.905 -3.591 1.00 . A A . 36 TYR HE2 1 1 7 1765 1 1 14 TYR HH H 15.876 -7.506 -3.026 1.00 . A A . 36 TYR HH 1 1 7 1766 1 1 14 TYR N N 19.895 -4.324 1.536 1.00 . A A . 36 TYR N 1 1 7 1767 1 1 14 TYR O O 21.884 -2.509 1.716 1.00 . A A . 36 TYR O 1 1 7 1768 1 1 14 TYR OH O 15.704 -6.984 -2.235 1.00 . A A . 36 TYR OH 1 1 7 1769 1 1 15 NH2 HN1 H 23.361 -4.069 -0.449 1.00 . A A . 37 NH2 HN1 1 1 7 1770 1 1 15 NH2 HN2 H 23.885 -2.763 0.503 1.00 . A A . 37 NH2 HN2 1 1 7 1771 1 1 15 NH2 N N 23.193 -3.404 0.248 1.00 . A A . 37 NH2 N 1 1 8 1772 1 1 1 ACE C C 2.737 0.069 -2.676 1.00 . A A . 23 ACE C 1 1 8 1773 1 1 1 ACE CH3 C 2.157 -1.309 -2.985 1.00 . A A . 23 ACE CH3 1 1 8 1774 1 1 1 ACE H1 H 1.101 -1.207 -3.198 1.00 . A A . 23 ACE H1 1 1 8 1775 1 1 1 ACE H2 H 2.283 -1.962 -2.134 1.00 . A A . 23 ACE H2 1 1 8 1776 1 1 1 ACE H3 H 2.662 -1.724 -3.845 1.00 . A A . 23 ACE H3 1 1 8 1777 1 1 1 ACE O O 2.735 0.945 -3.521 1.00 . A A . 23 ACE O 1 1 8 1778 1 1 2 ALA C C 5.260 1.747 -1.658 1.00 . A A . 24 ALA C 1 1 8 1779 1 1 2 ALA CA C 3.820 1.593 -1.131 1.00 . A A . 24 ALA CA 1 1 8 1780 1 1 2 ALA CB C 3.786 1.733 0.401 1.00 . A A . 24 ALA CB 1 1 8 1781 1 1 2 ALA H H 3.251 -0.478 -0.832 1.00 . A A . 24 ALA H 1 1 8 1782 1 1 2 ALA HA H 3.209 2.368 -1.575 1.00 . A A . 24 ALA HA 1 1 8 1783 1 1 2 ALA HB1 H 2.774 1.654 0.768 1.00 . A A . 24 ALA HB1 1 1 8 1784 1 1 2 ALA HB2 H 4.187 2.691 0.695 1.00 . A A . 24 ALA HB2 1 1 8 1785 1 1 2 ALA HB3 H 4.387 0.961 0.858 1.00 . A A . 24 ALA HB3 1 1 8 1786 1 1 2 ALA N N 3.245 0.254 -1.486 1.00 . A A . 24 ALA N 1 1 8 1787 1 1 2 ALA O O 6.191 2.015 -0.923 1.00 . A A . 24 ALA O 1 1 8 1788 1 1 3 ARG C C 7.597 2.836 -3.094 1.00 . A A . 25 ARG C 1 1 8 1789 1 1 3 ARG CA C 6.721 1.684 -3.629 1.00 . A A . 25 ARG CA 1 1 8 1790 1 1 3 ARG CB C 6.480 1.866 -5.159 1.00 . A A . 25 ARG CB 1 1 8 1791 1 1 3 ARG CD C 5.328 3.168 -7.013 1.00 . A A . 25 ARG CD 1 1 8 1792 1 1 3 ARG CG C 5.529 3.064 -5.486 1.00 . A A . 25 ARG CG 1 1 8 1793 1 1 3 ARG CZ C 6.953 4.483 -8.381 1.00 . A A . 25 ARG CZ 1 1 8 1794 1 1 3 ARG H H 4.588 1.348 -3.464 1.00 . A A . 25 ARG H 1 1 8 1795 1 1 3 ARG HA H 7.259 0.759 -3.466 1.00 . A A . 25 ARG HA 1 1 8 1796 1 1 3 ARG HB2 H 7.442 2.019 -5.623 1.00 . A A . 25 ARG HB2 1 1 8 1797 1 1 3 ARG HB3 H 6.059 0.950 -5.550 1.00 . A A . 25 ARG HB3 1 1 8 1798 1 1 3 ARG HD2 H 4.933 2.239 -7.408 1.00 . A A . 25 ARG HD2 1 1 8 1799 1 1 3 ARG HD3 H 4.615 3.948 -7.224 1.00 . A A . 25 ARG HD3 1 1 8 1800 1 1 3 ARG HE H 7.374 2.768 -7.465 1.00 . A A . 25 ARG HE 1 1 8 1801 1 1 3 ARG HG2 H 4.570 2.919 -5.008 1.00 . A A . 25 ARG HG2 1 1 8 1802 1 1 3 ARG HG3 H 5.947 3.999 -5.144 1.00 . A A . 25 ARG HG3 1 1 8 1803 1 1 3 ARG HH11 H 5.134 5.306 -8.263 1.00 . A A . 25 ARG HH11 1 1 8 1804 1 1 3 ARG HH12 H 6.256 6.192 -9.196 1.00 . A A . 25 ARG HH12 1 1 8 1805 1 1 3 ARG HH21 H 8.863 3.912 -8.679 1.00 . A A . 25 ARG HH21 1 1 8 1806 1 1 3 ARG HH22 H 8.412 5.372 -9.434 1.00 . A A . 25 ARG HH22 1 1 8 1807 1 1 3 ARG N N 5.393 1.566 -2.945 1.00 . A A . 25 ARG N 1 1 8 1808 1 1 3 ARG NE N 6.675 3.436 -7.637 1.00 . A A . 25 ARG NE 1 1 8 1809 1 1 3 ARG NH1 N 6.053 5.392 -8.632 1.00 . A A . 25 ARG NH1 1 1 8 1810 1 1 3 ARG NH2 N 8.156 4.595 -8.863 1.00 . A A . 25 ARG NH2 1 1 8 1811 1 1 3 ARG O O 8.762 2.665 -2.786 1.00 . A A . 25 ARG O 1 1 8 1812 1 1 4 HIS C C 8.270 5.119 -1.076 1.00 . A A . 26 HIS C 1 1 8 1813 1 1 4 HIS CA C 7.715 5.205 -2.494 1.00 . A A . 26 HIS CA 1 1 8 1814 1 1 4 HIS CB C 6.748 6.408 -2.620 1.00 . A A . 26 HIS CB 1 1 8 1815 1 1 4 HIS CD2 C 4.974 5.122 -1.140 1.00 . A A . 26 HIS CD2 1 1 8 1816 1 1 4 HIS CE1 C 3.404 6.332 -1.567 1.00 . A A . 26 HIS CE1 1 1 8 1817 1 1 4 HIS CG C 5.368 6.125 -1.999 1.00 . A A . 26 HIS CG 1 1 8 1818 1 1 4 HIS H H 6.046 4.047 -3.241 1.00 . A A . 26 HIS H 1 1 8 1819 1 1 4 HIS HA H 8.577 5.337 -3.127 1.00 . A A . 26 HIS HA 1 1 8 1820 1 1 4 HIS HB2 H 7.181 7.259 -2.110 1.00 . A A . 26 HIS HB2 1 1 8 1821 1 1 4 HIS HB3 H 6.620 6.668 -3.659 1.00 . A A . 26 HIS HB3 1 1 8 1822 1 1 4 HIS HD1 H 4.309 7.691 -2.836 1.00 . A A . 26 HIS HD1 1 1 8 1823 1 1 4 HIS HD2 H 5.595 4.341 -0.739 1.00 . A A . 26 HIS HD2 1 1 8 1824 1 1 4 HIS HE1 H 2.399 6.728 -1.564 1.00 . A A . 26 HIS HE1 1 1 8 1825 1 1 4 HIS N N 6.992 3.987 -2.991 1.00 . A A . 26 HIS N 1 1 8 1826 1 1 4 HIS ND1 N 4.354 6.894 -2.265 1.00 . A A . 26 HIS ND1 1 1 8 1827 1 1 4 HIS NE2 N 3.707 5.267 -0.871 1.00 . A A . 26 HIS NE2 1 1 8 1828 1 1 4 HIS O O 9.020 5.973 -0.645 1.00 . A A . 26 HIS O 1 1 8 1829 1 1 5 TYR C C 9.017 2.476 1.042 1.00 . A A . 27 TYR C 1 1 8 1830 1 1 5 TYR CA C 8.313 3.829 0.989 1.00 . A A . 27 TYR CA 1 1 8 1831 1 1 5 TYR CB C 7.090 3.827 1.910 1.00 . A A . 27 TYR CB 1 1 8 1832 1 1 5 TYR CD1 C 7.586 6.094 2.933 1.00 . A A . 27 TYR CD1 1 1 8 1833 1 1 5 TYR CD2 C 5.423 5.773 2.011 1.00 . A A . 27 TYR CD2 1 1 8 1834 1 1 5 TYR CE1 C 7.248 7.383 3.286 1.00 . A A . 27 TYR CE1 1 1 8 1835 1 1 5 TYR CE2 C 5.086 7.068 2.367 1.00 . A A . 27 TYR CE2 1 1 8 1836 1 1 5 TYR CG C 6.681 5.268 2.291 1.00 . A A . 27 TYR CG 1 1 8 1837 1 1 5 TYR CZ C 5.998 7.880 3.007 1.00 . A A . 27 TYR CZ 1 1 8 1838 1 1 5 TYR H H 7.266 3.453 -0.839 1.00 . A A . 27 TYR H 1 1 8 1839 1 1 5 TYR HA H 9.027 4.585 1.279 1.00 . A A . 27 TYR HA 1 1 8 1840 1 1 5 TYR HB2 H 6.262 3.319 1.438 1.00 . A A . 27 TYR HB2 1 1 8 1841 1 1 5 TYR HB3 H 7.366 3.272 2.785 1.00 . A A . 27 TYR HB3 1 1 8 1842 1 1 5 TYR HD1 H 8.574 5.731 3.166 1.00 . A A . 27 TYR HD1 1 1 8 1843 1 1 5 TYR HD2 H 4.688 5.158 1.513 1.00 . A A . 27 TYR HD2 1 1 8 1844 1 1 5 TYR HE1 H 7.974 8.007 3.784 1.00 . A A . 27 TYR HE1 1 1 8 1845 1 1 5 TYR HE2 H 4.101 7.448 2.140 1.00 . A A . 27 TYR HE2 1 1 8 1846 1 1 5 TYR HH H 5.203 9.144 4.208 1.00 . A A . 27 TYR HH 1 1 8 1847 1 1 5 TYR N N 7.872 4.084 -0.406 1.00 . A A . 27 TYR N 1 1 8 1848 1 1 5 TYR O O 9.256 1.925 2.097 1.00 . A A . 27 TYR O 1 1 8 1849 1 1 5 TYR OH O 5.671 9.170 3.368 1.00 . A A . 27 TYR OH 1 1 8 1850 1 1 6 LYS C C 11.468 0.960 0.194 1.00 . A A . 28 LYS C 1 1 8 1851 1 1 6 LYS CA C 10.033 0.685 -0.256 1.00 . A A . 28 LYS CA 1 1 8 1852 1 1 6 LYS CB C 9.970 0.219 -1.738 1.00 . A A . 28 LYS CB 1 1 8 1853 1 1 6 LYS CD C 10.646 -1.632 -3.346 1.00 . A A . 28 LYS CD 1 1 8 1854 1 1 6 LYS CE C 11.422 -2.980 -3.497 1.00 . A A . 28 LYS CE 1 1 8 1855 1 1 6 LYS CG C 10.511 -1.229 -1.853 1.00 . A A . 28 LYS CG 1 1 8 1856 1 1 6 LYS H H 9.099 2.522 -0.914 1.00 . A A . 28 LYS H 1 1 8 1857 1 1 6 LYS HA H 9.584 -0.042 0.398 1.00 . A A . 28 LYS HA 1 1 8 1858 1 1 6 LYS HB2 H 8.943 0.231 -2.071 1.00 . A A . 28 LYS HB2 1 1 8 1859 1 1 6 LYS HB3 H 10.538 0.883 -2.373 1.00 . A A . 28 LYS HB3 1 1 8 1860 1 1 6 LYS HD2 H 9.658 -1.759 -3.772 1.00 . A A . 28 LYS HD2 1 1 8 1861 1 1 6 LYS HD3 H 11.148 -0.842 -3.882 1.00 . A A . 28 LYS HD3 1 1 8 1862 1 1 6 LYS HE2 H 10.786 -3.831 -3.293 1.00 . A A . 28 LYS HE2 1 1 8 1863 1 1 6 LYS HE3 H 11.810 -3.072 -4.503 1.00 . A A . 28 LYS HE3 1 1 8 1864 1 1 6 LYS HG2 H 11.472 -1.278 -1.374 1.00 . A A . 28 LYS HG2 1 1 8 1865 1 1 6 LYS HG3 H 9.846 -1.919 -1.352 1.00 . A A . 28 LYS HG3 1 1 8 1866 1 1 6 LYS HZ1 H 12.328 -3.025 -1.580 1.00 . A A . 28 LYS HZ1 1 1 8 1867 1 1 6 LYS N N 9.336 1.995 -0.126 1.00 . A A . 28 LYS N 1 1 8 1868 1 1 6 LYS NZ N 12.556 -2.949 -2.528 1.00 . A A . 28 LYS NZ 1 1 8 1869 1 1 6 LYS O O 11.983 0.251 1.037 1.00 . A A . 28 LYS O 1 1 8 1870 1 1 7 ASN C C 13.841 2.011 1.430 1.00 . A A . 29 ASN C 1 1 8 1871 1 1 7 ASN CA C 13.492 2.370 -0.026 1.00 . A A . 29 ASN CA 1 1 8 1872 1 1 7 ASN CB C 13.660 3.910 -0.250 1.00 . A A . 29 ASN CB 1 1 8 1873 1 1 7 ASN CG C 14.981 4.398 0.379 1.00 . A A . 29 ASN CG 1 1 8 1874 1 1 7 ASN H H 11.562 2.481 -1.046 1.00 . A A . 29 ASN H 1 1 8 1875 1 1 7 ASN HA H 14.173 1.835 -0.673 1.00 . A A . 29 ASN HA 1 1 8 1876 1 1 7 ASN HB2 H 13.695 4.127 -1.310 1.00 . A A . 29 ASN HB2 1 1 8 1877 1 1 7 ASN HB3 H 12.838 4.458 0.185 1.00 . A A . 29 ASN HB3 1 1 8 1878 1 1 7 ASN HD21 H 14.173 5.912 1.402 1.00 . A A . 29 ASN HD21 1 1 8 1879 1 1 7 ASN HD22 H 15.851 5.721 1.552 1.00 . A A . 29 ASN HD22 1 1 8 1880 1 1 7 ASN N N 12.073 1.978 -0.376 1.00 . A A . 29 ASN N 1 1 8 1881 1 1 7 ASN ND2 N 14.995 5.429 1.177 1.00 . A A . 29 ASN ND2 1 1 8 1882 1 1 7 ASN O O 14.638 1.134 1.698 1.00 . A A . 29 ASN O 1 1 8 1883 1 1 7 ASN OD1 O 16.035 3.844 0.155 1.00 . A A . 29 ASN OD1 1 1 8 1884 1 1 8 LEU C C 13.693 1.152 4.230 1.00 . A A . 30 LEU C 1 1 8 1885 1 1 8 LEU CA C 13.359 2.581 3.787 1.00 . A A . 30 LEU CA 1 1 8 1886 1 1 8 LEU CB C 12.053 3.009 4.503 1.00 . A A . 30 LEU CB 1 1 8 1887 1 1 8 LEU CD1 C 10.347 4.778 5.007 1.00 . A A . 30 LEU CD1 1 1 8 1888 1 1 8 LEU CD2 C 12.743 5.468 4.684 1.00 . A A . 30 LEU CD2 1 1 8 1889 1 1 8 LEU CG C 11.643 4.483 4.213 1.00 . A A . 30 LEU CG 1 1 8 1890 1 1 8 LEU H H 12.580 3.410 1.972 1.00 . A A . 30 LEU H 1 1 8 1891 1 1 8 LEU HA H 14.179 3.207 4.103 1.00 . A A . 30 LEU HA 1 1 8 1892 1 1 8 LEU HB2 H 11.250 2.351 4.202 1.00 . A A . 30 LEU HB2 1 1 8 1893 1 1 8 LEU HB3 H 12.200 2.884 5.569 1.00 . A A . 30 LEU HB3 1 1 8 1894 1 1 8 LEU HD11 H 9.550 4.118 4.695 1.00 . A A . 30 LEU HD11 1 1 8 1895 1 1 8 LEU HD12 H 10.034 5.799 4.850 1.00 . A A . 30 LEU HD12 1 1 8 1896 1 1 8 LEU HD13 H 10.510 4.635 6.065 1.00 . A A . 30 LEU HD13 1 1 8 1897 1 1 8 LEU HD21 H 13.674 5.292 4.166 1.00 . A A . 30 LEU HD21 1 1 8 1898 1 1 8 LEU HD22 H 12.913 5.367 5.747 1.00 . A A . 30 LEU HD22 1 1 8 1899 1 1 8 LEU HD23 H 12.429 6.483 4.485 1.00 . A A . 30 LEU HD23 1 1 8 1900 1 1 8 LEU HG H 11.442 4.620 3.160 1.00 . A A . 30 LEU HG 1 1 8 1901 1 1 8 LEU N N 13.201 2.735 2.308 1.00 . A A . 30 LEU N 1 1 8 1902 1 1 8 LEU O O 14.604 0.928 5.006 1.00 . A A . 30 LEU O 1 1 8 1903 1 1 9 ILE C C 13.976 -1.939 3.017 1.00 . A A . 31 ILE C 1 1 8 1904 1 1 9 ILE CA C 13.109 -1.207 4.035 1.00 . A A . 31 ILE CA 1 1 8 1905 1 1 9 ILE CB C 11.710 -1.899 4.104 1.00 . A A . 31 ILE CB 1 1 8 1906 1 1 9 ILE CD1 C 9.313 -1.676 4.964 1.00 . A A . 31 ILE CD1 1 1 8 1907 1 1 9 ILE CG1 C 10.700 -1.002 4.899 1.00 . A A . 31 ILE CG1 1 1 8 1908 1 1 9 ILE CG2 C 11.871 -3.270 4.827 1.00 . A A . 31 ILE CG2 1 1 8 1909 1 1 9 ILE H H 12.228 0.510 3.057 1.00 . A A . 31 ILE H 1 1 8 1910 1 1 9 ILE HA H 13.617 -1.268 4.975 1.00 . A A . 31 ILE HA 1 1 8 1911 1 1 9 ILE HB H 11.338 -2.063 3.100 1.00 . A A . 31 ILE HB 1 1 8 1912 1 1 9 ILE HD11 H 8.614 -1.033 5.477 1.00 . A A . 31 ILE HD11 1 1 8 1913 1 1 9 ILE HD12 H 9.361 -2.614 5.495 1.00 . A A . 31 ILE HD12 1 1 8 1914 1 1 9 ILE HD13 H 8.944 -1.859 3.966 1.00 . A A . 31 ILE HD13 1 1 8 1915 1 1 9 ILE HG12 H 11.069 -0.823 5.900 1.00 . A A . 31 ILE HG12 1 1 8 1916 1 1 9 ILE HG13 H 10.587 -0.051 4.400 1.00 . A A . 31 ILE HG13 1 1 8 1917 1 1 9 ILE HG21 H 12.571 -3.896 4.293 1.00 . A A . 31 ILE HG21 1 1 8 1918 1 1 9 ILE HG22 H 10.930 -3.796 4.872 1.00 . A A . 31 ILE HG22 1 1 8 1919 1 1 9 ILE HG23 H 12.240 -3.133 5.834 1.00 . A A . 31 ILE HG23 1 1 8 1920 1 1 9 ILE N N 12.927 0.239 3.695 1.00 . A A . 31 ILE N 1 1 8 1921 1 1 9 ILE O O 14.603 -2.937 3.315 1.00 . A A . 31 ILE O 1 1 8 1922 1 1 10 GLU C C 16.244 -1.565 0.730 1.00 . A A . 32 GLU C 1 1 8 1923 1 1 10 GLU CA C 14.838 -2.100 0.778 1.00 . A A . 32 GLU CA 1 1 8 1924 1 1 10 GLU CB C 14.150 -1.909 -0.565 1.00 . A A . 32 GLU CB 1 1 8 1925 1 1 10 GLU CD C 13.819 -2.837 -2.874 1.00 . A A . 32 GLU CD 1 1 8 1926 1 1 10 GLU CG C 14.787 -2.822 -1.684 1.00 . A A . 32 GLU CG 1 1 8 1927 1 1 10 GLU H H 13.508 -0.591 1.674 1.00 . A A . 32 GLU H 1 1 8 1928 1 1 10 GLU HA H 14.900 -3.147 1.024 1.00 . A A . 32 GLU HA 1 1 8 1929 1 1 10 GLU HB2 H 13.108 -2.140 -0.411 1.00 . A A . 32 GLU HB2 1 1 8 1930 1 1 10 GLU HB3 H 14.218 -0.878 -0.879 1.00 . A A . 32 GLU HB3 1 1 8 1931 1 1 10 GLU HG2 H 15.736 -2.431 -2.022 1.00 . A A . 32 GLU HG2 1 1 8 1932 1 1 10 GLU HG3 H 14.922 -3.837 -1.345 1.00 . A A . 32 GLU HG3 1 1 8 1933 1 1 10 GLU N N 14.015 -1.420 1.829 1.00 . A A . 32 GLU N 1 1 8 1934 1 1 10 GLU O O 17.032 -2.010 -0.077 1.00 . A A . 32 GLU O 1 1 8 1935 1 1 10 GLU OE1 O 14.228 -2.764 -4.018 1.00 . A A . 32 GLU OE1 1 1 8 1936 1 1 11 ARG C C 18.623 -1.020 2.517 1.00 . A A . 33 ARG C 1 1 8 1937 1 1 11 ARG CA C 17.836 -0.001 1.703 1.00 . A A . 33 ARG CA 1 1 8 1938 1 1 11 ARG CB C 17.650 1.363 2.418 1.00 . A A . 33 ARG CB 1 1 8 1939 1 1 11 ARG CD C 18.620 3.619 2.836 1.00 . A A . 33 ARG CD 1 1 8 1940 1 1 11 ARG CG C 18.952 2.183 2.398 1.00 . A A . 33 ARG CG 1 1 8 1941 1 1 11 ARG CZ C 20.351 5.313 3.418 1.00 . A A . 33 ARG CZ 1 1 8 1942 1 1 11 ARG H H 15.753 -0.356 2.181 1.00 . A A . 33 ARG H 1 1 8 1943 1 1 11 ARG HA H 18.274 0.076 0.726 1.00 . A A . 33 ARG HA 1 1 8 1944 1 1 11 ARG HB2 H 16.884 1.906 1.881 1.00 . A A . 33 ARG HB2 1 1 8 1945 1 1 11 ARG HB3 H 17.312 1.217 3.436 1.00 . A A . 33 ARG HB3 1 1 8 1946 1 1 11 ARG HD2 H 17.789 4.007 2.259 1.00 . A A . 33 ARG HD2 1 1 8 1947 1 1 11 ARG HD3 H 18.348 3.621 3.878 1.00 . A A . 33 ARG HD3 1 1 8 1948 1 1 11 ARG HE H 20.248 4.357 1.682 1.00 . A A . 33 ARG HE 1 1 8 1949 1 1 11 ARG HG2 H 19.672 1.744 3.074 1.00 . A A . 33 ARG HG2 1 1 8 1950 1 1 11 ARG HG3 H 19.362 2.182 1.397 1.00 . A A . 33 ARG HG3 1 1 8 1951 1 1 11 ARG HH11 H 19.026 4.936 4.863 1.00 . A A . 33 ARG HH11 1 1 8 1952 1 1 11 ARG HH12 H 20.196 6.127 5.256 1.00 . A A . 33 ARG HH12 1 1 8 1953 1 1 11 ARG HH21 H 21.815 5.866 2.149 1.00 . A A . 33 ARG HH21 1 1 8 1954 1 1 11 ARG HH22 H 21.825 6.657 3.665 1.00 . A A . 33 ARG HH22 1 1 8 1955 1 1 11 ARG N N 16.493 -0.636 1.601 1.00 . A A . 33 ARG N 1 1 8 1956 1 1 11 ARG NE N 19.833 4.462 2.566 1.00 . A A . 33 ARG NE 1 1 8 1957 1 1 11 ARG NH1 N 19.822 5.471 4.597 1.00 . A A . 33 ARG NH1 1 1 8 1958 1 1 11 ARG NH2 N 21.401 5.990 3.052 1.00 . A A . 33 ARG NH2 1 1 8 1959 1 1 11 ARG O O 19.715 -1.409 2.161 1.00 . A A . 33 ARG O 1 1 8 1960 1 1 12 GLN C C 19.195 -3.599 3.637 1.00 . A A . 34 GLN C 1 1 8 1961 1 1 12 GLN CA C 18.670 -2.439 4.505 1.00 . A A . 34 GLN CA 1 1 8 1962 1 1 12 GLN CB C 17.637 -2.972 5.538 1.00 . A A . 34 GLN CB 1 1 8 1963 1 1 12 GLN CD C 16.381 -2.523 7.664 1.00 . A A . 34 GLN CD 1 1 8 1964 1 1 12 GLN CG C 17.312 -1.903 6.616 1.00 . A A . 34 GLN CG 1 1 8 1965 1 1 12 GLN H H 17.150 -1.038 3.795 1.00 . A A . 34 GLN H 1 1 8 1966 1 1 12 GLN HA H 19.518 -1.989 5.002 1.00 . A A . 34 GLN HA 1 1 8 1967 1 1 12 GLN HB2 H 16.714 -3.245 5.042 1.00 . A A . 34 GLN HB2 1 1 8 1968 1 1 12 GLN HB3 H 18.034 -3.856 6.021 1.00 . A A . 34 GLN HB3 1 1 8 1969 1 1 12 GLN HE21 H 17.575 -2.151 9.209 1.00 . A A . 34 GLN HE21 1 1 8 1970 1 1 12 GLN HE22 H 16.108 -2.939 9.561 1.00 . A A . 34 GLN HE22 1 1 8 1971 1 1 12 GLN HG2 H 18.216 -1.576 7.111 1.00 . A A . 34 GLN HG2 1 1 8 1972 1 1 12 GLN HG3 H 16.812 -1.045 6.187 1.00 . A A . 34 GLN HG3 1 1 8 1973 1 1 12 GLN N N 18.026 -1.427 3.605 1.00 . A A . 34 GLN N 1 1 8 1974 1 1 12 GLN NE2 N 16.724 -2.535 8.917 1.00 . A A . 34 GLN NE2 1 1 8 1975 1 1 12 GLN O O 20.300 -4.057 3.827 1.00 . A A . 34 GLN O 1 1 8 1976 1 1 12 GLN OE1 O 15.317 -3.017 7.352 1.00 . A A . 34 GLN OE1 1 1 8 1977 1 1 13 ARG C C 19.939 -4.712 0.779 1.00 . A A . 35 ARG C 1 1 8 1978 1 1 13 ARG CA C 18.890 -5.182 1.821 1.00 . A A . 35 ARG CA 1 1 8 1979 1 1 13 ARG CB C 17.689 -5.842 1.044 1.00 . A A . 35 ARG CB 1 1 8 1980 1 1 13 ARG CD C 15.858 -7.559 0.926 1.00 . A A . 35 ARG CD 1 1 8 1981 1 1 13 ARG CG C 16.889 -6.881 1.887 1.00 . A A . 35 ARG CG 1 1 8 1982 1 1 13 ARG CZ C 15.174 -9.966 1.063 1.00 . A A . 35 ARG CZ 1 1 8 1983 1 1 13 ARG H H 17.526 -3.654 2.557 1.00 . A A . 35 ARG H 1 1 8 1984 1 1 13 ARG HA H 19.363 -5.918 2.453 1.00 . A A . 35 ARG HA 1 1 8 1985 1 1 13 ARG HB2 H 17.032 -5.066 0.684 1.00 . A A . 35 ARG HB2 1 1 8 1986 1 1 13 ARG HB3 H 18.095 -6.351 0.180 1.00 . A A . 35 ARG HB3 1 1 8 1987 1 1 13 ARG HD2 H 15.078 -6.847 0.689 1.00 . A A . 35 ARG HD2 1 1 8 1988 1 1 13 ARG HD3 H 16.352 -7.830 0.006 1.00 . A A . 35 ARG HD3 1 1 8 1989 1 1 13 ARG HE H 14.803 -8.594 2.466 1.00 . A A . 35 ARG HE 1 1 8 1990 1 1 13 ARG HG2 H 17.564 -7.617 2.298 1.00 . A A . 35 ARG HG2 1 1 8 1991 1 1 13 ARG HG3 H 16.386 -6.380 2.704 1.00 . A A . 35 ARG HG3 1 1 8 1992 1 1 13 ARG HH11 H 16.196 -9.501 -0.603 1.00 . A A . 35 ARG HH11 1 1 8 1993 1 1 13 ARG HH12 H 15.670 -11.120 -0.519 1.00 . A A . 35 ARG HH12 1 1 8 1994 1 1 13 ARG HH21 H 14.164 -10.709 2.631 1.00 . A A . 35 ARG HH21 1 1 8 1995 1 1 13 ARG HH22 H 14.496 -11.844 1.398 1.00 . A A . 35 ARG HH22 1 1 8 1996 1 1 13 ARG N N 18.410 -4.052 2.690 1.00 . A A . 35 ARG N 1 1 8 1997 1 1 13 ARG NE N 15.217 -8.758 1.589 1.00 . A A . 35 ARG NE 1 1 8 1998 1 1 13 ARG NH1 N 15.716 -10.215 -0.099 1.00 . A A . 35 ARG NH1 1 1 8 1999 1 1 13 ARG NH2 N 14.571 -10.906 1.740 1.00 . A A . 35 ARG NH2 1 1 8 2000 1 1 13 ARG O O 20.041 -5.285 -0.289 1.00 . A A . 35 ARG O 1 1 8 2001 1 1 14 TYR C C 23.095 -3.690 0.631 1.00 . A A . 36 TYR C 1 1 8 2002 1 1 14 TYR CA C 21.732 -3.208 0.144 1.00 . A A . 36 TYR CA 1 1 8 2003 1 1 14 TYR CB C 21.737 -1.657 0.075 1.00 . A A . 36 TYR CB 1 1 8 2004 1 1 14 TYR CD1 C 22.991 -1.566 -2.136 1.00 . A A . 36 TYR CD1 1 1 8 2005 1 1 14 TYR CD2 C 23.982 -0.511 -0.248 1.00 . A A . 36 TYR CD2 1 1 8 2006 1 1 14 TYR CE1 C 24.075 -1.199 -2.908 1.00 . A A . 36 TYR CE1 1 1 8 2007 1 1 14 TYR CE2 C 25.064 -0.145 -1.023 1.00 . A A . 36 TYR CE2 1 1 8 2008 1 1 14 TYR CG C 22.935 -1.227 -0.797 1.00 . A A . 36 TYR CG 1 1 8 2009 1 1 14 TYR CZ C 25.119 -0.486 -2.356 1.00 . A A . 36 TYR CZ 1 1 8 2010 1 1 14 TYR H H 20.591 -3.252 1.959 1.00 . A A . 36 TYR H 1 1 8 2011 1 1 14 TYR HA H 21.536 -3.628 -0.823 1.00 . A A . 36 TYR HA 1 1 8 2012 1 1 14 TYR HB2 H 20.826 -1.304 -0.382 1.00 . A A . 36 TYR HB2 1 1 8 2013 1 1 14 TYR HB3 H 21.825 -1.218 1.058 1.00 . A A . 36 TYR HB3 1 1 8 2014 1 1 14 TYR HD1 H 22.183 -2.123 -2.588 1.00 . A A . 36 TYR HD1 1 1 8 2015 1 1 14 TYR HD2 H 23.960 -0.234 0.794 1.00 . A A . 36 TYR HD2 1 1 8 2016 1 1 14 TYR HE1 H 24.105 -1.470 -3.953 1.00 . A A . 36 TYR HE1 1 1 8 2017 1 1 14 TYR HE2 H 25.878 0.415 -0.584 1.00 . A A . 36 TYR HE2 1 1 8 2018 1 1 14 TYR HH H 26.656 -0.930 -3.406 1.00 . A A . 36 TYR HH 1 1 8 2019 1 1 14 TYR N N 20.701 -3.697 1.099 1.00 . A A . 36 TYR N 1 1 8 2020 1 1 14 TYR O O 23.833 -4.348 -0.069 1.00 . A A . 36 TYR O 1 1 8 2021 1 1 14 TYR OH O 26.209 -0.127 -3.123 1.00 . A A . 36 TYR OH 1 1 8 2022 1 1 15 NH2 HN1 H 22.887 -2.846 2.406 1.00 . A A . 37 NH2 HN1 1 1 8 2023 1 1 15 NH2 HN2 H 24.352 -3.680 2.141 1.00 . A A . 37 NH2 HN2 1 1 8 2024 1 1 15 NH2 N N 23.474 -3.377 1.831 1.00 . A A . 37 NH2 N 1 1 9 2025 1 1 1 ACE C C 2.025 1.145 -2.347 1.00 . A A . 23 ACE C 1 1 9 2026 1 1 1 ACE CH3 C 1.328 -0.138 -2.801 1.00 . A A . 23 ACE CH3 1 1 9 2027 1 1 1 ACE H1 H 0.287 0.071 -2.988 1.00 . A A . 23 ACE H1 1 1 9 2028 1 1 1 ACE H2 H 1.413 -0.902 -2.045 1.00 . A A . 23 ACE H2 1 1 9 2029 1 1 1 ACE H3 H 1.794 -0.488 -3.709 1.00 . A A . 23 ACE H3 1 1 9 2030 1 1 1 ACE O O 2.027 2.131 -3.059 1.00 . A A . 23 ACE O 1 1 9 2031 1 1 2 ALA C C 4.741 2.403 -1.247 1.00 . A A . 24 ALA C 1 1 9 2032 1 1 2 ALA CA C 3.324 2.335 -0.671 1.00 . A A . 24 ALA CA 1 1 9 2033 1 1 2 ALA CB C 3.360 2.255 0.865 1.00 . A A . 24 ALA CB 1 1 9 2034 1 1 2 ALA H H 2.627 0.298 -0.646 1.00 . A A . 24 ALA H 1 1 9 2035 1 1 2 ALA HA H 2.788 3.220 -0.968 1.00 . A A . 24 ALA HA 1 1 9 2036 1 1 2 ALA HB1 H 2.358 2.210 1.265 1.00 . A A . 24 ALA HB1 1 1 9 2037 1 1 2 ALA HB2 H 3.852 3.132 1.264 1.00 . A A . 24 ALA HB2 1 1 9 2038 1 1 2 ALA HB3 H 3.913 1.383 1.187 1.00 . A A . 24 ALA HB3 1 1 9 2039 1 1 2 ALA N N 2.625 1.116 -1.185 1.00 . A A . 24 ALA N 1 1 9 2040 1 1 2 ALA O O 5.714 2.479 -0.526 1.00 . A A . 24 ALA O 1 1 9 2041 1 1 3 ARG C C 7.158 3.309 -2.644 1.00 . A A . 25 ARG C 1 1 9 2042 1 1 3 ARG CA C 6.093 2.424 -3.314 1.00 . A A . 25 ARG CA 1 1 9 2043 1 1 3 ARG CB C 5.790 2.942 -4.744 1.00 . A A . 25 ARG CB 1 1 9 2044 1 1 3 ARG CD C 4.538 2.394 -6.882 1.00 . A A . 25 ARG CD 1 1 9 2045 1 1 3 ARG CG C 4.900 1.907 -5.469 1.00 . A A . 25 ARG CG 1 1 9 2046 1 1 3 ARG CZ C 4.390 0.553 -8.550 1.00 . A A . 25 ARG CZ 1 1 9 2047 1 1 3 ARG H H 3.945 2.294 -3.037 1.00 . A A . 25 ARG H 1 1 9 2048 1 1 3 ARG HA H 6.502 1.422 -3.364 1.00 . A A . 25 ARG HA 1 1 9 2049 1 1 3 ARG HB2 H 5.294 3.903 -4.701 1.00 . A A . 25 ARG HB2 1 1 9 2050 1 1 3 ARG HB3 H 6.722 3.060 -5.278 1.00 . A A . 25 ARG HB3 1 1 9 2051 1 1 3 ARG HD2 H 3.817 3.201 -6.810 1.00 . A A . 25 ARG HD2 1 1 9 2052 1 1 3 ARG HD3 H 5.390 2.754 -7.432 1.00 . A A . 25 ARG HD3 1 1 9 2053 1 1 3 ARG HE H 2.986 0.978 -7.198 1.00 . A A . 25 ARG HE 1 1 9 2054 1 1 3 ARG HG2 H 5.426 0.964 -5.532 1.00 . A A . 25 ARG HG2 1 1 9 2055 1 1 3 ARG HG3 H 3.989 1.751 -4.909 1.00 . A A . 25 ARG HG3 1 1 9 2056 1 1 3 ARG HH11 H 6.067 1.638 -8.652 1.00 . A A . 25 ARG HH11 1 1 9 2057 1 1 3 ARG HH12 H 5.981 0.363 -9.781 1.00 . A A . 25 ARG HH12 1 1 9 2058 1 1 3 ARG HH21 H 2.817 -0.695 -8.660 1.00 . A A . 25 ARG HH21 1 1 9 2059 1 1 3 ARG HH22 H 4.055 -0.979 -9.806 1.00 . A A . 25 ARG HH22 1 1 9 2060 1 1 3 ARG N N 4.797 2.363 -2.553 1.00 . A A . 25 ARG N 1 1 9 2061 1 1 3 ARG NE N 3.868 1.229 -7.553 1.00 . A A . 25 ARG NE 1 1 9 2062 1 1 3 ARG NH1 N 5.559 0.870 -9.030 1.00 . A A . 25 ARG NH1 1 1 9 2063 1 1 3 ARG NH2 N 3.707 -0.442 -9.039 1.00 . A A . 25 ARG NH2 1 1 9 2064 1 1 3 ARG O O 8.283 2.902 -2.425 1.00 . A A . 25 ARG O 1 1 9 2065 1 1 4 HIS C C 8.391 5.010 -0.467 1.00 . A A . 26 HIS C 1 1 9 2066 1 1 4 HIS CA C 7.634 5.526 -1.691 1.00 . A A . 26 HIS CA 1 1 9 2067 1 1 4 HIS CB C 6.762 6.756 -1.295 1.00 . A A . 26 HIS CB 1 1 9 2068 1 1 4 HIS CD2 C 5.061 5.932 0.517 1.00 . A A . 26 HIS CD2 1 1 9 2069 1 1 4 HIS CE1 C 3.428 5.828 -0.691 1.00 . A A . 26 HIS CE1 1 1 9 2070 1 1 4 HIS CG C 5.389 6.312 -0.761 1.00 . A A . 26 HIS CG 1 1 9 2071 1 1 4 HIS H H 5.823 4.748 -2.561 1.00 . A A . 26 HIS H 1 1 9 2072 1 1 4 HIS HA H 8.384 5.797 -2.400 1.00 . A A . 26 HIS HA 1 1 9 2073 1 1 4 HIS HB2 H 7.261 7.325 -0.524 1.00 . A A . 26 HIS HB2 1 1 9 2074 1 1 4 HIS HB3 H 6.617 7.398 -2.151 1.00 . A A . 26 HIS HB3 1 1 9 2075 1 1 4 HIS HD1 H 4.243 6.462 -2.482 1.00 . A A . 26 HIS HD1 1 1 9 2076 1 1 4 HIS HD2 H 5.731 5.897 1.359 1.00 . A A . 26 HIS HD2 1 1 9 2077 1 1 4 HIS HE1 H 2.405 5.662 -1.002 1.00 . A A . 26 HIS HE1 1 1 9 2078 1 1 4 HIS N N 6.748 4.510 -2.349 1.00 . A A . 26 HIS N 1 1 9 2079 1 1 4 HIS ND1 N 4.341 6.245 -1.529 1.00 . A A . 26 HIS ND1 1 1 9 2080 1 1 4 HIS NE2 N 3.793 5.620 0.548 1.00 . A A . 26 HIS NE2 1 1 9 2081 1 1 4 HIS O O 9.460 5.466 -0.115 1.00 . A A . 26 HIS O 1 1 9 2082 1 1 5 TYR C C 8.976 2.016 1.118 1.00 . A A . 27 TYR C 1 1 9 2083 1 1 5 TYR CA C 8.347 3.395 1.365 1.00 . A A . 27 TYR CA 1 1 9 2084 1 1 5 TYR CB C 7.200 3.282 2.387 1.00 . A A . 27 TYR CB 1 1 9 2085 1 1 5 TYR CD1 C 7.630 5.756 3.032 1.00 . A A . 27 TYR CD1 1 1 9 2086 1 1 5 TYR CD2 C 6.084 4.475 4.305 1.00 . A A . 27 TYR CD2 1 1 9 2087 1 1 5 TYR CE1 C 7.389 6.846 3.846 1.00 . A A . 27 TYR CE1 1 1 9 2088 1 1 5 TYR CE2 C 5.848 5.571 5.114 1.00 . A A . 27 TYR CE2 1 1 9 2089 1 1 5 TYR CG C 6.978 4.548 3.252 1.00 . A A . 27 TYR CG 1 1 9 2090 1 1 5 TYR CZ C 6.500 6.763 4.891 1.00 . A A . 27 TYR CZ 1 1 9 2091 1 1 5 TYR H H 6.942 3.764 -0.263 1.00 . A A . 27 TYR H 1 1 9 2092 1 1 5 TYR HA H 9.133 4.018 1.759 1.00 . A A . 27 TYR HA 1 1 9 2093 1 1 5 TYR HB2 H 6.281 3.078 1.852 1.00 . A A . 27 TYR HB2 1 1 9 2094 1 1 5 TYR HB3 H 7.409 2.439 3.022 1.00 . A A . 27 TYR HB3 1 1 9 2095 1 1 5 TYR HD1 H 8.334 5.870 2.223 1.00 . A A . 27 TYR HD1 1 1 9 2096 1 1 5 TYR HD2 H 5.557 3.552 4.504 1.00 . A A . 27 TYR HD2 1 1 9 2097 1 1 5 TYR HE1 H 7.902 7.777 3.659 1.00 . A A . 27 TYR HE1 1 1 9 2098 1 1 5 TYR HE2 H 5.143 5.494 5.929 1.00 . A A . 27 TYR HE2 1 1 9 2099 1 1 5 TYR HH H 6.673 7.700 6.566 1.00 . A A . 27 TYR HH 1 1 9 2100 1 1 5 TYR N N 7.788 4.045 0.139 1.00 . A A . 27 TYR N 1 1 9 2101 1 1 5 TYR O O 9.208 1.249 2.032 1.00 . A A . 27 TYR O 1 1 9 2102 1 1 5 TYR OH O 6.274 7.856 5.701 1.00 . A A . 27 TYR OH 1 1 9 2103 1 1 6 LYS C C 11.391 0.660 -0.358 1.00 . A A . 28 LYS C 1 1 9 2104 1 1 6 LYS CA C 9.876 0.423 -0.484 1.00 . A A . 28 LYS CA 1 1 9 2105 1 1 6 LYS CB C 9.496 0.055 -1.946 1.00 . A A . 28 LYS CB 1 1 9 2106 1 1 6 LYS CD C 9.305 -1.975 -3.486 1.00 . A A . 28 LYS CD 1 1 9 2107 1 1 6 LYS CE C 10.723 -1.825 -4.070 1.00 . A A . 28 LYS CE 1 1 9 2108 1 1 6 LYS CG C 9.280 -1.471 -2.029 1.00 . A A . 28 LYS CG 1 1 9 2109 1 1 6 LYS H H 9.033 2.420 -0.788 1.00 . A A . 28 LYS H 1 1 9 2110 1 1 6 LYS HA H 9.567 -0.340 0.218 1.00 . A A . 28 LYS HA 1 1 9 2111 1 1 6 LYS HB2 H 8.578 0.546 -2.227 1.00 . A A . 28 LYS HB2 1 1 9 2112 1 1 6 LYS HB3 H 10.269 0.349 -2.642 1.00 . A A . 28 LYS HB3 1 1 9 2113 1 1 6 LYS HD2 H 9.012 -3.014 -3.495 1.00 . A A . 28 LYS HD2 1 1 9 2114 1 1 6 LYS HD3 H 8.601 -1.416 -4.087 1.00 . A A . 28 LYS HD3 1 1 9 2115 1 1 6 LYS HE2 H 10.819 -2.470 -4.930 1.00 . A A . 28 LYS HE2 1 1 9 2116 1 1 6 LYS HE3 H 10.935 -0.806 -4.367 1.00 . A A . 28 LYS HE3 1 1 9 2117 1 1 6 LYS HG2 H 10.025 -1.998 -1.453 1.00 . A A . 28 LYS HG2 1 1 9 2118 1 1 6 LYS HG3 H 8.319 -1.720 -1.612 1.00 . A A . 28 LYS HG3 1 1 9 2119 1 1 6 LYS HZ1 H 11.608 -3.204 -2.680 1.00 . A A . 28 LYS HZ1 1 1 9 2120 1 1 6 LYS N N 9.255 1.741 -0.119 1.00 . A A . 28 LYS N 1 1 9 2121 1 1 6 LYS NZ N 11.681 -2.285 -3.012 1.00 . A A . 28 LYS NZ 1 1 9 2122 1 1 6 LYS O O 12.115 -0.064 0.305 1.00 . A A . 28 LYS O 1 1 9 2123 1 1 7 ASN C C 13.922 2.007 0.307 1.00 . A A . 29 ASN C 1 1 9 2124 1 1 7 ASN CA C 13.234 2.159 -1.073 1.00 . A A . 29 ASN CA 1 1 9 2125 1 1 7 ASN CB C 13.230 3.635 -1.538 1.00 . A A . 29 ASN CB 1 1 9 2126 1 1 7 ASN CG C 14.636 4.206 -1.797 1.00 . A A . 29 ASN CG 1 1 9 2127 1 1 7 ASN H H 11.121 2.194 -1.548 1.00 . A A . 29 ASN H 1 1 9 2128 1 1 7 ASN HA H 13.771 1.568 -1.802 1.00 . A A . 29 ASN HA 1 1 9 2129 1 1 7 ASN HB2 H 12.673 3.713 -2.458 1.00 . A A . 29 ASN HB2 1 1 9 2130 1 1 7 ASN HB3 H 12.749 4.262 -0.802 1.00 . A A . 29 ASN HB3 1 1 9 2131 1 1 7 ASN HD21 H 15.679 2.733 -0.944 1.00 . A A . 29 ASN HD21 1 1 9 2132 1 1 7 ASN HD22 H 16.579 4.000 -1.633 1.00 . A A . 29 ASN HD22 1 1 9 2133 1 1 7 ASN N N 11.800 1.701 -1.037 1.00 . A A . 29 ASN N 1 1 9 2134 1 1 7 ASN ND2 N 15.716 3.587 -1.424 1.00 . A A . 29 ASN ND2 1 1 9 2135 1 1 7 ASN O O 15.051 1.566 0.426 1.00 . A A . 29 ASN O 1 1 9 2136 1 1 7 ASN OD1 O 14.770 5.267 -2.366 1.00 . A A . 29 ASN OD1 1 1 9 2137 1 1 8 LEU C C 13.910 0.902 3.150 1.00 . A A . 30 LEU C 1 1 9 2138 1 1 8 LEU CA C 13.618 2.349 2.726 1.00 . A A . 30 LEU CA 1 1 9 2139 1 1 8 LEU CB C 12.504 2.935 3.627 1.00 . A A . 30 LEU CB 1 1 9 2140 1 1 8 LEU CD1 C 10.806 4.753 4.021 1.00 . A A . 30 LEU CD1 1 1 9 2141 1 1 8 LEU CD2 C 13.131 5.387 3.316 1.00 . A A . 30 LEU CD2 1 1 9 2142 1 1 8 LEU CG C 12.012 4.337 3.152 1.00 . A A . 30 LEU CG 1 1 9 2143 1 1 8 LEU H H 12.270 2.721 1.085 1.00 . A A . 30 LEU H 1 1 9 2144 1 1 8 LEU HA H 14.532 2.919 2.822 1.00 . A A . 30 LEU HA 1 1 9 2145 1 1 8 LEU HB2 H 11.663 2.257 3.648 1.00 . A A . 30 LEU HB2 1 1 9 2146 1 1 8 LEU HB3 H 12.894 3.011 4.632 1.00 . A A . 30 LEU HB3 1 1 9 2147 1 1 8 LEU HD11 H 10.439 5.721 3.715 1.00 . A A . 30 LEU HD11 1 1 9 2148 1 1 8 LEU HD12 H 11.085 4.814 5.064 1.00 . A A . 30 LEU HD12 1 1 9 2149 1 1 8 LEU HD13 H 10.002 4.038 3.928 1.00 . A A . 30 LEU HD13 1 1 9 2150 1 1 8 LEU HD21 H 13.436 5.456 4.349 1.00 . A A . 30 LEU HD21 1 1 9 2151 1 1 8 LEU HD22 H 12.785 6.360 2.996 1.00 . A A . 30 LEU HD22 1 1 9 2152 1 1 8 LEU HD23 H 13.989 5.119 2.718 1.00 . A A . 30 LEU HD23 1 1 9 2153 1 1 8 LEU HG H 11.699 4.312 2.118 1.00 . A A . 30 LEU HG 1 1 9 2154 1 1 8 LEU N N 13.168 2.395 1.300 1.00 . A A . 30 LEU N 1 1 9 2155 1 1 8 LEU O O 14.964 0.563 3.656 1.00 . A A . 30 LEU O 1 1 9 2156 1 1 9 ILE C C 14.074 -2.016 2.314 1.00 . A A . 31 ILE C 1 1 9 2157 1 1 9 ILE CA C 13.067 -1.379 3.271 1.00 . A A . 31 ILE CA 1 1 9 2158 1 1 9 ILE CB C 11.661 -2.045 3.159 1.00 . A A . 31 ILE CB 1 1 9 2159 1 1 9 ILE CD1 C 9.288 -1.901 4.137 1.00 . A A . 31 ILE CD1 1 1 9 2160 1 1 9 ILE CG1 C 10.697 -1.274 4.117 1.00 . A A . 31 ILE CG1 1 1 9 2161 1 1 9 ILE CG2 C 11.748 -3.542 3.580 1.00 . A A . 31 ILE CG2 1 1 9 2162 1 1 9 ILE H H 12.116 0.395 2.480 1.00 . A A . 31 ILE H 1 1 9 2163 1 1 9 ILE HA H 13.460 -1.449 4.276 1.00 . A A . 31 ILE HA 1 1 9 2164 1 1 9 ILE HB H 11.301 -1.969 2.141 1.00 . A A . 31 ILE HB 1 1 9 2165 1 1 9 ILE HD11 H 9.325 -2.908 4.526 1.00 . A A . 31 ILE HD11 1 1 9 2166 1 1 9 ILE HD12 H 8.866 -1.920 3.142 1.00 . A A . 31 ILE HD12 1 1 9 2167 1 1 9 ILE HD13 H 8.640 -1.314 4.773 1.00 . A A . 31 ILE HD13 1 1 9 2168 1 1 9 ILE HG12 H 11.102 -1.276 5.121 1.00 . A A . 31 ILE HG12 1 1 9 2169 1 1 9 ILE HG13 H 10.599 -0.244 3.799 1.00 . A A . 31 ILE HG13 1 1 9 2170 1 1 9 ILE HG21 H 10.784 -4.018 3.489 1.00 . A A . 31 ILE HG21 1 1 9 2171 1 1 9 ILE HG22 H 12.089 -3.634 4.600 1.00 . A A . 31 ILE HG22 1 1 9 2172 1 1 9 ILE HG23 H 12.438 -4.072 2.939 1.00 . A A . 31 ILE HG23 1 1 9 2173 1 1 9 ILE N N 12.935 0.069 2.910 1.00 . A A . 31 ILE N 1 1 9 2174 1 1 9 ILE O O 14.608 -3.081 2.555 1.00 . A A . 31 ILE O 1 1 9 2175 1 1 10 GLU C C 16.653 -1.209 0.482 1.00 . A A . 32 GLU C 1 1 9 2176 1 1 10 GLU CA C 15.275 -1.805 0.206 1.00 . A A . 32 GLU CA 1 1 9 2177 1 1 10 GLU CB C 14.760 -1.375 -1.166 1.00 . A A . 32 GLU CB 1 1 9 2178 1 1 10 GLU CD C 12.611 -1.504 -2.520 1.00 . A A . 32 GLU CD 1 1 9 2179 1 1 10 GLU CG C 13.469 -2.165 -1.452 1.00 . A A . 32 GLU CG 1 1 9 2180 1 1 10 GLU H H 13.830 -0.466 1.127 1.00 . A A . 32 GLU H 1 1 9 2181 1 1 10 GLU HA H 15.357 -2.881 0.273 1.00 . A A . 32 GLU HA 1 1 9 2182 1 1 10 GLU HB2 H 14.564 -0.315 -1.172 1.00 . A A . 32 GLU HB2 1 1 9 2183 1 1 10 GLU HB3 H 15.502 -1.590 -1.921 1.00 . A A . 32 GLU HB3 1 1 9 2184 1 1 10 GLU HG2 H 13.717 -3.158 -1.794 1.00 . A A . 32 GLU HG2 1 1 9 2185 1 1 10 GLU HG3 H 12.863 -2.248 -0.562 1.00 . A A . 32 GLU HG3 1 1 9 2186 1 1 10 GLU N N 14.310 -1.318 1.238 1.00 . A A . 32 GLU N 1 1 9 2187 1 1 10 GLU O O 17.544 -1.294 -0.339 1.00 . A A . 32 GLU O 1 1 9 2188 1 1 10 GLU OE1 O 12.790 -0.346 -2.853 1.00 . A A . 32 GLU OE1 1 1 9 2189 1 1 11 ARG C C 18.705 -1.022 2.997 1.00 . A A . 33 ARG C 1 1 9 2190 1 1 11 ARG CA C 18.077 0.003 2.050 1.00 . A A . 33 ARG CA 1 1 9 2191 1 1 11 ARG CB C 17.756 1.360 2.743 1.00 . A A . 33 ARG CB 1 1 9 2192 1 1 11 ARG CD C 19.914 2.667 2.146 1.00 . A A . 33 ARG CD 1 1 9 2193 1 1 11 ARG CG C 18.999 2.126 3.276 1.00 . A A . 33 ARG CG 1 1 9 2194 1 1 11 ARG CZ C 21.593 4.376 2.915 1.00 . A A . 33 ARG CZ 1 1 9 2195 1 1 11 ARG H H 16.000 -0.568 2.237 1.00 . A A . 33 ARG H 1 1 9 2196 1 1 11 ARG HA H 18.715 0.116 1.194 1.00 . A A . 33 ARG HA 1 1 9 2197 1 1 11 ARG HB2 H 17.229 1.981 2.033 1.00 . A A . 33 ARG HB2 1 1 9 2198 1 1 11 ARG HB3 H 17.097 1.202 3.582 1.00 . A A . 33 ARG HB3 1 1 9 2199 1 1 11 ARG HD2 H 20.737 1.994 1.968 1.00 . A A . 33 ARG HD2 1 1 9 2200 1 1 11 ARG HD3 H 19.356 2.761 1.224 1.00 . A A . 33 ARG HD3 1 1 9 2201 1 1 11 ARG HE H 19.675 4.732 2.593 1.00 . A A . 33 ARG HE 1 1 9 2202 1 1 11 ARG HG2 H 18.652 2.936 3.901 1.00 . A A . 33 ARG HG2 1 1 9 2203 1 1 11 ARG HG3 H 19.572 1.459 3.905 1.00 . A A . 33 ARG HG3 1 1 9 2204 1 1 11 ARG HH11 H 22.332 2.548 2.622 1.00 . A A . 33 ARG HH11 1 1 9 2205 1 1 11 ARG HH12 H 23.474 3.699 3.169 1.00 . A A . 33 ARG HH12 1 1 9 2206 1 1 11 ARG HH21 H 21.073 6.287 3.259 1.00 . A A . 33 ARG HH21 1 1 9 2207 1 1 11 ARG HH22 H 22.719 5.931 3.530 1.00 . A A . 33 ARG HH22 1 1 9 2208 1 1 11 ARG N N 16.780 -0.616 1.638 1.00 . A A . 33 ARG N 1 1 9 2209 1 1 11 ARG NE N 20.372 4.043 2.575 1.00 . A A . 33 ARG NE 1 1 9 2210 1 1 11 ARG NH1 N 22.537 3.481 2.903 1.00 . A A . 33 ARG NH1 1 1 9 2211 1 1 11 ARG NH2 N 21.812 5.613 3.258 1.00 . A A . 33 ARG NH2 1 1 9 2212 1 1 11 ARG O O 19.756 -1.575 2.738 1.00 . A A . 33 ARG O 1 1 9 2213 1 1 12 GLN C C 19.209 -3.437 4.578 1.00 . A A . 34 GLN C 1 1 9 2214 1 1 12 GLN CA C 18.460 -2.214 5.132 1.00 . A A . 34 GLN CA 1 1 9 2215 1 1 12 GLN CB C 17.227 -2.714 5.945 1.00 . A A . 34 GLN CB 1 1 9 2216 1 1 12 GLN CD C 15.569 -2.071 7.788 1.00 . A A . 34 GLN CD 1 1 9 2217 1 1 12 GLN CG C 16.753 -1.607 6.921 1.00 . A A . 34 GLN CG 1 1 9 2218 1 1 12 GLN H H 17.182 -0.731 4.169 1.00 . A A . 34 GLN H 1 1 9 2219 1 1 12 GLN HA H 19.144 -1.696 5.790 1.00 . A A . 34 GLN HA 1 1 9 2220 1 1 12 GLN HB2 H 16.427 -2.978 5.270 1.00 . A A . 34 GLN HB2 1 1 9 2221 1 1 12 GLN HB3 H 17.502 -3.593 6.515 1.00 . A A . 34 GLN HB3 1 1 9 2222 1 1 12 GLN HE21 H 15.245 -3.802 6.852 1.00 . A A . 34 GLN HE21 1 1 9 2223 1 1 12 GLN HE22 H 14.218 -3.437 8.152 1.00 . A A . 34 GLN HE22 1 1 9 2224 1 1 12 GLN HG2 H 17.553 -1.329 7.590 1.00 . A A . 34 GLN HG2 1 1 9 2225 1 1 12 GLN HG3 H 16.442 -0.730 6.375 1.00 . A A . 34 GLN HG3 1 1 9 2226 1 1 12 GLN N N 18.012 -1.240 4.080 1.00 . A A . 34 GLN N 1 1 9 2227 1 1 12 GLN NE2 N 14.968 -3.202 7.569 1.00 . A A . 34 GLN NE2 1 1 9 2228 1 1 12 GLN O O 20.323 -3.716 4.963 1.00 . A A . 34 GLN O 1 1 9 2229 1 1 12 GLN OE1 O 15.164 -1.389 8.701 1.00 . A A . 34 GLN OE1 1 1 9 2230 1 1 13 ARG C C 20.077 -5.048 1.828 1.00 . A A . 35 ARG C 1 1 9 2231 1 1 13 ARG CA C 19.247 -5.360 3.090 1.00 . A A . 35 ARG CA 1 1 9 2232 1 1 13 ARG CB C 18.103 -6.400 2.789 1.00 . A A . 35 ARG CB 1 1 9 2233 1 1 13 ARG CD C 17.147 -8.659 3.516 1.00 . A A . 35 ARG CD 1 1 9 2234 1 1 13 ARG CG C 18.384 -7.721 3.549 1.00 . A A . 35 ARG CG 1 1 9 2235 1 1 13 ARG CZ C 16.650 -10.267 1.676 1.00 . A A . 35 ARG CZ 1 1 9 2236 1 1 13 ARG H H 17.700 -3.888 3.377 1.00 . A A . 35 ARG H 1 1 9 2237 1 1 13 ARG HA H 19.921 -5.753 3.833 1.00 . A A . 35 ARG HA 1 1 9 2238 1 1 13 ARG HB2 H 17.141 -6.005 3.080 1.00 . A A . 35 ARG HB2 1 1 9 2239 1 1 13 ARG HB3 H 18.075 -6.601 1.727 1.00 . A A . 35 ARG HB3 1 1 9 2240 1 1 13 ARG HD2 H 17.392 -9.523 4.109 1.00 . A A . 35 ARG HD2 1 1 9 2241 1 1 13 ARG HD3 H 16.292 -8.176 3.969 1.00 . A A . 35 ARG HD3 1 1 9 2242 1 1 13 ARG HE H 16.714 -8.276 1.460 1.00 . A A . 35 ARG HE 1 1 9 2243 1 1 13 ARG HG2 H 19.237 -8.214 3.102 1.00 . A A . 35 ARG HG2 1 1 9 2244 1 1 13 ARG HG3 H 18.633 -7.500 4.579 1.00 . A A . 35 ARG HG3 1 1 9 2245 1 1 13 ARG HH11 H 17.007 -11.107 3.459 1.00 . A A . 35 ARG HH11 1 1 9 2246 1 1 13 ARG HH12 H 16.652 -12.214 2.213 1.00 . A A . 35 ARG HH12 1 1 9 2247 1 1 13 ARG HH21 H 16.273 -9.743 -0.224 1.00 . A A . 35 ARG HH21 1 1 9 2248 1 1 13 ARG HH22 H 16.217 -11.425 0.077 1.00 . A A . 35 ARG HH22 1 1 9 2249 1 1 13 ARG N N 18.591 -4.150 3.672 1.00 . A A . 35 ARG N 1 1 9 2250 1 1 13 ARG NE N 16.811 -9.025 2.090 1.00 . A A . 35 ARG NE 1 1 9 2251 1 1 13 ARG NH1 N 16.778 -11.265 2.505 1.00 . A A . 35 ARG NH1 1 1 9 2252 1 1 13 ARG NH2 N 16.360 -10.496 0.425 1.00 . A A . 35 ARG NH2 1 1 9 2253 1 1 13 ARG O O 20.042 -5.788 0.864 1.00 . A A . 35 ARG O 1 1 9 2254 1 1 14 TYR C C 23.109 -3.327 1.205 1.00 . A A . 36 TYR C 1 1 9 2255 1 1 14 TYR CA C 21.654 -3.539 0.716 1.00 . A A . 36 TYR CA 1 1 9 2256 1 1 14 TYR CB C 21.049 -2.234 0.126 1.00 . A A . 36 TYR CB 1 1 9 2257 1 1 14 TYR CD1 C 22.714 -2.014 -1.809 1.00 . A A . 36 TYR CD1 1 1 9 2258 1 1 14 TYR CD2 C 20.395 -2.007 -2.302 1.00 . A A . 36 TYR CD2 1 1 9 2259 1 1 14 TYR CE1 C 22.999 -1.879 -3.151 1.00 . A A . 36 TYR CE1 1 1 9 2260 1 1 14 TYR CE2 C 20.682 -1.870 -3.645 1.00 . A A . 36 TYR CE2 1 1 9 2261 1 1 14 TYR CG C 21.407 -2.081 -1.367 1.00 . A A . 36 TYR CG 1 1 9 2262 1 1 14 TYR CZ C 21.988 -1.805 -4.077 1.00 . A A . 36 TYR CZ 1 1 9 2263 1 1 14 TYR H H 20.786 -3.391 2.665 1.00 . A A . 36 TYR H 1 1 9 2264 1 1 14 TYR HA H 21.647 -4.328 -0.012 1.00 . A A . 36 TYR HA 1 1 9 2265 1 1 14 TYR HB2 H 19.973 -2.250 0.231 1.00 . A A . 36 TYR HB2 1 1 9 2266 1 1 14 TYR HB3 H 21.432 -1.377 0.660 1.00 . A A . 36 TYR HB3 1 1 9 2267 1 1 14 TYR HD1 H 23.531 -2.066 -1.107 1.00 . A A . 36 TYR HD1 1 1 9 2268 1 1 14 TYR HD2 H 19.365 -2.055 -1.978 1.00 . A A . 36 TYR HD2 1 1 9 2269 1 1 14 TYR HE1 H 24.026 -1.830 -3.476 1.00 . A A . 36 TYR HE1 1 1 9 2270 1 1 14 TYR HE2 H 19.874 -1.813 -4.360 1.00 . A A . 36 TYR HE2 1 1 9 2271 1 1 14 TYR HH H 22.475 -0.732 -5.556 1.00 . A A . 36 TYR HH 1 1 9 2272 1 1 14 TYR N N 20.801 -3.957 1.869 1.00 . A A . 36 TYR N 1 1 9 2273 1 1 14 TYR O O 23.679 -2.254 1.150 1.00 . A A . 36 TYR O 1 1 9 2274 1 1 14 TYR OH O 22.281 -1.662 -5.415 1.00 . A A . 36 TYR OH 1 1 9 2275 1 1 15 NH2 HN1 H 23.338 -5.213 1.766 1.00 . A A . 37 NH2 HN1 1 1 9 2276 1 1 15 NH2 HN2 H 24.679 -4.193 2.013 1.00 . A A . 37 NH2 HN2 1 1 9 2277 1 1 15 NH2 N N 23.761 -4.332 1.704 1.00 . A A . 37 NH2 N 1 1 10 2278 1 1 1 ACE C C 2.983 4.123 -1.109 1.00 . A A . 23 ACE C 1 1 10 2279 1 1 1 ACE CH3 C 1.743 4.937 -1.473 1.00 . A A . 23 ACE CH3 1 1 10 2280 1 1 1 ACE H1 H 1.746 5.149 -2.531 1.00 . A A . 23 ACE H1 1 1 10 2281 1 1 1 ACE H2 H 1.764 5.868 -0.925 1.00 . A A . 23 ACE H2 1 1 10 2282 1 1 1 ACE H3 H 0.851 4.389 -1.214 1.00 . A A . 23 ACE H3 1 1 10 2283 1 1 1 ACE O O 4.089 4.566 -1.343 1.00 . A A . 23 ACE O 1 1 10 2284 1 1 2 ALA C C 5.160 2.102 -0.907 1.00 . A A . 24 ALA C 1 1 10 2285 1 1 2 ALA CA C 3.848 2.018 -0.127 1.00 . A A . 24 ALA CA 1 1 10 2286 1 1 2 ALA CB C 3.336 0.573 -0.213 1.00 . A A . 24 ALA CB 1 1 10 2287 1 1 2 ALA H H 1.820 2.684 -0.420 1.00 . A A . 24 ALA H 1 1 10 2288 1 1 2 ALA HA H 4.083 2.250 0.896 1.00 . A A . 24 ALA HA 1 1 10 2289 1 1 2 ALA HB1 H 4.123 -0.099 0.103 1.00 . A A . 24 ALA HB1 1 1 10 2290 1 1 2 ALA HB2 H 3.057 0.317 -1.225 1.00 . A A . 24 ALA HB2 1 1 10 2291 1 1 2 ALA HB3 H 2.483 0.434 0.435 1.00 . A A . 24 ALA HB3 1 1 10 2292 1 1 2 ALA N N 2.752 2.956 -0.559 1.00 . A A . 24 ALA N 1 1 10 2293 1 1 2 ALA O O 6.225 2.114 -0.330 1.00 . A A . 24 ALA O 1 1 10 2294 1 1 3 ARG C C 7.208 3.292 -2.643 1.00 . A A . 25 ARG C 1 1 10 2295 1 1 3 ARG CA C 6.216 2.229 -3.122 1.00 . A A . 25 ARG CA 1 1 10 2296 1 1 3 ARG CB C 5.733 2.584 -4.535 1.00 . A A . 25 ARG CB 1 1 10 2297 1 1 3 ARG CD C 4.051 1.970 -6.291 1.00 . A A . 25 ARG CD 1 1 10 2298 1 1 3 ARG CG C 4.749 1.499 -5.019 1.00 . A A . 25 ARG CG 1 1 10 2299 1 1 3 ARG CZ C 1.748 1.059 -6.345 1.00 . A A . 25 ARG CZ 1 1 10 2300 1 1 3 ARG H H 4.122 2.120 -2.541 1.00 . A A . 25 ARG H 1 1 10 2301 1 1 3 ARG HA H 6.725 1.276 -3.117 1.00 . A A . 25 ARG HA 1 1 10 2302 1 1 3 ARG HB2 H 5.281 3.564 -4.534 1.00 . A A . 25 ARG HB2 1 1 10 2303 1 1 3 ARG HB3 H 6.595 2.612 -5.189 1.00 . A A . 25 ARG HB3 1 1 10 2304 1 1 3 ARG HD2 H 3.627 2.958 -6.215 1.00 . A A . 25 ARG HD2 1 1 10 2305 1 1 3 ARG HD3 H 4.776 1.990 -7.097 1.00 . A A . 25 ARG HD3 1 1 10 2306 1 1 3 ARG HE H 3.344 0.124 -7.077 1.00 . A A . 25 ARG HE 1 1 10 2307 1 1 3 ARG HG2 H 5.307 0.598 -5.234 1.00 . A A . 25 ARG HG2 1 1 10 2308 1 1 3 ARG HG3 H 4.018 1.260 -4.261 1.00 . A A . 25 ARG HG3 1 1 10 2309 1 1 3 ARG HH11 H 1.962 2.835 -5.459 1.00 . A A . 25 ARG HH11 1 1 10 2310 1 1 3 ARG HH12 H 0.349 2.249 -5.515 1.00 . A A . 25 ARG HH12 1 1 10 2311 1 1 3 ARG HH21 H 1.295 -0.712 -7.169 1.00 . A A . 25 ARG HH21 1 1 10 2312 1 1 3 ARG HH22 H -0.033 0.140 -6.510 1.00 . A A . 25 ARG HH22 1 1 10 2313 1 1 3 ARG N N 5.033 2.143 -2.201 1.00 . A A . 25 ARG N 1 1 10 2314 1 1 3 ARG NE N 3.021 0.931 -6.620 1.00 . A A . 25 ARG NE 1 1 10 2315 1 1 3 ARG NH1 N 1.318 2.124 -5.728 1.00 . A A . 25 ARG NH1 1 1 10 2316 1 1 3 ARG NH2 N 0.948 0.097 -6.698 1.00 . A A . 25 ARG NH2 1 1 10 2317 1 1 3 ARG O O 8.401 3.081 -2.587 1.00 . A A . 25 ARG O 1 1 10 2318 1 1 4 HIS C C 8.316 5.131 -0.558 1.00 . A A . 26 HIS C 1 1 10 2319 1 1 4 HIS CA C 7.558 5.543 -1.815 1.00 . A A . 26 HIS CA 1 1 10 2320 1 1 4 HIS CB C 6.672 6.764 -1.532 1.00 . A A . 26 HIS CB 1 1 10 2321 1 1 4 HIS CD2 C 4.750 7.106 -3.256 1.00 . A A . 26 HIS CD2 1 1 10 2322 1 1 4 HIS CE1 C 5.849 8.073 -4.674 1.00 . A A . 26 HIS CE1 1 1 10 2323 1 1 4 HIS CG C 6.052 7.245 -2.845 1.00 . A A . 26 HIS CG 1 1 10 2324 1 1 4 HIS H H 5.706 4.553 -2.349 1.00 . A A . 26 HIS H 1 1 10 2325 1 1 4 HIS HA H 8.295 5.731 -2.570 1.00 . A A . 26 HIS HA 1 1 10 2326 1 1 4 HIS HB2 H 5.881 6.514 -0.838 1.00 . A A . 26 HIS HB2 1 1 10 2327 1 1 4 HIS HB3 H 7.264 7.564 -1.111 1.00 . A A . 26 HIS HB3 1 1 10 2328 1 1 4 HIS HD1 H 7.702 8.111 -3.737 1.00 . A A . 26 HIS HD1 1 1 10 2329 1 1 4 HIS HD2 H 3.956 6.634 -2.699 1.00 . A A . 26 HIS HD2 1 1 10 2330 1 1 4 HIS HE1 H 6.089 8.580 -5.600 1.00 . A A . 26 HIS HE1 1 1 10 2331 1 1 4 HIS N N 6.681 4.431 -2.297 1.00 . A A . 26 HIS N 1 1 10 2332 1 1 4 HIS ND1 N 6.752 7.863 -3.750 1.00 . A A . 26 HIS ND1 1 1 10 2333 1 1 4 HIS NE2 N 4.633 7.645 -4.440 1.00 . A A . 26 HIS NE2 1 1 10 2334 1 1 4 HIS O O 9.346 5.665 -0.207 1.00 . A A . 26 HIS O 1 1 10 2335 1 1 5 TYR C C 8.890 2.186 1.081 1.00 . A A . 27 TYR C 1 1 10 2336 1 1 5 TYR CA C 8.308 3.583 1.332 1.00 . A A . 27 TYR CA 1 1 10 2337 1 1 5 TYR CB C 7.158 3.546 2.337 1.00 . A A . 27 TYR CB 1 1 10 2338 1 1 5 TYR CD1 C 8.428 3.038 4.467 1.00 . A A . 27 TYR CD1 1 1 10 2339 1 1 5 TYR CD2 C 7.442 5.189 4.248 1.00 . A A . 27 TYR CD2 1 1 10 2340 1 1 5 TYR CE1 C 8.921 3.390 5.701 1.00 . A A . 27 TYR CE1 1 1 10 2341 1 1 5 TYR CE2 C 7.938 5.540 5.489 1.00 . A A . 27 TYR CE2 1 1 10 2342 1 1 5 TYR CG C 7.686 3.933 3.726 1.00 . A A . 27 TYR CG 1 1 10 2343 1 1 5 TYR CZ C 8.680 4.639 6.219 1.00 . A A . 27 TYR CZ 1 1 10 2344 1 1 5 TYR H H 6.931 3.795 -0.325 1.00 . A A . 27 TYR H 1 1 10 2345 1 1 5 TYR HA H 9.103 4.224 1.686 1.00 . A A . 27 TYR HA 1 1 10 2346 1 1 5 TYR HB2 H 6.395 4.226 2.005 1.00 . A A . 27 TYR HB2 1 1 10 2347 1 1 5 TYR HB3 H 6.742 2.548 2.377 1.00 . A A . 27 TYR HB3 1 1 10 2348 1 1 5 TYR HD1 H 8.624 2.049 4.081 1.00 . A A . 27 TYR HD1 1 1 10 2349 1 1 5 TYR HD2 H 6.862 5.905 3.684 1.00 . A A . 27 TYR HD2 1 1 10 2350 1 1 5 TYR HE1 H 9.505 2.677 6.268 1.00 . A A . 27 TYR HE1 1 1 10 2351 1 1 5 TYR HE2 H 7.741 6.527 5.883 1.00 . A A . 27 TYR HE2 1 1 10 2352 1 1 5 TYR HH H 8.481 5.325 7.994 1.00 . A A . 27 TYR HH 1 1 10 2353 1 1 5 TYR N N 7.749 4.153 0.071 1.00 . A A . 27 TYR N 1 1 10 2354 1 1 5 TYR O O 9.059 1.395 1.985 1.00 . A A . 27 TYR O 1 1 10 2355 1 1 5 TYR OH O 9.192 4.970 7.454 1.00 . A A . 27 TYR OH 1 1 10 2356 1 1 6 LYS C C 11.319 0.662 -0.493 1.00 . A A . 28 LYS C 1 1 10 2357 1 1 6 LYS CA C 9.775 0.600 -0.553 1.00 . A A . 28 LYS CA 1 1 10 2358 1 1 6 LYS CB C 9.224 0.287 -1.972 1.00 . A A . 28 LYS CB 1 1 10 2359 1 1 6 LYS CD C 10.960 -0.310 -3.614 1.00 . A A . 28 LYS CD 1 1 10 2360 1 1 6 LYS CE C 11.852 -1.408 -4.149 1.00 . A A . 28 LYS CE 1 1 10 2361 1 1 6 LYS CG C 9.941 -0.899 -2.627 1.00 . A A . 28 LYS CG 1 1 10 2362 1 1 6 LYS H H 8.994 2.633 -0.809 1.00 . A A . 28 LYS H 1 1 10 2363 1 1 6 LYS HA H 9.429 -0.167 0.115 1.00 . A A . 28 LYS HA 1 1 10 2364 1 1 6 LYS HB2 H 8.170 0.067 -1.902 1.00 . A A . 28 LYS HB2 1 1 10 2365 1 1 6 LYS HB3 H 9.346 1.144 -2.612 1.00 . A A . 28 LYS HB3 1 1 10 2366 1 1 6 LYS HD2 H 10.408 0.151 -4.415 1.00 . A A . 28 LYS HD2 1 1 10 2367 1 1 6 LYS HD3 H 11.570 0.452 -3.156 1.00 . A A . 28 LYS HD3 1 1 10 2368 1 1 6 LYS HE2 H 11.271 -2.182 -4.629 1.00 . A A . 28 LYS HE2 1 1 10 2369 1 1 6 LYS HE3 H 12.575 -1.012 -4.852 1.00 . A A . 28 LYS HE3 1 1 10 2370 1 1 6 LYS HG2 H 10.434 -1.518 -1.891 1.00 . A A . 28 LYS HG2 1 1 10 2371 1 1 6 LYS HG3 H 9.237 -1.515 -3.168 1.00 . A A . 28 LYS HG3 1 1 10 2372 1 1 6 LYS HZ1 H 12.007 -2.443 -2.289 1.00 . A A . 28 LYS HZ1 1 1 10 2373 1 1 6 LYS N N 9.187 1.926 -0.157 1.00 . A A . 28 LYS N 1 1 10 2374 1 1 6 LYS NZ N 12.541 -1.974 -2.962 1.00 . A A . 28 LYS NZ 1 1 10 2375 1 1 6 LYS O O 11.983 -0.186 0.088 1.00 . A A . 28 LYS O 1 1 10 2376 1 1 7 ASN C C 13.890 1.717 0.312 1.00 . A A . 29 ASN C 1 1 10 2377 1 1 7 ASN CA C 13.339 1.877 -1.128 1.00 . A A . 29 ASN CA 1 1 10 2378 1 1 7 ASN CB C 13.648 3.287 -1.694 1.00 . A A . 29 ASN CB 1 1 10 2379 1 1 7 ASN CG C 15.131 3.364 -2.062 1.00 . A A . 29 ASN CG 1 1 10 2380 1 1 7 ASN H H 11.242 2.323 -1.551 1.00 . A A . 29 ASN H 1 1 10 2381 1 1 7 ASN HA H 13.780 1.117 -1.758 1.00 . A A . 29 ASN HA 1 1 10 2382 1 1 7 ASN HB2 H 13.062 3.489 -2.577 1.00 . A A . 29 ASN HB2 1 1 10 2383 1 1 7 ASN HB3 H 13.452 4.052 -0.958 1.00 . A A . 29 ASN HB3 1 1 10 2384 1 1 7 ASN HD21 H 14.820 3.476 -4.025 1.00 . A A . 29 ASN HD21 1 1 10 2385 1 1 7 ASN HD22 H 16.441 3.512 -3.506 1.00 . A A . 29 ASN HD22 1 1 10 2386 1 1 7 ASN N N 11.847 1.689 -1.109 1.00 . A A . 29 ASN N 1 1 10 2387 1 1 7 ASN ND2 N 15.485 3.458 -3.307 1.00 . A A . 29 ASN ND2 1 1 10 2388 1 1 7 ASN O O 14.786 0.936 0.573 1.00 . A A . 29 ASN O 1 1 10 2389 1 1 7 ASN OD1 O 16.003 3.338 -1.222 1.00 . A A . 29 ASN OD1 1 1 10 2390 1 1 8 LEU C C 13.849 1.043 3.161 1.00 . A A . 30 LEU C 1 1 10 2391 1 1 8 LEU CA C 13.686 2.479 2.650 1.00 . A A . 30 LEU CA 1 1 10 2392 1 1 8 LEU CB C 12.594 3.199 3.497 1.00 . A A . 30 LEU CB 1 1 10 2393 1 1 8 LEU CD1 C 12.237 5.193 1.870 1.00 . A A . 30 LEU CD1 1 1 10 2394 1 1 8 LEU CD2 C 11.615 5.403 4.295 1.00 . A A . 30 LEU CD2 1 1 10 2395 1 1 8 LEU CG C 12.606 4.755 3.306 1.00 . A A . 30 LEU CG 1 1 10 2396 1 1 8 LEU H H 12.588 3.076 0.897 1.00 . A A . 30 LEU H 1 1 10 2397 1 1 8 LEU HA H 14.638 2.978 2.755 1.00 . A A . 30 LEU HA 1 1 10 2398 1 1 8 LEU HB2 H 11.616 2.806 3.250 1.00 . A A . 30 LEU HB2 1 1 10 2399 1 1 8 LEU HB3 H 12.774 2.976 4.540 1.00 . A A . 30 LEU HB3 1 1 10 2400 1 1 8 LEU HD11 H 12.208 6.272 1.814 1.00 . A A . 30 LEU HD11 1 1 10 2401 1 1 8 LEU HD12 H 11.265 4.823 1.585 1.00 . A A . 30 LEU HD12 1 1 10 2402 1 1 8 LEU HD13 H 12.974 4.858 1.157 1.00 . A A . 30 LEU HD13 1 1 10 2403 1 1 8 LEU HD21 H 11.907 5.202 5.315 1.00 . A A . 30 LEU HD21 1 1 10 2404 1 1 8 LEU HD22 H 10.615 5.023 4.141 1.00 . A A . 30 LEU HD22 1 1 10 2405 1 1 8 LEU HD23 H 11.591 6.476 4.157 1.00 . A A . 30 LEU HD23 1 1 10 2406 1 1 8 LEU HG H 13.596 5.126 3.535 1.00 . A A . 30 LEU HG 1 1 10 2407 1 1 8 LEU N N 13.303 2.484 1.199 1.00 . A A . 30 LEU N 1 1 10 2408 1 1 8 LEU O O 14.761 0.728 3.901 1.00 . A A . 30 LEU O 1 1 10 2409 1 1 9 ILE C C 14.288 -1.794 2.599 1.00 . A A . 31 ILE C 1 1 10 2410 1 1 9 ILE CA C 13.008 -1.216 3.191 1.00 . A A . 31 ILE CA 1 1 10 2411 1 1 9 ILE CB C 11.745 -1.971 2.674 1.00 . A A . 31 ILE CB 1 1 10 2412 1 1 9 ILE CD1 C 9.191 -1.859 2.602 1.00 . A A . 31 ILE CD1 1 1 10 2413 1 1 9 ILE CG1 C 10.473 -1.230 3.188 1.00 . A A . 31 ILE CG1 1 1 10 2414 1 1 9 ILE CG2 C 11.746 -3.407 3.246 1.00 . A A . 31 ILE CG2 1 1 10 2415 1 1 9 ILE H H 12.219 0.505 2.153 1.00 . A A . 31 ILE H 1 1 10 2416 1 1 9 ILE HA H 13.090 -1.258 4.251 1.00 . A A . 31 ILE HA 1 1 10 2417 1 1 9 ILE HB H 11.745 -2.009 1.595 1.00 . A A . 31 ILE HB 1 1 10 2418 1 1 9 ILE HD11 H 9.221 -1.842 1.524 1.00 . A A . 31 ILE HD11 1 1 10 2419 1 1 9 ILE HD12 H 8.331 -1.293 2.932 1.00 . A A . 31 ILE HD12 1 1 10 2420 1 1 9 ILE HD13 H 9.072 -2.882 2.930 1.00 . A A . 31 ILE HD13 1 1 10 2421 1 1 9 ILE HG12 H 10.431 -1.289 4.266 1.00 . A A . 31 ILE HG12 1 1 10 2422 1 1 9 ILE HG13 H 10.501 -0.187 2.917 1.00 . A A . 31 ILE HG13 1 1 10 2423 1 1 9 ILE HG21 H 11.695 -3.380 4.327 1.00 . A A . 31 ILE HG21 1 1 10 2424 1 1 9 ILE HG22 H 12.646 -3.930 2.962 1.00 . A A . 31 ILE HG22 1 1 10 2425 1 1 9 ILE HG23 H 10.901 -3.966 2.874 1.00 . A A . 31 ILE HG23 1 1 10 2426 1 1 9 ILE N N 12.939 0.204 2.751 1.00 . A A . 31 ILE N 1 1 10 2427 1 1 9 ILE O O 15.128 -2.354 3.275 1.00 . A A . 31 ILE O 1 1 10 2428 1 1 10 GLU C C 16.929 -1.688 1.146 1.00 . A A . 32 GLU C 1 1 10 2429 1 1 10 GLU CA C 15.597 -2.133 0.574 1.00 . A A . 32 GLU CA 1 1 10 2430 1 1 10 GLU CB C 15.475 -1.705 -0.893 1.00 . A A . 32 GLU CB 1 1 10 2431 1 1 10 GLU CD C 13.832 -1.869 -2.784 1.00 . A A . 32 GLU CD 1 1 10 2432 1 1 10 GLU CG C 14.310 -2.519 -1.502 1.00 . A A . 32 GLU CG 1 1 10 2433 1 1 10 GLU H H 13.653 -1.121 0.911 1.00 . A A . 32 GLU H 1 1 10 2434 1 1 10 GLU HA H 15.596 -3.186 0.694 1.00 . A A . 32 GLU HA 1 1 10 2435 1 1 10 GLU HB2 H 15.284 -0.647 -0.983 1.00 . A A . 32 GLU HB2 1 1 10 2436 1 1 10 GLU HB3 H 16.390 -1.928 -1.424 1.00 . A A . 32 GLU HB3 1 1 10 2437 1 1 10 GLU HG2 H 14.630 -3.519 -1.744 1.00 . A A . 32 GLU HG2 1 1 10 2438 1 1 10 GLU HG3 H 13.473 -2.572 -0.824 1.00 . A A . 32 GLU HG3 1 1 10 2439 1 1 10 GLU N N 14.397 -1.617 1.320 1.00 . A A . 32 GLU N 1 1 10 2440 1 1 10 GLU O O 17.916 -2.392 1.059 1.00 . A A . 32 GLU O 1 1 10 2441 1 1 10 GLU OE1 O 14.609 -1.326 -3.545 1.00 . A A . 32 GLU OE1 1 1 10 2442 1 1 11 ARG C C 18.645 -0.869 3.366 1.00 . A A . 33 ARG C 1 1 10 2443 1 1 11 ARG CA C 18.073 0.124 2.349 1.00 . A A . 33 ARG CA 1 1 10 2444 1 1 11 ARG CB C 17.658 1.451 3.091 1.00 . A A . 33 ARG CB 1 1 10 2445 1 1 11 ARG CD C 18.538 3.377 4.606 1.00 . A A . 33 ARG CD 1 1 10 2446 1 1 11 ARG CG C 18.906 2.113 3.767 1.00 . A A . 33 ARG CG 1 1 10 2447 1 1 11 ARG CZ C 20.052 4.393 6.339 1.00 . A A . 33 ARG CZ 1 1 10 2448 1 1 11 ARG H H 15.985 -0.111 1.651 1.00 . A A . 33 ARG H 1 1 10 2449 1 1 11 ARG HA H 18.829 0.281 1.600 1.00 . A A . 33 ARG HA 1 1 10 2450 1 1 11 ARG HB2 H 17.205 2.132 2.383 1.00 . A A . 33 ARG HB2 1 1 10 2451 1 1 11 ARG HB3 H 16.931 1.224 3.854 1.00 . A A . 33 ARG HB3 1 1 10 2452 1 1 11 ARG HD2 H 18.022 4.127 4.016 1.00 . A A . 33 ARG HD2 1 1 10 2453 1 1 11 ARG HD3 H 17.904 3.058 5.421 1.00 . A A . 33 ARG HD3 1 1 10 2454 1 1 11 ARG HE H 20.589 3.925 4.482 1.00 . A A . 33 ARG HE 1 1 10 2455 1 1 11 ARG HG2 H 19.385 1.396 4.420 1.00 . A A . 33 ARG HG2 1 1 10 2456 1 1 11 ARG HG3 H 19.611 2.381 2.992 1.00 . A A . 33 ARG HG3 1 1 10 2457 1 1 11 ARG HH11 H 18.169 4.094 6.935 1.00 . A A . 33 ARG HH11 1 1 10 2458 1 1 11 ARG HH12 H 19.192 4.764 8.124 1.00 . A A . 33 ARG HH12 1 1 10 2459 1 1 11 ARG HH21 H 21.992 4.782 5.977 1.00 . A A . 33 ARG HH21 1 1 10 2460 1 1 11 ARG HH22 H 21.459 5.204 7.550 1.00 . A A . 33 ARG HH22 1 1 10 2461 1 1 11 ARG N N 16.875 -0.519 1.702 1.00 . A A . 33 ARG N 1 1 10 2462 1 1 11 ARG NE N 19.846 3.932 5.124 1.00 . A A . 33 ARG NE 1 1 10 2463 1 1 11 ARG NH1 N 19.071 4.421 7.196 1.00 . A A . 33 ARG NH1 1 1 10 2464 1 1 11 ARG NH2 N 21.248 4.823 6.647 1.00 . A A . 33 ARG NH2 1 1 10 2465 1 1 11 ARG O O 19.837 -1.017 3.540 1.00 . A A . 33 ARG O 1 1 10 2466 1 1 12 GLN C C 18.755 -3.754 4.376 1.00 . A A . 34 GLN C 1 1 10 2467 1 1 12 GLN CA C 18.121 -2.540 5.039 1.00 . A A . 34 GLN CA 1 1 10 2468 1 1 12 GLN CB C 16.875 -2.945 5.805 1.00 . A A . 34 GLN CB 1 1 10 2469 1 1 12 GLN CD C 14.945 -2.109 7.099 1.00 . A A . 34 GLN CD 1 1 10 2470 1 1 12 GLN CG C 16.244 -1.689 6.432 1.00 . A A . 34 GLN CG 1 1 10 2471 1 1 12 GLN H H 16.785 -1.375 3.793 1.00 . A A . 34 GLN H 1 1 10 2472 1 1 12 GLN HA H 18.856 -2.098 5.699 1.00 . A A . 34 GLN HA 1 1 10 2473 1 1 12 GLN HB2 H 16.170 -3.427 5.140 1.00 . A A . 34 GLN HB2 1 1 10 2474 1 1 12 GLN HB3 H 17.138 -3.645 6.586 1.00 . A A . 34 GLN HB3 1 1 10 2475 1 1 12 GLN HE21 H 13.838 -0.901 5.998 1.00 . A A . 34 GLN HE21 1 1 10 2476 1 1 12 GLN HE22 H 12.993 -1.846 7.145 1.00 . A A . 34 GLN HE22 1 1 10 2477 1 1 12 GLN HG2 H 16.894 -1.268 7.186 1.00 . A A . 34 GLN HG2 1 1 10 2478 1 1 12 GLN HG3 H 16.030 -0.937 5.686 1.00 . A A . 34 GLN HG3 1 1 10 2479 1 1 12 GLN N N 17.732 -1.537 4.008 1.00 . A A . 34 GLN N 1 1 10 2480 1 1 12 GLN NE2 N 13.828 -1.570 6.713 1.00 . A A . 34 GLN NE2 1 1 10 2481 1 1 12 GLN O O 19.467 -4.512 5.001 1.00 . A A . 34 GLN O 1 1 10 2482 1 1 12 GLN OE1 O 14.926 -2.937 7.983 1.00 . A A . 34 GLN OE1 1 1 10 2483 1 1 13 ARG C C 20.471 -4.624 1.851 1.00 . A A . 35 ARG C 1 1 10 2484 1 1 13 ARG CA C 19.087 -5.084 2.386 1.00 . A A . 35 ARG CA 1 1 10 2485 1 1 13 ARG CB C 18.087 -5.464 1.248 1.00 . A A . 35 ARG CB 1 1 10 2486 1 1 13 ARG CD C 19.570 -7.387 0.509 1.00 . A A . 35 ARG CD 1 1 10 2487 1 1 13 ARG CG C 18.134 -6.975 0.860 1.00 . A A . 35 ARG CG 1 1 10 2488 1 1 13 ARG CZ C 20.392 -9.033 -1.114 1.00 . A A . 35 ARG CZ 1 1 10 2489 1 1 13 ARG H H 17.941 -3.283 2.644 1.00 . A A . 35 ARG H 1 1 10 2490 1 1 13 ARG HA H 19.223 -5.894 3.080 1.00 . A A . 35 ARG HA 1 1 10 2491 1 1 13 ARG HB2 H 17.085 -5.226 1.573 1.00 . A A . 35 ARG HB2 1 1 10 2492 1 1 13 ARG HB3 H 18.307 -4.859 0.379 1.00 . A A . 35 ARG HB3 1 1 10 2493 1 1 13 ARG HD2 H 19.912 -6.648 -0.196 1.00 . A A . 35 ARG HD2 1 1 10 2494 1 1 13 ARG HD3 H 20.213 -7.397 1.380 1.00 . A A . 35 ARG HD3 1 1 10 2495 1 1 13 ARG HE H 18.925 -9.402 0.190 1.00 . A A . 35 ARG HE 1 1 10 2496 1 1 13 ARG HG2 H 17.759 -7.570 1.681 1.00 . A A . 35 ARG HG2 1 1 10 2497 1 1 13 ARG HG3 H 17.490 -7.133 0.006 1.00 . A A . 35 ARG HG3 1 1 10 2498 1 1 13 ARG HH11 H 21.326 -7.251 -1.087 1.00 . A A . 35 ARG HH11 1 1 10 2499 1 1 13 ARG HH12 H 21.892 -8.336 -2.276 1.00 . A A . 35 ARG HH12 1 1 10 2500 1 1 13 ARG HH21 H 19.666 -10.908 -1.345 1.00 . A A . 35 ARG HH21 1 1 10 2501 1 1 13 ARG HH22 H 20.939 -10.484 -2.399 1.00 . A A . 35 ARG HH22 1 1 10 2502 1 1 13 ARG N N 18.508 -3.923 3.111 1.00 . A A . 35 ARG N 1 1 10 2503 1 1 13 ARG NE N 19.572 -8.738 -0.134 1.00 . A A . 35 ARG NE 1 1 10 2504 1 1 13 ARG NH1 N 21.263 -8.148 -1.523 1.00 . A A . 35 ARG NH1 1 1 10 2505 1 1 13 ARG NH2 N 20.326 -10.220 -1.652 1.00 . A A . 35 ARG NH2 1 1 10 2506 1 1 13 ARG O O 20.926 -5.002 0.789 1.00 . A A . 35 ARG O 1 1 10 2507 1 1 14 TYR C C 23.244 -3.549 3.596 1.00 . A A . 36 TYR C 1 1 10 2508 1 1 14 TYR CA C 22.446 -3.252 2.319 1.00 . A A . 36 TYR CA 1 1 10 2509 1 1 14 TYR CB C 22.345 -1.730 2.061 1.00 . A A . 36 TYR CB 1 1 10 2510 1 1 14 TYR CD1 C 24.132 -1.512 0.259 1.00 . A A . 36 TYR CD1 1 1 10 2511 1 1 14 TYR CD2 C 24.508 -0.450 2.356 1.00 . A A . 36 TYR CD2 1 1 10 2512 1 1 14 TYR CE1 C 25.350 -1.048 -0.191 1.00 . A A . 36 TYR CE1 1 1 10 2513 1 1 14 TYR CE2 C 25.725 0.013 1.905 1.00 . A A . 36 TYR CE2 1 1 10 2514 1 1 14 TYR CG C 23.700 -1.217 1.540 1.00 . A A . 36 TYR CG 1 1 10 2515 1 1 14 TYR CZ C 26.153 -0.283 0.629 1.00 . A A . 36 TYR CZ 1 1 10 2516 1 1 14 TYR H H 20.699 -3.517 3.476 1.00 . A A . 36 TYR H 1 1 10 2517 1 1 14 TYR HA H 22.866 -3.796 1.492 1.00 . A A . 36 TYR HA 1 1 10 2518 1 1 14 TYR HB2 H 21.572 -1.510 1.340 1.00 . A A . 36 TYR HB2 1 1 10 2519 1 1 14 TYR HB3 H 22.113 -1.225 2.991 1.00 . A A . 36 TYR HB3 1 1 10 2520 1 1 14 TYR HD1 H 23.514 -2.111 -0.395 1.00 . A A . 36 TYR HD1 1 1 10 2521 1 1 14 TYR HD2 H 24.181 -0.219 3.359 1.00 . A A . 36 TYR HD2 1 1 10 2522 1 1 14 TYR HE1 H 25.681 -1.285 -1.192 1.00 . A A . 36 TYR HE1 1 1 10 2523 1 1 14 TYR HE2 H 26.341 0.609 2.562 1.00 . A A . 36 TYR HE2 1 1 10 2524 1 1 14 TYR HH H 27.555 1.009 0.623 1.00 . A A . 36 TYR HH 1 1 10 2525 1 1 14 TYR N N 21.107 -3.800 2.638 1.00 . A A . 36 TYR N 1 1 10 2526 1 1 14 TYR O O 23.792 -2.685 4.246 1.00 . A A . 36 TYR O 1 1 10 2527 1 1 14 TYR OH O 27.368 0.181 0.173 1.00 . A A . 36 TYR OH 1 1 10 2528 1 1 15 NH2 HN1 H 22.891 -5.496 3.492 1.00 . A A . 37 NH2 HN1 1 1 10 2529 1 1 15 NH2 HN2 H 23.824 -4.978 4.816 1.00 . A A . 37 NH2 HN2 1 1 10 2530 1 1 15 NH2 N N 23.324 -4.782 3.998 1.00 . A A . 37 NH2 N 1 1 11 2531 1 1 1 ACE C C 1.857 1.929 -2.835 1.00 . A A . 23 ACE C 1 1 11 2532 1 1 1 ACE CH3 C 0.916 0.840 -3.335 1.00 . A A . 23 ACE CH3 1 1 11 2533 1 1 1 ACE H1 H 1.397 0.282 -4.125 1.00 . A A . 23 ACE H1 1 1 11 2534 1 1 1 ACE H2 H 0.020 1.305 -3.720 1.00 . A A . 23 ACE H2 1 1 11 2535 1 1 1 ACE H3 H 0.652 0.175 -2.529 1.00 . A A . 23 ACE H3 1 1 11 2536 1 1 1 ACE O O 2.233 2.802 -3.594 1.00 . A A . 23 ACE O 1 1 11 2537 1 1 2 ALA C C 4.646 2.637 -1.408 1.00 . A A . 24 ALA C 1 1 11 2538 1 1 2 ALA CA C 3.173 2.933 -1.050 1.00 . A A . 24 ALA CA 1 1 11 2539 1 1 2 ALA CB C 2.990 2.994 0.479 1.00 . A A . 24 ALA CB 1 1 11 2540 1 1 2 ALA H H 1.946 1.145 -1.011 1.00 . A A . 24 ALA H 1 1 11 2541 1 1 2 ALA HA H 2.902 3.890 -1.476 1.00 . A A . 24 ALA HA 1 1 11 2542 1 1 2 ALA HB1 H 3.244 2.044 0.932 1.00 . A A . 24 ALA HB1 1 1 11 2543 1 1 2 ALA HB2 H 1.969 3.244 0.732 1.00 . A A . 24 ALA HB2 1 1 11 2544 1 1 2 ALA HB3 H 3.642 3.750 0.891 1.00 . A A . 24 ALA HB3 1 1 11 2545 1 1 2 ALA N N 2.251 1.876 -1.590 1.00 . A A . 24 ALA N 1 1 11 2546 1 1 2 ALA O O 5.549 2.775 -0.607 1.00 . A A . 24 ALA O 1 1 11 2547 1 1 3 ARG C C 7.272 2.902 -2.791 1.00 . A A . 25 ARG C 1 1 11 2548 1 1 3 ARG CA C 6.175 1.902 -3.202 1.00 . A A . 25 ARG CA 1 1 11 2549 1 1 3 ARG CB C 6.012 1.838 -4.733 1.00 . A A . 25 ARG CB 1 1 11 2550 1 1 3 ARG CD C 4.555 2.972 -6.461 1.00 . A A . 25 ARG CD 1 1 11 2551 1 1 3 ARG CG C 5.483 3.195 -5.264 1.00 . A A . 25 ARG CG 1 1 11 2552 1 1 3 ARG CZ C 3.209 5.031 -6.431 1.00 . A A . 25 ARG CZ 1 1 11 2553 1 1 3 ARG H H 4.035 2.164 -3.209 1.00 . A A . 25 ARG H 1 1 11 2554 1 1 3 ARG HA H 6.461 0.928 -2.830 1.00 . A A . 25 ARG HA 1 1 11 2555 1 1 3 ARG HB2 H 6.981 1.634 -5.169 1.00 . A A . 25 ARG HB2 1 1 11 2556 1 1 3 ARG HB3 H 5.351 1.024 -4.994 1.00 . A A . 25 ARG HB3 1 1 11 2557 1 1 3 ARG HD2 H 5.080 2.445 -7.247 1.00 . A A . 25 ARG HD2 1 1 11 2558 1 1 3 ARG HD3 H 3.673 2.397 -6.209 1.00 . A A . 25 ARG HD3 1 1 11 2559 1 1 3 ARG HE H 4.682 4.675 -7.733 1.00 . A A . 25 ARG HE 1 1 11 2560 1 1 3 ARG HG2 H 4.943 3.731 -4.500 1.00 . A A . 25 ARG HG2 1 1 11 2561 1 1 3 ARG HG3 H 6.322 3.804 -5.568 1.00 . A A . 25 ARG HG3 1 1 11 2562 1 1 3 ARG HH11 H 2.826 3.660 -5.023 1.00 . A A . 25 ARG HH11 1 1 11 2563 1 1 3 ARG HH12 H 1.815 5.022 -4.956 1.00 . A A . 25 ARG HH12 1 1 11 2564 1 1 3 ARG HH21 H 3.435 6.543 -7.730 1.00 . A A . 25 ARG HH21 1 1 11 2565 1 1 3 ARG HH22 H 2.205 6.765 -6.563 1.00 . A A . 25 ARG HH22 1 1 11 2566 1 1 3 ARG N N 4.826 2.240 -2.637 1.00 . A A . 25 ARG N 1 1 11 2567 1 1 3 ARG NE N 4.176 4.332 -6.967 1.00 . A A . 25 ARG NE 1 1 11 2568 1 1 3 ARG NH1 N 2.570 4.550 -5.405 1.00 . A A . 25 ARG NH1 1 1 11 2569 1 1 3 ARG NH2 N 2.930 6.193 -6.943 1.00 . A A . 25 ARG NH2 1 1 11 2570 1 1 3 ARG O O 8.400 2.538 -2.528 1.00 . A A . 25 ARG O 1 1 11 2571 1 1 4 HIS C C 8.567 4.912 -1.010 1.00 . A A . 26 HIS C 1 1 11 2572 1 1 4 HIS CA C 7.907 5.216 -2.361 1.00 . A A . 26 HIS CA 1 1 11 2573 1 1 4 HIS CB C 7.169 6.561 -2.303 1.00 . A A . 26 HIS CB 1 1 11 2574 1 1 4 HIS CD2 C 5.099 6.962 -3.829 1.00 . A A . 26 HIS CD2 1 1 11 2575 1 1 4 HIS CE1 C 6.096 7.212 -5.589 1.00 . A A . 26 HIS CE1 1 1 11 2576 1 1 4 HIS CG C 6.451 6.841 -3.631 1.00 . A A . 26 HIS CG 1 1 11 2577 1 1 4 HIS H H 6.006 4.404 -2.983 1.00 . A A . 26 HIS H 1 1 11 2578 1 1 4 HIS HA H 8.690 5.205 -3.088 1.00 . A A . 26 HIS HA 1 1 11 2579 1 1 4 HIS HB2 H 6.445 6.556 -1.503 1.00 . A A . 26 HIS HB2 1 1 11 2580 1 1 4 HIS HB3 H 7.878 7.356 -2.120 1.00 . A A . 26 HIS HB3 1 1 11 2581 1 1 4 HIS HD1 H 8.049 6.966 -4.931 1.00 . A A . 26 HIS HD1 1 1 11 2582 1 1 4 HIS HD2 H 4.336 6.879 -3.070 1.00 . A A . 26 HIS HD2 1 1 11 2583 1 1 4 HIS HE1 H 6.272 7.391 -6.642 1.00 . A A . 26 HIS HE1 1 1 11 2584 1 1 4 HIS N N 6.922 4.158 -2.751 1.00 . A A . 26 HIS N 1 1 11 2585 1 1 4 HIS ND1 N 7.081 7.000 -4.758 1.00 . A A . 26 HIS ND1 1 1 11 2586 1 1 4 HIS NE2 N 4.884 7.202 -5.096 1.00 . A A . 26 HIS NE2 1 1 11 2587 1 1 4 HIS O O 9.679 5.308 -0.725 1.00 . A A . 26 HIS O 1 1 11 2588 1 1 5 TYR C C 8.819 2.332 1.130 1.00 . A A . 27 TYR C 1 1 11 2589 1 1 5 TYR CA C 8.251 3.763 1.145 1.00 . A A . 27 TYR CA 1 1 11 2590 1 1 5 TYR CB C 7.035 3.811 2.098 1.00 . A A . 27 TYR CB 1 1 11 2591 1 1 5 TYR CD1 C 6.711 6.359 2.079 1.00 . A A . 27 TYR CD1 1 1 11 2592 1 1 5 TYR CD2 C 6.748 5.236 4.170 1.00 . A A . 27 TYR CD2 1 1 11 2593 1 1 5 TYR CE1 C 6.513 7.562 2.737 1.00 . A A . 27 TYR CE1 1 1 11 2594 1 1 5 TYR CE2 C 6.551 6.436 4.823 1.00 . A A . 27 TYR CE2 1 1 11 2595 1 1 5 TYR CG C 6.830 5.178 2.788 1.00 . A A . 27 TYR CG 1 1 11 2596 1 1 5 TYR CZ C 6.432 7.607 4.111 1.00 . A A . 27 TYR CZ 1 1 11 2597 1 1 5 TYR H H 6.957 3.927 -0.602 1.00 . A A . 27 TYR H 1 1 11 2598 1 1 5 TYR HA H 9.028 4.427 1.495 1.00 . A A . 27 TYR HA 1 1 11 2599 1 1 5 TYR HB2 H 6.138 3.565 1.550 1.00 . A A . 27 TYR HB2 1 1 11 2600 1 1 5 TYR HB3 H 7.171 3.050 2.849 1.00 . A A . 27 TYR HB3 1 1 11 2601 1 1 5 TYR HD1 H 6.776 6.346 1.003 1.00 . A A . 27 TYR HD1 1 1 11 2602 1 1 5 TYR HD2 H 6.837 4.332 4.755 1.00 . A A . 27 TYR HD2 1 1 11 2603 1 1 5 TYR HE1 H 6.420 8.483 2.179 1.00 . A A . 27 TYR HE1 1 1 11 2604 1 1 5 TYR HE2 H 6.489 6.454 5.902 1.00 . A A . 27 TYR HE2 1 1 11 2605 1 1 5 TYR HH H 6.917 8.915 5.426 1.00 . A A . 27 TYR HH 1 1 11 2606 1 1 5 TYR N N 7.824 4.189 -0.231 1.00 . A A . 27 TYR N 1 1 11 2607 1 1 5 TYR O O 8.940 1.687 2.153 1.00 . A A . 27 TYR O 1 1 11 2608 1 1 5 TYR OH O 6.233 8.808 4.759 1.00 . A A . 27 TYR OH 1 1 11 2609 1 1 6 LYS C C 11.258 0.725 -0.071 1.00 . A A . 28 LYS C 1 1 11 2610 1 1 6 LYS CA C 9.737 0.503 -0.212 1.00 . A A . 28 LYS CA 1 1 11 2611 1 1 6 LYS CB C 9.379 -0.031 -1.620 1.00 . A A . 28 LYS CB 1 1 11 2612 1 1 6 LYS CD C 9.249 -2.163 -3.006 1.00 . A A . 28 LYS CD 1 1 11 2613 1 1 6 LYS CE C 10.615 -1.937 -3.680 1.00 . A A . 28 LYS CE 1 1 11 2614 1 1 6 LYS CG C 9.260 -1.563 -1.579 1.00 . A A . 28 LYS CG 1 1 11 2615 1 1 6 LYS H H 9.017 2.476 -0.803 1.00 . A A . 28 LYS H 1 1 11 2616 1 1 6 LYS HA H 9.391 -0.164 0.566 1.00 . A A . 28 LYS HA 1 1 11 2617 1 1 6 LYS HB2 H 8.423 0.354 -1.930 1.00 . A A . 28 LYS HB2 1 1 11 2618 1 1 6 LYS HB3 H 10.121 0.265 -2.347 1.00 . A A . 28 LYS HB3 1 1 11 2619 1 1 6 LYS HD2 H 9.060 -3.220 -2.907 1.00 . A A . 28 LYS HD2 1 1 11 2620 1 1 6 LYS HD3 H 8.463 -1.727 -3.607 1.00 . A A . 28 LYS HD3 1 1 11 2621 1 1 6 LYS HE2 H 10.697 -2.592 -4.533 1.00 . A A . 28 LYS HE2 1 1 11 2622 1 1 6 LYS HE3 H 10.761 -0.915 -4.002 1.00 . A A . 28 LYS HE3 1 1 11 2623 1 1 6 LYS HG2 H 10.054 -2.001 -0.997 1.00 . A A . 28 LYS HG2 1 1 11 2624 1 1 6 LYS HG3 H 8.322 -1.834 -1.120 1.00 . A A . 28 LYS HG3 1 1 11 2625 1 1 6 LYS HZ1 H 11.651 -3.255 -2.347 1.00 . A A . 28 LYS HZ1 1 1 11 2626 1 1 6 LYS N N 9.159 1.882 -0.040 1.00 . A A . 28 LYS N 1 1 11 2627 1 1 6 LYS NZ N 11.636 -2.327 -2.661 1.00 . A A . 28 LYS NZ 1 1 11 2628 1 1 6 LYS O O 11.989 -0.028 0.554 1.00 . A A . 28 LYS O 1 1 11 2629 1 1 7 ASN C C 13.745 2.072 0.700 1.00 . A A . 29 ASN C 1 1 11 2630 1 1 7 ASN CA C 13.113 2.227 -0.703 1.00 . A A . 29 ASN CA 1 1 11 2631 1 1 7 ASN CB C 13.176 3.695 -1.136 1.00 . A A . 29 ASN CB 1 1 11 2632 1 1 7 ASN CG C 14.639 4.024 -1.392 1.00 . A A . 29 ASN CG 1 1 11 2633 1 1 7 ASN H H 11.015 2.321 -1.190 1.00 . A A . 29 ASN H 1 1 11 2634 1 1 7 ASN HA H 13.655 1.621 -1.414 1.00 . A A . 29 ASN HA 1 1 11 2635 1 1 7 ASN HB2 H 12.632 3.845 -2.058 1.00 . A A . 29 ASN HB2 1 1 11 2636 1 1 7 ASN HB3 H 12.787 4.366 -0.383 1.00 . A A . 29 ASN HB3 1 1 11 2637 1 1 7 ASN HD21 H 14.953 4.906 0.359 1.00 . A A . 29 ASN HD21 1 1 11 2638 1 1 7 ASN HD22 H 16.287 4.826 -0.698 1.00 . A A . 29 ASN HD22 1 1 11 2639 1 1 7 ASN N N 11.679 1.792 -0.699 1.00 . A A . 29 ASN N 1 1 11 2640 1 1 7 ASN ND2 N 15.348 4.639 -0.495 1.00 . A A . 29 ASN ND2 1 1 11 2641 1 1 7 ASN O O 14.773 1.453 0.900 1.00 . A A . 29 ASN O 1 1 11 2642 1 1 7 ASN OD1 O 15.172 3.709 -2.433 1.00 . A A . 29 ASN OD1 1 1 11 2643 1 1 8 LEU C C 13.671 1.268 3.625 1.00 . A A . 30 LEU C 1 1 11 2644 1 1 8 LEU CA C 13.442 2.679 3.077 1.00 . A A . 30 LEU CA 1 1 11 2645 1 1 8 LEU CB C 12.327 3.379 3.885 1.00 . A A . 30 LEU CB 1 1 11 2646 1 1 8 LEU CD1 C 10.864 5.408 4.117 1.00 . A A . 30 LEU CD1 1 1 11 2647 1 1 8 LEU CD2 C 13.278 5.719 3.528 1.00 . A A . 30 LEU CD2 1 1 11 2648 1 1 8 LEU CG C 12.042 4.808 3.336 1.00 . A A . 30 LEU CG 1 1 11 2649 1 1 8 LEU H H 12.230 3.131 1.357 1.00 . A A . 30 LEU H 1 1 11 2650 1 1 8 LEU HA H 14.376 3.209 3.172 1.00 . A A . 30 LEU HA 1 1 11 2651 1 1 8 LEU HB2 H 11.424 2.785 3.848 1.00 . A A . 30 LEU HB2 1 1 11 2652 1 1 8 LEU HB3 H 12.642 3.440 4.919 1.00 . A A . 30 LEU HB3 1 1 11 2653 1 1 8 LEU HD11 H 9.975 4.803 4.014 1.00 . A A . 30 LEU HD11 1 1 11 2654 1 1 8 LEU HD12 H 10.641 6.396 3.741 1.00 . A A . 30 LEU HD12 1 1 11 2655 1 1 8 LEU HD13 H 11.104 5.487 5.168 1.00 . A A . 30 LEU HD13 1 1 11 2656 1 1 8 LEU HD21 H 13.538 5.791 4.573 1.00 . A A . 30 LEU HD21 1 1 11 2657 1 1 8 LEU HD22 H 13.069 6.717 3.166 1.00 . A A . 30 LEU HD22 1 1 11 2658 1 1 8 LEU HD23 H 14.128 5.334 2.989 1.00 . A A . 30 LEU HD23 1 1 11 2659 1 1 8 LEU HG H 11.779 4.777 2.290 1.00 . A A . 30 LEU HG 1 1 11 2660 1 1 8 LEU N N 13.050 2.671 1.629 1.00 . A A . 30 LEU N 1 1 11 2661 1 1 8 LEU O O 14.486 1.048 4.502 1.00 . A A . 30 LEU O 1 1 11 2662 1 1 9 ILE C C 14.010 -1.773 2.555 1.00 . A A . 31 ILE C 1 1 11 2663 1 1 9 ILE CA C 13.020 -1.082 3.491 1.00 . A A . 31 ILE CA 1 1 11 2664 1 1 9 ILE CB C 11.605 -1.706 3.390 1.00 . A A . 31 ILE CB 1 1 11 2665 1 1 9 ILE CD1 C 9.191 -1.287 4.048 1.00 . A A . 31 ILE CD1 1 1 11 2666 1 1 9 ILE CG1 C 10.653 -0.902 4.323 1.00 . A A . 31 ILE CG1 1 1 11 2667 1 1 9 ILE CG2 C 11.650 -3.186 3.869 1.00 . A A . 31 ILE CG2 1 1 11 2668 1 1 9 ILE H H 12.291 0.601 2.367 1.00 . A A . 31 ILE H 1 1 11 2669 1 1 9 ILE HA H 13.404 -1.137 4.495 1.00 . A A . 31 ILE HA 1 1 11 2670 1 1 9 ILE HB H 11.249 -1.664 2.370 1.00 . A A . 31 ILE HB 1 1 11 2671 1 1 9 ILE HD11 H 9.022 -2.340 4.214 1.00 . A A . 31 ILE HD11 1 1 11 2672 1 1 9 ILE HD12 H 8.933 -1.046 3.027 1.00 . A A . 31 ILE HD12 1 1 11 2673 1 1 9 ILE HD13 H 8.537 -0.728 4.700 1.00 . A A . 31 ILE HD13 1 1 11 2674 1 1 9 ILE HG12 H 10.897 -1.097 5.359 1.00 . A A . 31 ILE HG12 1 1 11 2675 1 1 9 ILE HG13 H 10.758 0.160 4.148 1.00 . A A . 31 ILE HG13 1 1 11 2676 1 1 9 ILE HG21 H 11.985 -3.250 4.894 1.00 . A A . 31 ILE HG21 1 1 11 2677 1 1 9 ILE HG22 H 12.323 -3.762 3.251 1.00 . A A . 31 ILE HG22 1 1 11 2678 1 1 9 ILE HG23 H 10.672 -3.637 3.801 1.00 . A A . 31 ILE HG23 1 1 11 2679 1 1 9 ILE N N 12.927 0.350 3.073 1.00 . A A . 31 ILE N 1 1 11 2680 1 1 9 ILE O O 14.497 -2.854 2.817 1.00 . A A . 31 ILE O 1 1 11 2681 1 1 10 GLU C C 16.625 -1.042 0.709 1.00 . A A . 32 GLU C 1 1 11 2682 1 1 10 GLU CA C 15.252 -1.647 0.456 1.00 . A A . 32 GLU CA 1 1 11 2683 1 1 10 GLU CB C 14.718 -1.275 -0.932 1.00 . A A . 32 GLU CB 1 1 11 2684 1 1 10 GLU CD C 12.507 -1.475 -2.180 1.00 . A A . 32 GLU CD 1 1 11 2685 1 1 10 GLU CG C 13.433 -2.099 -1.153 1.00 . A A . 32 GLU CG 1 1 11 2686 1 1 10 GLU H H 13.873 -0.231 1.335 1.00 . A A . 32 GLU H 1 1 11 2687 1 1 10 GLU HA H 15.334 -2.719 0.566 1.00 . A A . 32 GLU HA 1 1 11 2688 1 1 10 GLU HB2 H 14.497 -0.221 -0.974 1.00 . A A . 32 GLU HB2 1 1 11 2689 1 1 10 GLU HB3 H 15.456 -1.501 -1.689 1.00 . A A . 32 GLU HB3 1 1 11 2690 1 1 10 GLU HG2 H 13.692 -3.088 -1.501 1.00 . A A . 32 GLU HG2 1 1 11 2691 1 1 10 GLU HG3 H 12.869 -2.199 -0.237 1.00 . A A . 32 GLU HG3 1 1 11 2692 1 1 10 GLU N N 14.299 -1.106 1.471 1.00 . A A . 32 GLU N 1 1 11 2693 1 1 10 GLU O O 17.454 -0.948 -0.173 1.00 . A A . 32 GLU O 1 1 11 2694 1 1 10 GLU OE1 O 12.585 -0.299 -2.486 1.00 . A A . 32 GLU OE1 1 1 11 2695 1 1 11 ARG C C 18.738 -1.252 3.099 1.00 . A A . 33 ARG C 1 1 11 2696 1 1 11 ARG CA C 18.074 -0.055 2.410 1.00 . A A . 33 ARG CA 1 1 11 2697 1 1 11 ARG CB C 17.717 1.112 3.380 1.00 . A A . 33 ARG CB 1 1 11 2698 1 1 11 ARG CD C 19.878 2.389 2.913 1.00 . A A . 33 ARG CD 1 1 11 2699 1 1 11 ARG CG C 18.980 1.760 4.005 1.00 . A A . 33 ARG CG 1 1 11 2700 1 1 11 ARG CZ C 21.120 4.492 3.431 1.00 . A A . 33 ARG CZ 1 1 11 2701 1 1 11 ARG H H 16.052 -0.781 2.564 1.00 . A A . 33 ARG H 1 1 11 2702 1 1 11 ARG HA H 18.662 0.248 1.565 1.00 . A A . 33 ARG HA 1 1 11 2703 1 1 11 ARG HB2 H 17.173 1.858 2.820 1.00 . A A . 33 ARG HB2 1 1 11 2704 1 1 11 ARG HB3 H 17.066 0.772 4.173 1.00 . A A . 33 ARG HB3 1 1 11 2705 1 1 11 ARG HD2 H 20.367 1.603 2.351 1.00 . A A . 33 ARG HD2 1 1 11 2706 1 1 11 ARG HD3 H 19.290 2.974 2.228 1.00 . A A . 33 ARG HD3 1 1 11 2707 1 1 11 ARG HE H 21.547 2.700 4.193 1.00 . A A . 33 ARG HE 1 1 11 2708 1 1 11 ARG HG2 H 18.667 2.508 4.721 1.00 . A A . 33 ARG HG2 1 1 11 2709 1 1 11 ARG HG3 H 19.535 1.000 4.540 1.00 . A A . 33 ARG HG3 1 1 11 2710 1 1 11 ARG HH11 H 19.590 4.704 2.164 1.00 . A A . 33 ARG HH11 1 1 11 2711 1 1 11 ARG HH12 H 20.436 6.147 2.503 1.00 . A A . 33 ARG HH12 1 1 11 2712 1 1 11 ARG HH21 H 22.684 4.542 4.676 1.00 . A A . 33 ARG HH21 1 1 11 2713 1 1 11 ARG HH22 H 22.271 6.055 3.981 1.00 . A A . 33 ARG HH22 1 1 11 2714 1 1 11 ARG N N 16.798 -0.661 1.944 1.00 . A A . 33 ARG N 1 1 11 2715 1 1 11 ARG NE N 20.949 3.200 3.596 1.00 . A A . 33 ARG NE 1 1 11 2716 1 1 11 ARG NH1 N 20.328 5.164 2.644 1.00 . A A . 33 ARG NH1 1 1 11 2717 1 1 11 ARG NH2 N 22.091 5.073 4.072 1.00 . A A . 33 ARG NH2 1 1 11 2718 1 1 11 ARG O O 19.783 -1.725 2.706 1.00 . A A . 33 ARG O 1 1 11 2719 1 1 12 GLN C C 19.279 -3.936 4.173 1.00 . A A . 34 GLN C 1 1 11 2720 1 1 12 GLN CA C 18.508 -2.860 4.958 1.00 . A A . 34 GLN CA 1 1 11 2721 1 1 12 GLN CB C 17.254 -3.521 5.613 1.00 . A A . 34 GLN CB 1 1 11 2722 1 1 12 GLN CD C 16.290 -1.317 6.394 1.00 . A A . 34 GLN CD 1 1 11 2723 1 1 12 GLN CG C 16.715 -2.711 6.829 1.00 . A A . 34 GLN CG 1 1 11 2724 1 1 12 GLN H H 17.257 -1.206 4.352 1.00 . A A . 34 GLN H 1 1 11 2725 1 1 12 GLN HA H 19.167 -2.487 5.731 1.00 . A A . 34 GLN HA 1 1 11 2726 1 1 12 GLN HB2 H 16.468 -3.622 4.876 1.00 . A A . 34 GLN HB2 1 1 11 2727 1 1 12 GLN HB3 H 17.516 -4.512 5.956 1.00 . A A . 34 GLN HB3 1 1 11 2728 1 1 12 GLN HE21 H 14.346 -1.702 6.420 1.00 . A A . 34 GLN HE21 1 1 11 2729 1 1 12 GLN HE22 H 14.792 -0.126 5.940 1.00 . A A . 34 GLN HE22 1 1 11 2730 1 1 12 GLN HG2 H 15.873 -3.213 7.284 1.00 . A A . 34 GLN HG2 1 1 11 2731 1 1 12 GLN HG3 H 17.490 -2.606 7.575 1.00 . A A . 34 GLN HG3 1 1 11 2732 1 1 12 GLN N N 18.075 -1.691 4.126 1.00 . A A . 34 GLN N 1 1 11 2733 1 1 12 GLN NE2 N 15.035 -1.032 6.242 1.00 . A A . 34 GLN NE2 1 1 11 2734 1 1 12 GLN O O 20.326 -4.392 4.581 1.00 . A A . 34 GLN O 1 1 11 2735 1 1 12 GLN OE1 O 17.107 -0.453 6.165 1.00 . A A . 34 GLN OE1 1 1 11 2736 1 1 13 ARG C C 20.403 -4.792 1.182 1.00 . A A . 35 ARG C 1 1 11 2737 1 1 13 ARG CA C 19.410 -5.372 2.213 1.00 . A A . 35 ARG CA 1 1 11 2738 1 1 13 ARG CB C 18.308 -6.181 1.483 1.00 . A A . 35 ARG CB 1 1 11 2739 1 1 13 ARG CD C 17.997 -8.164 -0.046 1.00 . A A . 35 ARG CD 1 1 11 2740 1 1 13 ARG CG C 18.863 -7.573 1.076 1.00 . A A . 35 ARG CG 1 1 11 2741 1 1 13 ARG CZ C 19.320 -9.960 -1.135 1.00 . A A . 35 ARG CZ 1 1 11 2742 1 1 13 ARG H H 17.909 -3.909 2.748 1.00 . A A . 35 ARG H 1 1 11 2743 1 1 13 ARG HA H 19.955 -6.015 2.883 1.00 . A A . 35 ARG HA 1 1 11 2744 1 1 13 ARG HB2 H 17.460 -6.316 2.139 1.00 . A A . 35 ARG HB2 1 1 11 2745 1 1 13 ARG HB3 H 17.986 -5.630 0.608 1.00 . A A . 35 ARG HB3 1 1 11 2746 1 1 13 ARG HD2 H 16.958 -8.146 0.263 1.00 . A A . 35 ARG HD2 1 1 11 2747 1 1 13 ARG HD3 H 18.068 -7.591 -0.961 1.00 . A A . 35 ARG HD3 1 1 11 2748 1 1 13 ARG HE H 17.958 -10.281 0.275 1.00 . A A . 35 ARG HE 1 1 11 2749 1 1 13 ARG HG2 H 19.886 -7.492 0.740 1.00 . A A . 35 ARG HG2 1 1 11 2750 1 1 13 ARG HG3 H 18.844 -8.228 1.938 1.00 . A A . 35 ARG HG3 1 1 11 2751 1 1 13 ARG HH11 H 19.753 -8.097 -1.702 1.00 . A A . 35 ARG HH11 1 1 11 2752 1 1 13 ARG HH12 H 20.631 -9.304 -2.529 1.00 . A A . 35 ARG HH12 1 1 11 2753 1 1 13 ARG HH21 H 19.095 -11.911 -0.706 1.00 . A A . 35 ARG HH21 1 1 11 2754 1 1 13 ARG HH22 H 20.255 -11.574 -1.910 1.00 . A A . 35 ARG HH22 1 1 11 2755 1 1 13 ARG N N 18.742 -4.319 3.043 1.00 . A A . 35 ARG N 1 1 11 2756 1 1 13 ARG NE N 18.414 -9.595 -0.262 1.00 . A A . 35 ARG NE 1 1 11 2757 1 1 13 ARG NH1 N 19.948 -9.064 -1.842 1.00 . A A . 35 ARG NH1 1 1 11 2758 1 1 13 ARG NH2 N 19.576 -11.232 -1.260 1.00 . A A . 35 ARG NH2 1 1 11 2759 1 1 13 ARG O O 20.577 -5.330 0.103 1.00 . A A . 35 ARG O 1 1 11 2760 1 1 14 TYR C C 23.352 -3.179 1.429 1.00 . A A . 36 TYR C 1 1 11 2761 1 1 14 TYR CA C 22.024 -3.031 0.673 1.00 . A A . 36 TYR CA 1 1 11 2762 1 1 14 TYR CB C 21.579 -1.542 0.496 1.00 . A A . 36 TYR CB 1 1 11 2763 1 1 14 TYR CD1 C 23.653 -0.340 -0.414 1.00 . A A . 36 TYR CD1 1 1 11 2764 1 1 14 TYR CD2 C 21.797 -0.642 -1.870 1.00 . A A . 36 TYR CD2 1 1 11 2765 1 1 14 TYR CE1 C 24.339 0.302 -1.421 1.00 . A A . 36 TYR CE1 1 1 11 2766 1 1 14 TYR CE2 C 22.491 0.002 -2.875 1.00 . A A . 36 TYR CE2 1 1 11 2767 1 1 14 TYR CG C 22.371 -0.821 -0.621 1.00 . A A . 36 TYR CG 1 1 11 2768 1 1 14 TYR CZ C 23.765 0.478 -2.658 1.00 . A A . 36 TYR CZ 1 1 11 2769 1 1 14 TYR H H 20.851 -3.321 2.428 1.00 . A A . 36 TYR H 1 1 11 2770 1 1 14 TYR HA H 22.074 -3.550 -0.263 1.00 . A A . 36 TYR HA 1 1 11 2771 1 1 14 TYR HB2 H 20.525 -1.501 0.262 1.00 . A A . 36 TYR HB2 1 1 11 2772 1 1 14 TYR HB3 H 21.741 -1.009 1.422 1.00 . A A . 36 TYR HB3 1 1 11 2773 1 1 14 TYR HD1 H 24.130 -0.458 0.546 1.00 . A A . 36 TYR HD1 1 1 11 2774 1 1 14 TYR HD2 H 20.798 -1.007 -2.062 1.00 . A A . 36 TYR HD2 1 1 11 2775 1 1 14 TYR HE1 H 25.338 0.670 -1.237 1.00 . A A . 36 TYR HE1 1 1 11 2776 1 1 14 TYR HE2 H 22.038 0.137 -3.846 1.00 . A A . 36 TYR HE2 1 1 11 2777 1 1 14 TYR HH H 25.120 0.529 -4.018 1.00 . A A . 36 TYR HH 1 1 11 2778 1 1 14 TYR N N 21.031 -3.710 1.550 1.00 . A A . 36 TYR N 1 1 11 2779 1 1 14 TYR O O 24.016 -2.238 1.808 1.00 . A A . 36 TYR O 1 1 11 2780 1 1 14 TYR OH O 24.452 1.123 -3.663 1.00 . A A . 36 TYR OH 1 1 11 2781 1 1 15 NH2 HN1 H 23.256 -5.150 1.383 1.00 . A A . 37 NH2 HN1 1 1 11 2782 1 1 15 NH2 HN2 H 24.620 -4.494 2.167 1.00 . A A . 37 NH2 HN2 1 1 11 2783 1 1 15 NH2 N N 23.778 -4.378 1.680 1.00 . A A . 37 NH2 N 1 1 12 2784 1 1 1 ACE C C 1.027 2.532 -1.162 1.00 . A A . 23 ACE C 1 1 12 2785 1 1 1 ACE CH3 C 0.170 1.285 -0.964 1.00 . A A . 23 ACE CH3 1 1 12 2786 1 1 1 ACE H1 H 0.525 0.505 -1.621 1.00 . A A . 23 ACE H1 1 1 12 2787 1 1 1 ACE H2 H -0.854 1.520 -1.209 1.00 . A A . 23 ACE H2 1 1 12 2788 1 1 1 ACE H3 H 0.226 0.954 0.062 1.00 . A A . 23 ACE H3 1 1 12 2789 1 1 1 ACE O O 1.064 3.089 -2.243 1.00 . A A . 23 ACE O 1 1 12 2790 1 1 2 ALA C C 3.950 3.804 -0.864 1.00 . A A . 24 ALA C 1 1 12 2791 1 1 2 ALA CA C 2.583 4.168 -0.248 1.00 . A A . 24 ALA CA 1 1 12 2792 1 1 2 ALA CB C 2.757 4.765 1.163 1.00 . A A . 24 ALA CB 1 1 12 2793 1 1 2 ALA H H 1.672 2.455 0.713 1.00 . A A . 24 ALA H 1 1 12 2794 1 1 2 ALA HA H 2.092 4.887 -0.891 1.00 . A A . 24 ALA HA 1 1 12 2795 1 1 2 ALA HB1 H 3.386 5.643 1.109 1.00 . A A . 24 ALA HB1 1 1 12 2796 1 1 2 ALA HB2 H 3.231 4.047 1.816 1.00 . A A . 24 ALA HB2 1 1 12 2797 1 1 2 ALA HB3 H 1.801 5.048 1.577 1.00 . A A . 24 ALA HB3 1 1 12 2798 1 1 2 ALA N N 1.720 2.946 -0.133 1.00 . A A . 24 ALA N 1 1 12 2799 1 1 2 ALA O O 4.998 4.010 -0.283 1.00 . A A . 24 ALA O 1 1 12 2800 1 1 3 ARG C C 6.304 3.609 -2.653 1.00 . A A . 25 ARG C 1 1 12 2801 1 1 3 ARG CA C 5.013 2.808 -2.887 1.00 . A A . 25 ARG CA 1 1 12 2802 1 1 3 ARG CB C 4.643 2.906 -4.399 1.00 . A A . 25 ARG CB 1 1 12 2803 1 1 3 ARG CD C 6.080 3.063 -6.527 1.00 . A A . 25 ARG CD 1 1 12 2804 1 1 3 ARG CG C 5.768 2.233 -5.259 1.00 . A A . 25 ARG CG 1 1 12 2805 1 1 3 ARG CZ C 4.955 2.726 -8.721 1.00 . A A . 25 ARG CZ 1 1 12 2806 1 1 3 ARG H H 2.935 3.147 -2.403 1.00 . A A . 25 ARG H 1 1 12 2807 1 1 3 ARG HA H 5.213 1.776 -2.633 1.00 . A A . 25 ARG HA 1 1 12 2808 1 1 3 ARG HB2 H 3.710 2.386 -4.563 1.00 . A A . 25 ARG HB2 1 1 12 2809 1 1 3 ARG HB3 H 4.514 3.942 -4.675 1.00 . A A . 25 ARG HB3 1 1 12 2810 1 1 3 ARG HD2 H 6.321 4.084 -6.261 1.00 . A A . 25 ARG HD2 1 1 12 2811 1 1 3 ARG HD3 H 6.949 2.632 -6.994 1.00 . A A . 25 ARG HD3 1 1 12 2812 1 1 3 ARG HE H 4.027 3.327 -7.063 1.00 . A A . 25 ARG HE 1 1 12 2813 1 1 3 ARG HG2 H 6.678 2.101 -4.688 1.00 . A A . 25 ARG HG2 1 1 12 2814 1 1 3 ARG HG3 H 5.436 1.249 -5.563 1.00 . A A . 25 ARG HG3 1 1 12 2815 1 1 3 ARG HH11 H 6.928 2.339 -8.746 1.00 . A A . 25 ARG HH11 1 1 12 2816 1 1 3 ARG HH12 H 6.131 2.110 -10.234 1.00 . A A . 25 ARG HH12 1 1 12 2817 1 1 3 ARG HH21 H 2.982 3.023 -9.051 1.00 . A A . 25 ARG HH21 1 1 12 2818 1 1 3 ARG HH22 H 3.878 2.518 -10.413 1.00 . A A . 25 ARG HH22 1 1 12 2819 1 1 3 ARG N N 3.846 3.259 -2.051 1.00 . A A . 25 ARG N 1 1 12 2820 1 1 3 ARG NE N 4.889 3.060 -7.449 1.00 . A A . 25 ARG NE 1 1 12 2821 1 1 3 ARG NH1 N 6.081 2.367 -9.271 1.00 . A A . 25 ARG NH1 1 1 12 2822 1 1 3 ARG NH2 N 3.865 2.758 -9.440 1.00 . A A . 25 ARG NH2 1 1 12 2823 1 1 3 ARG O O 7.365 3.053 -2.452 1.00 . A A . 25 ARG O 1 1 12 2824 1 1 4 HIS C C 8.071 5.611 -1.126 1.00 . A A . 26 HIS C 1 1 12 2825 1 1 4 HIS CA C 7.354 5.813 -2.482 1.00 . A A . 26 HIS CA 1 1 12 2826 1 1 4 HIS CB C 6.850 7.277 -2.637 1.00 . A A . 26 HIS CB 1 1 12 2827 1 1 4 HIS CD2 C 8.129 8.996 -4.117 1.00 . A A . 26 HIS CD2 1 1 12 2828 1 1 4 HIS CE1 C 9.747 9.263 -2.915 1.00 . A A . 26 HIS CE1 1 1 12 2829 1 1 4 HIS CG C 8.012 8.224 -2.990 1.00 . A A . 26 HIS CG 1 1 12 2830 1 1 4 HIS H H 5.280 5.286 -2.842 1.00 . A A . 26 HIS H 1 1 12 2831 1 1 4 HIS HA H 8.074 5.586 -3.253 1.00 . A A . 26 HIS HA 1 1 12 2832 1 1 4 HIS HB2 H 6.113 7.339 -3.423 1.00 . A A . 26 HIS HB2 1 1 12 2833 1 1 4 HIS HB3 H 6.404 7.621 -1.716 1.00 . A A . 26 HIS HB3 1 1 12 2834 1 1 4 HIS HD1 H 9.250 7.976 -1.358 1.00 . A A . 26 HIS HD1 1 1 12 2835 1 1 4 HIS HD2 H 7.413 9.046 -4.924 1.00 . A A . 26 HIS HD2 1 1 12 2836 1 1 4 HIS HE1 H 10.697 9.635 -2.555 1.00 . A A . 26 HIS HE1 1 1 12 2837 1 1 4 HIS N N 6.170 4.909 -2.685 1.00 . A A . 26 HIS N 1 1 12 2838 1 1 4 HIS ND1 N 9.048 8.400 -2.226 1.00 . A A . 26 HIS ND1 1 1 12 2839 1 1 4 HIS NE2 N 9.251 9.662 -4.059 1.00 . A A . 26 HIS NE2 1 1 12 2840 1 1 4 HIS O O 9.026 6.299 -0.818 1.00 . A A . 26 HIS O 1 1 12 2841 1 1 5 TYR C C 8.859 2.989 0.987 1.00 . A A . 27 TYR C 1 1 12 2842 1 1 5 TYR CA C 8.214 4.384 0.992 1.00 . A A . 27 TYR CA 1 1 12 2843 1 1 5 TYR CB C 7.093 4.468 2.043 1.00 . A A . 27 TYR CB 1 1 12 2844 1 1 5 TYR CD1 C 8.351 5.541 3.947 1.00 . A A . 27 TYR CD1 1 1 12 2845 1 1 5 TYR CD2 C 7.539 3.325 4.273 1.00 . A A . 27 TYR CD2 1 1 12 2846 1 1 5 TYR CE1 C 8.876 5.534 5.220 1.00 . A A . 27 TYR CE1 1 1 12 2847 1 1 5 TYR CE2 C 8.067 3.318 5.548 1.00 . A A . 27 TYR CE2 1 1 12 2848 1 1 5 TYR CG C 7.677 4.438 3.462 1.00 . A A . 27 TYR CG 1 1 12 2849 1 1 5 TYR CZ C 8.738 4.426 6.023 1.00 . A A . 27 TYR CZ 1 1 12 2850 1 1 5 TYR H H 6.819 4.172 -0.640 1.00 . A A . 27 TYR H 1 1 12 2851 1 1 5 TYR HA H 9.006 5.082 1.157 1.00 . A A . 27 TYR HA 1 1 12 2852 1 1 5 TYR HB2 H 6.536 5.383 1.912 1.00 . A A . 27 TYR HB2 1 1 12 2853 1 1 5 TYR HB3 H 6.413 3.637 1.919 1.00 . A A . 27 TYR HB3 1 1 12 2854 1 1 5 TYR HD1 H 8.468 6.417 3.325 1.00 . A A . 27 TYR HD1 1 1 12 2855 1 1 5 TYR HD2 H 7.018 2.450 3.910 1.00 . A A . 27 TYR HD2 1 1 12 2856 1 1 5 TYR HE1 H 9.404 6.398 5.598 1.00 . A A . 27 TYR HE1 1 1 12 2857 1 1 5 TYR HE2 H 7.955 2.443 6.173 1.00 . A A . 27 TYR HE2 1 1 12 2858 1 1 5 TYR HH H 8.558 4.401 7.928 1.00 . A A . 27 TYR HH 1 1 12 2859 1 1 5 TYR N N 7.601 4.679 -0.344 1.00 . A A . 27 TYR N 1 1 12 2860 1 1 5 TYR O O 9.463 2.540 1.941 1.00 . A A . 27 TYR O 1 1 12 2861 1 1 5 TYR OH O 9.274 4.443 7.290 1.00 . A A . 27 TYR OH 1 1 12 2862 1 1 6 LYS C C 10.777 0.930 -0.298 1.00 . A A . 28 LYS C 1 1 12 2863 1 1 6 LYS CA C 9.256 0.980 -0.345 1.00 . A A . 28 LYS CA 1 1 12 2864 1 1 6 LYS CB C 8.741 0.441 -1.722 1.00 . A A . 28 LYS CB 1 1 12 2865 1 1 6 LYS CD C 10.636 -1.155 -2.516 1.00 . A A . 28 LYS CD 1 1 12 2866 1 1 6 LYS CE C 11.105 -2.604 -2.367 1.00 . A A . 28 LYS CE 1 1 12 2867 1 1 6 LYS CG C 9.177 -1.043 -1.972 1.00 . A A . 28 LYS CG 1 1 12 2868 1 1 6 LYS H H 8.229 2.842 -0.833 1.00 . A A . 28 LYS H 1 1 12 2869 1 1 6 LYS HA H 8.883 0.350 0.449 1.00 . A A . 28 LYS HA 1 1 12 2870 1 1 6 LYS HB2 H 7.662 0.494 -1.732 1.00 . A A . 28 LYS HB2 1 1 12 2871 1 1 6 LYS HB3 H 9.118 1.060 -2.522 1.00 . A A . 28 LYS HB3 1 1 12 2872 1 1 6 LYS HD2 H 10.640 -0.890 -3.565 1.00 . A A . 28 LYS HD2 1 1 12 2873 1 1 6 LYS HD3 H 11.341 -0.523 -2.010 1.00 . A A . 28 LYS HD3 1 1 12 2874 1 1 6 LYS HE2 H 10.887 -2.967 -1.369 1.00 . A A . 28 LYS HE2 1 1 12 2875 1 1 6 LYS HE3 H 10.602 -3.231 -3.089 1.00 . A A . 28 LYS HE3 1 1 12 2876 1 1 6 LYS HG2 H 9.097 -1.602 -1.048 1.00 . A A . 28 LYS HG2 1 1 12 2877 1 1 6 LYS HG3 H 8.504 -1.493 -2.686 1.00 . A A . 28 LYS HG3 1 1 12 2878 1 1 6 LYS HZ1 H 12.922 -2.400 -3.502 1.00 . A A . 28 LYS HZ1 1 1 12 2879 1 1 6 LYS N N 8.712 2.356 -0.137 1.00 . A A . 28 LYS N 1 1 12 2880 1 1 6 LYS NZ N 12.583 -2.650 -2.616 1.00 . A A . 28 LYS NZ 1 1 12 2881 1 1 6 LYS O O 11.325 0.135 0.439 1.00 . A A . 28 LYS O 1 1 12 2882 1 1 7 ASN C C 13.591 1.424 0.145 1.00 . A A . 29 ASN C 1 1 12 2883 1 1 7 ASN CA C 12.908 1.852 -1.156 1.00 . A A . 29 ASN CA 1 1 12 2884 1 1 7 ASN CB C 13.310 3.305 -1.521 1.00 . A A . 29 ASN CB 1 1 12 2885 1 1 7 ASN CG C 14.820 3.382 -1.799 1.00 . A A . 29 ASN CG 1 1 12 2886 1 1 7 ASN H H 10.856 2.380 -1.615 1.00 . A A . 29 ASN H 1 1 12 2887 1 1 7 ASN HA H 13.237 1.183 -1.937 1.00 . A A . 29 ASN HA 1 1 12 2888 1 1 7 ASN HB2 H 12.774 3.634 -2.400 1.00 . A A . 29 ASN HB2 1 1 12 2889 1 1 7 ASN HB3 H 13.090 3.977 -0.705 1.00 . A A . 29 ASN HB3 1 1 12 2890 1 1 7 ASN HD21 H 14.599 3.781 -3.739 1.00 . A A . 29 ASN HD21 1 1 12 2891 1 1 7 ASN HD22 H 16.197 3.687 -3.169 1.00 . A A . 29 ASN HD22 1 1 12 2892 1 1 7 ASN N N 11.406 1.778 -1.075 1.00 . A A . 29 ASN N 1 1 12 2893 1 1 7 ASN ND2 N 15.234 3.638 -3.007 1.00 . A A . 29 ASN ND2 1 1 12 2894 1 1 7 ASN O O 14.461 0.579 0.131 1.00 . A A . 29 ASN O 1 1 12 2895 1 1 7 ASN OD1 O 15.650 3.210 -0.928 1.00 . A A . 29 ASN OD1 1 1 12 2896 1 1 8 LEU C C 13.976 0.193 2.848 1.00 . A A . 30 LEU C 1 1 12 2897 1 1 8 LEU CA C 13.757 1.693 2.578 1.00 . A A . 30 LEU CA 1 1 12 2898 1 1 8 LEU CB C 12.824 2.278 3.653 1.00 . A A . 30 LEU CB 1 1 12 2899 1 1 8 LEU CD1 C 11.807 4.408 4.501 1.00 . A A . 30 LEU CD1 1 1 12 2900 1 1 8 LEU CD2 C 14.303 4.181 4.403 1.00 . A A . 30 LEU CD2 1 1 12 2901 1 1 8 LEU CG C 12.975 3.819 3.691 1.00 . A A . 30 LEU CG 1 1 12 2902 1 1 8 LEU H H 12.463 2.684 1.154 1.00 . A A . 30 LEU H 1 1 12 2903 1 1 8 LEU HA H 14.725 2.165 2.628 1.00 . A A . 30 LEU HA 1 1 12 2904 1 1 8 LEU HB2 H 11.798 2.014 3.429 1.00 . A A . 30 LEU HB2 1 1 12 2905 1 1 8 LEU HB3 H 13.074 1.857 4.617 1.00 . A A . 30 LEU HB3 1 1 12 2906 1 1 8 LEU HD11 H 11.890 5.485 4.554 1.00 . A A . 30 LEU HD11 1 1 12 2907 1 1 8 LEU HD12 H 11.784 4.016 5.507 1.00 . A A . 30 LEU HD12 1 1 12 2908 1 1 8 LEU HD13 H 10.870 4.160 4.020 1.00 . A A . 30 LEU HD13 1 1 12 2909 1 1 8 LEU HD21 H 14.417 5.255 4.435 1.00 . A A . 30 LEU HD21 1 1 12 2910 1 1 8 LEU HD22 H 15.153 3.768 3.880 1.00 . A A . 30 LEU HD22 1 1 12 2911 1 1 8 LEU HD23 H 14.310 3.804 5.416 1.00 . A A . 30 LEU HD23 1 1 12 2912 1 1 8 LEU HG H 12.970 4.236 2.693 1.00 . A A . 30 LEU HG 1 1 12 2913 1 1 8 LEU N N 13.177 2.017 1.232 1.00 . A A . 30 LEU N 1 1 12 2914 1 1 8 LEU O O 14.999 -0.210 3.377 1.00 . A A . 30 LEU O 1 1 12 2915 1 1 9 ILE C C 14.312 -2.682 1.964 1.00 . A A . 31 ILE C 1 1 12 2916 1 1 9 ILE CA C 13.098 -2.081 2.689 1.00 . A A . 31 ILE CA 1 1 12 2917 1 1 9 ILE CB C 11.745 -2.691 2.197 1.00 . A A . 31 ILE CB 1 1 12 2918 1 1 9 ILE CD1 C 9.223 -2.639 2.648 1.00 . A A . 31 ILE CD1 1 1 12 2919 1 1 9 ILE CG1 C 10.591 -2.055 3.047 1.00 . A A . 31 ILE CG1 1 1 12 2920 1 1 9 ILE CG2 C 11.754 -4.227 2.404 1.00 . A A . 31 ILE CG2 1 1 12 2921 1 1 9 ILE H H 12.212 -0.221 2.039 1.00 . A A . 31 ILE H 1 1 12 2922 1 1 9 ILE HA H 13.256 -2.252 3.742 1.00 . A A . 31 ILE HA 1 1 12 2923 1 1 9 ILE HB H 11.590 -2.457 1.151 1.00 . A A . 31 ILE HB 1 1 12 2924 1 1 9 ILE HD11 H 9.178 -3.696 2.860 1.00 . A A . 31 ILE HD11 1 1 12 2925 1 1 9 ILE HD12 H 9.054 -2.482 1.593 1.00 . A A . 31 ILE HD12 1 1 12 2926 1 1 9 ILE HD13 H 8.440 -2.148 3.205 1.00 . A A . 31 ILE HD13 1 1 12 2927 1 1 9 ILE HG12 H 10.763 -2.241 4.098 1.00 . A A . 31 ILE HG12 1 1 12 2928 1 1 9 ILE HG13 H 10.561 -0.987 2.895 1.00 . A A . 31 ILE HG13 1 1 12 2929 1 1 9 ILE HG21 H 12.571 -4.673 1.853 1.00 . A A . 31 ILE HG21 1 1 12 2930 1 1 9 ILE HG22 H 10.835 -4.662 2.043 1.00 . A A . 31 ILE HG22 1 1 12 2931 1 1 9 ILE HG23 H 11.870 -4.471 3.450 1.00 . A A . 31 ILE HG23 1 1 12 2932 1 1 9 ILE N N 13.009 -0.600 2.474 1.00 . A A . 31 ILE N 1 1 12 2933 1 1 9 ILE O O 14.775 -3.764 2.268 1.00 . A A . 31 ILE O 1 1 12 2934 1 1 10 GLU C C 17.238 -1.631 0.732 1.00 . A A . 32 GLU C 1 1 12 2935 1 1 10 GLU CA C 15.991 -2.369 0.212 1.00 . A A . 32 GLU CA 1 1 12 2936 1 1 10 GLU CB C 15.780 -2.008 -1.291 1.00 . A A . 32 GLU CB 1 1 12 2937 1 1 10 GLU CD C 13.427 -3.021 -1.677 1.00 . A A . 32 GLU CD 1 1 12 2938 1 1 10 GLU CG C 14.911 -3.027 -2.070 1.00 . A A . 32 GLU CG 1 1 12 2939 1 1 10 GLU H H 14.371 -1.076 0.847 1.00 . A A . 32 GLU H 1 1 12 2940 1 1 10 GLU HA H 16.146 -3.431 0.340 1.00 . A A . 32 GLU HA 1 1 12 2941 1 1 10 GLU HB2 H 15.307 -1.039 -1.357 1.00 . A A . 32 GLU HB2 1 1 12 2942 1 1 10 GLU HB3 H 16.745 -1.936 -1.774 1.00 . A A . 32 GLU HB3 1 1 12 2943 1 1 10 GLU HG2 H 14.975 -2.831 -3.130 1.00 . A A . 32 GLU HG2 1 1 12 2944 1 1 10 GLU HG3 H 15.284 -4.022 -1.890 1.00 . A A . 32 GLU HG3 1 1 12 2945 1 1 10 GLU N N 14.807 -1.939 1.017 1.00 . A A . 32 GLU N 1 1 12 2946 1 1 10 GLU O O 18.266 -1.625 0.084 1.00 . A A . 32 GLU O 1 1 12 2947 1 1 10 GLU OE1 O 13.092 -3.348 -0.556 1.00 . A A . 32 GLU OE1 1 1 12 2948 1 1 11 ARG C C 18.927 -1.124 3.569 1.00 . A A . 33 ARG C 1 1 12 2949 1 1 11 ARG CA C 18.257 -0.279 2.491 1.00 . A A . 33 ARG CA 1 1 12 2950 1 1 11 ARG CB C 17.715 1.053 3.081 1.00 . A A . 33 ARG CB 1 1 12 2951 1 1 11 ARG CD C 19.611 2.335 2.010 1.00 . A A . 33 ARG CD 1 1 12 2952 1 1 11 ARG CG C 18.864 2.071 3.340 1.00 . A A . 33 ARG CG 1 1 12 2953 1 1 11 ARG CZ C 20.289 4.642 1.406 1.00 . A A . 33 ARG CZ 1 1 12 2954 1 1 11 ARG H H 16.250 -1.078 2.352 1.00 . A A . 33 ARG H 1 1 12 2955 1 1 11 ARG HA H 18.979 -0.108 1.721 1.00 . A A . 33 ARG HA 1 1 12 2956 1 1 11 ARG HB2 H 16.995 1.480 2.396 1.00 . A A . 33 ARG HB2 1 1 12 2957 1 1 11 ARG HB3 H 17.198 0.857 4.011 1.00 . A A . 33 ARG HB3 1 1 12 2958 1 1 11 ARG HD2 H 20.289 1.517 1.798 1.00 . A A . 33 ARG HD2 1 1 12 2959 1 1 11 ARG HD3 H 18.906 2.396 1.199 1.00 . A A . 33 ARG HD3 1 1 12 2960 1 1 11 ARG HE H 21.132 3.566 2.859 1.00 . A A . 33 ARG HE 1 1 12 2961 1 1 11 ARG HG2 H 18.444 2.990 3.725 1.00 . A A . 33 ARG HG2 1 1 12 2962 1 1 11 ARG HG3 H 19.544 1.674 4.084 1.00 . A A . 33 ARG HG3 1 1 12 2963 1 1 11 ARG HH11 H 18.774 3.879 0.323 1.00 . A A . 33 ARG HH11 1 1 12 2964 1 1 11 ARG HH12 H 19.252 5.469 -0.109 1.00 . A A . 33 ARG HH12 1 1 12 2965 1 1 11 ARG HH21 H 21.773 5.626 2.334 1.00 . A A . 33 ARG HH21 1 1 12 2966 1 1 11 ARG HH22 H 21.002 6.507 1.090 1.00 . A A . 33 ARG HH22 1 1 12 2967 1 1 11 ARG N N 17.112 -1.030 1.888 1.00 . A A . 33 ARG N 1 1 12 2968 1 1 11 ARG NE N 20.443 3.579 2.158 1.00 . A A . 33 ARG NE 1 1 12 2969 1 1 11 ARG NH1 N 19.373 4.664 0.474 1.00 . A A . 33 ARG NH1 1 1 12 2970 1 1 11 ARG NH2 N 21.072 5.662 1.622 1.00 . A A . 33 ARG NH2 1 1 12 2971 1 1 11 ARG O O 20.134 -1.269 3.600 1.00 . A A . 33 ARG O 1 1 12 2972 1 1 12 GLN C C 19.782 -3.426 5.071 1.00 . A A . 34 GLN C 1 1 12 2973 1 1 12 GLN CA C 18.624 -2.514 5.553 1.00 . A A . 34 GLN CA 1 1 12 2974 1 1 12 GLN CB C 17.438 -3.361 6.094 1.00 . A A . 34 GLN CB 1 1 12 2975 1 1 12 GLN CD C 16.702 -4.990 7.850 1.00 . A A . 34 GLN CD 1 1 12 2976 1 1 12 GLN CG C 17.905 -4.236 7.285 1.00 . A A . 34 GLN CG 1 1 12 2977 1 1 12 GLN H H 17.154 -1.455 4.323 1.00 . A A . 34 GLN H 1 1 12 2978 1 1 12 GLN HA H 19.010 -1.868 6.330 1.00 . A A . 34 GLN HA 1 1 12 2979 1 1 12 GLN HB2 H 16.651 -2.708 6.443 1.00 . A A . 34 GLN HB2 1 1 12 2980 1 1 12 GLN HB3 H 17.034 -3.991 5.314 1.00 . A A . 34 GLN HB3 1 1 12 2981 1 1 12 GLN HE21 H 17.225 -6.722 7.045 1.00 . A A . 34 GLN HE21 1 1 12 2982 1 1 12 GLN HE22 H 15.785 -6.721 7.956 1.00 . A A . 34 GLN HE22 1 1 12 2983 1 1 12 GLN HG2 H 18.661 -4.944 6.979 1.00 . A A . 34 GLN HG2 1 1 12 2984 1 1 12 GLN HG3 H 18.306 -3.610 8.068 1.00 . A A . 34 GLN HG3 1 1 12 2985 1 1 12 GLN N N 18.110 -1.650 4.436 1.00 . A A . 34 GLN N 1 1 12 2986 1 1 12 GLN NE2 N 16.565 -6.254 7.591 1.00 . A A . 34 GLN NE2 1 1 12 2987 1 1 12 GLN O O 20.871 -3.416 5.607 1.00 . A A . 34 GLN O 1 1 12 2988 1 1 12 GLN OE1 O 15.867 -4.440 8.534 1.00 . A A . 34 GLN OE1 1 1 12 2989 1 1 13 ARG C C 21.309 -4.443 2.342 1.00 . A A . 35 ARG C 1 1 12 2990 1 1 13 ARG CA C 20.509 -5.130 3.470 1.00 . A A . 35 ARG CA 1 1 12 2991 1 1 13 ARG CB C 19.779 -6.390 2.896 1.00 . A A . 35 ARG CB 1 1 12 2992 1 1 13 ARG CD C 20.194 -7.997 4.851 1.00 . A A . 35 ARG CD 1 1 12 2993 1 1 13 ARG CG C 19.118 -7.296 3.975 1.00 . A A . 35 ARG CG 1 1 12 2994 1 1 13 ARG CZ C 19.985 -10.398 5.522 1.00 . A A . 35 ARG CZ 1 1 12 2995 1 1 13 ARG H H 18.614 -4.141 3.658 1.00 . A A . 35 ARG H 1 1 12 2996 1 1 13 ARG HA H 21.195 -5.408 4.251 1.00 . A A . 35 ARG HA 1 1 12 2997 1 1 13 ARG HB2 H 19.022 -6.057 2.199 1.00 . A A . 35 ARG HB2 1 1 12 2998 1 1 13 ARG HB3 H 20.494 -6.970 2.328 1.00 . A A . 35 ARG HB3 1 1 12 2999 1 1 13 ARG HD2 H 21.017 -8.307 4.229 1.00 . A A . 35 ARG HD2 1 1 12 3000 1 1 13 ARG HD3 H 20.565 -7.303 5.595 1.00 . A A . 35 ARG HD3 1 1 12 3001 1 1 13 ARG HE H 18.722 -8.963 6.065 1.00 . A A . 35 ARG HE 1 1 12 3002 1 1 13 ARG HG2 H 18.471 -6.688 4.593 1.00 . A A . 35 ARG HG2 1 1 12 3003 1 1 13 ARG HG3 H 18.509 -8.037 3.474 1.00 . A A . 35 ARG HG3 1 1 12 3004 1 1 13 ARG HH11 H 21.571 -9.993 4.366 1.00 . A A . 35 ARG HH11 1 1 12 3005 1 1 13 ARG HH12 H 21.419 -11.631 4.824 1.00 . A A . 35 ARG HH12 1 1 12 3006 1 1 13 ARG HH21 H 18.484 -11.074 6.674 1.00 . A A . 35 ARG HH21 1 1 12 3007 1 1 13 ARG HH22 H 19.610 -12.263 6.184 1.00 . A A . 35 ARG HH22 1 1 12 3008 1 1 13 ARG N N 19.501 -4.194 4.051 1.00 . A A . 35 ARG N 1 1 12 3009 1 1 13 ARG NE N 19.537 -9.162 5.558 1.00 . A A . 35 ARG NE 1 1 12 3010 1 1 13 ARG NH1 N 21.067 -10.697 4.859 1.00 . A A . 35 ARG NH1 1 1 12 3011 1 1 13 ARG NH2 N 19.316 -11.309 6.171 1.00 . A A . 35 ARG NH2 1 1 12 3012 1 1 13 ARG O O 21.519 -5.019 1.292 1.00 . A A . 35 ARG O 1 1 12 3013 1 1 14 TYR C C 23.970 -2.370 2.056 1.00 . A A . 36 TYR C 1 1 12 3014 1 1 14 TYR CA C 22.525 -2.502 1.539 1.00 . A A . 36 TYR CA 1 1 12 3015 1 1 14 TYR CB C 21.822 -1.135 1.325 1.00 . A A . 36 TYR CB 1 1 12 3016 1 1 14 TYR CD1 C 23.399 0.048 -0.298 1.00 . A A . 36 TYR CD1 1 1 12 3017 1 1 14 TYR CD2 C 21.217 -0.522 -1.049 1.00 . A A . 36 TYR CD2 1 1 12 3018 1 1 14 TYR CE1 C 23.681 0.593 -1.535 1.00 . A A . 36 TYR CE1 1 1 12 3019 1 1 14 TYR CE2 C 21.502 0.022 -2.282 1.00 . A A . 36 TYR CE2 1 1 12 3020 1 1 14 TYR CG C 22.165 -0.515 -0.040 1.00 . A A . 36 TYR CG 1 1 12 3021 1 1 14 TYR CZ C 22.733 0.581 -2.534 1.00 . A A . 36 TYR CZ 1 1 12 3022 1 1 14 TYR H H 21.546 -2.805 3.431 1.00 . A A . 36 TYR H 1 1 12 3023 1 1 14 TYR HA H 22.523 -3.077 0.635 1.00 . A A . 36 TYR HA 1 1 12 3024 1 1 14 TYR HB2 H 20.755 -1.285 1.366 1.00 . A A . 36 TYR HB2 1 1 12 3025 1 1 14 TYR HB3 H 22.107 -0.444 2.108 1.00 . A A . 36 TYR HB3 1 1 12 3026 1 1 14 TYR HD1 H 24.152 0.068 0.476 1.00 . A A . 36 TYR HD1 1 1 12 3027 1 1 14 TYR HD2 H 20.243 -0.959 -0.873 1.00 . A A . 36 TYR HD2 1 1 12 3028 1 1 14 TYR HE1 H 24.650 1.029 -1.716 1.00 . A A . 36 TYR HE1 1 1 12 3029 1 1 14 TYR HE2 H 20.753 0.011 -3.060 1.00 . A A . 36 TYR HE2 1 1 12 3030 1 1 14 TYR HH H 23.854 0.791 -4.072 1.00 . A A . 36 TYR HH 1 1 12 3031 1 1 14 TYR N N 21.741 -3.236 2.576 1.00 . A A . 36 TYR N 1 1 12 3032 1 1 14 TYR O O 24.531 -1.304 2.201 1.00 . A A . 36 TYR O 1 1 12 3033 1 1 14 TYR OH O 23.001 1.118 -3.775 1.00 . A A . 36 TYR OH 1 1 12 3034 1 1 15 NH2 HN1 H 24.175 -4.326 2.235 1.00 . A A . 37 NH2 HN1 1 1 12 3035 1 1 15 NH2 HN2 H 25.537 -3.393 2.675 1.00 . A A . 37 NH2 HN2 1 1 12 3036 1 1 15 NH2 N N 24.615 -3.457 2.347 1.00 . A A . 37 NH2 N 1 1 13 3037 1 1 1 ACE C C 1.809 1.233 -1.727 1.00 . A A . 23 ACE C 1 1 13 3038 1 1 1 ACE CH3 C 1.134 -0.066 -2.156 1.00 . A A . 23 ACE CH3 1 1 13 3039 1 1 1 ACE H1 H 1.448 -0.319 -3.159 1.00 . A A . 23 ACE H1 1 1 13 3040 1 1 1 ACE H2 H 0.063 0.073 -2.137 1.00 . A A . 23 ACE H2 1 1 13 3041 1 1 1 ACE H3 H 1.396 -0.866 -1.480 1.00 . A A . 23 ACE H3 1 1 13 3042 1 1 1 ACE O O 1.607 2.258 -2.354 1.00 . A A . 23 ACE O 1 1 13 3043 1 1 2 ALA C C 4.589 2.635 -1.027 1.00 . A A . 24 ALA C 1 1 13 3044 1 1 2 ALA CA C 3.298 2.420 -0.216 1.00 . A A . 24 ALA CA 1 1 13 3045 1 1 2 ALA CB C 3.590 2.239 1.284 1.00 . A A . 24 ALA CB 1 1 13 3046 1 1 2 ALA H H 2.755 0.328 -0.235 1.00 . A A . 24 ALA H 1 1 13 3047 1 1 2 ALA HA H 2.649 3.274 -0.353 1.00 . A A . 24 ALA HA 1 1 13 3048 1 1 2 ALA HB1 H 2.672 2.095 1.835 1.00 . A A . 24 ALA HB1 1 1 13 3049 1 1 2 ALA HB2 H 4.076 3.123 1.666 1.00 . A A . 24 ALA HB2 1 1 13 3050 1 1 2 ALA HB3 H 4.238 1.390 1.449 1.00 . A A . 24 ALA HB3 1 1 13 3051 1 1 2 ALA N N 2.607 1.181 -0.694 1.00 . A A . 24 ALA N 1 1 13 3052 1 1 2 ALA O O 5.701 2.627 -0.537 1.00 . A A . 24 ALA O 1 1 13 3053 1 1 3 ARG C C 6.567 3.920 -2.814 1.00 . A A . 25 ARG C 1 1 13 3054 1 1 3 ARG CA C 5.410 3.048 -3.319 1.00 . A A . 25 ARG CA 1 1 13 3055 1 1 3 ARG CB C 4.723 3.681 -4.574 1.00 . A A . 25 ARG CB 1 1 13 3056 1 1 3 ARG CD C 3.484 1.437 -5.111 1.00 . A A . 25 ARG CD 1 1 13 3057 1 1 3 ARG CG C 4.382 2.591 -5.637 1.00 . A A . 25 ARG CG 1 1 13 3058 1 1 3 ARG CZ C 1.138 1.715 -5.855 1.00 . A A . 25 ARG CZ 1 1 13 3059 1 1 3 ARG H H 3.403 2.787 -2.580 1.00 . A A . 25 ARG H 1 1 13 3060 1 1 3 ARG HA H 5.840 2.087 -3.571 1.00 . A A . 25 ARG HA 1 1 13 3061 1 1 3 ARG HB2 H 3.826 4.212 -4.289 1.00 . A A . 25 ARG HB2 1 1 13 3062 1 1 3 ARG HB3 H 5.396 4.394 -5.031 1.00 . A A . 25 ARG HB3 1 1 13 3063 1 1 3 ARG HD2 H 3.545 0.561 -5.740 1.00 . A A . 25 ARG HD2 1 1 13 3064 1 1 3 ARG HD3 H 3.841 1.127 -4.137 1.00 . A A . 25 ARG HD3 1 1 13 3065 1 1 3 ARG HE H 1.820 2.361 -4.107 1.00 . A A . 25 ARG HE 1 1 13 3066 1 1 3 ARG HG2 H 3.893 3.074 -6.471 1.00 . A A . 25 ARG HG2 1 1 13 3067 1 1 3 ARG HG3 H 5.308 2.173 -6.008 1.00 . A A . 25 ARG HG3 1 1 13 3068 1 1 3 ARG HH11 H 2.401 0.868 -7.134 1.00 . A A . 25 ARG HH11 1 1 13 3069 1 1 3 ARG HH12 H 0.782 0.954 -7.693 1.00 . A A . 25 ARG HH12 1 1 13 3070 1 1 3 ARG HH21 H -0.297 2.559 -4.732 1.00 . A A . 25 ARG HH21 1 1 13 3071 1 1 3 ARG HH22 H -0.809 2.012 -6.272 1.00 . A A . 25 ARG HH22 1 1 13 3072 1 1 3 ARG N N 4.341 2.811 -2.300 1.00 . A A . 25 ARG N 1 1 13 3073 1 1 3 ARG NE N 2.062 1.908 -4.949 1.00 . A A . 25 ARG NE 1 1 13 3074 1 1 3 ARG NH1 N 1.454 1.137 -6.977 1.00 . A A . 25 ARG NH1 1 1 13 3075 1 1 3 ARG NH2 N -0.073 2.123 -5.605 1.00 . A A . 25 ARG NH2 1 1 13 3076 1 1 3 ARG O O 7.681 3.446 -2.709 1.00 . A A . 25 ARG O 1 1 13 3077 1 1 4 HIS C C 7.890 5.684 -0.561 1.00 . A A . 26 HIS C 1 1 13 3078 1 1 4 HIS CA C 7.436 6.035 -1.997 1.00 . A A . 26 HIS CA 1 1 13 3079 1 1 4 HIS CB C 6.971 7.514 -2.050 1.00 . A A . 26 HIS CB 1 1 13 3080 1 1 4 HIS CD2 C 6.738 7.223 -4.651 1.00 . A A . 26 HIS CD2 1 1 13 3081 1 1 4 HIS CE1 C 5.991 9.074 -5.045 1.00 . A A . 26 HIS CE1 1 1 13 3082 1 1 4 HIS CG C 6.620 7.948 -3.485 1.00 . A A . 26 HIS CG 1 1 13 3083 1 1 4 HIS H H 5.398 5.512 -2.569 1.00 . A A . 26 HIS H 1 1 13 3084 1 1 4 HIS HA H 8.285 5.904 -2.652 1.00 . A A . 26 HIS HA 1 1 13 3085 1 1 4 HIS HB2 H 6.107 7.650 -1.416 1.00 . A A . 26 HIS HB2 1 1 13 3086 1 1 4 HIS HB3 H 7.770 8.144 -1.682 1.00 . A A . 26 HIS HB3 1 1 13 3087 1 1 4 HIS HD1 H 5.947 9.878 -3.140 1.00 . A A . 26 HIS HD1 1 1 13 3088 1 1 4 HIS HD2 H 7.110 6.213 -4.735 1.00 . A A . 26 HIS HD2 1 1 13 3089 1 1 4 HIS HE1 H 5.603 9.912 -5.607 1.00 . A A . 26 HIS HE1 1 1 13 3090 1 1 4 HIS N N 6.309 5.161 -2.489 1.00 . A A . 26 HIS N 1 1 13 3091 1 1 4 HIS ND1 N 6.142 9.132 -3.747 1.00 . A A . 26 HIS ND1 1 1 13 3092 1 1 4 HIS NE2 N 6.329 7.961 -5.647 1.00 . A A . 26 HIS NE2 1 1 13 3093 1 1 4 HIS O O 8.517 6.479 0.112 1.00 . A A . 26 HIS O 1 1 13 3094 1 1 5 TYR C C 8.458 2.552 1.044 1.00 . A A . 27 TYR C 1 1 13 3095 1 1 5 TYR CA C 7.904 3.981 1.205 1.00 . A A . 27 TYR CA 1 1 13 3096 1 1 5 TYR CB C 6.618 4.004 2.055 1.00 . A A . 27 TYR CB 1 1 13 3097 1 1 5 TYR CD1 C 7.501 3.368 4.354 1.00 . A A . 27 TYR CD1 1 1 13 3098 1 1 5 TYR CD2 C 6.586 5.541 4.050 1.00 . A A . 27 TYR CD2 1 1 13 3099 1 1 5 TYR CE1 C 7.755 3.660 5.675 1.00 . A A . 27 TYR CE1 1 1 13 3100 1 1 5 TYR CE2 C 6.840 5.829 5.370 1.00 . A A . 27 TYR CE2 1 1 13 3101 1 1 5 TYR CG C 6.914 4.306 3.529 1.00 . A A . 27 TYR CG 1 1 13 3102 1 1 5 TYR CZ C 7.425 4.896 6.192 1.00 . A A . 27 TYR CZ 1 1 13 3103 1 1 5 TYR H H 7.032 3.905 -0.738 1.00 . A A . 27 TYR H 1 1 13 3104 1 1 5 TYR HA H 8.687 4.595 1.608 1.00 . A A . 27 TYR HA 1 1 13 3105 1 1 5 TYR HB2 H 5.925 4.736 1.669 1.00 . A A . 27 TYR HB2 1 1 13 3106 1 1 5 TYR HB3 H 6.154 3.030 2.005 1.00 . A A . 27 TYR HB3 1 1 13 3107 1 1 5 TYR HD1 H 7.762 2.395 3.968 1.00 . A A . 27 TYR HD1 1 1 13 3108 1 1 5 TYR HD2 H 6.125 6.292 3.423 1.00 . A A . 27 TYR HD2 1 1 13 3109 1 1 5 TYR HE1 H 8.217 2.910 6.301 1.00 . A A . 27 TYR HE1 1 1 13 3110 1 1 5 TYR HE2 H 6.580 6.798 5.770 1.00 . A A . 27 TYR HE2 1 1 13 3111 1 1 5 TYR HH H 8.558 4.942 7.735 1.00 . A A . 27 TYR HH 1 1 13 3112 1 1 5 TYR N N 7.547 4.493 -0.149 1.00 . A A . 27 TYR N 1 1 13 3113 1 1 5 TYR O O 8.665 1.829 2.000 1.00 . A A . 27 TYR O 1 1 13 3114 1 1 5 TYR OH O 7.665 5.214 7.510 1.00 . A A . 27 TYR OH 1 1 13 3115 1 1 6 LYS C C 10.765 0.820 -0.466 1.00 . A A . 28 LYS C 1 1 13 3116 1 1 6 LYS CA C 9.238 0.819 -0.472 1.00 . A A . 28 LYS CA 1 1 13 3117 1 1 6 LYS CB C 8.662 0.365 -1.846 1.00 . A A . 28 LYS CB 1 1 13 3118 1 1 6 LYS CD C 10.403 -0.727 -3.319 1.00 . A A . 28 LYS CD 1 1 13 3119 1 1 6 LYS CE C 11.106 -2.038 -3.657 1.00 . A A . 28 LYS CE 1 1 13 3120 1 1 6 LYS CG C 9.289 -0.988 -2.290 1.00 . A A . 28 LYS CG 1 1 13 3121 1 1 6 LYS H H 8.517 2.837 -0.895 1.00 . A A . 28 LYS H 1 1 13 3122 1 1 6 LYS HA H 8.899 0.129 0.281 1.00 . A A . 28 LYS HA 1 1 13 3123 1 1 6 LYS HB2 H 7.593 0.239 -1.744 1.00 . A A . 28 LYS HB2 1 1 13 3124 1 1 6 LYS HB3 H 8.831 1.126 -2.596 1.00 . A A . 28 LYS HB3 1 1 13 3125 1 1 6 LYS HD2 H 9.961 -0.306 -4.206 1.00 . A A . 28 LYS HD2 1 1 13 3126 1 1 6 LYS HD3 H 11.136 -0.031 -2.954 1.00 . A A . 28 LYS HD3 1 1 13 3127 1 1 6 LYS HE2 H 10.394 -2.818 -3.896 1.00 . A A . 28 LYS HE2 1 1 13 3128 1 1 6 LYS HE3 H 11.774 -1.906 -4.500 1.00 . A A . 28 LYS HE3 1 1 13 3129 1 1 6 LYS HG2 H 9.695 -1.531 -1.449 1.00 . A A . 28 LYS HG2 1 1 13 3130 1 1 6 LYS HG3 H 8.529 -1.608 -2.746 1.00 . A A . 28 LYS HG3 1 1 13 3131 1 1 6 LYS HZ1 H 11.395 -2.658 -1.623 1.00 . A A . 28 LYS HZ1 1 1 13 3132 1 1 6 LYS N N 8.701 2.187 -0.184 1.00 . A A . 28 LYS N 1 1 13 3133 1 1 6 LYS NZ N 11.889 -2.444 -2.443 1.00 . A A . 28 LYS NZ 1 1 13 3134 1 1 6 LYS O O 11.368 0.124 0.328 1.00 . A A . 28 LYS O 1 1 13 3135 1 1 7 ASN C C 13.560 1.462 -0.129 1.00 . A A . 29 ASN C 1 1 13 3136 1 1 7 ASN CA C 12.842 1.715 -1.464 1.00 . A A . 29 ASN CA 1 1 13 3137 1 1 7 ASN CB C 13.189 3.136 -1.988 1.00 . A A . 29 ASN CB 1 1 13 3138 1 1 7 ASN CG C 14.705 3.374 -2.105 1.00 . A A . 29 ASN CG 1 1 13 3139 1 1 7 ASN H H 10.758 2.115 -1.936 1.00 . A A . 29 ASN H 1 1 13 3140 1 1 7 ASN HA H 13.173 0.974 -2.176 1.00 . A A . 29 ASN HA 1 1 13 3141 1 1 7 ASN HB2 H 12.762 3.277 -2.970 1.00 . A A . 29 ASN HB2 1 1 13 3142 1 1 7 ASN HB3 H 12.787 3.897 -1.336 1.00 . A A . 29 ASN HB3 1 1 13 3143 1 1 7 ASN HD21 H 15.291 1.532 -1.598 1.00 . A A . 29 ASN HD21 1 1 13 3144 1 1 7 ASN HD22 H 16.519 2.643 -1.963 1.00 . A A . 29 ASN HD22 1 1 13 3145 1 1 7 ASN N N 11.344 1.601 -1.343 1.00 . A A . 29 ASN N 1 1 13 3146 1 1 7 ASN ND2 N 15.568 2.433 -1.867 1.00 . A A . 29 ASN ND2 1 1 13 3147 1 1 7 ASN O O 14.424 0.611 -0.037 1.00 . A A . 29 ASN O 1 1 13 3148 1 1 7 ASN OD1 O 15.140 4.459 -2.427 1.00 . A A . 29 ASN OD1 1 1 13 3149 1 1 8 LEU C C 13.910 0.730 2.740 1.00 . A A . 30 LEU C 1 1 13 3150 1 1 8 LEU CA C 13.711 2.175 2.235 1.00 . A A . 30 LEU CA 1 1 13 3151 1 1 8 LEU CB C 12.736 2.917 3.186 1.00 . A A . 30 LEU CB 1 1 13 3152 1 1 8 LEU CD1 C 11.348 4.958 3.660 1.00 . A A . 30 LEU CD1 1 1 13 3153 1 1 8 LEU CD2 C 13.561 5.255 2.522 1.00 . A A . 30 LEU CD2 1 1 13 3154 1 1 8 LEU CG C 12.332 4.330 2.659 1.00 . A A . 30 LEU CG 1 1 13 3155 1 1 8 LEU H H 12.464 2.887 0.636 1.00 . A A . 30 LEU H 1 1 13 3156 1 1 8 LEU HA H 14.679 2.656 2.246 1.00 . A A . 30 LEU HA 1 1 13 3157 1 1 8 LEU HB2 H 11.838 2.327 3.318 1.00 . A A . 30 LEU HB2 1 1 13 3158 1 1 8 LEU HB3 H 13.205 3.018 4.155 1.00 . A A . 30 LEU HB3 1 1 13 3159 1 1 8 LEU HD11 H 11.036 5.932 3.311 1.00 . A A . 30 LEU HD11 1 1 13 3160 1 1 8 LEU HD12 H 11.801 5.071 4.637 1.00 . A A . 30 LEU HD12 1 1 13 3161 1 1 8 LEU HD13 H 10.467 4.341 3.762 1.00 . A A . 30 LEU HD13 1 1 13 3162 1 1 8 LEU HD21 H 14.051 5.388 3.476 1.00 . A A . 30 LEU HD21 1 1 13 3163 1 1 8 LEU HD22 H 13.250 6.225 2.161 1.00 . A A . 30 LEU HD22 1 1 13 3164 1 1 8 LEU HD23 H 14.271 4.848 1.817 1.00 . A A . 30 LEU HD23 1 1 13 3165 1 1 8 LEU HG H 11.824 4.259 1.709 1.00 . A A . 30 LEU HG 1 1 13 3166 1 1 8 LEU N N 13.163 2.236 0.842 1.00 . A A . 30 LEU N 1 1 13 3167 1 1 8 LEU O O 14.965 0.338 3.203 1.00 . A A . 30 LEU O 1 1 13 3168 1 1 9 ILE C C 13.968 -2.293 2.374 1.00 . A A . 31 ILE C 1 1 13 3169 1 1 9 ILE CA C 12.877 -1.470 3.069 1.00 . A A . 31 ILE CA 1 1 13 3170 1 1 9 ILE CB C 11.451 -2.050 2.789 1.00 . A A . 31 ILE CB 1 1 13 3171 1 1 9 ILE CD1 C 8.948 -1.675 3.275 1.00 . A A . 31 ILE CD1 1 1 13 3172 1 1 9 ILE CG1 C 10.392 -1.204 3.580 1.00 . A A . 31 ILE CG1 1 1 13 3173 1 1 9 ILE CG2 C 11.364 -3.536 3.237 1.00 . A A . 31 ILE CG2 1 1 13 3174 1 1 9 ILE H H 12.046 0.331 2.208 1.00 . A A . 31 ILE H 1 1 13 3175 1 1 9 ILE HA H 13.121 -1.485 4.123 1.00 . A A . 31 ILE HA 1 1 13 3176 1 1 9 ILE HB H 11.267 -1.971 1.725 1.00 . A A . 31 ILE HB 1 1 13 3177 1 1 9 ILE HD11 H 8.238 -1.056 3.806 1.00 . A A . 31 ILE HD11 1 1 13 3178 1 1 9 ILE HD12 H 8.798 -2.698 3.583 1.00 . A A . 31 ILE HD12 1 1 13 3179 1 1 9 ILE HD13 H 8.751 -1.595 2.216 1.00 . A A . 31 ILE HD13 1 1 13 3180 1 1 9 ILE HG12 H 10.574 -1.288 4.642 1.00 . A A . 31 ILE HG12 1 1 13 3181 1 1 9 ILE HG13 H 10.464 -0.160 3.308 1.00 . A A . 31 ILE HG13 1 1 13 3182 1 1 9 ILE HG21 H 10.383 -3.937 3.041 1.00 . A A . 31 ILE HG21 1 1 13 3183 1 1 9 ILE HG22 H 11.566 -3.625 4.295 1.00 . A A . 31 ILE HG22 1 1 13 3184 1 1 9 ILE HG23 H 12.078 -4.145 2.704 1.00 . A A . 31 ILE HG23 1 1 13 3185 1 1 9 ILE N N 12.862 -0.037 2.618 1.00 . A A . 31 ILE N 1 1 13 3186 1 1 9 ILE O O 14.297 -3.389 2.777 1.00 . A A . 31 ILE O 1 1 13 3187 1 1 10 GLU C C 16.969 -1.836 0.883 1.00 . A A . 32 GLU C 1 1 13 3188 1 1 10 GLU CA C 15.595 -2.451 0.574 1.00 . A A . 32 GLU CA 1 1 13 3189 1 1 10 GLU CB C 15.217 -2.335 -0.911 1.00 . A A . 32 GLU CB 1 1 13 3190 1 1 10 GLU CD C 13.196 -2.522 -2.437 1.00 . A A . 32 GLU CD 1 1 13 3191 1 1 10 GLU CG C 13.789 -2.950 -1.102 1.00 . A A . 32 GLU CG 1 1 13 3192 1 1 10 GLU H H 14.218 -0.846 1.072 1.00 . A A . 32 GLU H 1 1 13 3193 1 1 10 GLU HA H 15.624 -3.491 0.871 1.00 . A A . 32 GLU HA 1 1 13 3194 1 1 10 GLU HB2 H 15.223 -1.299 -1.219 1.00 . A A . 32 GLU HB2 1 1 13 3195 1 1 10 GLU HB3 H 15.931 -2.872 -1.520 1.00 . A A . 32 GLU HB3 1 1 13 3196 1 1 10 GLU HG2 H 13.833 -4.029 -1.089 1.00 . A A . 32 GLU HG2 1 1 13 3197 1 1 10 GLU HG3 H 13.109 -2.624 -0.331 1.00 . A A . 32 GLU HG3 1 1 13 3198 1 1 10 GLU N N 14.523 -1.741 1.335 1.00 . A A . 32 GLU N 1 1 13 3199 1 1 10 GLU O O 17.920 -1.998 0.138 1.00 . A A . 32 GLU O 1 1 13 3200 1 1 10 GLU OE1 O 13.912 -2.291 -3.395 1.00 . A A . 32 GLU OE1 1 1 13 3201 1 1 11 ARG C C 18.904 -1.453 3.460 1.00 . A A . 33 ARG C 1 1 13 3202 1 1 11 ARG CA C 18.254 -0.487 2.486 1.00 . A A . 33 ARG CA 1 1 13 3203 1 1 11 ARG CB C 17.897 0.853 3.208 1.00 . A A . 33 ARG CB 1 1 13 3204 1 1 11 ARG CD C 20.223 2.017 3.205 1.00 . A A . 33 ARG CD 1 1 13 3205 1 1 11 ARG CG C 19.077 1.435 4.060 1.00 . A A . 33 ARG CG 1 1 13 3206 1 1 11 ARG CZ C 20.019 3.611 1.314 1.00 . A A . 33 ARG CZ 1 1 13 3207 1 1 11 ARG H H 16.183 -1.073 2.531 1.00 . A A . 33 ARG H 1 1 13 3208 1 1 11 ARG HA H 18.921 -0.342 1.659 1.00 . A A . 33 ARG HA 1 1 13 3209 1 1 11 ARG HB2 H 17.578 1.577 2.473 1.00 . A A . 33 ARG HB2 1 1 13 3210 1 1 11 ARG HB3 H 17.075 0.680 3.883 1.00 . A A . 33 ARG HB3 1 1 13 3211 1 1 11 ARG HD2 H 21.086 2.261 3.814 1.00 . A A . 33 ARG HD2 1 1 13 3212 1 1 11 ARG HD3 H 20.502 1.263 2.486 1.00 . A A . 33 ARG HD3 1 1 13 3213 1 1 11 ARG HE H 19.084 3.816 3.061 1.00 . A A . 33 ARG HE 1 1 13 3214 1 1 11 ARG HG2 H 18.689 2.196 4.721 1.00 . A A . 33 ARG HG2 1 1 13 3215 1 1 11 ARG HG3 H 19.490 0.658 4.688 1.00 . A A . 33 ARG HG3 1 1 13 3216 1 1 11 ARG HH11 H 21.285 2.084 1.031 1.00 . A A . 33 ARG HH11 1 1 13 3217 1 1 11 ARG HH12 H 21.107 3.127 -0.312 1.00 . A A . 33 ARG HH12 1 1 13 3218 1 1 11 ARG HH21 H 18.847 5.247 1.348 1.00 . A A . 33 ARG HH21 1 1 13 3219 1 1 11 ARG HH22 H 19.706 5.012 -0.107 1.00 . A A . 33 ARG HH22 1 1 13 3220 1 1 11 ARG N N 17.006 -1.155 2.001 1.00 . A A . 33 ARG N 1 1 13 3221 1 1 11 ARG NE N 19.703 3.262 2.537 1.00 . A A . 33 ARG NE 1 1 13 3222 1 1 11 ARG NH1 N 20.861 2.891 0.627 1.00 . A A . 33 ARG NH1 1 1 13 3223 1 1 11 ARG NH2 N 19.490 4.694 0.818 1.00 . A A . 33 ARG NH2 1 1 13 3224 1 1 11 ARG O O 20.099 -1.649 3.409 1.00 . A A . 33 ARG O 1 1 13 3225 1 1 12 GLN C C 19.820 -3.803 4.918 1.00 . A A . 34 GLN C 1 1 13 3226 1 1 12 GLN CA C 18.580 -2.994 5.349 1.00 . A A . 34 GLN CA 1 1 13 3227 1 1 12 GLN CB C 17.428 -3.983 5.726 1.00 . A A . 34 GLN CB 1 1 13 3228 1 1 12 GLN CD C 16.030 -5.930 5.125 1.00 . A A . 34 GLN CD 1 1 13 3229 1 1 12 GLN CG C 16.860 -4.789 4.527 1.00 . A A . 34 GLN CG 1 1 13 3230 1 1 12 GLN H H 17.143 -1.769 4.256 1.00 . A A . 34 GLN H 1 1 13 3231 1 1 12 GLN HA H 18.858 -2.437 6.232 1.00 . A A . 34 GLN HA 1 1 13 3232 1 1 12 GLN HB2 H 17.806 -4.675 6.468 1.00 . A A . 34 GLN HB2 1 1 13 3233 1 1 12 GLN HB3 H 16.618 -3.438 6.192 1.00 . A A . 34 GLN HB3 1 1 13 3234 1 1 12 GLN HE21 H 17.135 -7.398 4.361 1.00 . A A . 34 GLN HE21 1 1 13 3235 1 1 12 GLN HE22 H 15.809 -7.875 5.311 1.00 . A A . 34 GLN HE22 1 1 13 3236 1 1 12 GLN HG2 H 16.200 -4.174 3.932 1.00 . A A . 34 GLN HG2 1 1 13 3237 1 1 12 GLN HG3 H 17.626 -5.211 3.900 1.00 . A A . 34 GLN HG3 1 1 13 3238 1 1 12 GLN N N 18.091 -2.015 4.315 1.00 . A A . 34 GLN N 1 1 13 3239 1 1 12 GLN NE2 N 16.358 -7.169 4.909 1.00 . A A . 34 GLN NE2 1 1 13 3240 1 1 12 GLN O O 20.747 -3.977 5.683 1.00 . A A . 34 GLN O 1 1 13 3241 1 1 12 GLN OE1 O 15.059 -5.709 5.817 1.00 . A A . 34 GLN OE1 1 1 13 3242 1 1 13 ARG C C 22.202 -4.171 2.834 1.00 . A A . 35 ARG C 1 1 13 3243 1 1 13 ARG CA C 20.999 -5.062 3.212 1.00 . A A . 35 ARG CA 1 1 13 3244 1 1 13 ARG CB C 20.522 -5.924 1.994 1.00 . A A . 35 ARG CB 1 1 13 3245 1 1 13 ARG CD C 20.810 -4.168 0.113 1.00 . A A . 35 ARG CD 1 1 13 3246 1 1 13 ARG CG C 19.833 -5.139 0.820 1.00 . A A . 35 ARG CG 1 1 13 3247 1 1 13 ARG CZ C 20.893 -4.202 -2.372 1.00 . A A . 35 ARG CZ 1 1 13 3248 1 1 13 ARG H H 19.070 -4.089 3.107 1.00 . A A . 35 ARG H 1 1 13 3249 1 1 13 ARG HA H 21.313 -5.719 4.011 1.00 . A A . 35 ARG HA 1 1 13 3250 1 1 13 ARG HB2 H 21.381 -6.452 1.604 1.00 . A A . 35 ARG HB2 1 1 13 3251 1 1 13 ARG HB3 H 19.828 -6.666 2.359 1.00 . A A . 35 ARG HB3 1 1 13 3252 1 1 13 ARG HD2 H 20.849 -3.236 0.664 1.00 . A A . 35 ARG HD2 1 1 13 3253 1 1 13 ARG HD3 H 21.803 -4.579 0.074 1.00 . A A . 35 ARG HD3 1 1 13 3254 1 1 13 ARG HE H 19.384 -3.443 -1.285 1.00 . A A . 35 ARG HE 1 1 13 3255 1 1 13 ARG HG2 H 19.466 -5.863 0.105 1.00 . A A . 35 ARG HG2 1 1 13 3256 1 1 13 ARG HG3 H 18.983 -4.585 1.190 1.00 . A A . 35 ARG HG3 1 1 13 3257 1 1 13 ARG HH11 H 22.502 -5.001 -1.462 1.00 . A A . 35 ARG HH11 1 1 13 3258 1 1 13 ARG HH12 H 22.563 -5.031 -3.160 1.00 . A A . 35 ARG HH12 1 1 13 3259 1 1 13 ARG HH21 H 19.422 -3.458 -3.525 1.00 . A A . 35 ARG HH21 1 1 13 3260 1 1 13 ARG HH22 H 20.737 -4.140 -4.387 1.00 . A A . 35 ARG HH22 1 1 13 3261 1 1 13 ARG N N 19.828 -4.268 3.694 1.00 . A A . 35 ARG N 1 1 13 3262 1 1 13 ARG NE N 20.264 -3.886 -1.260 1.00 . A A . 35 ARG NE 1 1 13 3263 1 1 13 ARG NH1 N 22.063 -4.782 -2.332 1.00 . A A . 35 ARG NH1 1 1 13 3264 1 1 13 ARG NH2 N 20.314 -3.915 -3.508 1.00 . A A . 35 ARG NH2 1 1 13 3265 1 1 13 ARG O O 22.956 -4.464 1.927 1.00 . A A . 35 ARG O 1 1 13 3266 1 1 14 TYR C C 24.114 -2.019 4.728 1.00 . A A . 36 TYR C 1 1 13 3267 1 1 14 TYR CA C 23.432 -2.123 3.358 1.00 . A A . 36 TYR CA 1 1 13 3268 1 1 14 TYR CB C 22.776 -0.801 2.892 1.00 . A A . 36 TYR CB 1 1 13 3269 1 1 14 TYR CD1 C 24.382 1.095 3.427 1.00 . A A . 36 TYR CD1 1 1 13 3270 1 1 14 TYR CD2 C 24.145 0.435 1.156 1.00 . A A . 36 TYR CD2 1 1 13 3271 1 1 14 TYR CE1 C 25.291 2.060 3.053 1.00 . A A . 36 TYR CE1 1 1 13 3272 1 1 14 TYR CE2 C 25.056 1.403 0.784 1.00 . A A . 36 TYR CE2 1 1 13 3273 1 1 14 TYR CG C 23.798 0.272 2.483 1.00 . A A . 36 TYR CG 1 1 13 3274 1 1 14 TYR CZ C 25.634 2.222 1.728 1.00 . A A . 36 TYR CZ 1 1 13 3275 1 1 14 TYR H H 21.701 -2.924 4.276 1.00 . A A . 36 TYR H 1 1 13 3276 1 1 14 TYR HA H 24.123 -2.515 2.636 1.00 . A A . 36 TYR HA 1 1 13 3277 1 1 14 TYR HB2 H 22.120 -1.004 2.060 1.00 . A A . 36 TYR HB2 1 1 13 3278 1 1 14 TYR HB3 H 22.180 -0.413 3.705 1.00 . A A . 36 TYR HB3 1 1 13 3279 1 1 14 TYR HD1 H 24.127 0.985 4.471 1.00 . A A . 36 TYR HD1 1 1 13 3280 1 1 14 TYR HD2 H 23.703 -0.199 0.401 1.00 . A A . 36 TYR HD2 1 1 13 3281 1 1 14 TYR HE1 H 25.734 2.693 3.808 1.00 . A A . 36 TYR HE1 1 1 13 3282 1 1 14 TYR HE2 H 25.324 1.524 -0.255 1.00 . A A . 36 TYR HE2 1 1 13 3283 1 1 14 TYR HH H 27.354 3.077 1.840 1.00 . A A . 36 TYR HH 1 1 13 3284 1 1 14 TYR N N 22.340 -3.101 3.561 1.00 . A A . 36 TYR N 1 1 13 3285 1 1 14 TYR O O 23.989 -1.044 5.434 1.00 . A A . 36 TYR O 1 1 13 3286 1 1 14 TYR OH O 26.539 3.187 1.342 1.00 . A A . 36 TYR OH 1 1 13 3287 1 1 15 NH2 HN1 H 24.967 -3.813 4.614 1.00 . A A . 37 NH2 HN1 1 1 13 3288 1 1 15 NH2 HN2 H 25.270 -2.934 6.037 1.00 . A A . 37 NH2 HN2 1 1 13 3289 1 1 15 NH2 N N 24.843 -3.007 5.157 1.00 . A A . 37 NH2 N 1 1 14 3290 1 1 1 ACE C C 2.609 6.182 -1.671 1.00 . A A . 23 ACE C 1 1 14 3291 1 1 1 ACE CH3 C 1.663 7.117 -2.416 1.00 . A A . 23 ACE CH3 1 1 14 3292 1 1 1 ACE H1 H 1.738 6.928 -3.476 1.00 . A A . 23 ACE H1 1 1 14 3293 1 1 1 ACE H2 H 1.947 8.139 -2.211 1.00 . A A . 23 ACE H2 1 1 14 3294 1 1 1 ACE H3 H 0.647 6.956 -2.091 1.00 . A A . 23 ACE H3 1 1 14 3295 1 1 1 ACE O O 3.803 6.233 -1.891 1.00 . A A . 23 ACE O 1 1 14 3296 1 1 2 ALA C C 4.108 3.895 -0.672 1.00 . A A . 24 ALA C 1 1 14 3297 1 1 2 ALA CA C 2.824 4.366 0.002 1.00 . A A . 24 ALA CA 1 1 14 3298 1 1 2 ALA CB C 1.926 3.150 0.296 1.00 . A A . 24 ALA CB 1 1 14 3299 1 1 2 ALA H H 1.072 5.388 -0.710 1.00 . A A . 24 ALA H 1 1 14 3300 1 1 2 ALA HA H 3.103 4.843 0.924 1.00 . A A . 24 ALA HA 1 1 14 3301 1 1 2 ALA HB1 H 1.605 2.677 -0.620 1.00 . A A . 24 ALA HB1 1 1 14 3302 1 1 2 ALA HB2 H 1.052 3.454 0.855 1.00 . A A . 24 ALA HB2 1 1 14 3303 1 1 2 ALA HB3 H 2.473 2.427 0.887 1.00 . A A . 24 ALA HB3 1 1 14 3304 1 1 2 ALA N N 2.045 5.356 -0.819 1.00 . A A . 24 ALA N 1 1 14 3305 1 1 2 ALA O O 5.160 3.893 -0.066 1.00 . A A . 24 ALA O 1 1 14 3306 1 1 3 ARG C C 6.411 3.705 -2.447 1.00 . A A . 25 ARG C 1 1 14 3307 1 1 3 ARG CA C 5.076 3.008 -2.764 1.00 . A A . 25 ARG CA 1 1 14 3308 1 1 3 ARG CB C 4.727 3.217 -4.265 1.00 . A A . 25 ARG CB 1 1 14 3309 1 1 3 ARG CD C 4.415 4.797 -6.177 1.00 . A A . 25 ARG CD 1 1 14 3310 1 1 3 ARG CG C 4.602 4.714 -4.655 1.00 . A A . 25 ARG CG 1 1 14 3311 1 1 3 ARG CZ C 5.561 6.734 -7.230 1.00 . A A . 25 ARG CZ 1 1 14 3312 1 1 3 ARG H H 3.036 3.555 -2.261 1.00 . A A . 25 ARG H 1 1 14 3313 1 1 3 ARG HA H 5.204 1.952 -2.568 1.00 . A A . 25 ARG HA 1 1 14 3314 1 1 3 ARG HB2 H 5.510 2.754 -4.849 1.00 . A A . 25 ARG HB2 1 1 14 3315 1 1 3 ARG HB3 H 3.803 2.700 -4.482 1.00 . A A . 25 ARG HB3 1 1 14 3316 1 1 3 ARG HD2 H 5.111 4.167 -6.707 1.00 . A A . 25 ARG HD2 1 1 14 3317 1 1 3 ARG HD3 H 3.419 4.457 -6.429 1.00 . A A . 25 ARG HD3 1 1 14 3318 1 1 3 ARG HE H 3.772 6.823 -6.358 1.00 . A A . 25 ARG HE 1 1 14 3319 1 1 3 ARG HG2 H 3.759 5.162 -4.146 1.00 . A A . 25 ARG HG2 1 1 14 3320 1 1 3 ARG HG3 H 5.498 5.254 -4.384 1.00 . A A . 25 ARG HG3 1 1 14 3321 1 1 3 ARG HH11 H 6.592 5.017 -7.250 1.00 . A A . 25 ARG HH11 1 1 14 3322 1 1 3 ARG HH12 H 7.367 6.326 -8.032 1.00 . A A . 25 ARG HH12 1 1 14 3323 1 1 3 ARG HH21 H 4.752 8.576 -7.323 1.00 . A A . 25 ARG HH21 1 1 14 3324 1 1 3 ARG HH22 H 6.292 8.427 -8.044 1.00 . A A . 25 ARG HH22 1 1 14 3325 1 1 3 ARG N N 3.945 3.505 -1.910 1.00 . A A . 25 ARG N 1 1 14 3326 1 1 3 ARG NE N 4.529 6.241 -6.585 1.00 . A A . 25 ARG NE 1 1 14 3327 1 1 3 ARG NH1 N 6.579 5.974 -7.526 1.00 . A A . 25 ARG NH1 1 1 14 3328 1 1 3 ARG NH2 N 5.534 7.997 -7.554 1.00 . A A . 25 ARG NH2 1 1 14 3329 1 1 3 ARG O O 7.462 3.100 -2.498 1.00 . A A . 25 ARG O 1 1 14 3330 1 1 4 HIS C C 8.461 5.171 -0.773 1.00 . A A . 26 HIS C 1 1 14 3331 1 1 4 HIS CA C 7.515 5.806 -1.799 1.00 . A A . 26 HIS CA 1 1 14 3332 1 1 4 HIS CB C 6.951 7.167 -1.313 1.00 . A A . 26 HIS CB 1 1 14 3333 1 1 4 HIS CD2 C 8.175 8.794 0.300 1.00 . A A . 26 HIS CD2 1 1 14 3334 1 1 4 HIS CE1 C 9.681 9.340 -0.955 1.00 . A A . 26 HIS CE1 1 1 14 3335 1 1 4 HIS CG C 8.050 8.153 -0.909 1.00 . A A . 26 HIS CG 1 1 14 3336 1 1 4 HIS H H 5.422 5.377 -2.137 1.00 . A A . 26 HIS H 1 1 14 3337 1 1 4 HIS HA H 8.108 5.868 -2.686 1.00 . A A . 26 HIS HA 1 1 14 3338 1 1 4 HIS HB2 H 6.359 7.621 -2.094 1.00 . A A . 26 HIS HB2 1 1 14 3339 1 1 4 HIS HB3 H 6.306 7.007 -0.460 1.00 . A A . 26 HIS HB3 1 1 14 3340 1 1 4 HIS HD1 H 9.202 8.221 -2.626 1.00 . A A . 26 HIS HD1 1 1 14 3341 1 1 4 HIS HD2 H 7.512 8.692 1.148 1.00 . A A . 26 HIS HD2 1 1 14 3342 1 1 4 HIS HE1 H 10.572 9.839 -1.313 1.00 . A A . 26 HIS HE1 1 1 14 3343 1 1 4 HIS N N 6.318 4.971 -2.141 1.00 . A A . 26 HIS N 1 1 14 3344 1 1 4 HIS ND1 N 9.015 8.505 -1.707 1.00 . A A . 26 HIS ND1 1 1 14 3345 1 1 4 HIS NE2 N 9.234 9.558 0.256 1.00 . A A . 26 HIS NE2 1 1 14 3346 1 1 4 HIS O O 9.641 5.456 -0.716 1.00 . A A . 26 HIS O 1 1 14 3347 1 1 5 TYR C C 9.215 2.227 0.620 1.00 . A A . 27 TYR C 1 1 14 3348 1 1 5 TYR CA C 8.686 3.591 1.067 1.00 . A A . 27 TYR CA 1 1 14 3349 1 1 5 TYR CB C 7.784 3.405 2.304 1.00 . A A . 27 TYR CB 1 1 14 3350 1 1 5 TYR CD1 C 8.070 5.928 2.858 1.00 . A A . 27 TYR CD1 1 1 14 3351 1 1 5 TYR CD2 C 6.868 4.528 4.357 1.00 . A A . 27 TYR CD2 1 1 14 3352 1 1 5 TYR CE1 C 7.849 7.003 3.705 1.00 . A A . 27 TYR CE1 1 1 14 3353 1 1 5 TYR CE2 C 6.650 5.601 5.198 1.00 . A A . 27 TYR CE2 1 1 14 3354 1 1 5 TYR CG C 7.579 4.670 3.178 1.00 . A A . 27 TYR CG 1 1 14 3355 1 1 5 TYR CZ C 7.139 6.848 4.879 1.00 . A A . 27 TYR CZ 1 1 14 3356 1 1 5 TYR H H 6.955 4.135 -0.135 1.00 . A A . 27 TYR H 1 1 14 3357 1 1 5 TYR HA H 9.551 4.183 1.295 1.00 . A A . 27 TYR HA 1 1 14 3358 1 1 5 TYR HB2 H 6.813 3.062 1.977 1.00 . A A . 27 TYR HB2 1 1 14 3359 1 1 5 TYR HB3 H 8.217 2.630 2.913 1.00 . A A . 27 TYR HB3 1 1 14 3360 1 1 5 TYR HD1 H 8.629 6.084 1.946 1.00 . A A . 27 TYR HD1 1 1 14 3361 1 1 5 TYR HD2 H 6.473 3.559 4.628 1.00 . A A . 27 TYR HD2 1 1 14 3362 1 1 5 TYR HE1 H 8.236 7.979 3.449 1.00 . A A . 27 TYR HE1 1 1 14 3363 1 1 5 TYR HE2 H 6.088 5.453 6.109 1.00 . A A . 27 TYR HE2 1 1 14 3364 1 1 5 TYR HH H 6.799 7.622 6.612 1.00 . A A . 27 TYR HH 1 1 14 3365 1 1 5 TYR N N 7.906 4.300 0.008 1.00 . A A . 27 TYR N 1 1 14 3366 1 1 5 TYR O O 9.748 1.468 1.409 1.00 . A A . 27 TYR O 1 1 14 3367 1 1 5 TYR OH O 6.934 7.930 5.712 1.00 . A A . 27 TYR OH 1 1 14 3368 1 1 6 LYS C C 11.064 0.623 -1.077 1.00 . A A . 28 LYS C 1 1 14 3369 1 1 6 LYS CA C 9.548 0.657 -1.206 1.00 . A A . 28 LYS CA 1 1 14 3370 1 1 6 LYS CB C 9.131 0.528 -2.701 1.00 . A A . 28 LYS CB 1 1 14 3371 1 1 6 LYS CD C 11.063 -0.455 -4.055 1.00 . A A . 28 LYS CD 1 1 14 3372 1 1 6 LYS CE C 11.877 -1.746 -4.276 1.00 . A A . 28 LYS CE 1 1 14 3373 1 1 6 LYS CG C 9.752 -0.783 -3.297 1.00 . A A . 28 LYS CG 1 1 14 3374 1 1 6 LYS H H 8.633 2.646 -1.186 1.00 . A A . 28 LYS H 1 1 14 3375 1 1 6 LYS HA H 9.135 -0.168 -0.654 1.00 . A A . 28 LYS HA 1 1 14 3376 1 1 6 LYS HB2 H 8.053 0.483 -2.772 1.00 . A A . 28 LYS HB2 1 1 14 3377 1 1 6 LYS HB3 H 9.470 1.389 -3.258 1.00 . A A . 28 LYS HB3 1 1 14 3378 1 1 6 LYS HD2 H 10.787 -0.016 -4.996 1.00 . A A . 28 LYS HD2 1 1 14 3379 1 1 6 LYS HD3 H 11.672 0.258 -3.523 1.00 . A A . 28 LYS HD3 1 1 14 3380 1 1 6 LYS HE2 H 11.259 -2.549 -4.654 1.00 . A A . 28 LYS HE2 1 1 14 3381 1 1 6 LYS HE3 H 12.694 -1.570 -4.964 1.00 . A A . 28 LYS HE3 1 1 14 3382 1 1 6 LYS HG2 H 9.962 -1.500 -2.516 1.00 . A A . 28 LYS HG2 1 1 14 3383 1 1 6 LYS HG3 H 9.053 -1.239 -3.982 1.00 . A A . 28 LYS HG3 1 1 14 3384 1 1 6 LYS HZ1 H 11.787 -2.166 -2.180 1.00 . A A . 28 LYS HZ1 1 1 14 3385 1 1 6 LYS N N 9.067 1.961 -0.642 1.00 . A A . 28 LYS N 1 1 14 3386 1 1 6 LYS NZ N 12.415 -2.126 -2.933 1.00 . A A . 28 LYS NZ 1 1 14 3387 1 1 6 LYS O O 11.626 -0.332 -0.573 1.00 . A A . 28 LYS O 1 1 14 3388 1 1 7 ASN C C 13.679 1.441 -0.068 1.00 . A A . 29 ASN C 1 1 14 3389 1 1 7 ASN CA C 13.173 1.781 -1.481 1.00 . A A . 29 ASN CA 1 1 14 3390 1 1 7 ASN CB C 13.600 3.219 -1.872 1.00 . A A . 29 ASN CB 1 1 14 3391 1 1 7 ASN CG C 15.126 3.283 -2.039 1.00 . A A . 29 ASN CG 1 1 14 3392 1 1 7 ASN H H 11.126 2.406 -1.926 1.00 . A A . 29 ASN H 1 1 14 3393 1 1 7 ASN HA H 13.595 1.062 -2.171 1.00 . A A . 29 ASN HA 1 1 14 3394 1 1 7 ASN HB2 H 13.134 3.501 -2.804 1.00 . A A . 29 ASN HB2 1 1 14 3395 1 1 7 ASN HB3 H 13.315 3.930 -1.112 1.00 . A A . 29 ASN HB3 1 1 14 3396 1 1 7 ASN HD21 H 15.032 3.716 -3.979 1.00 . A A . 29 ASN HD21 1 1 14 3397 1 1 7 ASN HD22 H 16.591 3.583 -3.315 1.00 . A A . 29 ASN HD22 1 1 14 3398 1 1 7 ASN N N 11.676 1.684 -1.543 1.00 . A A . 29 ASN N 1 1 14 3399 1 1 7 ASN ND2 N 15.619 3.551 -3.212 1.00 . A A . 29 ASN ND2 1 1 14 3400 1 1 7 ASN O O 14.467 0.536 0.121 1.00 . A A . 29 ASN O 1 1 14 3401 1 1 7 ASN OD1 O 15.893 3.093 -1.115 1.00 . A A . 29 ASN OD1 1 1 14 3402 1 1 8 LEU C C 13.741 0.610 2.811 1.00 . A A . 30 LEU C 1 1 14 3403 1 1 8 LEU CA C 13.538 2.054 2.324 1.00 . A A . 30 LEU CA 1 1 14 3404 1 1 8 LEU CB C 12.430 2.715 3.191 1.00 . A A . 30 LEU CB 1 1 14 3405 1 1 8 LEU CD1 C 11.249 4.822 3.891 1.00 . A A . 30 LEU CD1 1 1 14 3406 1 1 8 LEU CD2 C 13.541 5.012 2.879 1.00 . A A . 30 LEU CD2 1 1 14 3407 1 1 8 LEU CG C 12.212 4.220 2.844 1.00 . A A . 30 LEU CG 1 1 14 3408 1 1 8 LEU H H 12.553 2.901 0.607 1.00 . A A . 30 LEU H 1 1 14 3409 1 1 8 LEU HA H 14.471 2.570 2.492 1.00 . A A . 30 LEU HA 1 1 14 3410 1 1 8 LEU HB2 H 11.498 2.181 3.057 1.00 . A A . 30 LEU HB2 1 1 14 3411 1 1 8 LEU HB3 H 12.714 2.625 4.230 1.00 . A A . 30 LEU HB3 1 1 14 3412 1 1 8 LEU HD11 H 11.665 4.758 4.888 1.00 . A A . 30 LEU HD11 1 1 14 3413 1 1 8 LEU HD12 H 10.308 4.291 3.880 1.00 . A A . 30 LEU HD12 1 1 14 3414 1 1 8 LEU HD13 H 11.050 5.862 3.670 1.00 . A A . 30 LEU HD13 1 1 14 3415 1 1 8 LEU HD21 H 13.351 6.050 2.647 1.00 . A A . 30 LEU HD21 1 1 14 3416 1 1 8 LEU HD22 H 14.243 4.635 2.151 1.00 . A A . 30 LEU HD22 1 1 14 3417 1 1 8 LEU HD23 H 13.989 4.959 3.861 1.00 . A A . 30 LEU HD23 1 1 14 3418 1 1 8 LEU HG H 11.765 4.318 1.865 1.00 . A A . 30 LEU HG 1 1 14 3419 1 1 8 LEU N N 13.185 2.205 0.873 1.00 . A A . 30 LEU N 1 1 14 3420 1 1 8 LEU O O 14.800 0.256 3.295 1.00 . A A . 30 LEU O 1 1 14 3421 1 1 9 ILE C C 13.979 -2.366 2.443 1.00 . A A . 31 ILE C 1 1 14 3422 1 1 9 ILE CA C 12.828 -1.630 3.126 1.00 . A A . 31 ILE CA 1 1 14 3423 1 1 9 ILE CB C 11.461 -2.331 2.838 1.00 . A A . 31 ILE CB 1 1 14 3424 1 1 9 ILE CD1 C 9.002 -2.296 3.572 1.00 . A A . 31 ILE CD1 1 1 14 3425 1 1 9 ILE CG1 C 10.363 -1.579 3.662 1.00 . A A . 31 ILE CG1 1 1 14 3426 1 1 9 ILE CG2 C 11.507 -3.830 3.265 1.00 . A A . 31 ILE CG2 1 1 14 3427 1 1 9 ILE H H 11.889 0.131 2.269 1.00 . A A . 31 ILE H 1 1 14 3428 1 1 9 ILE HA H 13.062 -1.625 4.180 1.00 . A A . 31 ILE HA 1 1 14 3429 1 1 9 ILE HB H 11.239 -2.258 1.781 1.00 . A A . 31 ILE HB 1 1 14 3430 1 1 9 ILE HD11 H 9.054 -3.284 4.002 1.00 . A A . 31 ILE HD11 1 1 14 3431 1 1 9 ILE HD12 H 8.692 -2.379 2.541 1.00 . A A . 31 ILE HD12 1 1 14 3432 1 1 9 ILE HD13 H 8.258 -1.731 4.114 1.00 . A A . 31 ILE HD13 1 1 14 3433 1 1 9 ILE HG12 H 10.659 -1.513 4.699 1.00 . A A . 31 ILE HG12 1 1 14 3434 1 1 9 ILE HG13 H 10.245 -0.573 3.281 1.00 . A A . 31 ILE HG13 1 1 14 3435 1 1 9 ILE HG21 H 10.570 -4.315 3.038 1.00 . A A . 31 ILE HG21 1 1 14 3436 1 1 9 ILE HG22 H 11.696 -3.913 4.325 1.00 . A A . 31 ILE HG22 1 1 14 3437 1 1 9 ILE HG23 H 12.285 -4.362 2.738 1.00 . A A . 31 ILE HG23 1 1 14 3438 1 1 9 ILE N N 12.724 -0.200 2.674 1.00 . A A . 31 ILE N 1 1 14 3439 1 1 9 ILE O O 14.410 -3.418 2.875 1.00 . A A . 31 ILE O 1 1 14 3440 1 1 10 GLU C C 16.883 -1.695 1.028 1.00 . A A . 32 GLU C 1 1 14 3441 1 1 10 GLU CA C 15.598 -2.428 0.636 1.00 . A A . 32 GLU CA 1 1 14 3442 1 1 10 GLU CB C 15.370 -2.273 -0.872 1.00 . A A . 32 GLU CB 1 1 14 3443 1 1 10 GLU CD C 13.675 -2.403 -2.711 1.00 . A A . 32 GLU CD 1 1 14 3444 1 1 10 GLU CG C 13.965 -2.753 -1.255 1.00 . A A . 32 GLU CG 1 1 14 3445 1 1 10 GLU H H 14.085 -0.938 1.100 1.00 . A A . 32 GLU H 1 1 14 3446 1 1 10 GLU HA H 15.695 -3.471 0.913 1.00 . A A . 32 GLU HA 1 1 14 3447 1 1 10 GLU HB2 H 15.478 -1.234 -1.152 1.00 . A A . 32 GLU HB2 1 1 14 3448 1 1 10 GLU HB3 H 16.115 -2.837 -1.416 1.00 . A A . 32 GLU HB3 1 1 14 3449 1 1 10 GLU HG2 H 13.867 -3.821 -1.140 1.00 . A A . 32 GLU HG2 1 1 14 3450 1 1 10 GLU HG3 H 13.222 -2.262 -0.645 1.00 . A A . 32 GLU HG3 1 1 14 3451 1 1 10 GLU N N 14.469 -1.795 1.386 1.00 . A A . 32 GLU N 1 1 14 3452 1 1 10 GLU O O 17.866 -1.767 0.317 1.00 . A A . 32 GLU O 1 1 14 3453 1 1 10 GLU OE1 O 14.550 -2.415 -3.557 1.00 . A A . 32 GLU OE1 1 1 14 3454 1 1 11 ARG C C 18.801 -1.087 3.640 1.00 . A A . 33 ARG C 1 1 14 3455 1 1 11 ARG CA C 18.067 -0.279 2.586 1.00 . A A . 33 ARG CA 1 1 14 3456 1 1 11 ARG CB C 17.660 1.104 3.156 1.00 . A A . 33 ARG CB 1 1 14 3457 1 1 11 ARG CD C 19.391 2.248 1.717 1.00 . A A . 33 ARG CD 1 1 14 3458 1 1 11 ARG CG C 18.892 2.056 3.174 1.00 . A A . 33 ARG CG 1 1 14 3459 1 1 11 ARG CZ C 20.406 4.379 0.995 1.00 . A A . 33 ARG CZ 1 1 14 3460 1 1 11 ARG H H 16.021 -0.992 2.675 1.00 . A A . 33 ARG H 1 1 14 3461 1 1 11 ARG HA H 18.716 -0.196 1.742 1.00 . A A . 33 ARG HA 1 1 14 3462 1 1 11 ARG HB2 H 16.870 1.527 2.552 1.00 . A A . 33 ARG HB2 1 1 14 3463 1 1 11 ARG HB3 H 17.280 0.988 4.161 1.00 . A A . 33 ARG HB3 1 1 14 3464 1 1 11 ARG HD2 H 19.837 1.343 1.337 1.00 . A A . 33 ARG HD2 1 1 14 3465 1 1 11 ARG HD3 H 18.564 2.495 1.072 1.00 . A A . 33 ARG HD3 1 1 14 3466 1 1 11 ARG HE H 21.261 3.091 2.259 1.00 . A A . 33 ARG HE 1 1 14 3467 1 1 11 ARG HG2 H 18.608 3.004 3.609 1.00 . A A . 33 ARG HG2 1 1 14 3468 1 1 11 ARG HG3 H 19.673 1.623 3.787 1.00 . A A . 33 ARG HG3 1 1 14 3469 1 1 11 ARG HH11 H 18.576 4.006 0.218 1.00 . A A . 33 ARG HH11 1 1 14 3470 1 1 11 ARG HH12 H 19.300 5.464 -0.290 1.00 . A A . 33 ARG HH12 1 1 14 3471 1 1 11 ARG HH21 H 22.217 4.982 1.624 1.00 . A A . 33 ARG HH21 1 1 14 3472 1 1 11 ARG HH22 H 21.437 6.054 0.547 1.00 . A A . 33 ARG HH22 1 1 14 3473 1 1 11 ARG N N 16.847 -1.018 2.146 1.00 . A A . 33 ARG N 1 1 14 3474 1 1 11 ARG NE N 20.473 3.282 1.703 1.00 . A A . 33 ARG NE 1 1 14 3475 1 1 11 ARG NH1 N 19.355 4.632 0.258 1.00 . A A . 33 ARG NH1 1 1 14 3476 1 1 11 ARG NH2 N 21.420 5.194 1.058 1.00 . A A . 33 ARG NH2 1 1 14 3477 1 1 11 ARG O O 20.014 -1.129 3.651 1.00 . A A . 33 ARG O 1 1 14 3478 1 1 12 GLN C C 19.756 -3.415 4.963 1.00 . A A . 34 GLN C 1 1 14 3479 1 1 12 GLN CA C 18.654 -2.536 5.596 1.00 . A A . 34 GLN CA 1 1 14 3480 1 1 12 GLN CB C 17.515 -3.389 6.212 1.00 . A A . 34 GLN CB 1 1 14 3481 1 1 12 GLN CD C 16.841 -4.925 8.064 1.00 . A A . 34 GLN CD 1 1 14 3482 1 1 12 GLN CG C 18.042 -4.293 7.353 1.00 . A A . 34 GLN CG 1 1 14 3483 1 1 12 GLN H H 17.080 -1.588 4.434 1.00 . A A . 34 GLN H 1 1 14 3484 1 1 12 GLN HA H 19.108 -1.884 6.329 1.00 . A A . 34 GLN HA 1 1 14 3485 1 1 12 GLN HB2 H 16.749 -2.741 6.619 1.00 . A A . 34 GLN HB2 1 1 14 3486 1 1 12 GLN HB3 H 17.061 -4.010 5.452 1.00 . A A . 34 GLN HB3 1 1 14 3487 1 1 12 GLN HE21 H 17.293 -6.808 7.586 1.00 . A A . 34 GLN HE21 1 1 14 3488 1 1 12 GLN HE22 H 15.886 -6.570 8.508 1.00 . A A . 34 GLN HE22 1 1 14 3489 1 1 12 GLN HG2 H 18.681 -5.077 6.972 1.00 . A A . 34 GLN HG2 1 1 14 3490 1 1 12 GLN HG3 H 18.594 -3.712 8.077 1.00 . A A . 34 GLN HG3 1 1 14 3491 1 1 12 GLN N N 18.049 -1.697 4.511 1.00 . A A . 34 GLN N 1 1 14 3492 1 1 12 GLN NE2 N 16.668 -6.212 8.044 1.00 . A A . 34 GLN NE2 1 1 14 3493 1 1 12 GLN O O 20.860 -3.550 5.450 1.00 . A A . 34 GLN O 1 1 14 3494 1 1 12 GLN OE1 O 16.028 -4.246 8.654 1.00 . A A . 34 GLN OE1 1 1 14 3495 1 1 13 ARG C C 21.072 -4.085 2.000 1.00 . A A . 35 ARG C 1 1 14 3496 1 1 13 ARG CA C 20.267 -4.884 3.062 1.00 . A A . 35 ARG CA 1 1 14 3497 1 1 13 ARG CB C 19.353 -5.933 2.396 1.00 . A A . 35 ARG CB 1 1 14 3498 1 1 13 ARG CD C 19.212 -8.086 1.153 1.00 . A A . 35 ARG CD 1 1 14 3499 1 1 13 ARG CG C 20.118 -7.224 2.053 1.00 . A A . 35 ARG CG 1 1 14 3500 1 1 13 ARG CZ C 20.332 -10.215 0.512 1.00 . A A . 35 ARG CZ 1 1 14 3501 1 1 13 ARG H H 18.476 -3.812 3.534 1.00 . A A . 35 ARG H 1 1 14 3502 1 1 13 ARG HA H 20.960 -5.353 3.743 1.00 . A A . 35 ARG HA 1 1 14 3503 1 1 13 ARG HB2 H 18.533 -6.171 3.059 1.00 . A A . 35 ARG HB2 1 1 14 3504 1 1 13 ARG HB3 H 18.943 -5.501 1.492 1.00 . A A . 35 ARG HB3 1 1 14 3505 1 1 13 ARG HD2 H 18.178 -7.968 1.457 1.00 . A A . 35 ARG HD2 1 1 14 3506 1 1 13 ARG HD3 H 19.272 -7.782 0.118 1.00 . A A . 35 ARG HD3 1 1 14 3507 1 1 13 ARG HE H 19.229 -9.967 2.144 1.00 . A A . 35 ARG HE 1 1 14 3508 1 1 13 ARG HG2 H 21.031 -6.976 1.530 1.00 . A A . 35 ARG HG2 1 1 14 3509 1 1 13 ARG HG3 H 20.375 -7.749 2.963 1.00 . A A . 35 ARG HG3 1 1 14 3510 1 1 13 ARG HH11 H 20.684 -8.677 -0.709 1.00 . A A . 35 ARG HH11 1 1 14 3511 1 1 13 ARG HH12 H 21.384 -10.159 -1.208 1.00 . A A . 35 ARG HH12 1 1 14 3512 1 1 13 ARG HH21 H 20.173 -11.905 1.596 1.00 . A A . 35 ARG HH21 1 1 14 3513 1 1 13 ARG HH22 H 21.121 -12.039 0.180 1.00 . A A . 35 ARG HH22 1 1 14 3514 1 1 13 ARG N N 19.378 -3.988 3.853 1.00 . A A . 35 ARG N 1 1 14 3515 1 1 13 ARG NE N 19.590 -9.527 1.343 1.00 . A A . 35 ARG NE 1 1 14 3516 1 1 13 ARG NH1 N 20.837 -9.648 -0.545 1.00 . A A . 35 ARG NH1 1 1 14 3517 1 1 13 ARG NH2 N 20.558 -11.470 0.781 1.00 . A A . 35 ARG NH2 1 1 14 3518 1 1 13 ARG O O 21.328 -4.594 0.925 1.00 . A A . 35 ARG O 1 1 14 3519 1 1 14 TYR C C 23.496 -1.568 2.129 1.00 . A A . 36 TYR C 1 1 14 3520 1 1 14 TYR CA C 22.228 -2.007 1.382 1.00 . A A . 36 TYR CA 1 1 14 3521 1 1 14 TYR CB C 21.347 -0.795 0.984 1.00 . A A . 36 TYR CB 1 1 14 3522 1 1 14 TYR CD1 C 23.072 0.853 0.031 1.00 . A A . 36 TYR CD1 1 1 14 3523 1 1 14 TYR CD2 C 21.448 -0.047 -1.447 1.00 . A A . 36 TYR CD2 1 1 14 3524 1 1 14 TYR CE1 C 23.623 1.573 -1.011 1.00 . A A . 36 TYR CE1 1 1 14 3525 1 1 14 TYR CE2 C 22.000 0.675 -2.489 1.00 . A A . 36 TYR CE2 1 1 14 3526 1 1 14 TYR CG C 21.976 0.030 -0.170 1.00 . A A . 36 TYR CG 1 1 14 3527 1 1 14 TYR CZ C 23.092 1.491 -2.278 1.00 . A A . 36 TYR CZ 1 1 14 3528 1 1 14 TYR H H 21.223 -2.509 3.195 1.00 . A A . 36 TYR H 1 1 14 3529 1 1 14 TYR HA H 22.509 -2.590 0.526 1.00 . A A . 36 TYR HA 1 1 14 3530 1 1 14 TYR HB2 H 20.365 -1.138 0.691 1.00 . A A . 36 TYR HB2 1 1 14 3531 1 1 14 TYR HB3 H 21.252 -0.159 1.852 1.00 . A A . 36 TYR HB3 1 1 14 3532 1 1 14 TYR HD1 H 23.511 0.946 1.010 1.00 . A A . 36 TYR HD1 1 1 14 3533 1 1 14 TYR HD2 H 20.593 -0.680 -1.637 1.00 . A A . 36 TYR HD2 1 1 14 3534 1 1 14 TYR HE1 H 24.479 2.207 -0.827 1.00 . A A . 36 TYR HE1 1 1 14 3535 1 1 14 TYR HE2 H 21.573 0.604 -3.479 1.00 . A A . 36 TYR HE2 1 1 14 3536 1 1 14 TYR HH H 24.556 1.921 -3.449 1.00 . A A . 36 TYR HH 1 1 14 3537 1 1 14 TYR N N 21.449 -2.875 2.317 1.00 . A A . 36 TYR N 1 1 14 3538 1 1 14 TYR O O 23.599 -0.484 2.663 1.00 . A A . 36 TYR O 1 1 14 3539 1 1 14 TYR OH O 23.648 2.211 -3.316 1.00 . A A . 36 TYR OH 1 1 14 3540 1 1 15 NH2 HN1 H 24.426 -3.276 1.781 1.00 . A A . 37 NH2 HN1 1 1 14 3541 1 1 15 NH2 HN2 H 25.297 -2.131 2.688 1.00 . A A . 37 NH2 HN2 1 1 14 3542 1 1 15 NH2 N N 24.489 -2.397 2.204 1.00 . A A . 37 NH2 N 1 1 15 3543 1 1 1 ACE C C 2.676 6.080 -1.020 1.00 . A A . 23 ACE C 1 1 15 3544 1 1 1 ACE CH3 C 1.696 7.184 -1.412 1.00 . A A . 23 ACE CH3 1 1 15 3545 1 1 1 ACE H1 H 1.603 7.209 -2.487 1.00 . A A . 23 ACE H1 1 1 15 3546 1 1 1 ACE H2 H 2.083 8.131 -1.064 1.00 . A A . 23 ACE H2 1 1 15 3547 1 1 1 ACE H3 H 0.731 7.003 -0.965 1.00 . A A . 23 ACE H3 1 1 15 3548 1 1 1 ACE O O 3.822 6.124 -1.420 1.00 . A A . 23 ACE O 1 1 15 3549 1 1 2 ALA C C 4.137 3.572 -0.727 1.00 . A A . 24 ALA C 1 1 15 3550 1 1 2 ALA CA C 3.011 3.964 0.225 1.00 . A A . 24 ALA CA 1 1 15 3551 1 1 2 ALA CB C 2.081 2.749 0.439 1.00 . A A . 24 ALA CB 1 1 15 3552 1 1 2 ALA H H 1.252 5.181 0.012 1.00 . A A . 24 ALA H 1 1 15 3553 1 1 2 ALA HA H 3.469 4.242 1.158 1.00 . A A . 24 ALA HA 1 1 15 3554 1 1 2 ALA HB1 H 1.583 2.463 -0.478 1.00 . A A . 24 ALA HB1 1 1 15 3555 1 1 2 ALA HB2 H 1.335 2.977 1.184 1.00 . A A . 24 ALA HB2 1 1 15 3556 1 1 2 ALA HB3 H 2.664 1.909 0.790 1.00 . A A . 24 ALA HB3 1 1 15 3557 1 1 2 ALA N N 2.191 5.128 -0.257 1.00 . A A . 24 ALA N 1 1 15 3558 1 1 2 ALA O O 5.259 3.359 -0.318 1.00 . A A . 24 ALA O 1 1 15 3559 1 1 3 ARG C C 6.112 3.750 -2.811 1.00 . A A . 25 ARG C 1 1 15 3560 1 1 3 ARG CA C 4.729 3.113 -3.072 1.00 . A A . 25 ARG CA 1 1 15 3561 1 1 3 ARG CB C 4.158 3.615 -4.443 1.00 . A A . 25 ARG CB 1 1 15 3562 1 1 3 ARG CD C 4.024 3.062 -6.934 1.00 . A A . 25 ARG CD 1 1 15 3563 1 1 3 ARG CG C 4.463 2.563 -5.541 1.00 . A A . 25 ARG CG 1 1 15 3564 1 1 3 ARG CZ C 4.663 5.375 -7.639 1.00 . A A . 25 ARG CZ 1 1 15 3565 1 1 3 ARG H H 2.833 3.667 -2.165 1.00 . A A . 25 ARG H 1 1 15 3566 1 1 3 ARG HA H 4.850 2.039 -3.062 1.00 . A A . 25 ARG HA 1 1 15 3567 1 1 3 ARG HB2 H 3.092 3.764 -4.372 1.00 . A A . 25 ARG HB2 1 1 15 3568 1 1 3 ARG HB3 H 4.620 4.556 -4.709 1.00 . A A . 25 ARG HB3 1 1 15 3569 1 1 3 ARG HD2 H 4.085 2.228 -7.623 1.00 . A A . 25 ARG HD2 1 1 15 3570 1 1 3 ARG HD3 H 3.000 3.400 -6.932 1.00 . A A . 25 ARG HD3 1 1 15 3571 1 1 3 ARG HE H 5.909 3.835 -7.553 1.00 . A A . 25 ARG HE 1 1 15 3572 1 1 3 ARG HG2 H 5.519 2.331 -5.553 1.00 . A A . 25 ARG HG2 1 1 15 3573 1 1 3 ARG HG3 H 3.932 1.648 -5.312 1.00 . A A . 25 ARG HG3 1 1 15 3574 1 1 3 ARG HH11 H 2.751 5.169 -7.100 1.00 . A A . 25 ARG HH11 1 1 15 3575 1 1 3 ARG HH12 H 3.182 6.741 -7.624 1.00 . A A . 25 ARG HH12 1 1 15 3576 1 1 3 ARG HH21 H 6.530 5.850 -8.218 1.00 . A A . 25 ARG HH21 1 1 15 3577 1 1 3 ARG HH22 H 5.412 7.139 -8.255 1.00 . A A . 25 ARG HH22 1 1 15 3578 1 1 3 ARG N N 3.772 3.481 -1.975 1.00 . A A . 25 ARG N 1 1 15 3579 1 1 3 ARG NE N 4.983 4.125 -7.404 1.00 . A A . 25 ARG NE 1 1 15 3580 1 1 3 ARG NH1 N 3.446 5.794 -7.441 1.00 . A A . 25 ARG NH1 1 1 15 3581 1 1 3 ARG NH2 N 5.597 6.175 -8.066 1.00 . A A . 25 ARG NH2 1 1 15 3582 1 1 3 ARG O O 7.142 3.102 -2.835 1.00 . A A . 25 ARG O 1 1 15 3583 1 1 4 HIS C C 7.968 5.472 -0.897 1.00 . A A . 26 HIS C 1 1 15 3584 1 1 4 HIS CA C 7.354 5.774 -2.273 1.00 . A A . 26 HIS CA 1 1 15 3585 1 1 4 HIS CB C 7.067 7.287 -2.391 1.00 . A A . 26 HIS CB 1 1 15 3586 1 1 4 HIS CD2 C 6.450 6.878 -4.915 1.00 . A A . 26 HIS CD2 1 1 15 3587 1 1 4 HIS CE1 C 5.985 8.811 -5.362 1.00 . A A . 26 HIS CE1 1 1 15 3588 1 1 4 HIS CG C 6.611 7.678 -3.806 1.00 . A A . 26 HIS CG 1 1 15 3589 1 1 4 HIS H H 5.218 5.497 -2.495 1.00 . A A . 26 HIS H 1 1 15 3590 1 1 4 HIS HA H 8.079 5.496 -3.023 1.00 . A A . 26 HIS HA 1 1 15 3591 1 1 4 HIS HB2 H 6.297 7.561 -1.682 1.00 . A A . 26 HIS HB2 1 1 15 3592 1 1 4 HIS HB3 H 7.963 7.841 -2.151 1.00 . A A . 26 HIS HB3 1 1 15 3593 1 1 4 HIS HD1 H 6.332 9.702 -3.523 1.00 . A A . 26 HIS HD1 1 1 15 3594 1 1 4 HIS HD2 H 6.629 5.813 -4.956 1.00 . A A . 26 HIS HD2 1 1 15 3595 1 1 4 HIS HE1 H 5.678 9.678 -5.931 1.00 . A A . 26 HIS HE1 1 1 15 3596 1 1 4 HIS N N 6.083 5.028 -2.537 1.00 . A A . 26 HIS N 1 1 15 3597 1 1 4 HIS ND1 N 6.312 8.908 -4.100 1.00 . A A . 26 HIS ND1 1 1 15 3598 1 1 4 HIS NE2 N 6.046 7.624 -5.907 1.00 . A A . 26 HIS NE2 1 1 15 3599 1 1 4 HIS O O 8.683 6.290 -0.352 1.00 . A A . 26 HIS O 1 1 15 3600 1 1 5 TYR C C 8.834 2.495 0.799 1.00 . A A . 27 TYR C 1 1 15 3601 1 1 5 TYR CA C 8.213 3.895 0.955 1.00 . A A . 27 TYR CA 1 1 15 3602 1 1 5 TYR CB C 7.037 3.906 1.967 1.00 . A A . 27 TYR CB 1 1 15 3603 1 1 5 TYR CD1 C 8.133 3.162 4.142 1.00 . A A . 27 TYR CD1 1 1 15 3604 1 1 5 TYR CD2 C 7.484 5.437 3.912 1.00 . A A . 27 TYR CD2 1 1 15 3605 1 1 5 TYR CE1 C 8.608 3.432 5.407 1.00 . A A . 27 TYR CE1 1 1 15 3606 1 1 5 TYR CE2 C 7.961 5.707 5.178 1.00 . A A . 27 TYR CE2 1 1 15 3607 1 1 5 TYR CG C 7.566 4.165 3.383 1.00 . A A . 27 TYR CG 1 1 15 3608 1 1 5 TYR CZ C 8.528 4.701 5.933 1.00 . A A . 27 TYR CZ 1 1 15 3609 1 1 5 TYR H H 7.063 3.709 -0.854 1.00 . A A . 27 TYR H 1 1 15 3610 1 1 5 TYR HA H 9.008 4.565 1.226 1.00 . A A . 27 TYR HA 1 1 15 3611 1 1 5 TYR HB2 H 6.325 4.674 1.705 1.00 . A A . 27 TYR HB2 1 1 15 3612 1 1 5 TYR HB3 H 6.528 2.953 1.948 1.00 . A A . 27 TYR HB3 1 1 15 3613 1 1 5 TYR HD1 H 8.205 2.157 3.751 1.00 . A A . 27 TYR HD1 1 1 15 3614 1 1 5 TYR HD2 H 7.043 6.231 3.327 1.00 . A A . 27 TYR HD2 1 1 15 3615 1 1 5 TYR HE1 H 9.050 2.642 5.994 1.00 . A A . 27 TYR HE1 1 1 15 3616 1 1 5 TYR HE2 H 7.886 6.711 5.570 1.00 . A A . 27 TYR HE2 1 1 15 3617 1 1 5 TYR HH H 8.459 5.552 7.665 1.00 . A A . 27 TYR HH 1 1 15 3618 1 1 5 TYR N N 7.669 4.313 -0.373 1.00 . A A . 27 TYR N 1 1 15 3619 1 1 5 TYR O O 9.251 1.855 1.745 1.00 . A A . 27 TYR O 1 1 15 3620 1 1 5 TYR OH O 9.025 4.931 7.199 1.00 . A A . 27 TYR OH 1 1 15 3621 1 1 6 LYS C C 10.987 0.765 -0.600 1.00 . A A . 28 LYS C 1 1 15 3622 1 1 6 LYS CA C 9.460 0.720 -0.761 1.00 . A A . 28 LYS CA 1 1 15 3623 1 1 6 LYS CB C 9.021 0.374 -2.215 1.00 . A A . 28 LYS CB 1 1 15 3624 1 1 6 LYS CD C 10.866 -0.608 -3.639 1.00 . A A . 28 LYS CD 1 1 15 3625 1 1 6 LYS CE C 11.670 -1.884 -3.968 1.00 . A A . 28 LYS CE 1 1 15 3626 1 1 6 LYS CG C 9.690 -0.946 -2.701 1.00 . A A . 28 LYS CG 1 1 15 3627 1 1 6 LYS H H 8.529 2.659 -1.124 1.00 . A A . 28 LYS H 1 1 15 3628 1 1 6 LYS HA H 9.065 -0.028 -0.095 1.00 . A A . 28 LYS HA 1 1 15 3629 1 1 6 LYS HB2 H 7.948 0.239 -2.220 1.00 . A A . 28 LYS HB2 1 1 15 3630 1 1 6 LYS HB3 H 9.253 1.191 -2.884 1.00 . A A . 28 LYS HB3 1 1 15 3631 1 1 6 LYS HD2 H 10.449 -0.175 -4.532 1.00 . A A . 28 LYS HD2 1 1 15 3632 1 1 6 LYS HD3 H 11.524 0.117 -3.187 1.00 . A A . 28 LYS HD3 1 1 15 3633 1 1 6 LYS HE2 H 11.017 -2.690 -4.269 1.00 . A A . 28 LYS HE2 1 1 15 3634 1 1 6 LYS HE3 H 12.387 -1.688 -4.755 1.00 . A A . 28 LYS HE3 1 1 15 3635 1 1 6 LYS HG2 H 10.042 -1.535 -1.868 1.00 . A A . 28 LYS HG2 1 1 15 3636 1 1 6 LYS HG3 H 8.967 -1.539 -3.242 1.00 . A A . 28 LYS HG3 1 1 15 3637 1 1 6 LYS HZ1 H 11.842 -2.411 -1.903 1.00 . A A . 28 LYS HZ1 1 1 15 3638 1 1 6 LYS N N 8.884 2.066 -0.431 1.00 . A A . 28 LYS N 1 1 15 3639 1 1 6 LYS NZ N 12.379 -2.255 -2.707 1.00 . A A . 28 LYS NZ 1 1 15 3640 1 1 6 LYS O O 11.562 -0.027 0.126 1.00 . A A . 28 LYS O 1 1 15 3641 1 1 7 ASN C C 13.638 1.602 0.152 1.00 . A A . 29 ASN C 1 1 15 3642 1 1 7 ASN CA C 13.085 1.894 -1.253 1.00 . A A . 29 ASN CA 1 1 15 3643 1 1 7 ASN CB C 13.422 3.361 -1.652 1.00 . A A . 29 ASN CB 1 1 15 3644 1 1 7 ASN CG C 14.346 3.399 -2.873 1.00 . A A . 29 ASN CG 1 1 15 3645 1 1 7 ASN H H 11.026 2.271 -1.848 1.00 . A A . 29 ASN H 1 1 15 3646 1 1 7 ASN HA H 13.542 1.185 -1.931 1.00 . A A . 29 ASN HA 1 1 15 3647 1 1 7 ASN HB2 H 12.530 3.919 -1.892 1.00 . A A . 29 ASN HB2 1 1 15 3648 1 1 7 ASN HB3 H 13.932 3.872 -0.846 1.00 . A A . 29 ASN HB3 1 1 15 3649 1 1 7 ASN HD21 H 13.493 1.866 -3.828 1.00 . A A . 29 ASN HD21 1 1 15 3650 1 1 7 ASN HD22 H 14.814 2.600 -4.604 1.00 . A A . 29 ASN HD22 1 1 15 3651 1 1 7 ASN N N 11.591 1.696 -1.293 1.00 . A A . 29 ASN N 1 1 15 3652 1 1 7 ASN ND2 N 14.197 2.546 -3.845 1.00 . A A . 29 ASN ND2 1 1 15 3653 1 1 7 ASN O O 14.530 0.802 0.343 1.00 . A A . 29 ASN O 1 1 15 3654 1 1 7 ASN OD1 O 15.229 4.224 -2.968 1.00 . A A . 29 ASN OD1 1 1 15 3655 1 1 8 LEU C C 13.618 0.756 3.078 1.00 . A A . 30 LEU C 1 1 15 3656 1 1 8 LEU CA C 13.430 2.181 2.540 1.00 . A A . 30 LEU CA 1 1 15 3657 1 1 8 LEU CB C 12.347 2.898 3.389 1.00 . A A . 30 LEU CB 1 1 15 3658 1 1 8 LEU CD1 C 11.284 5.086 3.997 1.00 . A A . 30 LEU CD1 1 1 15 3659 1 1 8 LEU CD2 C 13.755 5.009 3.714 1.00 . A A . 30 LEU CD2 1 1 15 3660 1 1 8 LEU CG C 12.413 4.439 3.185 1.00 . A A . 30 LEU CG 1 1 15 3661 1 1 8 LEU H H 12.351 2.922 0.828 1.00 . A A . 30 LEU H 1 1 15 3662 1 1 8 LEU HA H 14.385 2.666 2.663 1.00 . A A . 30 LEU HA 1 1 15 3663 1 1 8 LEU HB2 H 11.367 2.531 3.109 1.00 . A A . 30 LEU HB2 1 1 15 3664 1 1 8 LEU HB3 H 12.497 2.660 4.433 1.00 . A A . 30 LEU HB3 1 1 15 3665 1 1 8 LEU HD11 H 11.293 6.161 3.876 1.00 . A A . 30 LEU HD11 1 1 15 3666 1 1 8 LEU HD12 H 11.378 4.859 5.050 1.00 . A A . 30 LEU HD12 1 1 15 3667 1 1 8 LEU HD13 H 10.329 4.718 3.652 1.00 . A A . 30 LEU HD13 1 1 15 3668 1 1 8 LEU HD21 H 13.768 6.080 3.578 1.00 . A A . 30 LEU HD21 1 1 15 3669 1 1 8 LEU HD22 H 14.597 4.602 3.176 1.00 . A A . 30 LEU HD22 1 1 15 3670 1 1 8 LEU HD23 H 13.876 4.796 4.766 1.00 . A A . 30 LEU HD23 1 1 15 3671 1 1 8 LEU HG H 12.287 4.691 2.140 1.00 . A A . 30 LEU HG 1 1 15 3672 1 1 8 LEU N N 13.059 2.298 1.093 1.00 . A A . 30 LEU N 1 1 15 3673 1 1 8 LEU O O 14.430 0.543 3.956 1.00 . A A . 30 LEU O 1 1 15 3674 1 1 9 ILE C C 14.063 -2.377 2.226 1.00 . A A . 31 ILE C 1 1 15 3675 1 1 9 ILE CA C 12.977 -1.616 3.007 1.00 . A A . 31 ILE CA 1 1 15 3676 1 1 9 ILE CB C 11.586 -2.226 2.783 1.00 . A A . 31 ILE CB 1 1 15 3677 1 1 9 ILE CD1 C 9.081 -1.965 3.336 1.00 . A A . 31 ILE CD1 1 1 15 3678 1 1 9 ILE CG1 C 10.496 -1.356 3.505 1.00 . A A . 31 ILE CG1 1 1 15 3679 1 1 9 ILE CG2 C 11.507 -3.701 3.280 1.00 . A A . 31 ILE CG2 1 1 15 3680 1 1 9 ILE H H 12.252 0.067 1.835 1.00 . A A . 31 ILE H 1 1 15 3681 1 1 9 ILE HA H 13.292 -1.632 4.044 1.00 . A A . 31 ILE HA 1 1 15 3682 1 1 9 ILE HB H 11.480 -2.166 1.708 1.00 . A A . 31 ILE HB 1 1 15 3683 1 1 9 ILE HD11 H 8.845 -2.057 2.286 1.00 . A A . 31 ILE HD11 1 1 15 3684 1 1 9 ILE HD12 H 8.346 -1.324 3.803 1.00 . A A . 31 ILE HD12 1 1 15 3685 1 1 9 ILE HD13 H 9.018 -2.940 3.798 1.00 . A A . 31 ILE HD13 1 1 15 3686 1 1 9 ILE HG12 H 10.727 -1.275 4.560 1.00 . A A . 31 ILE HG12 1 1 15 3687 1 1 9 ILE HG13 H 10.479 -0.357 3.088 1.00 . A A . 31 ILE HG13 1 1 15 3688 1 1 9 ILE HG21 H 10.523 -4.112 3.110 1.00 . A A . 31 ILE HG21 1 1 15 3689 1 1 9 ILE HG22 H 11.728 -3.745 4.337 1.00 . A A . 31 ILE HG22 1 1 15 3690 1 1 9 ILE HG23 H 12.213 -4.327 2.755 1.00 . A A . 31 ILE HG23 1 1 15 3691 1 1 9 ILE N N 12.883 -0.179 2.549 1.00 . A A . 31 ILE N 1 1 15 3692 1 1 9 ILE O O 14.302 -3.561 2.372 1.00 . A A . 31 ILE O 1 1 15 3693 1 1 10 GLU C C 17.108 -1.506 0.898 1.00 . A A . 32 GLU C 1 1 15 3694 1 1 10 GLU CA C 15.798 -2.197 0.535 1.00 . A A . 32 GLU CA 1 1 15 3695 1 1 10 GLU CB C 15.454 -1.963 -0.933 1.00 . A A . 32 GLU CB 1 1 15 3696 1 1 10 GLU CD C 13.681 -2.375 -2.628 1.00 . A A . 32 GLU CD 1 1 15 3697 1 1 10 GLU CG C 14.175 -2.752 -1.247 1.00 . A A . 32 GLU CG 1 1 15 3698 1 1 10 GLU H H 14.404 -0.702 1.317 1.00 . A A . 32 GLU H 1 1 15 3699 1 1 10 GLU HA H 15.919 -3.254 0.739 1.00 . A A . 32 GLU HA 1 1 15 3700 1 1 10 GLU HB2 H 15.294 -0.911 -1.118 1.00 . A A . 32 GLU HB2 1 1 15 3701 1 1 10 GLU HB3 H 16.266 -2.298 -1.564 1.00 . A A . 32 GLU HB3 1 1 15 3702 1 1 10 GLU HG2 H 14.355 -3.816 -1.231 1.00 . A A . 32 GLU HG2 1 1 15 3703 1 1 10 GLU HG3 H 13.400 -2.512 -0.535 1.00 . A A . 32 GLU HG3 1 1 15 3704 1 1 10 GLU N N 14.697 -1.636 1.378 1.00 . A A . 32 GLU N 1 1 15 3705 1 1 10 GLU O O 18.028 -1.471 0.107 1.00 . A A . 32 GLU O 1 1 15 3706 1 1 10 GLU OE1 O 14.459 -2.223 -3.550 1.00 . A A . 32 GLU OE1 1 1 15 3707 1 1 11 ARG C C 19.078 -1.272 3.502 1.00 . A A . 33 ARG C 1 1 15 3708 1 1 11 ARG CA C 18.361 -0.279 2.591 1.00 . A A . 33 ARG CA 1 1 15 3709 1 1 11 ARG CB C 17.940 1.012 3.376 1.00 . A A . 33 ARG CB 1 1 15 3710 1 1 11 ARG CD C 18.849 2.991 4.745 1.00 . A A . 33 ARG CD 1 1 15 3711 1 1 11 ARG CG C 19.191 1.623 4.097 1.00 . A A . 33 ARG CG 1 1 15 3712 1 1 11 ARG CZ C 19.792 3.753 6.930 1.00 . A A . 33 ARG CZ 1 1 15 3713 1 1 11 ARG H H 16.341 -1.066 2.665 1.00 . A A . 33 ARG H 1 1 15 3714 1 1 11 ARG HA H 19.007 -0.045 1.758 1.00 . A A . 33 ARG HA 1 1 15 3715 1 1 11 ARG HB2 H 17.538 1.723 2.666 1.00 . A A . 33 ARG HB2 1 1 15 3716 1 1 11 ARG HB3 H 17.168 0.776 4.095 1.00 . A A . 33 ARG HB3 1 1 15 3717 1 1 11 ARG HD2 H 18.761 3.753 3.978 1.00 . A A . 33 ARG HD2 1 1 15 3718 1 1 11 ARG HD3 H 17.901 2.903 5.247 1.00 . A A . 33 ARG HD3 1 1 15 3719 1 1 11 ARG HE H 20.886 3.348 5.315 1.00 . A A . 33 ARG HE 1 1 15 3720 1 1 11 ARG HG2 H 19.535 0.937 4.861 1.00 . A A . 33 ARG HG2 1 1 15 3721 1 1 11 ARG HG3 H 19.985 1.747 3.373 1.00 . A A . 33 ARG HG3 1 1 15 3722 1 1 11 ARG HH11 H 17.808 3.558 6.851 1.00 . A A . 33 ARG HH11 1 1 15 3723 1 1 11 ARG HH12 H 18.404 4.087 8.359 1.00 . A A . 33 ARG HH12 1 1 15 3724 1 1 11 ARG HH21 H 21.761 4.016 7.268 1.00 . A A . 33 ARG HH21 1 1 15 3725 1 1 11 ARG HH22 H 20.744 4.359 8.598 1.00 . A A . 33 ARG HH22 1 1 15 3726 1 1 11 ARG N N 17.139 -0.984 2.094 1.00 . A A . 33 ARG N 1 1 15 3727 1 1 11 ARG NE N 19.974 3.383 5.682 1.00 . A A . 33 ARG NE 1 1 15 3728 1 1 11 ARG NH1 N 18.585 3.804 7.418 1.00 . A A . 33 ARG NH1 1 1 15 3729 1 1 11 ARG NH2 N 20.836 4.064 7.647 1.00 . A A . 33 ARG NH2 1 1 15 3730 1 1 11 ARG O O 20.260 -1.515 3.390 1.00 . A A . 33 ARG O 1 1 15 3731 1 1 12 GLN C C 19.941 -3.679 4.925 1.00 . A A . 34 GLN C 1 1 15 3732 1 1 12 GLN CA C 18.747 -2.816 5.407 1.00 . A A . 34 GLN CA 1 1 15 3733 1 1 12 GLN CB C 17.528 -3.723 5.770 1.00 . A A . 34 GLN CB 1 1 15 3734 1 1 12 GLN CD C 15.750 -1.845 5.729 1.00 . A A . 34 GLN CD 1 1 15 3735 1 1 12 GLN CG C 16.403 -2.957 6.558 1.00 . A A . 34 GLN CG 1 1 15 3736 1 1 12 GLN H H 17.350 -1.532 4.353 1.00 . A A . 34 GLN H 1 1 15 3737 1 1 12 GLN HA H 19.075 -2.276 6.283 1.00 . A A . 34 GLN HA 1 1 15 3738 1 1 12 GLN HB2 H 17.094 -4.125 4.867 1.00 . A A . 34 GLN HB2 1 1 15 3739 1 1 12 GLN HB3 H 17.869 -4.555 6.370 1.00 . A A . 34 GLN HB3 1 1 15 3740 1 1 12 GLN HE21 H 15.396 -0.613 7.247 1.00 . A A . 34 GLN HE21 1 1 15 3741 1 1 12 GLN HE22 H 14.900 -0.076 5.701 1.00 . A A . 34 GLN HE22 1 1 15 3742 1 1 12 GLN HG2 H 15.631 -3.649 6.863 1.00 . A A . 34 GLN HG2 1 1 15 3743 1 1 12 GLN HG3 H 16.828 -2.517 7.448 1.00 . A A . 34 GLN HG3 1 1 15 3744 1 1 12 GLN N N 18.288 -1.813 4.388 1.00 . A A . 34 GLN N 1 1 15 3745 1 1 12 GLN NE2 N 15.314 -0.754 6.282 1.00 . A A . 34 GLN NE2 1 1 15 3746 1 1 12 GLN O O 21.036 -3.536 5.429 1.00 . A A . 34 GLN O 1 1 15 3747 1 1 12 GLN OE1 O 15.622 -1.958 4.530 1.00 . A A . 34 GLN OE1 1 1 15 3748 1 1 13 ARG C C 21.510 -4.784 2.237 1.00 . A A . 35 ARG C 1 1 15 3749 1 1 13 ARG CA C 20.808 -5.414 3.453 1.00 . A A . 35 ARG CA 1 1 15 3750 1 1 13 ARG CB C 20.271 -6.839 3.047 1.00 . A A . 35 ARG CB 1 1 15 3751 1 1 13 ARG CD C 18.934 -8.319 1.476 1.00 . A A . 35 ARG CD 1 1 15 3752 1 1 13 ARG CG C 19.261 -6.837 1.862 1.00 . A A . 35 ARG CG 1 1 15 3753 1 1 13 ARG CZ C 17.892 -9.001 -0.711 1.00 . A A . 35 ARG CZ 1 1 15 3754 1 1 13 ARG H H 18.796 -4.631 3.610 1.00 . A A . 35 ARG H 1 1 15 3755 1 1 13 ARG HA H 21.532 -5.527 4.242 1.00 . A A . 35 ARG HA 1 1 15 3756 1 1 13 ARG HB2 H 21.129 -7.442 2.783 1.00 . A A . 35 ARG HB2 1 1 15 3757 1 1 13 ARG HB3 H 19.809 -7.286 3.917 1.00 . A A . 35 ARG HB3 1 1 15 3758 1 1 13 ARG HD2 H 19.839 -8.794 1.128 1.00 . A A . 35 ARG HD2 1 1 15 3759 1 1 13 ARG HD3 H 18.565 -8.863 2.337 1.00 . A A . 35 ARG HD3 1 1 15 3760 1 1 13 ARG HE H 17.105 -7.712 0.576 1.00 . A A . 35 ARG HE 1 1 15 3761 1 1 13 ARG HG2 H 18.363 -6.314 2.157 1.00 . A A . 35 ARG HG2 1 1 15 3762 1 1 13 ARG HG3 H 19.699 -6.328 1.014 1.00 . A A . 35 ARG HG3 1 1 15 3763 1 1 13 ARG HH11 H 19.640 -9.894 -0.345 1.00 . A A . 35 ARG HH11 1 1 15 3764 1 1 13 ARG HH12 H 18.902 -10.361 -1.818 1.00 . A A . 35 ARG HH12 1 1 15 3765 1 1 13 ARG HH21 H 16.140 -8.222 -1.307 1.00 . A A . 35 ARG HH21 1 1 15 3766 1 1 13 ARG HH22 H 16.824 -9.357 -2.389 1.00 . A A . 35 ARG HH22 1 1 15 3767 1 1 13 ARG N N 19.696 -4.552 3.972 1.00 . A A . 35 ARG N 1 1 15 3768 1 1 13 ARG NE N 17.869 -8.304 0.405 1.00 . A A . 35 ARG NE 1 1 15 3769 1 1 13 ARG NH1 N 18.878 -9.810 -0.981 1.00 . A A . 35 ARG NH1 1 1 15 3770 1 1 13 ARG NH2 N 16.885 -8.852 -1.526 1.00 . A A . 35 ARG NH2 1 1 15 3771 1 1 13 ARG O O 22.457 -5.339 1.718 1.00 . A A . 35 ARG O 1 1 15 3772 1 1 14 TYR C C 21.730 -1.450 0.990 1.00 . A A . 36 TYR C 1 1 15 3773 1 1 14 TYR CA C 21.613 -2.943 0.638 1.00 . A A . 36 TYR CA 1 1 15 3774 1 1 14 TYR CB C 20.674 -3.236 -0.559 1.00 . A A . 36 TYR CB 1 1 15 3775 1 1 14 TYR CD1 C 22.292 -2.866 -2.503 1.00 . A A . 36 TYR CD1 1 1 15 3776 1 1 14 TYR CD2 C 20.332 -1.522 -2.361 1.00 . A A . 36 TYR CD2 1 1 15 3777 1 1 14 TYR CE1 C 22.654 -2.206 -3.664 1.00 . A A . 36 TYR CE1 1 1 15 3778 1 1 14 TYR CE2 C 20.697 -0.868 -3.514 1.00 . A A . 36 TYR CE2 1 1 15 3779 1 1 14 TYR CG C 21.122 -2.526 -1.844 1.00 . A A . 36 TYR CG 1 1 15 3780 1 1 14 TYR CZ C 21.853 -1.204 -4.172 1.00 . A A . 36 TYR CZ 1 1 15 3781 1 1 14 TYR H H 20.269 -3.230 2.262 1.00 . A A . 36 TYR H 1 1 15 3782 1 1 14 TYR HA H 22.599 -3.334 0.461 1.00 . A A . 36 TYR HA 1 1 15 3783 1 1 14 TYR HB2 H 20.659 -4.299 -0.754 1.00 . A A . 36 TYR HB2 1 1 15 3784 1 1 14 TYR HB3 H 19.671 -2.924 -0.321 1.00 . A A . 36 TYR HB3 1 1 15 3785 1 1 14 TYR HD1 H 22.924 -3.649 -2.110 1.00 . A A . 36 TYR HD1 1 1 15 3786 1 1 14 TYR HD2 H 19.420 -1.241 -1.851 1.00 . A A . 36 TYR HD2 1 1 15 3787 1 1 14 TYR HE1 H 23.567 -2.476 -4.176 1.00 . A A . 36 TYR HE1 1 1 15 3788 1 1 14 TYR HE2 H 20.065 -0.086 -3.907 1.00 . A A . 36 TYR HE2 1 1 15 3789 1 1 14 TYR HH H 22.915 0.068 -5.137 1.00 . A A . 36 TYR HH 1 1 15 3790 1 1 14 TYR N N 21.025 -3.649 1.808 1.00 . A A . 36 TYR N 1 1 15 3791 1 1 14 TYR O O 21.066 -0.582 0.460 1.00 . A A . 36 TYR O 1 1 15 3792 1 1 14 TYR OH O 22.183 -0.526 -5.325 1.00 . A A . 36 TYR OH 1 1 15 3793 1 1 15 NH2 HN1 H 23.125 -1.791 2.348 1.00 . A A . 37 NH2 HN1 1 1 15 3794 1 1 15 NH2 HN2 H 22.668 -0.167 2.150 1.00 . A A . 37 NH2 HN2 1 1 15 3795 1 1 15 NH2 N N 22.580 -1.108 1.907 1.00 . A A . 37 NH2 N 1 1 16 3796 1 1 1 ACE C C 1.729 3.552 -1.952 1.00 . A A . 23 ACE C 1 1 16 3797 1 1 1 ACE CH3 C 0.459 3.116 -2.672 1.00 . A A . 23 ACE CH3 1 1 16 3798 1 1 1 ACE H1 H -0.324 3.831 -2.463 1.00 . A A . 23 ACE H1 1 1 16 3799 1 1 1 ACE H2 H 0.154 2.138 -2.333 1.00 . A A . 23 ACE H2 1 1 16 3800 1 1 1 ACE H3 H 0.643 3.087 -3.735 1.00 . A A . 23 ACE H3 1 1 16 3801 1 1 1 ACE O O 2.249 4.620 -2.215 1.00 . A A . 23 ACE O 1 1 16 3802 1 1 2 ALA C C 4.730 2.636 -1.088 1.00 . A A . 24 ALA C 1 1 16 3803 1 1 2 ALA CA C 3.477 3.099 -0.330 1.00 . A A . 24 ALA CA 1 1 16 3804 1 1 2 ALA CB C 3.416 2.449 1.060 1.00 . A A . 24 ALA CB 1 1 16 3805 1 1 2 ALA H H 1.795 1.863 -0.900 1.00 . A A . 24 ALA H 1 1 16 3806 1 1 2 ALA HA H 3.522 4.174 -0.220 1.00 . A A . 24 ALA HA 1 1 16 3807 1 1 2 ALA HB1 H 4.307 2.697 1.618 1.00 . A A . 24 ALA HB1 1 1 16 3808 1 1 2 ALA HB2 H 3.359 1.374 0.969 1.00 . A A . 24 ALA HB2 1 1 16 3809 1 1 2 ALA HB3 H 2.558 2.801 1.612 1.00 . A A . 24 ALA HB3 1 1 16 3810 1 1 2 ALA N N 2.231 2.724 -1.074 1.00 . A A . 24 ALA N 1 1 16 3811 1 1 2 ALA O O 5.797 2.472 -0.527 1.00 . A A . 24 ALA O 1 1 16 3812 1 1 3 ARG C C 6.885 2.928 -2.986 1.00 . A A . 25 ARG C 1 1 16 3813 1 1 3 ARG CA C 5.698 1.990 -3.232 1.00 . A A . 25 ARG CA 1 1 16 3814 1 1 3 ARG CB C 5.270 2.014 -4.752 1.00 . A A . 25 ARG CB 1 1 16 3815 1 1 3 ARG CD C 3.641 4.055 -4.954 1.00 . A A . 25 ARG CD 1 1 16 3816 1 1 3 ARG CG C 4.981 3.417 -5.400 1.00 . A A . 25 ARG CG 1 1 16 3817 1 1 3 ARG CZ C 3.091 6.475 -5.240 1.00 . A A . 25 ARG CZ 1 1 16 3818 1 1 3 ARG H H 3.674 2.578 -2.754 1.00 . A A . 25 ARG H 1 1 16 3819 1 1 3 ARG HA H 5.982 0.991 -2.936 1.00 . A A . 25 ARG HA 1 1 16 3820 1 1 3 ARG HB2 H 6.071 1.552 -5.313 1.00 . A A . 25 ARG HB2 1 1 16 3821 1 1 3 ARG HB3 H 4.402 1.382 -4.876 1.00 . A A . 25 ARG HB3 1 1 16 3822 1 1 3 ARG HD2 H 2.804 3.398 -5.157 1.00 . A A . 25 ARG HD2 1 1 16 3823 1 1 3 ARG HD3 H 3.687 4.272 -3.904 1.00 . A A . 25 ARG HD3 1 1 16 3824 1 1 3 ARG HE H 3.679 5.269 -6.707 1.00 . A A . 25 ARG HE 1 1 16 3825 1 1 3 ARG HG2 H 5.805 4.090 -5.214 1.00 . A A . 25 ARG HG2 1 1 16 3826 1 1 3 ARG HG3 H 4.944 3.258 -6.469 1.00 . A A . 25 ARG HG3 1 1 16 3827 1 1 3 ARG HH11 H 2.827 5.799 -3.364 1.00 . A A . 25 ARG HH11 1 1 16 3828 1 1 3 ARG HH12 H 2.519 7.458 -3.574 1.00 . A A . 25 ARG HH12 1 1 16 3829 1 1 3 ARG HH21 H 3.225 7.419 -7.011 1.00 . A A . 25 ARG HH21 1 1 16 3830 1 1 3 ARG HH22 H 2.718 8.395 -5.706 1.00 . A A . 25 ARG HH22 1 1 16 3831 1 1 3 ARG N N 4.559 2.436 -2.372 1.00 . A A . 25 ARG N 1 1 16 3832 1 1 3 ARG NE N 3.473 5.325 -5.748 1.00 . A A . 25 ARG NE 1 1 16 3833 1 1 3 ARG NH1 N 2.794 6.587 -3.978 1.00 . A A . 25 ARG NH1 1 1 16 3834 1 1 3 ARG NH2 N 3.006 7.498 -6.040 1.00 . A A . 25 ARG NH2 1 1 16 3835 1 1 3 ARG O O 8.017 2.521 -2.804 1.00 . A A . 25 ARG O 1 1 16 3836 1 1 4 HIS C C 8.036 5.274 -1.243 1.00 . A A . 26 HIS C 1 1 16 3837 1 1 4 HIS CA C 7.628 5.223 -2.731 1.00 . A A . 26 HIS CA 1 1 16 3838 1 1 4 HIS CB C 7.068 6.578 -3.205 1.00 . A A . 26 HIS CB 1 1 16 3839 1 1 4 HIS CD2 C 8.285 8.784 -2.544 1.00 . A A . 26 HIS CD2 1 1 16 3840 1 1 4 HIS CE1 C 9.898 8.571 -3.766 1.00 . A A . 26 HIS CE1 1 1 16 3841 1 1 4 HIS CG C 8.191 7.618 -3.261 1.00 . A A . 26 HIS CG 1 1 16 3842 1 1 4 HIS H H 5.633 4.456 -3.085 1.00 . A A . 26 HIS H 1 1 16 3843 1 1 4 HIS HA H 8.501 4.952 -3.308 1.00 . A A . 26 HIS HA 1 1 16 3844 1 1 4 HIS HB2 H 6.632 6.493 -4.188 1.00 . A A . 26 HIS HB2 1 1 16 3845 1 1 4 HIS HB3 H 6.320 6.928 -2.509 1.00 . A A . 26 HIS HB3 1 1 16 3846 1 1 4 HIS HD1 H 9.447 6.766 -4.666 1.00 . A A . 26 HIS HD1 1 1 16 3847 1 1 4 HIS HD2 H 7.569 9.142 -1.821 1.00 . A A . 26 HIS HD2 1 1 16 3848 1 1 4 HIS HE1 H 10.840 8.792 -4.248 1.00 . A A . 26 HIS HE1 1 1 16 3849 1 1 4 HIS N N 6.567 4.196 -2.959 1.00 . A A . 26 HIS N 1 1 16 3850 1 1 4 HIS ND1 N 9.224 7.486 -4.039 1.00 . A A . 26 HIS ND1 1 1 16 3851 1 1 4 HIS NE2 N 9.392 9.391 -2.879 1.00 . A A . 26 HIS NE2 1 1 16 3852 1 1 4 HIS O O 8.493 6.282 -0.743 1.00 . A A . 26 HIS O 1 1 16 3853 1 1 5 TYR C C 8.964 2.729 1.027 1.00 . A A . 27 TYR C 1 1 16 3854 1 1 5 TYR CA C 8.204 4.055 0.873 1.00 . A A . 27 TYR CA 1 1 16 3855 1 1 5 TYR CB C 6.898 4.070 1.695 1.00 . A A . 27 TYR CB 1 1 16 3856 1 1 5 TYR CD1 C 7.801 4.046 4.085 1.00 . A A . 27 TYR CD1 1 1 16 3857 1 1 5 TYR CD2 C 6.654 5.986 3.325 1.00 . A A . 27 TYR CD2 1 1 16 3858 1 1 5 TYR CE1 C 7.997 4.643 5.313 1.00 . A A . 27 TYR CE1 1 1 16 3859 1 1 5 TYR CE2 C 6.854 6.578 4.552 1.00 . A A . 27 TYR CE2 1 1 16 3860 1 1 5 TYR CG C 7.126 4.710 3.076 1.00 . A A . 27 TYR CG 1 1 16 3861 1 1 5 TYR CZ C 7.525 5.915 5.554 1.00 . A A . 27 TYR CZ 1 1 16 3862 1 1 5 TYR H H 7.447 3.385 -1.004 1.00 . A A . 27 TYR H 1 1 16 3863 1 1 5 TYR HA H 8.885 4.847 1.119 1.00 . A A . 27 TYR HA 1 1 16 3864 1 1 5 TYR HB2 H 6.144 4.621 1.157 1.00 . A A . 27 TYR HB2 1 1 16 3865 1 1 5 TYR HB3 H 6.548 3.057 1.838 1.00 . A A . 27 TYR HB3 1 1 16 3866 1 1 5 TYR HD1 H 8.179 3.048 3.922 1.00 . A A . 27 TYR HD1 1 1 16 3867 1 1 5 TYR HD2 H 6.123 6.529 2.557 1.00 . A A . 27 TYR HD2 1 1 16 3868 1 1 5 TYR HE1 H 8.526 4.101 6.082 1.00 . A A . 27 TYR HE1 1 1 16 3869 1 1 5 TYR HE2 H 6.482 7.575 4.735 1.00 . A A . 27 TYR HE2 1 1 16 3870 1 1 5 TYR HH H 8.051 5.909 7.410 1.00 . A A . 27 TYR HH 1 1 16 3871 1 1 5 TYR N N 7.846 4.169 -0.571 1.00 . A A . 27 TYR N 1 1 16 3872 1 1 5 TYR O O 9.245 2.271 2.116 1.00 . A A . 27 TYR O 1 1 16 3873 1 1 5 TYR OH O 7.707 6.538 6.771 1.00 . A A . 27 TYR OH 1 1 16 3874 1 1 6 LYS C C 11.500 1.116 0.075 1.00 . A A . 28 LYS C 1 1 16 3875 1 1 6 LYS CA C 10.025 0.861 -0.103 1.00 . A A . 28 LYS CA 1 1 16 3876 1 1 6 LYS CB C 9.820 0.127 -1.428 1.00 . A A . 28 LYS CB 1 1 16 3877 1 1 6 LYS CD C 8.618 -1.980 -2.159 1.00 . A A . 28 LYS CD 1 1 16 3878 1 1 6 LYS CE C 9.471 -2.989 -1.338 1.00 . A A . 28 LYS CE 1 1 16 3879 1 1 6 LYS CG C 8.482 -0.620 -1.428 1.00 . A A . 28 LYS CG 1 1 16 3880 1 1 6 LYS H H 9.039 2.573 -0.940 1.00 . A A . 28 LYS H 1 1 16 3881 1 1 6 LYS HA H 9.684 0.253 0.725 1.00 . A A . 28 LYS HA 1 1 16 3882 1 1 6 LYS HB2 H 9.825 0.833 -2.247 1.00 . A A . 28 LYS HB2 1 1 16 3883 1 1 6 LYS HB3 H 10.632 -0.552 -1.582 1.00 . A A . 28 LYS HB3 1 1 16 3884 1 1 6 LYS HD2 H 7.633 -2.397 -2.326 1.00 . A A . 28 LYS HD2 1 1 16 3885 1 1 6 LYS HD3 H 9.077 -1.822 -3.125 1.00 . A A . 28 LYS HD3 1 1 16 3886 1 1 6 LYS HE2 H 9.390 -2.791 -0.276 1.00 . A A . 28 LYS HE2 1 1 16 3887 1 1 6 LYS HE3 H 9.106 -3.989 -1.526 1.00 . A A . 28 LYS HE3 1 1 16 3888 1 1 6 LYS HG2 H 8.122 -0.788 -0.424 1.00 . A A . 28 LYS HG2 1 1 16 3889 1 1 6 LYS HG3 H 7.752 -0.024 -1.953 1.00 . A A . 28 LYS HG3 1 1 16 3890 1 1 6 LYS HZ1 H 11.123 -2.964 -2.709 1.00 . A A . 28 LYS HZ1 1 1 16 3891 1 1 6 LYS N N 9.288 2.150 -0.097 1.00 . A A . 28 LYS N 1 1 16 3892 1 1 6 LYS NZ N 10.912 -2.920 -1.753 1.00 . A A . 28 LYS NZ 1 1 16 3893 1 1 6 LYS O O 12.135 0.393 0.804 1.00 . A A . 28 LYS O 1 1 16 3894 1 1 7 ASN C C 14.047 2.144 0.847 1.00 . A A . 29 ASN C 1 1 16 3895 1 1 7 ASN CA C 13.452 2.516 -0.528 1.00 . A A . 29 ASN CA 1 1 16 3896 1 1 7 ASN CB C 13.513 4.045 -0.795 1.00 . A A . 29 ASN CB 1 1 16 3897 1 1 7 ASN CG C 14.947 4.582 -0.828 1.00 . A A . 29 ASN CG 1 1 16 3898 1 1 7 ASN H H 11.382 2.634 -1.163 1.00 . A A . 29 ASN H 1 1 16 3899 1 1 7 ASN HA H 13.999 1.981 -1.288 1.00 . A A . 29 ASN HA 1 1 16 3900 1 1 7 ASN HB2 H 13.052 4.258 -1.748 1.00 . A A . 29 ASN HB2 1 1 16 3901 1 1 7 ASN HB3 H 12.977 4.583 -0.030 1.00 . A A . 29 ASN HB3 1 1 16 3902 1 1 7 ASN HD21 H 14.760 5.410 -2.631 1.00 . A A . 29 ASN HD21 1 1 16 3903 1 1 7 ASN HD22 H 16.273 5.596 -1.880 1.00 . A A . 29 ASN HD22 1 1 16 3904 1 1 7 ASN N N 11.997 2.125 -0.597 1.00 . A A . 29 ASN N 1 1 16 3905 1 1 7 ASN ND2 N 15.355 5.250 -1.869 1.00 . A A . 29 ASN ND2 1 1 16 3906 1 1 7 ASN O O 15.023 1.425 0.954 1.00 . A A . 29 ASN O 1 1 16 3907 1 1 7 ASN OD1 O 15.718 4.410 0.092 1.00 . A A . 29 ASN OD1 1 1 16 3908 1 1 8 LEU C C 13.854 0.892 3.589 1.00 . A A . 30 LEU C 1 1 16 3909 1 1 8 LEU CA C 13.826 2.395 3.271 1.00 . A A . 30 LEU CA 1 1 16 3910 1 1 8 LEU CB C 12.839 3.113 4.211 1.00 . A A . 30 LEU CB 1 1 16 3911 1 1 8 LEU CD1 C 14.380 5.065 4.797 1.00 . A A . 30 LEU CD1 1 1 16 3912 1 1 8 LEU CD2 C 12.857 5.292 2.806 1.00 . A A . 30 LEU CD2 1 1 16 3913 1 1 8 LEU CG C 13.005 4.666 4.213 1.00 . A A . 30 LEU CG 1 1 16 3914 1 1 8 LEU H H 12.609 3.197 1.689 1.00 . A A . 30 LEU H 1 1 16 3915 1 1 8 LEU HA H 14.818 2.793 3.410 1.00 . A A . 30 LEU HA 1 1 16 3916 1 1 8 LEU HB2 H 11.827 2.870 3.921 1.00 . A A . 30 LEU HB2 1 1 16 3917 1 1 8 LEU HB3 H 12.978 2.742 5.216 1.00 . A A . 30 LEU HB3 1 1 16 3918 1 1 8 LEU HD11 H 14.470 6.141 4.820 1.00 . A A . 30 LEU HD11 1 1 16 3919 1 1 8 LEU HD12 H 15.198 4.675 4.211 1.00 . A A . 30 LEU HD12 1 1 16 3920 1 1 8 LEU HD13 H 14.475 4.697 5.809 1.00 . A A . 30 LEU HD13 1 1 16 3921 1 1 8 LEU HD21 H 13.642 4.951 2.147 1.00 . A A . 30 LEU HD21 1 1 16 3922 1 1 8 LEU HD22 H 12.933 6.368 2.878 1.00 . A A . 30 LEU HD22 1 1 16 3923 1 1 8 LEU HD23 H 11.892 5.052 2.381 1.00 . A A . 30 LEU HD23 1 1 16 3924 1 1 8 LEU HG H 12.237 5.077 4.849 1.00 . A A . 30 LEU HG 1 1 16 3925 1 1 8 LEU N N 13.400 2.646 1.862 1.00 . A A . 30 LEU N 1 1 16 3926 1 1 8 LEU O O 14.837 0.336 4.043 1.00 . A A . 30 LEU O 1 1 16 3927 1 1 9 ILE C C 13.405 -1.994 2.587 1.00 . A A . 31 ILE C 1 1 16 3928 1 1 9 ILE CA C 12.529 -1.179 3.540 1.00 . A A . 31 ILE CA 1 1 16 3929 1 1 9 ILE CB C 11.001 -1.448 3.335 1.00 . A A . 31 ILE CB 1 1 16 3930 1 1 9 ILE CD1 C 8.690 -0.607 4.035 1.00 . A A . 31 ILE CD1 1 1 16 3931 1 1 9 ILE CG1 C 10.201 -0.545 4.332 1.00 . A A . 31 ILE CG1 1 1 16 3932 1 1 9 ILE CG2 C 10.664 -2.932 3.613 1.00 . A A . 31 ILE CG2 1 1 16 3933 1 1 9 ILE H H 12.010 0.811 2.915 1.00 . A A . 31 ILE H 1 1 16 3934 1 1 9 ILE HA H 12.868 -1.411 4.537 1.00 . A A . 31 ILE HA 1 1 16 3935 1 1 9 ILE HB H 10.731 -1.215 2.312 1.00 . A A . 31 ILE HB 1 1 16 3936 1 1 9 ILE HD11 H 8.500 -0.264 3.028 1.00 . A A . 31 ILE HD11 1 1 16 3937 1 1 9 ILE HD12 H 8.154 0.031 4.724 1.00 . A A . 31 ILE HD12 1 1 16 3938 1 1 9 ILE HD13 H 8.315 -1.615 4.136 1.00 . A A . 31 ILE HD13 1 1 16 3939 1 1 9 ILE HG12 H 10.383 -0.868 5.350 1.00 . A A . 31 ILE HG12 1 1 16 3940 1 1 9 ILE HG13 H 10.513 0.485 4.248 1.00 . A A . 31 ILE HG13 1 1 16 3941 1 1 9 ILE HG21 H 10.930 -3.201 4.624 1.00 . A A . 31 ILE HG21 1 1 16 3942 1 1 9 ILE HG22 H 11.217 -3.566 2.937 1.00 . A A . 31 ILE HG22 1 1 16 3943 1 1 9 ILE HG23 H 9.613 -3.126 3.462 1.00 . A A . 31 ILE HG23 1 1 16 3944 1 1 9 ILE N N 12.739 0.284 3.307 1.00 . A A . 31 ILE N 1 1 16 3945 1 1 9 ILE O O 13.658 -3.160 2.808 1.00 . A A . 31 ILE O 1 1 16 3946 1 1 10 GLU C C 16.147 -1.466 0.723 1.00 . A A . 32 GLU C 1 1 16 3947 1 1 10 GLU CA C 14.725 -2.003 0.532 1.00 . A A . 32 GLU CA 1 1 16 3948 1 1 10 GLU CB C 14.238 -1.668 -0.916 1.00 . A A . 32 GLU CB 1 1 16 3949 1 1 10 GLU CD C 11.893 -2.806 -0.887 1.00 . A A . 32 GLU CD 1 1 16 3950 1 1 10 GLU CG C 13.290 -2.752 -1.523 1.00 . A A . 32 GLU CG 1 1 16 3951 1 1 10 GLU H H 13.598 -0.401 1.457 1.00 . A A . 32 GLU H 1 1 16 3952 1 1 10 GLU HA H 14.743 -3.071 0.709 1.00 . A A . 32 GLU HA 1 1 16 3953 1 1 10 GLU HB2 H 13.729 -0.716 -0.906 1.00 . A A . 32 GLU HB2 1 1 16 3954 1 1 10 GLU HB3 H 15.095 -1.574 -1.570 1.00 . A A . 32 GLU HB3 1 1 16 3955 1 1 10 GLU HG2 H 13.166 -2.554 -2.578 1.00 . A A . 32 GLU HG2 1 1 16 3956 1 1 10 GLU HG3 H 13.734 -3.729 -1.415 1.00 . A A . 32 GLU HG3 1 1 16 3957 1 1 10 GLU N N 13.853 -1.344 1.550 1.00 . A A . 32 GLU N 1 1 16 3958 1 1 10 GLU O O 16.964 -1.534 -0.173 1.00 . A A . 32 GLU O 1 1 16 3959 1 1 10 GLU OE1 O 11.752 -2.760 0.318 1.00 . A A . 32 GLU OE1 1 1 16 3960 1 1 11 ARG C C 18.504 -1.476 2.981 1.00 . A A . 33 ARG C 1 1 16 3961 1 1 11 ARG CA C 17.772 -0.398 2.175 1.00 . A A . 33 ARG CA 1 1 16 3962 1 1 11 ARG CB C 17.614 0.931 2.974 1.00 . A A . 33 ARG CB 1 1 16 3963 1 1 11 ARG CD C 20.004 1.163 3.929 1.00 . A A . 33 ARG CD 1 1 16 3964 1 1 11 ARG CG C 18.941 1.752 2.971 1.00 . A A . 33 ARG CG 1 1 16 3965 1 1 11 ARG CZ C 21.504 3.015 4.536 1.00 . A A . 33 ARG CZ 1 1 16 3966 1 1 11 ARG H H 15.698 -0.898 2.569 1.00 . A A . 33 ARG H 1 1 16 3967 1 1 11 ARG HA H 18.294 -0.234 1.247 1.00 . A A . 33 ARG HA 1 1 16 3968 1 1 11 ARG HB2 H 16.837 1.524 2.506 1.00 . A A . 33 ARG HB2 1 1 16 3969 1 1 11 ARG HB3 H 17.309 0.720 3.988 1.00 . A A . 33 ARG HB3 1 1 16 3970 1 1 11 ARG HD2 H 19.686 1.092 4.958 1.00 . A A . 33 ARG HD2 1 1 16 3971 1 1 11 ARG HD3 H 20.275 0.171 3.613 1.00 . A A . 33 ARG HD3 1 1 16 3972 1 1 11 ARG HE H 21.917 1.621 3.135 1.00 . A A . 33 ARG HE 1 1 16 3973 1 1 11 ARG HG2 H 19.345 1.765 1.968 1.00 . A A . 33 ARG HG2 1 1 16 3974 1 1 11 ARG HG3 H 18.714 2.773 3.245 1.00 . A A . 33 ARG HG3 1 1 16 3975 1 1 11 ARG HH11 H 19.728 2.890 5.416 1.00 . A A . 33 ARG HH11 1 1 16 3976 1 1 11 ARG HH12 H 20.697 4.198 5.970 1.00 . A A . 33 ARG HH12 1 1 16 3977 1 1 11 ARG HH21 H 23.332 3.315 3.749 1.00 . A A . 33 ARG HH21 1 1 16 3978 1 1 11 ARG HH22 H 22.861 4.450 4.935 1.00 . A A . 33 ARG HH22 1 1 16 3979 1 1 11 ARG N N 16.408 -0.942 1.893 1.00 . A A . 33 ARG N 1 1 16 3980 1 1 11 ARG NE N 21.264 1.962 3.801 1.00 . A A . 33 ARG NE 1 1 16 3981 1 1 11 ARG NH1 N 20.583 3.404 5.373 1.00 . A A . 33 ARG NH1 1 1 16 3982 1 1 11 ARG NH2 N 22.642 3.637 4.397 1.00 . A A . 33 ARG NH2 1 1 16 3983 1 1 11 ARG O O 19.678 -1.712 2.796 1.00 . A A . 33 ARG O 1 1 16 3984 1 1 12 GLN C C 19.482 -4.061 4.219 1.00 . A A . 34 GLN C 1 1 16 3985 1 1 12 GLN CA C 18.301 -3.189 4.747 1.00 . A A . 34 GLN CA 1 1 16 3986 1 1 12 GLN CB C 17.097 -4.092 5.104 1.00 . A A . 34 GLN CB 1 1 16 3987 1 1 12 GLN CD C 14.890 -4.159 6.300 1.00 . A A . 34 GLN CD 1 1 16 3988 1 1 12 GLN CG C 16.051 -3.260 5.890 1.00 . A A . 34 GLN CG 1 1 16 3989 1 1 12 GLN H H 16.834 -1.821 3.917 1.00 . A A . 34 GLN H 1 1 16 3990 1 1 12 GLN HA H 18.653 -2.721 5.656 1.00 . A A . 34 GLN HA 1 1 16 3991 1 1 12 GLN HB2 H 16.629 -4.470 4.204 1.00 . A A . 34 GLN HB2 1 1 16 3992 1 1 12 GLN HB3 H 17.418 -4.931 5.704 1.00 . A A . 34 GLN HB3 1 1 16 3993 1 1 12 GLN HE21 H 14.847 -3.498 8.173 1.00 . A A . 34 GLN HE21 1 1 16 3994 1 1 12 GLN HE22 H 13.698 -4.684 7.771 1.00 . A A . 34 GLN HE22 1 1 16 3995 1 1 12 GLN HG2 H 16.501 -2.850 6.783 1.00 . A A . 34 GLN HG2 1 1 16 3996 1 1 12 GLN HG3 H 15.647 -2.454 5.295 1.00 . A A . 34 GLN HG3 1 1 16 3997 1 1 12 GLN N N 17.773 -2.098 3.856 1.00 . A A . 34 GLN N 1 1 16 3998 1 1 12 GLN NE2 N 14.445 -4.105 7.517 1.00 . A A . 34 GLN NE2 1 1 16 3999 1 1 12 GLN O O 20.301 -4.491 5.004 1.00 . A A . 34 GLN O 1 1 16 4000 1 1 12 GLN OE1 O 14.364 -4.926 5.525 1.00 . A A . 34 GLN OE1 1 1 16 4001 1 1 13 ARG C C 21.920 -4.326 1.965 1.00 . A A . 35 ARG C 1 1 16 4002 1 1 13 ARG CA C 20.681 -5.148 2.368 1.00 . A A . 35 ARG CA 1 1 16 4003 1 1 13 ARG CB C 20.174 -5.925 1.108 1.00 . A A . 35 ARG CB 1 1 16 4004 1 1 13 ARG CD C 18.236 -7.301 2.158 1.00 . A A . 35 ARG CD 1 1 16 4005 1 1 13 ARG CG C 19.608 -7.337 1.452 1.00 . A A . 35 ARG CG 1 1 16 4006 1 1 13 ARG CZ C 16.916 -9.436 2.005 1.00 . A A . 35 ARG CZ 1 1 16 4007 1 1 13 ARG H H 18.889 -3.939 2.338 1.00 . A A . 35 ARG H 1 1 16 4008 1 1 13 ARG HA H 20.995 -5.830 3.134 1.00 . A A . 35 ARG HA 1 1 16 4009 1 1 13 ARG HB2 H 19.425 -5.347 0.586 1.00 . A A . 35 ARG HB2 1 1 16 4010 1 1 13 ARG HB3 H 21.004 -6.055 0.424 1.00 . A A . 35 ARG HB3 1 1 16 4011 1 1 13 ARG HD2 H 18.303 -6.716 3.066 1.00 . A A . 35 ARG HD2 1 1 16 4012 1 1 13 ARG HD3 H 17.484 -6.856 1.526 1.00 . A A . 35 ARG HD3 1 1 16 4013 1 1 13 ARG HE H 18.478 -9.151 3.193 1.00 . A A . 35 ARG HE 1 1 16 4014 1 1 13 ARG HG2 H 19.519 -7.897 0.532 1.00 . A A . 35 ARG HG2 1 1 16 4015 1 1 13 ARG HG3 H 20.329 -7.852 2.073 1.00 . A A . 35 ARG HG3 1 1 16 4016 1 1 13 ARG HH11 H 16.254 -7.982 0.795 1.00 . A A . 35 ARG HH11 1 1 16 4017 1 1 13 ARG HH12 H 15.379 -9.446 0.703 1.00 . A A . 35 ARG HH12 1 1 16 4018 1 1 13 ARG HH21 H 17.374 -11.059 3.113 1.00 . A A . 35 ARG HH21 1 1 16 4019 1 1 13 ARG HH22 H 16.033 -11.256 2.083 1.00 . A A . 35 ARG HH22 1 1 16 4020 1 1 13 ARG N N 19.563 -4.309 2.934 1.00 . A A . 35 ARG N 1 1 16 4021 1 1 13 ARG NE N 17.902 -8.731 2.518 1.00 . A A . 35 ARG NE 1 1 16 4022 1 1 13 ARG NH1 N 16.128 -8.920 1.106 1.00 . A A . 35 ARG NH1 1 1 16 4023 1 1 13 ARG NH2 N 16.762 -10.663 2.426 1.00 . A A . 35 ARG NH2 1 1 16 4024 1 1 13 ARG O O 23.017 -4.836 1.852 1.00 . A A . 35 ARG O 1 1 16 4025 1 1 14 TYR C C 22.885 -1.058 2.495 1.00 . A A . 36 TYR C 1 1 16 4026 1 1 14 TYR CA C 22.718 -2.082 1.359 1.00 . A A . 36 TYR CA 1 1 16 4027 1 1 14 TYR CB C 22.249 -1.415 0.045 1.00 . A A . 36 TYR CB 1 1 16 4028 1 1 14 TYR CD1 C 22.678 -3.480 -1.376 1.00 . A A . 36 TYR CD1 1 1 16 4029 1 1 14 TYR CD2 C 20.474 -2.588 -1.325 1.00 . A A . 36 TYR CD2 1 1 16 4030 1 1 14 TYR CE1 C 22.253 -4.481 -2.221 1.00 . A A . 36 TYR CE1 1 1 16 4031 1 1 14 TYR CE2 C 20.052 -3.590 -2.171 1.00 . A A . 36 TYR CE2 1 1 16 4032 1 1 14 TYR CG C 21.790 -2.523 -0.917 1.00 . A A . 36 TYR CG 1 1 16 4033 1 1 14 TYR CZ C 20.936 -4.542 -2.624 1.00 . A A . 36 TYR CZ 1 1 16 4034 1 1 14 TYR H H 20.769 -2.753 1.883 1.00 . A A . 36 TYR H 1 1 16 4035 1 1 14 TYR HA H 23.642 -2.607 1.216 1.00 . A A . 36 TYR HA 1 1 16 4036 1 1 14 TYR HB2 H 21.437 -0.729 0.233 1.00 . A A . 36 TYR HB2 1 1 16 4037 1 1 14 TYR HB3 H 23.068 -0.874 -0.406 1.00 . A A . 36 TYR HB3 1 1 16 4038 1 1 14 TYR HD1 H 23.713 -3.446 -1.070 1.00 . A A . 36 TYR HD1 1 1 16 4039 1 1 14 TYR HD2 H 19.760 -1.853 -0.983 1.00 . A A . 36 TYR HD2 1 1 16 4040 1 1 14 TYR HE1 H 22.965 -5.218 -2.565 1.00 . A A . 36 TYR HE1 1 1 16 4041 1 1 14 TYR HE2 H 19.020 -3.628 -2.485 1.00 . A A . 36 TYR HE2 1 1 16 4042 1 1 14 TYR HH H 21.213 -5.781 -4.048 1.00 . A A . 36 TYR HH 1 1 16 4043 1 1 14 TYR N N 21.678 -3.065 1.761 1.00 . A A . 36 TYR N 1 1 16 4044 1 1 14 TYR O O 22.582 0.117 2.383 1.00 . A A . 36 TYR O 1 1 16 4045 1 1 14 TYR OH O 20.489 -5.539 -3.464 1.00 . A A . 36 TYR OH 1 1 16 4046 1 1 15 NH2 HN1 H 23.614 -2.422 3.722 1.00 . A A . 37 NH2 HN1 1 1 16 4047 1 1 15 NH2 HN2 H 23.480 -0.854 4.365 1.00 . A A . 37 NH2 HN2 1 1 16 4048 1 1 15 NH2 N N 23.367 -1.479 3.624 1.00 . A A . 37 NH2 N 1 1 17 4049 1 1 1 ACE C C 1.320 1.872 -0.988 1.00 . A A . 23 ACE C 1 1 17 4050 1 1 1 ACE CH3 C 0.328 0.738 -1.237 1.00 . A A . 23 ACE CH3 1 1 17 4051 1 1 1 ACE H1 H 0.509 -0.071 -0.544 1.00 . A A . 23 ACE H1 1 1 17 4052 1 1 1 ACE H2 H 0.441 0.378 -2.249 1.00 . A A . 23 ACE H2 1 1 17 4053 1 1 1 ACE H3 H -0.676 1.113 -1.095 1.00 . A A . 23 ACE H3 1 1 17 4054 1 1 1 ACE O O 1.320 2.861 -1.694 1.00 . A A . 23 ACE O 1 1 17 4055 1 1 2 ALA C C 4.418 2.627 -0.587 1.00 . A A . 24 ALA C 1 1 17 4056 1 1 2 ALA CA C 3.179 2.785 0.309 1.00 . A A . 24 ALA CA 1 1 17 4057 1 1 2 ALA CB C 3.550 2.657 1.793 1.00 . A A . 24 ALA CB 1 1 17 4058 1 1 2 ALA H H 2.168 0.892 0.520 1.00 . A A . 24 ALA H 1 1 17 4059 1 1 2 ALA HA H 2.737 3.755 0.127 1.00 . A A . 24 ALA HA 1 1 17 4060 1 1 2 ALA HB1 H 4.261 3.422 2.062 1.00 . A A . 24 ALA HB1 1 1 17 4061 1 1 2 ALA HB2 H 3.999 1.693 1.987 1.00 . A A . 24 ALA HB2 1 1 17 4062 1 1 2 ALA HB3 H 2.675 2.769 2.413 1.00 . A A . 24 ALA HB3 1 1 17 4063 1 1 2 ALA N N 2.174 1.715 -0.009 1.00 . A A . 24 ALA N 1 1 17 4064 1 1 2 ALA O O 5.555 2.575 -0.159 1.00 . A A . 24 ALA O 1 1 17 4065 1 1 3 ARG C C 6.291 3.382 -2.773 1.00 . A A . 25 ARG C 1 1 17 4066 1 1 3 ARG CA C 5.119 2.410 -2.938 1.00 . A A . 25 ARG CA 1 1 17 4067 1 1 3 ARG CB C 4.399 2.649 -4.271 1.00 . A A . 25 ARG CB 1 1 17 4068 1 1 3 ARG CD C 2.408 1.970 -5.653 1.00 . A A . 25 ARG CD 1 1 17 4069 1 1 3 ARG CG C 3.348 1.539 -4.511 1.00 . A A . 25 ARG CG 1 1 17 4070 1 1 3 ARG CZ C 3.159 3.695 -7.286 1.00 . A A . 25 ARG CZ 1 1 17 4071 1 1 3 ARG H H 3.155 2.627 -2.081 1.00 . A A . 25 ARG H 1 1 17 4072 1 1 3 ARG HA H 5.520 1.407 -2.886 1.00 . A A . 25 ARG HA 1 1 17 4073 1 1 3 ARG HB2 H 3.933 3.622 -4.263 1.00 . A A . 25 ARG HB2 1 1 17 4074 1 1 3 ARG HB3 H 5.124 2.626 -5.070 1.00 . A A . 25 ARG HB3 1 1 17 4075 1 1 3 ARG HD2 H 1.841 1.110 -5.991 1.00 . A A . 25 ARG HD2 1 1 17 4076 1 1 3 ARG HD3 H 1.702 2.698 -5.288 1.00 . A A . 25 ARG HD3 1 1 17 4077 1 1 3 ARG HE H 3.873 1.839 -7.201 1.00 . A A . 25 ARG HE 1 1 17 4078 1 1 3 ARG HG2 H 3.852 0.616 -4.770 1.00 . A A . 25 ARG HG2 1 1 17 4079 1 1 3 ARG HG3 H 2.763 1.358 -3.621 1.00 . A A . 25 ARG HG3 1 1 17 4080 1 1 3 ARG HH11 H 1.762 4.313 -5.993 1.00 . A A . 25 ARG HH11 1 1 17 4081 1 1 3 ARG HH12 H 2.241 5.484 -7.135 1.00 . A A . 25 ARG HH12 1 1 17 4082 1 1 3 ARG HH21 H 4.567 3.358 -8.687 1.00 . A A . 25 ARG HH21 1 1 17 4083 1 1 3 ARG HH22 H 3.898 4.928 -8.688 1.00 . A A . 25 ARG HH22 1 1 17 4084 1 1 3 ARG N N 4.106 2.564 -1.849 1.00 . A A . 25 ARG N 1 1 17 4085 1 1 3 ARG NE N 3.241 2.478 -6.803 1.00 . A A . 25 ARG NE 1 1 17 4086 1 1 3 ARG NH1 N 2.330 4.559 -6.771 1.00 . A A . 25 ARG NH1 1 1 17 4087 1 1 3 ARG NH2 N 3.926 4.014 -8.289 1.00 . A A . 25 ARG NH2 1 1 17 4088 1 1 3 ARG O O 7.442 2.999 -2.715 1.00 . A A . 25 ARG O 1 1 17 4089 1 1 4 HIS C C 7.768 5.531 -1.205 1.00 . A A . 26 HIS C 1 1 17 4090 1 1 4 HIS CA C 7.011 5.691 -2.531 1.00 . A A . 26 HIS CA 1 1 17 4091 1 1 4 HIS CB C 6.345 7.090 -2.593 1.00 . A A . 26 HIS CB 1 1 17 4092 1 1 4 HIS CD2 C 8.714 8.122 -3.133 1.00 . A A . 26 HIS CD2 1 1 17 4093 1 1 4 HIS CE1 C 8.198 10.067 -2.854 1.00 . A A . 26 HIS CE1 1 1 17 4094 1 1 4 HIS CG C 7.387 8.211 -2.775 1.00 . A A . 26 HIS CG 1 1 17 4095 1 1 4 HIS H H 5.003 4.887 -2.721 1.00 . A A . 26 HIS H 1 1 17 4096 1 1 4 HIS HA H 7.725 5.557 -3.325 1.00 . A A . 26 HIS HA 1 1 17 4097 1 1 4 HIS HB2 H 5.649 7.141 -3.417 1.00 . A A . 26 HIS HB2 1 1 17 4098 1 1 4 HIS HB3 H 5.811 7.279 -1.675 1.00 . A A . 26 HIS HB3 1 1 17 4099 1 1 4 HIS HD1 H 6.212 9.853 -2.333 1.00 . A A . 26 HIS HD1 1 1 17 4100 1 1 4 HIS HD2 H 9.256 7.213 -3.339 1.00 . A A . 26 HIS HD2 1 1 17 4101 1 1 4 HIS HE1 H 8.287 11.144 -2.800 1.00 . A A . 26 HIS HE1 1 1 17 4102 1 1 4 HIS N N 5.950 4.642 -2.687 1.00 . A A . 26 HIS N 1 1 17 4103 1 1 4 HIS ND1 N 7.068 9.459 -2.597 1.00 . A A . 26 HIS ND1 1 1 17 4104 1 1 4 HIS NE2 N 9.223 9.324 -3.181 1.00 . A A . 26 HIS NE2 1 1 17 4105 1 1 4 HIS O O 8.722 6.231 -0.940 1.00 . A A . 26 HIS O 1 1 17 4106 1 1 5 TYR C C 8.580 2.932 0.922 1.00 . A A . 27 TYR C 1 1 17 4107 1 1 5 TYR CA C 7.954 4.332 0.920 1.00 . A A . 27 TYR CA 1 1 17 4108 1 1 5 TYR CB C 6.860 4.422 1.974 1.00 . A A . 27 TYR CB 1 1 17 4109 1 1 5 TYR CD1 C 7.472 6.401 3.409 1.00 . A A . 27 TYR CD1 1 1 17 4110 1 1 5 TYR CD2 C 7.765 4.223 4.328 1.00 . A A . 27 TYR CD2 1 1 17 4111 1 1 5 TYR CE1 C 7.935 6.958 4.582 1.00 . A A . 27 TYR CE1 1 1 17 4112 1 1 5 TYR CE2 C 8.228 4.783 5.502 1.00 . A A . 27 TYR CE2 1 1 17 4113 1 1 5 TYR CG C 7.383 5.030 3.276 1.00 . A A . 27 TYR CG 1 1 17 4114 1 1 5 TYR CZ C 8.315 6.156 5.635 1.00 . A A . 27 TYR CZ 1 1 17 4115 1 1 5 TYR H H 6.553 4.068 -0.698 1.00 . A A . 27 TYR H 1 1 17 4116 1 1 5 TYR HA H 8.742 5.048 1.089 1.00 . A A . 27 TYR HA 1 1 17 4117 1 1 5 TYR HB2 H 6.056 5.022 1.588 1.00 . A A . 27 TYR HB2 1 1 17 4118 1 1 5 TYR HB3 H 6.479 3.432 2.179 1.00 . A A . 27 TYR HB3 1 1 17 4119 1 1 5 TYR HD1 H 7.180 7.044 2.590 1.00 . A A . 27 TYR HD1 1 1 17 4120 1 1 5 TYR HD2 H 7.705 3.148 4.231 1.00 . A A . 27 TYR HD2 1 1 17 4121 1 1 5 TYR HE1 H 8.000 8.032 4.680 1.00 . A A . 27 TYR HE1 1 1 17 4122 1 1 5 TYR HE2 H 8.522 4.134 6.311 1.00 . A A . 27 TYR HE2 1 1 17 4123 1 1 5 TYR HH H 8.876 6.074 7.475 1.00 . A A . 27 TYR HH 1 1 17 4124 1 1 5 TYR N N 7.321 4.601 -0.411 1.00 . A A . 27 TYR N 1 1 17 4125 1 1 5 TYR O O 8.897 2.378 1.958 1.00 . A A . 27 TYR O 1 1 17 4126 1 1 5 TYR OH O 8.768 6.744 6.797 1.00 . A A . 27 TYR OH 1 1 17 4127 1 1 6 LYS C C 10.887 1.138 -0.340 1.00 . A A . 28 LYS C 1 1 17 4128 1 1 6 LYS CA C 9.351 1.029 -0.368 1.00 . A A . 28 LYS CA 1 1 17 4129 1 1 6 LYS CB C 8.842 0.390 -1.703 1.00 . A A . 28 LYS CB 1 1 17 4130 1 1 6 LYS CD C 10.134 -1.856 -1.386 1.00 . A A . 28 LYS CD 1 1 17 4131 1 1 6 LYS CE C 11.113 -1.543 -2.530 1.00 . A A . 28 LYS CE 1 1 17 4132 1 1 6 LYS CG C 8.764 -1.172 -1.636 1.00 . A A . 28 LYS CG 1 1 17 4133 1 1 6 LYS H H 8.468 2.917 -1.036 1.00 . A A . 28 LYS H 1 1 17 4134 1 1 6 LYS HA H 9.034 0.436 0.478 1.00 . A A . 28 LYS HA 1 1 17 4135 1 1 6 LYS HB2 H 7.850 0.760 -1.916 1.00 . A A . 28 LYS HB2 1 1 17 4136 1 1 6 LYS HB3 H 9.482 0.675 -2.524 1.00 . A A . 28 LYS HB3 1 1 17 4137 1 1 6 LYS HD2 H 10.540 -1.539 -0.441 1.00 . A A . 28 LYS HD2 1 1 17 4138 1 1 6 LYS HD3 H 9.979 -2.927 -1.338 1.00 . A A . 28 LYS HD3 1 1 17 4139 1 1 6 LYS HE2 H 10.723 -1.913 -3.471 1.00 . A A . 28 LYS HE2 1 1 17 4140 1 1 6 LYS HE3 H 11.274 -0.477 -2.617 1.00 . A A . 28 LYS HE3 1 1 17 4141 1 1 6 LYS HG2 H 8.087 -1.458 -0.842 1.00 . A A . 28 LYS HG2 1 1 17 4142 1 1 6 LYS HG3 H 8.352 -1.541 -2.566 1.00 . A A . 28 LYS HG3 1 1 17 4143 1 1 6 LYS HZ1 H 12.433 -3.195 -2.124 1.00 . A A . 28 LYS HZ1 1 1 17 4144 1 1 6 LYS N N 8.752 2.398 -0.251 1.00 . A A . 28 LYS N 1 1 17 4145 1 1 6 LYS NZ N 12.420 -2.224 -2.244 1.00 . A A . 28 LYS NZ 1 1 17 4146 1 1 6 LYS O O 11.527 0.382 0.364 1.00 . A A . 28 LYS O 1 1 17 4147 1 1 7 ASN C C 13.638 1.903 0.105 1.00 . A A . 29 ASN C 1 1 17 4148 1 1 7 ASN CA C 12.904 2.336 -1.188 1.00 . A A . 29 ASN CA 1 1 17 4149 1 1 7 ASN CB C 13.111 3.865 -1.471 1.00 . A A . 29 ASN CB 1 1 17 4150 1 1 7 ASN CG C 14.195 4.098 -2.540 1.00 . A A . 29 ASN CG 1 1 17 4151 1 1 7 ASN H H 10.794 2.643 -1.587 1.00 . A A . 29 ASN H 1 1 17 4152 1 1 7 ASN HA H 13.299 1.777 -2.015 1.00 . A A . 29 ASN HA 1 1 17 4153 1 1 7 ASN HB2 H 12.195 4.329 -1.798 1.00 . A A . 29 ASN HB2 1 1 17 4154 1 1 7 ASN HB3 H 13.437 4.374 -0.577 1.00 . A A . 29 ASN HB3 1 1 17 4155 1 1 7 ASN HD21 H 12.973 4.888 -3.906 1.00 . A A . 29 ASN HD21 1 1 17 4156 1 1 7 ASN HD22 H 14.613 4.775 -4.340 1.00 . A A . 29 ASN HD22 1 1 17 4157 1 1 7 ASN N N 11.415 2.084 -1.082 1.00 . A A . 29 ASN N 1 1 17 4158 1 1 7 ASN ND2 N 13.893 4.633 -3.689 1.00 . A A . 29 ASN ND2 1 1 17 4159 1 1 7 ASN O O 14.571 1.122 0.096 1.00 . A A . 29 ASN O 1 1 17 4160 1 1 7 ASN OD1 O 15.351 3.796 -2.345 1.00 . A A . 29 ASN OD1 1 1 17 4161 1 1 8 LEU C C 14.018 0.654 2.816 1.00 . A A . 30 LEU C 1 1 17 4162 1 1 8 LEU CA C 13.725 2.151 2.555 1.00 . A A . 30 LEU CA 1 1 17 4163 1 1 8 LEU CB C 12.725 2.671 3.619 1.00 . A A . 30 LEU CB 1 1 17 4164 1 1 8 LEU CD1 C 14.027 4.790 4.262 1.00 . A A . 30 LEU CD1 1 1 17 4165 1 1 8 LEU CD2 C 12.343 4.923 2.387 1.00 . A A . 30 LEU CD2 1 1 17 4166 1 1 8 LEU CG C 12.679 4.233 3.732 1.00 . A A . 30 LEU CG 1 1 17 4167 1 1 8 LEU H H 12.407 3.048 1.115 1.00 . A A . 30 LEU H 1 1 17 4168 1 1 8 LEU HA H 14.649 2.693 2.659 1.00 . A A . 30 LEU HA 1 1 17 4169 1 1 8 LEU HB2 H 11.732 2.307 3.388 1.00 . A A . 30 LEU HB2 1 1 17 4170 1 1 8 LEU HB3 H 13.000 2.263 4.582 1.00 . A A . 30 LEU HB3 1 1 17 4171 1 1 8 LEU HD11 H 13.966 5.863 4.353 1.00 . A A . 30 LEU HD11 1 1 17 4172 1 1 8 LEU HD12 H 14.838 4.552 3.590 1.00 . A A . 30 LEU HD12 1 1 17 4173 1 1 8 LEU HD13 H 14.243 4.378 5.239 1.00 . A A . 30 LEU HD13 1 1 17 4174 1 1 8 LEU HD21 H 12.289 5.992 2.531 1.00 . A A . 30 LEU HD21 1 1 17 4175 1 1 8 LEU HD22 H 11.384 4.588 2.021 1.00 . A A . 30 LEU HD22 1 1 17 4176 1 1 8 LEU HD23 H 13.107 4.732 1.648 1.00 . A A . 30 LEU HD23 1 1 17 4177 1 1 8 LEU HG H 11.906 4.483 4.439 1.00 . A A . 30 LEU HG 1 1 17 4178 1 1 8 LEU N N 13.166 2.438 1.196 1.00 . A A . 30 LEU N 1 1 17 4179 1 1 8 LEU O O 15.083 0.278 3.271 1.00 . A A . 30 LEU O 1 1 17 4180 1 1 9 ILE C C 14.452 -2.199 2.015 1.00 . A A . 31 ILE C 1 1 17 4181 1 1 9 ILE CA C 13.233 -1.650 2.744 1.00 . A A . 31 ILE CA 1 1 17 4182 1 1 9 ILE CB C 11.901 -2.362 2.286 1.00 . A A . 31 ILE CB 1 1 17 4183 1 1 9 ILE CD1 C 10.339 -0.594 3.390 1.00 . A A . 31 ILE CD1 1 1 17 4184 1 1 9 ILE CG1 C 10.717 -2.089 3.273 1.00 . A A . 31 ILE CG1 1 1 17 4185 1 1 9 ILE CG2 C 12.061 -3.902 2.199 1.00 . A A . 31 ILE CG2 1 1 17 4186 1 1 9 ILE H H 12.214 0.157 2.133 1.00 . A A . 31 ILE H 1 1 17 4187 1 1 9 ILE HA H 13.459 -1.788 3.791 1.00 . A A . 31 ILE HA 1 1 17 4188 1 1 9 ILE HB H 11.637 -1.991 1.304 1.00 . A A . 31 ILE HB 1 1 17 4189 1 1 9 ILE HD11 H 11.146 -0.011 3.808 1.00 . A A . 31 ILE HD11 1 1 17 4190 1 1 9 ILE HD12 H 9.488 -0.495 4.048 1.00 . A A . 31 ILE HD12 1 1 17 4191 1 1 9 ILE HD13 H 10.068 -0.191 2.424 1.00 . A A . 31 ILE HD13 1 1 17 4192 1 1 9 ILE HG12 H 9.842 -2.629 2.935 1.00 . A A . 31 ILE HG12 1 1 17 4193 1 1 9 ILE HG13 H 10.978 -2.464 4.253 1.00 . A A . 31 ILE HG13 1 1 17 4194 1 1 9 ILE HG21 H 12.338 -4.308 3.163 1.00 . A A . 31 ILE HG21 1 1 17 4195 1 1 9 ILE HG22 H 12.818 -4.174 1.480 1.00 . A A . 31 ILE HG22 1 1 17 4196 1 1 9 ILE HG23 H 11.130 -4.353 1.886 1.00 . A A . 31 ILE HG23 1 1 17 4197 1 1 9 ILE N N 13.056 -0.179 2.518 1.00 . A A . 31 ILE N 1 1 17 4198 1 1 9 ILE O O 14.951 -3.258 2.338 1.00 . A A . 31 ILE O 1 1 17 4199 1 1 10 GLU C C 17.383 -1.314 0.896 1.00 . A A . 32 GLU C 1 1 17 4200 1 1 10 GLU CA C 16.120 -1.945 0.297 1.00 . A A . 32 GLU CA 1 1 17 4201 1 1 10 GLU CB C 15.955 -1.558 -1.198 1.00 . A A . 32 GLU CB 1 1 17 4202 1 1 10 GLU CD C 13.543 -1.548 -2.151 1.00 . A A . 32 GLU CD 1 1 17 4203 1 1 10 GLU CG C 14.794 -2.387 -1.859 1.00 . A A . 32 GLU CG 1 1 17 4204 1 1 10 GLU H H 14.490 -0.604 0.848 1.00 . A A . 32 GLU H 1 1 17 4205 1 1 10 GLU HA H 16.212 -3.020 0.400 1.00 . A A . 32 GLU HA 1 1 17 4206 1 1 10 GLU HB2 H 15.749 -0.500 -1.279 1.00 . A A . 32 GLU HB2 1 1 17 4207 1 1 10 GLU HB3 H 16.881 -1.752 -1.721 1.00 . A A . 32 GLU HB3 1 1 17 4208 1 1 10 GLU HG2 H 15.128 -2.794 -2.801 1.00 . A A . 32 GLU HG2 1 1 17 4209 1 1 10 GLU HG3 H 14.496 -3.206 -1.222 1.00 . A A . 32 GLU HG3 1 1 17 4210 1 1 10 GLU N N 14.926 -1.465 1.051 1.00 . A A . 32 GLU N 1 1 17 4211 1 1 10 GLU O O 18.374 -1.127 0.222 1.00 . A A . 32 GLU O 1 1 17 4212 1 1 10 GLU OE1 O 13.624 -0.346 -2.303 1.00 . A A . 32 GLU OE1 1 1 17 4213 1 1 11 ARG C C 19.115 -1.491 3.735 1.00 . A A . 33 ARG C 1 1 17 4214 1 1 11 ARG CA C 18.439 -0.387 2.906 1.00 . A A . 33 ARG CA 1 1 17 4215 1 1 11 ARG CB C 17.903 0.750 3.839 1.00 . A A . 33 ARG CB 1 1 17 4216 1 1 11 ARG CD C 20.041 2.178 4.036 1.00 . A A . 33 ARG CD 1 1 17 4217 1 1 11 ARG CG C 19.011 1.294 4.783 1.00 . A A . 33 ARG CG 1 1 17 4218 1 1 11 ARG CZ C 19.276 4.493 3.491 1.00 . A A . 33 ARG CZ 1 1 17 4219 1 1 11 ARG H H 16.442 -1.165 2.629 1.00 . A A . 33 ARG H 1 1 17 4220 1 1 11 ARG HA H 19.155 -0.008 2.200 1.00 . A A . 33 ARG HA 1 1 17 4221 1 1 11 ARG HB2 H 17.505 1.540 3.217 1.00 . A A . 33 ARG HB2 1 1 17 4222 1 1 11 ARG HB3 H 17.093 0.387 4.455 1.00 . A A . 33 ARG HB3 1 1 17 4223 1 1 11 ARG HD2 H 21.033 1.968 4.423 1.00 . A A . 33 ARG HD2 1 1 17 4224 1 1 11 ARG HD3 H 20.058 1.993 2.975 1.00 . A A . 33 ARG HD3 1 1 17 4225 1 1 11 ARG HE H 19.810 3.869 5.300 1.00 . A A . 33 ARG HE 1 1 17 4226 1 1 11 ARG HG2 H 18.528 1.866 5.564 1.00 . A A . 33 ARG HG2 1 1 17 4227 1 1 11 ARG HG3 H 19.521 0.474 5.269 1.00 . A A . 33 ARG HG3 1 1 17 4228 1 1 11 ARG HH11 H 19.286 3.278 1.884 1.00 . A A . 33 ARG HH11 1 1 17 4229 1 1 11 ARG HH12 H 18.791 4.888 1.578 1.00 . A A . 33 ARG HH12 1 1 17 4230 1 1 11 ARG HH21 H 19.173 5.909 4.918 1.00 . A A . 33 ARG HH21 1 1 17 4231 1 1 11 ARG HH22 H 18.701 6.418 3.357 1.00 . A A . 33 ARG HH22 1 1 17 4232 1 1 11 ARG N N 17.292 -1.000 2.164 1.00 . A A . 33 ARG N 1 1 17 4233 1 1 11 ARG NE N 19.697 3.608 4.360 1.00 . A A . 33 ARG NE 1 1 17 4234 1 1 11 ARG NH1 N 19.107 4.196 2.229 1.00 . A A . 33 ARG NH1 1 1 17 4235 1 1 11 ARG NH2 N 19.033 5.686 3.952 1.00 . A A . 33 ARG NH2 1 1 17 4236 1 1 11 ARG O O 20.258 -1.850 3.535 1.00 . A A . 33 ARG O 1 1 17 4237 1 1 12 GLN C C 19.753 -4.104 4.964 1.00 . A A . 34 GLN C 1 1 17 4238 1 1 12 GLN CA C 18.792 -3.076 5.590 1.00 . A A . 34 GLN CA 1 1 17 4239 1 1 12 GLN CB C 17.537 -3.797 6.149 1.00 . A A . 34 GLN CB 1 1 17 4240 1 1 12 GLN CD C 15.496 -3.438 7.620 1.00 . A A . 34 GLN CD 1 1 17 4241 1 1 12 GLN CG C 16.774 -2.802 7.064 1.00 . A A . 34 GLN CG 1 1 17 4242 1 1 12 GLN H H 17.422 -1.615 4.705 1.00 . A A . 34 GLN H 1 1 17 4243 1 1 12 GLN HA H 19.324 -2.609 6.408 1.00 . A A . 34 GLN HA 1 1 17 4244 1 1 12 GLN HB2 H 16.899 -4.137 5.348 1.00 . A A . 34 GLN HB2 1 1 17 4245 1 1 12 GLN HB3 H 17.840 -4.656 6.737 1.00 . A A . 34 GLN HB3 1 1 17 4246 1 1 12 GLN HE21 H 14.292 -2.215 6.615 1.00 . A A . 34 GLN HE21 1 1 17 4247 1 1 12 GLN HE22 H 13.538 -3.361 7.633 1.00 . A A . 34 GLN HE22 1 1 17 4248 1 1 12 GLN HG2 H 17.392 -2.536 7.912 1.00 . A A . 34 GLN HG2 1 1 17 4249 1 1 12 GLN HG3 H 16.512 -1.897 6.539 1.00 . A A . 34 GLN HG3 1 1 17 4250 1 1 12 GLN N N 18.333 -1.986 4.657 1.00 . A A . 34 GLN N 1 1 17 4251 1 1 12 GLN NE2 N 14.347 -2.957 7.251 1.00 . A A . 34 GLN NE2 1 1 17 4252 1 1 12 GLN O O 20.807 -4.406 5.489 1.00 . A A . 34 GLN O 1 1 17 4253 1 1 12 GLN OE1 O 15.524 -4.372 8.391 1.00 . A A . 34 GLN OE1 1 1 17 4254 1 1 13 ARG C C 21.182 -4.987 2.123 1.00 . A A . 35 ARG C 1 1 17 4255 1 1 13 ARG CA C 20.186 -5.627 3.120 1.00 . A A . 35 ARG CA 1 1 17 4256 1 1 13 ARG CB C 19.205 -6.597 2.386 1.00 . A A . 35 ARG CB 1 1 17 4257 1 1 13 ARG CD C 17.007 -7.908 2.626 1.00 . A A . 35 ARG CD 1 1 17 4258 1 1 13 ARG CG C 18.058 -7.040 3.356 1.00 . A A . 35 ARG CG 1 1 17 4259 1 1 13 ARG CZ C 17.591 -9.787 1.091 1.00 . A A . 35 ARG CZ 1 1 17 4260 1 1 13 ARG H H 18.513 -4.322 3.446 1.00 . A A . 35 ARG H 1 1 17 4261 1 1 13 ARG HA H 20.752 -6.172 3.856 1.00 . A A . 35 ARG HA 1 1 17 4262 1 1 13 ARG HB2 H 18.806 -6.096 1.516 1.00 . A A . 35 ARG HB2 1 1 17 4263 1 1 13 ARG HB3 H 19.763 -7.460 2.047 1.00 . A A . 35 ARG HB3 1 1 17 4264 1 1 13 ARG HD2 H 16.158 -8.091 3.273 1.00 . A A . 35 ARG HD2 1 1 17 4265 1 1 13 ARG HD3 H 16.668 -7.369 1.754 1.00 . A A . 35 ARG HD3 1 1 17 4266 1 1 13 ARG HE H 18.154 -9.663 2.987 1.00 . A A . 35 ARG HE 1 1 17 4267 1 1 13 ARG HG2 H 18.477 -7.585 4.190 1.00 . A A . 35 ARG HG2 1 1 17 4268 1 1 13 ARG HG3 H 17.551 -6.173 3.753 1.00 . A A . 35 ARG HG3 1 1 17 4269 1 1 13 ARG HH11 H 16.461 -8.367 0.241 1.00 . A A . 35 ARG HH11 1 1 17 4270 1 1 13 ARG HH12 H 16.878 -9.670 -0.788 1.00 . A A . 35 ARG HH12 1 1 17 4271 1 1 13 ARG HH21 H 18.717 -11.326 1.700 1.00 . A A . 35 ARG HH21 1 1 17 4272 1 1 13 ARG HH22 H 18.196 -11.426 0.077 1.00 . A A . 35 ARG HH22 1 1 17 4273 1 1 13 ARG N N 19.358 -4.612 3.831 1.00 . A A . 35 ARG N 1 1 17 4274 1 1 13 ARG NE N 17.653 -9.218 2.269 1.00 . A A . 35 ARG NE 1 1 17 4275 1 1 13 ARG NH1 N 16.930 -9.236 0.111 1.00 . A A . 35 ARG NH1 1 1 17 4276 1 1 13 ARG NH2 N 18.207 -10.924 0.941 1.00 . A A . 35 ARG NH2 1 1 17 4277 1 1 13 ARG O O 21.363 -5.492 1.031 1.00 . A A . 35 ARG O 1 1 17 4278 1 1 14 TYR C C 24.124 -3.083 2.396 1.00 . A A . 36 TYR C 1 1 17 4279 1 1 14 TYR CA C 22.781 -3.202 1.640 1.00 . A A . 36 TYR CA 1 1 17 4280 1 1 14 TYR CB C 22.205 -1.811 1.281 1.00 . A A . 36 TYR CB 1 1 17 4281 1 1 14 TYR CD1 C 23.103 -1.564 -1.092 1.00 . A A . 36 TYR CD1 1 1 17 4282 1 1 14 TYR CD2 C 23.878 -0.043 0.567 1.00 . A A . 36 TYR CD2 1 1 17 4283 1 1 14 TYR CE1 C 23.899 -0.935 -2.031 1.00 . A A . 36 TYR CE1 1 1 17 4284 1 1 14 TYR CE2 C 24.671 0.583 -0.374 1.00 . A A . 36 TYR CE2 1 1 17 4285 1 1 14 TYR CG C 23.086 -1.122 0.220 1.00 . A A . 36 TYR CG 1 1 17 4286 1 1 14 TYR CZ C 24.686 0.140 -1.679 1.00 . A A . 36 TYR CZ 1 1 17 4287 1 1 14 TYR H H 21.608 -3.518 3.399 1.00 . A A . 36 TYR H 1 1 17 4288 1 1 14 TYR HA H 22.937 -3.800 0.761 1.00 . A A . 36 TYR HA 1 1 17 4289 1 1 14 TYR HB2 H 21.202 -1.921 0.892 1.00 . A A . 36 TYR HB2 1 1 17 4290 1 1 14 TYR HB3 H 22.167 -1.194 2.165 1.00 . A A . 36 TYR HB3 1 1 17 4291 1 1 14 TYR HD1 H 22.493 -2.406 -1.389 1.00 . A A . 36 TYR HD1 1 1 17 4292 1 1 14 TYR HD2 H 23.881 0.310 1.589 1.00 . A A . 36 TYR HD2 1 1 17 4293 1 1 14 TYR HE1 H 23.904 -1.285 -3.053 1.00 . A A . 36 TYR HE1 1 1 17 4294 1 1 14 TYR HE2 H 25.280 1.426 -0.086 1.00 . A A . 36 TYR HE2 1 1 17 4295 1 1 14 TYR HH H 26.395 0.693 -2.346 1.00 . A A . 36 TYR HH 1 1 17 4296 1 1 14 TYR N N 21.795 -3.900 2.516 1.00 . A A . 36 TYR N 1 1 17 4297 1 1 14 TYR O O 24.692 -2.026 2.572 1.00 . A A . 36 TYR O 1 1 17 4298 1 1 14 TYR OH O 25.478 0.758 -2.625 1.00 . A A . 36 TYR OH 1 1 17 4299 1 1 15 NH2 HN1 H 24.241 -5.030 2.746 1.00 . A A . 37 NH2 HN1 1 1 17 4300 1 1 15 NH2 HN2 H 25.521 -4.087 3.349 1.00 . A A . 37 NH2 HN2 1 1 17 4301 1 1 15 NH2 N N 24.671 -4.161 2.870 1.00 . A A . 37 NH2 N 1 1 18 4302 1 1 1 ACE C C 1.206 2.108 -1.316 1.00 . A A . 23 ACE C 1 1 18 4303 1 1 1 ACE CH3 C 0.462 0.777 -1.400 1.00 . A A . 23 ACE CH3 1 1 18 4304 1 1 1 ACE H1 H -0.596 0.972 -1.482 1.00 . A A . 23 ACE H1 1 1 18 4305 1 1 1 ACE H2 H 0.655 0.186 -0.517 1.00 . A A . 23 ACE H2 1 1 18 4306 1 1 1 ACE H3 H 0.796 0.242 -2.276 1.00 . A A . 23 ACE H3 1 1 18 4307 1 1 1 ACE O O 1.117 2.916 -2.221 1.00 . A A . 23 ACE O 1 1 18 4308 1 1 2 ALA C C 4.022 3.521 -0.863 1.00 . A A . 24 ALA C 1 1 18 4309 1 1 2 ALA CA C 2.700 3.591 -0.084 1.00 . A A . 24 ALA CA 1 1 18 4310 1 1 2 ALA CB C 2.971 3.813 1.425 1.00 . A A . 24 ALA CB 1 1 18 4311 1 1 2 ALA H H 1.990 1.621 0.440 1.00 . A A . 24 ALA H 1 1 18 4312 1 1 2 ALA HA H 2.108 4.408 -0.475 1.00 . A A . 24 ALA HA 1 1 18 4313 1 1 2 ALA HB1 H 3.524 4.730 1.563 1.00 . A A . 24 ALA HB1 1 1 18 4314 1 1 2 ALA HB2 H 3.562 2.998 1.818 1.00 . A A . 24 ALA HB2 1 1 18 4315 1 1 2 ALA HB3 H 2.044 3.881 1.976 1.00 . A A . 24 ALA HB3 1 1 18 4316 1 1 2 ALA N N 1.940 2.311 -0.251 1.00 . A A . 24 ALA N 1 1 18 4317 1 1 2 ALA O O 5.095 3.611 -0.302 1.00 . A A . 24 ALA O 1 1 18 4318 1 1 3 ARG C C 6.358 3.841 -2.606 1.00 . A A . 25 ARG C 1 1 18 4319 1 1 3 ARG CA C 5.028 3.258 -3.114 1.00 . A A . 25 ARG CA 1 1 18 4320 1 1 3 ARG CB C 4.602 3.969 -4.432 1.00 . A A . 25 ARG CB 1 1 18 4321 1 1 3 ARG CD C 2.821 2.137 -4.814 1.00 . A A . 25 ARG CD 1 1 18 4322 1 1 3 ARG CG C 3.945 2.986 -5.444 1.00 . A A . 25 ARG CG 1 1 18 4323 1 1 3 ARG CZ C 2.311 0.103 -6.167 1.00 . A A . 25 ARG CZ 1 1 18 4324 1 1 3 ARG H H 2.952 3.285 -2.484 1.00 . A A . 25 ARG H 1 1 18 4325 1 1 3 ARG HA H 5.208 2.212 -3.308 1.00 . A A . 25 ARG HA 1 1 18 4326 1 1 3 ARG HB2 H 3.919 4.779 -4.216 1.00 . A A . 25 ARG HB2 1 1 18 4327 1 1 3 ARG HB3 H 5.474 4.402 -4.905 1.00 . A A . 25 ARG HB3 1 1 18 4328 1 1 3 ARG HD2 H 3.182 1.472 -4.045 1.00 . A A . 25 ARG HD2 1 1 18 4329 1 1 3 ARG HD3 H 2.080 2.792 -4.371 1.00 . A A . 25 ARG HD3 1 1 18 4330 1 1 3 ARG HE H 1.563 1.907 -6.509 1.00 . A A . 25 ARG HE 1 1 18 4331 1 1 3 ARG HG2 H 3.546 3.566 -6.265 1.00 . A A . 25 ARG HG2 1 1 18 4332 1 1 3 ARG HG3 H 4.713 2.335 -5.843 1.00 . A A . 25 ARG HG3 1 1 18 4333 1 1 3 ARG HH11 H 3.622 -0.220 -4.685 1.00 . A A . 25 ARG HH11 1 1 18 4334 1 1 3 ARG HH12 H 3.203 -1.608 -5.601 1.00 . A A . 25 ARG HH12 1 1 18 4335 1 1 3 ARG HH21 H 1.049 0.147 -7.728 1.00 . A A . 25 ARG HH21 1 1 18 4336 1 1 3 ARG HH22 H 1.733 -1.382 -7.389 1.00 . A A . 25 ARG HH22 1 1 18 4337 1 1 3 ARG N N 3.873 3.350 -2.151 1.00 . A A . 25 ARG N 1 1 18 4338 1 1 3 ARG NE N 2.159 1.384 -5.931 1.00 . A A . 25 ARG NE 1 1 18 4339 1 1 3 ARG NH1 N 3.101 -0.627 -5.432 1.00 . A A . 25 ARG NH1 1 1 18 4340 1 1 3 ARG NH2 N 1.653 -0.413 -7.163 1.00 . A A . 25 ARG NH2 1 1 18 4341 1 1 3 ARG O O 7.358 3.150 -2.534 1.00 . A A . 25 ARG O 1 1 18 4342 1 1 4 HIS C C 8.207 5.172 -0.480 1.00 . A A . 26 HIS C 1 1 18 4343 1 1 4 HIS CA C 7.571 5.777 -1.751 1.00 . A A . 26 HIS CA 1 1 18 4344 1 1 4 HIS CB C 7.220 7.253 -1.505 1.00 . A A . 26 HIS CB 1 1 18 4345 1 1 4 HIS CD2 C 5.436 8.266 -3.104 1.00 . A A . 26 HIS CD2 1 1 18 4346 1 1 4 HIS CE1 C 6.645 8.503 -4.726 1.00 . A A . 26 HIS CE1 1 1 18 4347 1 1 4 HIS CG C 6.709 7.842 -2.821 1.00 . A A . 26 HIS CG 1 1 18 4348 1 1 4 HIS H H 5.493 5.599 -2.323 1.00 . A A . 26 HIS H 1 1 18 4349 1 1 4 HIS HA H 8.315 5.722 -2.532 1.00 . A A . 26 HIS HA 1 1 18 4350 1 1 4 HIS HB2 H 6.458 7.347 -0.744 1.00 . A A . 26 HIS HB2 1 1 18 4351 1 1 4 HIS HB3 H 8.096 7.802 -1.188 1.00 . A A . 26 HIS HB3 1 1 18 4352 1 1 4 HIS HD1 H 8.435 7.789 -3.959 1.00 . A A . 26 HIS HD1 1 1 18 4353 1 1 4 HIS HD2 H 4.598 8.251 -2.423 1.00 . A A . 26 HIS HD2 1 1 18 4354 1 1 4 HIS HE1 H 6.958 8.762 -5.728 1.00 . A A . 26 HIS HE1 1 1 18 4355 1 1 4 HIS N N 6.331 5.097 -2.256 1.00 . A A . 26 HIS N 1 1 18 4356 1 1 4 HIS ND1 N 7.479 7.995 -3.858 1.00 . A A . 26 HIS ND1 1 1 18 4357 1 1 4 HIS NE2 N 5.407 8.691 -4.339 1.00 . A A . 26 HIS NE2 1 1 18 4358 1 1 4 HIS O O 9.069 5.792 0.110 1.00 . A A . 26 HIS O 1 1 18 4359 1 1 5 TYR C C 9.059 2.038 0.746 1.00 . A A . 27 TYR C 1 1 18 4360 1 1 5 TYR CA C 8.354 3.350 1.135 1.00 . A A . 27 TYR CA 1 1 18 4361 1 1 5 TYR CB C 7.187 3.098 2.119 1.00 . A A . 27 TYR CB 1 1 18 4362 1 1 5 TYR CD1 C 7.920 4.361 4.172 1.00 . A A . 27 TYR CD1 1 1 18 4363 1 1 5 TYR CD2 C 7.822 1.990 4.323 1.00 . A A . 27 TYR CD2 1 1 18 4364 1 1 5 TYR CE1 C 8.336 4.430 5.482 1.00 . A A . 27 TYR CE1 1 1 18 4365 1 1 5 TYR CE2 C 8.238 2.061 5.637 1.00 . A A . 27 TYR CE2 1 1 18 4366 1 1 5 TYR CG C 7.658 3.142 3.578 1.00 . A A . 27 TYR CG 1 1 18 4367 1 1 5 TYR CZ C 8.497 3.281 6.223 1.00 . A A . 27 TYR CZ 1 1 18 4368 1 1 5 TYR H H 7.062 3.553 -0.588 1.00 . A A . 27 TYR H 1 1 18 4369 1 1 5 TYR HA H 9.111 3.993 1.535 1.00 . A A . 27 TYR HA 1 1 18 4370 1 1 5 TYR HB2 H 6.426 3.855 1.982 1.00 . A A . 27 TYR HB2 1 1 18 4371 1 1 5 TYR HB3 H 6.731 2.137 1.928 1.00 . A A . 27 TYR HB3 1 1 18 4372 1 1 5 TYR HD1 H 7.797 5.273 3.604 1.00 . A A . 27 TYR HD1 1 1 18 4373 1 1 5 TYR HD2 H 7.624 1.026 3.878 1.00 . A A . 27 TYR HD2 1 1 18 4374 1 1 5 TYR HE1 H 8.537 5.392 5.929 1.00 . A A . 27 TYR HE1 1 1 18 4375 1 1 5 TYR HE2 H 8.364 1.156 6.212 1.00 . A A . 27 TYR HE2 1 1 18 4376 1 1 5 TYR HH H 8.222 3.782 8.054 1.00 . A A . 27 TYR HH 1 1 18 4377 1 1 5 TYR N N 7.779 4.000 -0.085 1.00 . A A . 27 TYR N 1 1 18 4378 1 1 5 TYR O O 9.561 1.300 1.575 1.00 . A A . 27 TYR O 1 1 18 4379 1 1 5 TYR OH O 8.908 3.351 7.537 1.00 . A A . 27 TYR OH 1 1 18 4380 1 1 6 LYS C C 11.247 0.710 -1.053 1.00 . A A . 28 LYS C 1 1 18 4381 1 1 6 LYS CA C 9.731 0.564 -1.074 1.00 . A A . 28 LYS CA 1 1 18 4382 1 1 6 LYS CB C 9.242 0.301 -2.529 1.00 . A A . 28 LYS CB 1 1 18 4383 1 1 6 LYS CD C 10.994 -0.981 -3.941 1.00 . A A . 28 LYS CD 1 1 18 4384 1 1 6 LYS CE C 11.614 -2.387 -4.116 1.00 . A A . 28 LYS CE 1 1 18 4385 1 1 6 LYS CG C 9.765 -1.099 -3.007 1.00 . A A . 28 LYS CG 1 1 18 4386 1 1 6 LYS H H 8.668 2.480 -1.121 1.00 . A A . 28 LYS H 1 1 18 4387 1 1 6 LYS HA H 9.462 -0.270 -0.449 1.00 . A A . 28 LYS HA 1 1 18 4388 1 1 6 LYS HB2 H 8.162 0.313 -2.557 1.00 . A A . 28 LYS HB2 1 1 18 4389 1 1 6 LYS HB3 H 9.607 1.077 -3.187 1.00 . A A . 28 LYS HB3 1 1 18 4390 1 1 6 LYS HD2 H 10.679 -0.593 -4.896 1.00 . A A . 28 LYS HD2 1 1 18 4391 1 1 6 LYS HD3 H 11.735 -0.309 -3.528 1.00 . A A . 28 LYS HD3 1 1 18 4392 1 1 6 LYS HE2 H 10.861 -3.129 -4.349 1.00 . A A . 28 LYS HE2 1 1 18 4393 1 1 6 LYS HE3 H 12.371 -2.385 -4.890 1.00 . A A . 28 LYS HE3 1 1 18 4394 1 1 6 LYS HG2 H 10.032 -1.713 -2.158 1.00 . A A . 28 LYS HG2 1 1 18 4395 1 1 6 LYS HG3 H 8.977 -1.611 -3.539 1.00 . A A . 28 LYS HG3 1 1 18 4396 1 1 6 LYS HZ1 H 11.658 -2.655 -1.996 1.00 . A A . 28 LYS HZ1 1 1 18 4397 1 1 6 LYS N N 9.084 1.808 -0.538 1.00 . A A . 28 LYS N 1 1 18 4398 1 1 6 LYS NZ N 12.228 -2.696 -2.792 1.00 . A A . 28 LYS NZ 1 1 18 4399 1 1 6 LYS O O 11.959 -0.169 -0.601 1.00 . A A . 28 LYS O 1 1 18 4400 1 1 7 ASN C C 13.761 2.415 -0.140 1.00 . A A . 29 ASN C 1 1 18 4401 1 1 7 ASN CA C 13.214 2.039 -1.537 1.00 . A A . 29 ASN CA 1 1 18 4402 1 1 7 ASN CB C 13.523 3.148 -2.576 1.00 . A A . 29 ASN CB 1 1 18 4403 1 1 7 ASN CG C 15.040 3.236 -2.775 1.00 . A A . 29 ASN CG 1 1 18 4404 1 1 7 ASN H H 11.110 2.507 -1.850 1.00 . A A . 29 ASN H 1 1 18 4405 1 1 7 ASN HA H 13.682 1.120 -1.851 1.00 . A A . 29 ASN HA 1 1 18 4406 1 1 7 ASN HB2 H 13.067 2.918 -3.527 1.00 . A A . 29 ASN HB2 1 1 18 4407 1 1 7 ASN HB3 H 13.161 4.103 -2.224 1.00 . A A . 29 ASN HB3 1 1 18 4408 1 1 7 ASN HD21 H 15.139 5.227 -2.685 1.00 . A A . 29 ASN HD21 1 1 18 4409 1 1 7 ASN HD22 H 16.605 4.401 -2.921 1.00 . A A . 29 ASN HD22 1 1 18 4410 1 1 7 ASN N N 11.731 1.828 -1.520 1.00 . A A . 29 ASN N 1 1 18 4411 1 1 7 ASN ND2 N 15.636 4.391 -2.794 1.00 . A A . 29 ASN ND2 1 1 18 4412 1 1 7 ASN O O 14.722 3.143 0.008 1.00 . A A . 29 ASN O 1 1 18 4413 1 1 7 ASN OD1 O 15.712 2.238 -2.927 1.00 . A A . 29 ASN OD1 1 1 18 4414 1 1 8 LEU C C 13.774 0.750 2.881 1.00 . A A . 30 LEU C 1 1 18 4415 1 1 8 LEU CA C 13.481 2.114 2.275 1.00 . A A . 30 LEU CA 1 1 18 4416 1 1 8 LEU CB C 12.313 2.803 3.043 1.00 . A A . 30 LEU CB 1 1 18 4417 1 1 8 LEU CD1 C 11.344 5.000 3.811 1.00 . A A . 30 LEU CD1 1 1 18 4418 1 1 8 LEU CD2 C 13.799 4.610 4.046 1.00 . A A . 30 LEU CD2 1 1 18 4419 1 1 8 LEU CG C 12.566 4.332 3.142 1.00 . A A . 30 LEU CG 1 1 18 4420 1 1 8 LEU H H 12.331 1.305 0.649 1.00 . A A . 30 LEU H 1 1 18 4421 1 1 8 LEU HA H 14.388 2.698 2.302 1.00 . A A . 30 LEU HA 1 1 18 4422 1 1 8 LEU HB2 H 11.374 2.626 2.534 1.00 . A A . 30 LEU HB2 1 1 18 4423 1 1 8 LEU HB3 H 12.233 2.388 4.038 1.00 . A A . 30 LEU HB3 1 1 18 4424 1 1 8 LEU HD11 H 11.169 4.596 4.799 1.00 . A A . 30 LEU HD11 1 1 18 4425 1 1 8 LEU HD12 H 10.460 4.836 3.213 1.00 . A A . 30 LEU HD12 1 1 18 4426 1 1 8 LEU HD13 H 11.498 6.066 3.898 1.00 . A A . 30 LEU HD13 1 1 18 4427 1 1 8 LEU HD21 H 13.633 4.223 5.042 1.00 . A A . 30 LEU HD21 1 1 18 4428 1 1 8 LEU HD22 H 13.961 5.675 4.118 1.00 . A A . 30 LEU HD22 1 1 18 4429 1 1 8 LEU HD23 H 14.696 4.166 3.647 1.00 . A A . 30 LEU HD23 1 1 18 4430 1 1 8 LEU HG H 12.722 4.753 2.156 1.00 . A A . 30 LEU HG 1 1 18 4431 1 1 8 LEU N N 13.101 1.878 0.853 1.00 . A A . 30 LEU N 1 1 18 4432 1 1 8 LEU O O 14.865 0.490 3.345 1.00 . A A . 30 LEU O 1 1 18 4433 1 1 9 ILE C C 14.174 -2.139 2.723 1.00 . A A . 31 ILE C 1 1 18 4434 1 1 9 ILE CA C 12.989 -1.477 3.433 1.00 . A A . 31 ILE CA 1 1 18 4435 1 1 9 ILE CB C 11.687 -2.310 3.232 1.00 . A A . 31 ILE CB 1 1 18 4436 1 1 9 ILE CD1 C 9.152 -2.278 3.582 1.00 . A A . 31 ILE CD1 1 1 18 4437 1 1 9 ILE CG1 C 10.465 -1.487 3.759 1.00 . A A . 31 ILE CG1 1 1 18 4438 1 1 9 ILE CG2 C 11.811 -3.612 4.076 1.00 . A A . 31 ILE CG2 1 1 18 4439 1 1 9 ILE H H 11.931 0.154 2.470 1.00 . A A . 31 ILE H 1 1 18 4440 1 1 9 ILE HA H 13.271 -1.369 4.462 1.00 . A A . 31 ILE HA 1 1 18 4441 1 1 9 ILE HB H 11.550 -2.556 2.188 1.00 . A A . 31 ILE HB 1 1 18 4442 1 1 9 ILE HD11 H 8.992 -2.513 2.540 1.00 . A A . 31 ILE HD11 1 1 18 4443 1 1 9 ILE HD12 H 8.320 -1.683 3.932 1.00 . A A . 31 ILE HD12 1 1 18 4444 1 1 9 ILE HD13 H 9.171 -3.196 4.149 1.00 . A A . 31 ILE HD13 1 1 18 4445 1 1 9 ILE HG12 H 10.601 -1.245 4.803 1.00 . A A . 31 ILE HG12 1 1 18 4446 1 1 9 ILE HG13 H 10.361 -0.560 3.213 1.00 . A A . 31 ILE HG13 1 1 18 4447 1 1 9 ILE HG21 H 11.902 -3.382 5.128 1.00 . A A . 31 ILE HG21 1 1 18 4448 1 1 9 ILE HG22 H 12.683 -4.175 3.778 1.00 . A A . 31 ILE HG22 1 1 18 4449 1 1 9 ILE HG23 H 10.948 -4.245 3.937 1.00 . A A . 31 ILE HG23 1 1 18 4450 1 1 9 ILE N N 12.792 -0.107 2.859 1.00 . A A . 31 ILE N 1 1 18 4451 1 1 9 ILE O O 14.944 -2.893 3.282 1.00 . A A . 31 ILE O 1 1 18 4452 1 1 10 GLU C C 16.739 -1.629 0.893 1.00 . A A . 32 GLU C 1 1 18 4453 1 1 10 GLU CA C 15.419 -2.386 0.653 1.00 . A A . 32 GLU CA 1 1 18 4454 1 1 10 GLU CB C 15.040 -2.305 -0.837 1.00 . A A . 32 GLU CB 1 1 18 4455 1 1 10 GLU CD C 13.487 -3.013 -2.639 1.00 . A A . 32 GLU CD 1 1 18 4456 1 1 10 GLU CG C 13.883 -3.276 -1.188 1.00 . A A . 32 GLU CG 1 1 18 4457 1 1 10 GLU H H 13.643 -1.178 1.121 1.00 . A A . 32 GLU H 1 1 18 4458 1 1 10 GLU HA H 15.574 -3.418 0.947 1.00 . A A . 32 GLU HA 1 1 18 4459 1 1 10 GLU HB2 H 14.744 -1.291 -1.071 1.00 . A A . 32 GLU HB2 1 1 18 4460 1 1 10 GLU HB3 H 15.897 -2.547 -1.450 1.00 . A A . 32 GLU HB3 1 1 18 4461 1 1 10 GLU HG2 H 14.189 -4.307 -1.103 1.00 . A A . 32 GLU HG2 1 1 18 4462 1 1 10 GLU HG3 H 13.024 -3.101 -0.559 1.00 . A A . 32 GLU HG3 1 1 18 4463 1 1 10 GLU N N 14.303 -1.810 1.472 1.00 . A A . 32 GLU N 1 1 18 4464 1 1 10 GLU O O 17.605 -1.599 0.036 1.00 . A A . 32 GLU O 1 1 18 4465 1 1 10 GLU OE1 O 14.311 -3.109 -3.530 1.00 . A A . 32 GLU OE1 1 1 18 4466 1 1 11 ARG C C 18.852 -1.243 3.330 1.00 . A A . 33 ARG C 1 1 18 4467 1 1 11 ARG CA C 18.079 -0.282 2.427 1.00 . A A . 33 ARG CA 1 1 18 4468 1 1 11 ARG CB C 17.683 1.025 3.183 1.00 . A A . 33 ARG CB 1 1 18 4469 1 1 11 ARG CD C 18.596 3.136 4.295 1.00 . A A . 33 ARG CD 1 1 18 4470 1 1 11 ARG CG C 18.961 1.793 3.610 1.00 . A A . 33 ARG CG 1 1 18 4471 1 1 11 ARG CZ C 20.370 4.892 4.199 1.00 . A A . 33 ARG CZ 1 1 18 4472 1 1 11 ARG H H 16.103 -1.096 2.693 1.00 . A A . 33 ARG H 1 1 18 4473 1 1 11 ARG HA H 18.664 -0.077 1.548 1.00 . A A . 33 ARG HA 1 1 18 4474 1 1 11 ARG HB2 H 17.080 1.636 2.524 1.00 . A A . 33 ARG HB2 1 1 18 4475 1 1 11 ARG HB3 H 17.090 0.791 4.056 1.00 . A A . 33 ARG HB3 1 1 18 4476 1 1 11 ARG HD2 H 18.011 3.773 3.651 1.00 . A A . 33 ARG HD2 1 1 18 4477 1 1 11 ARG HD3 H 18.010 2.949 5.188 1.00 . A A . 33 ARG HD3 1 1 18 4478 1 1 11 ARG HE H 20.411 3.308 5.402 1.00 . A A . 33 ARG HE 1 1 18 4479 1 1 11 ARG HG2 H 19.520 1.183 4.307 1.00 . A A . 33 ARG HG2 1 1 18 4480 1 1 11 ARG HG3 H 19.590 1.978 2.749 1.00 . A A . 33 ARG HG3 1 1 18 4481 1 1 11 ARG HH11 H 18.865 5.152 2.917 1.00 . A A . 33 ARG HH11 1 1 18 4482 1 1 11 ARG HH12 H 20.035 6.404 2.900 1.00 . A A . 33 ARG HH12 1 1 18 4483 1 1 11 ARG HH21 H 22.014 4.855 5.367 1.00 . A A . 33 ARG HH21 1 1 18 4484 1 1 11 ARG HH22 H 21.915 6.170 4.284 1.00 . A A . 33 ARG HH22 1 1 18 4485 1 1 11 ARG N N 16.848 -1.041 2.055 1.00 . A A . 33 ARG N 1 1 18 4486 1 1 11 ARG NE N 19.897 3.775 4.705 1.00 . A A . 33 ARG NE 1 1 18 4487 1 1 11 ARG NH1 N 19.713 5.532 3.273 1.00 . A A . 33 ARG NH1 1 1 18 4488 1 1 11 ARG NH2 N 21.509 5.333 4.649 1.00 . A A . 33 ARG NH2 1 1 18 4489 1 1 11 ARG O O 19.971 -1.622 3.050 1.00 . A A . 33 ARG O 1 1 18 4490 1 1 12 GLN C C 19.684 -3.597 4.870 1.00 . A A . 34 GLN C 1 1 18 4491 1 1 12 GLN CA C 18.722 -2.533 5.444 1.00 . A A . 34 GLN CA 1 1 18 4492 1 1 12 GLN CB C 17.490 -3.187 6.135 1.00 . A A . 34 GLN CB 1 1 18 4493 1 1 12 GLN CD C 16.717 -4.526 8.093 1.00 . A A . 34 GLN CD 1 1 18 4494 1 1 12 GLN CG C 17.950 -4.090 7.300 1.00 . A A . 34 GLN CG 1 1 18 4495 1 1 12 GLN H H 17.296 -1.212 4.501 1.00 . A A . 34 GLN H 1 1 18 4496 1 1 12 GLN HA H 19.274 -1.948 6.167 1.00 . A A . 34 GLN HA 1 1 18 4497 1 1 12 GLN HB2 H 16.840 -2.418 6.530 1.00 . A A . 34 GLN HB2 1 1 18 4498 1 1 12 GLN HB3 H 16.924 -3.779 5.427 1.00 . A A . 34 GLN HB3 1 1 18 4499 1 1 12 GLN HE21 H 17.349 -3.761 9.809 1.00 . A A . 34 GLN HE21 1 1 18 4500 1 1 12 GLN HE22 H 15.837 -4.539 9.857 1.00 . A A . 34 GLN HE22 1 1 18 4501 1 1 12 GLN HG2 H 18.443 -4.977 6.930 1.00 . A A . 34 GLN HG2 1 1 18 4502 1 1 12 GLN HG3 H 18.627 -3.566 7.958 1.00 . A A . 34 GLN HG3 1 1 18 4503 1 1 12 GLN N N 18.191 -1.596 4.399 1.00 . A A . 34 GLN N 1 1 18 4504 1 1 12 GLN NE2 N 16.630 -4.250 9.359 1.00 . A A . 34 GLN NE2 1 1 18 4505 1 1 12 GLN O O 20.697 -3.915 5.455 1.00 . A A . 34 GLN O 1 1 18 4506 1 1 12 GLN OE1 O 15.808 -5.127 7.562 1.00 . A A . 34 GLN OE1 1 1 18 4507 1 1 13 ARG C C 21.575 -4.665 2.592 1.00 . A A . 35 ARG C 1 1 18 4508 1 1 13 ARG CA C 20.184 -5.170 3.048 1.00 . A A . 35 ARG CA 1 1 18 4509 1 1 13 ARG CB C 19.391 -5.709 1.814 1.00 . A A . 35 ARG CB 1 1 18 4510 1 1 13 ARG CD C 20.170 -3.789 0.264 1.00 . A A . 35 ARG CD 1 1 18 4511 1 1 13 ARG CG C 18.949 -4.582 0.803 1.00 . A A . 35 ARG CG 1 1 18 4512 1 1 13 ARG CZ C 20.178 -3.062 -2.114 1.00 . A A . 35 ARG CZ 1 1 18 4513 1 1 13 ARG H H 18.514 -3.809 3.309 1.00 . A A . 35 ARG H 1 1 18 4514 1 1 13 ARG HA H 20.345 -5.977 3.751 1.00 . A A . 35 ARG HA 1 1 18 4515 1 1 13 ARG HB2 H 20.007 -6.432 1.297 1.00 . A A . 35 ARG HB2 1 1 18 4516 1 1 13 ARG HB3 H 18.510 -6.226 2.167 1.00 . A A . 35 ARG HB3 1 1 18 4517 1 1 13 ARG HD2 H 20.505 -3.112 1.040 1.00 . A A . 35 ARG HD2 1 1 18 4518 1 1 13 ARG HD3 H 20.992 -4.440 0.014 1.00 . A A . 35 ARG HD3 1 1 18 4519 1 1 13 ARG HE H 19.109 -2.200 -0.664 1.00 . A A . 35 ARG HE 1 1 18 4520 1 1 13 ARG HG2 H 18.434 -5.048 -0.025 1.00 . A A . 35 ARG HG2 1 1 18 4521 1 1 13 ARG HG3 H 18.260 -3.905 1.286 1.00 . A A . 35 ARG HG3 1 1 18 4522 1 1 13 ARG HH11 H 21.308 -4.650 -1.709 1.00 . A A . 35 ARG HH11 1 1 18 4523 1 1 13 ARG HH12 H 21.363 -4.153 -3.345 1.00 . A A . 35 ARG HH12 1 1 18 4524 1 1 13 ARG HH21 H 19.096 -1.498 -2.760 1.00 . A A . 35 ARG HH21 1 1 18 4525 1 1 13 ARG HH22 H 20.044 -2.276 -3.954 1.00 . A A . 35 ARG HH22 1 1 18 4526 1 1 13 ARG N N 19.342 -4.121 3.724 1.00 . A A . 35 ARG N 1 1 18 4527 1 1 13 ARG NE N 19.746 -2.922 -0.885 1.00 . A A . 35 ARG NE 1 1 18 4528 1 1 13 ARG NH1 N 21.010 -4.019 -2.418 1.00 . A A . 35 ARG NH1 1 1 18 4529 1 1 13 ARG NH2 N 19.743 -2.221 -3.006 1.00 . A A . 35 ARG NH2 1 1 18 4530 1 1 13 ARG O O 22.302 -5.351 1.897 1.00 . A A . 35 ARG O 1 1 18 4531 1 1 14 TYR C C 24.261 -3.447 3.567 1.00 . A A . 36 TYR C 1 1 18 4532 1 1 14 TYR CA C 23.216 -2.859 2.620 1.00 . A A . 36 TYR CA 1 1 18 4533 1 1 14 TYR CB C 23.077 -1.319 2.773 1.00 . A A . 36 TYR CB 1 1 18 4534 1 1 14 TYR CD1 C 25.476 -0.416 2.634 1.00 . A A . 36 TYR CD1 1 1 18 4535 1 1 14 TYR CD2 C 23.982 0.027 0.839 1.00 . A A . 36 TYR CD2 1 1 18 4536 1 1 14 TYR CE1 C 26.466 0.284 1.975 1.00 . A A . 36 TYR CE1 1 1 18 4537 1 1 14 TYR CE2 C 24.971 0.724 0.185 1.00 . A A . 36 TYR CE2 1 1 18 4538 1 1 14 TYR CG C 24.218 -0.553 2.072 1.00 . A A . 36 TYR CG 1 1 18 4539 1 1 14 TYR CZ C 26.215 0.859 0.745 1.00 . A A . 36 TYR CZ 1 1 18 4540 1 1 14 TYR H H 21.285 -2.962 3.548 1.00 . A A . 36 TYR H 1 1 18 4541 1 1 14 TYR HA H 23.459 -3.128 1.605 1.00 . A A . 36 TYR HA 1 1 18 4542 1 1 14 TYR HB2 H 22.134 -0.988 2.367 1.00 . A A . 36 TYR HB2 1 1 18 4543 1 1 14 TYR HB3 H 23.099 -1.065 3.824 1.00 . A A . 36 TYR HB3 1 1 18 4544 1 1 14 TYR HD1 H 25.701 -0.855 3.597 1.00 . A A . 36 TYR HD1 1 1 18 4545 1 1 14 TYR HD2 H 23.014 -0.065 0.375 1.00 . A A . 36 TYR HD2 1 1 18 4546 1 1 14 TYR HE1 H 27.441 0.378 2.432 1.00 . A A . 36 TYR HE1 1 1 18 4547 1 1 14 TYR HE2 H 24.772 1.172 -0.778 1.00 . A A . 36 TYR HE2 1 1 18 4548 1 1 14 TYR HH H 27.853 1.852 0.682 1.00 . A A . 36 TYR HH 1 1 18 4549 1 1 14 TYR N N 21.909 -3.470 2.992 1.00 . A A . 36 TYR N 1 1 18 4550 1 1 14 TYR O O 24.860 -2.775 4.378 1.00 . A A . 36 TYR O 1 1 18 4551 1 1 14 TYR OH O 27.176 1.571 0.063 1.00 . A A . 36 TYR OH 1 1 18 4552 1 1 15 NH2 HN1 H 24.017 -5.266 2.832 1.00 . A A . 37 NH2 HN1 1 1 18 4553 1 1 15 NH2 HN2 H 25.169 -5.120 4.083 1.00 . A A . 37 NH2 HN2 1 1 18 4554 1 1 15 NH2 N N 24.505 -4.720 3.489 1.00 . A A . 37 NH2 N 1 1 19 4555 1 1 1 ACE C C 2.296 4.365 -1.254 1.00 . A A . 23 ACE C 1 1 19 4556 1 1 1 ACE CH3 C 1.019 4.855 -1.932 1.00 . A A . 23 ACE CH3 1 1 19 4557 1 1 1 ACE H1 H 0.274 4.073 -1.935 1.00 . A A . 23 ACE H1 1 1 19 4558 1 1 1 ACE H2 H 1.249 5.137 -2.950 1.00 . A A . 23 ACE H2 1 1 19 4559 1 1 1 ACE H3 H 0.644 5.716 -1.397 1.00 . A A . 23 ACE H3 1 1 19 4560 1 1 1 ACE O O 3.267 5.092 -1.161 1.00 . A A . 23 ACE O 1 1 19 4561 1 1 2 ALA C C 4.506 2.100 -1.186 1.00 . A A . 24 ALA C 1 1 19 4562 1 1 2 ALA CA C 3.531 2.610 -0.120 1.00 . A A . 24 ALA CA 1 1 19 4563 1 1 2 ALA CB C 3.111 1.469 0.821 1.00 . A A . 24 ALA CB 1 1 19 4564 1 1 2 ALA H H 1.518 2.567 -0.909 1.00 . A A . 24 ALA H 1 1 19 4565 1 1 2 ALA HA H 4.009 3.402 0.442 1.00 . A A . 24 ALA HA 1 1 19 4566 1 1 2 ALA HB1 H 2.663 0.666 0.256 1.00 . A A . 24 ALA HB1 1 1 19 4567 1 1 2 ALA HB2 H 2.404 1.825 1.555 1.00 . A A . 24 ALA HB2 1 1 19 4568 1 1 2 ALA HB3 H 3.980 1.082 1.335 1.00 . A A . 24 ALA HB3 1 1 19 4569 1 1 2 ALA N N 2.305 3.139 -0.801 1.00 . A A . 24 ALA N 1 1 19 4570 1 1 2 ALA O O 4.993 0.988 -1.143 1.00 . A A . 24 ALA O 1 1 19 4571 1 1 3 ARG C C 7.026 3.293 -2.903 1.00 . A A . 25 ARG C 1 1 19 4572 1 1 3 ARG CA C 5.697 2.613 -3.247 1.00 . A A . 25 ARG CA 1 1 19 4573 1 1 3 ARG CB C 5.089 3.151 -4.565 1.00 . A A . 25 ARG CB 1 1 19 4574 1 1 3 ARG CD C 5.117 0.918 -5.784 1.00 . A A . 25 ARG CD 1 1 19 4575 1 1 3 ARG CG C 5.627 2.384 -5.800 1.00 . A A . 25 ARG CG 1 1 19 4576 1 1 3 ARG CZ C 4.568 -0.148 -7.971 1.00 . A A . 25 ARG CZ 1 1 19 4577 1 1 3 ARG H H 4.333 3.838 -2.094 1.00 . A A . 25 ARG H 1 1 19 4578 1 1 3 ARG HA H 5.853 1.543 -3.263 1.00 . A A . 25 ARG HA 1 1 19 4579 1 1 3 ARG HB2 H 4.012 3.065 -4.524 1.00 . A A . 25 ARG HB2 1 1 19 4580 1 1 3 ARG HB3 H 5.331 4.197 -4.685 1.00 . A A . 25 ARG HB3 1 1 19 4581 1 1 3 ARG HD2 H 5.638 0.357 -5.018 1.00 . A A . 25 ARG HD2 1 1 19 4582 1 1 3 ARG HD3 H 4.063 0.879 -5.563 1.00 . A A . 25 ARG HD3 1 1 19 4583 1 1 3 ARG HE H 6.415 0.237 -7.324 1.00 . A A . 25 ARG HE 1 1 19 4584 1 1 3 ARG HG2 H 5.295 2.884 -6.698 1.00 . A A . 25 ARG HG2 1 1 19 4585 1 1 3 ARG HG3 H 6.709 2.402 -5.782 1.00 . A A . 25 ARG HG3 1 1 19 4586 1 1 3 ARG HH11 H 2.985 0.336 -6.856 1.00 . A A . 25 ARG HH11 1 1 19 4587 1 1 3 ARG HH12 H 2.603 -0.412 -8.342 1.00 . A A . 25 ARG HH12 1 1 19 4588 1 1 3 ARG HH21 H 5.971 -0.733 -9.292 1.00 . A A . 25 ARG HH21 1 1 19 4589 1 1 3 ARG HH22 H 4.360 -1.017 -9.778 1.00 . A A . 25 ARG HH22 1 1 19 4590 1 1 3 ARG N N 4.765 2.958 -2.134 1.00 . A A . 25 ARG N 1 1 19 4591 1 1 3 ARG NE N 5.457 0.298 -7.115 1.00 . A A . 25 ARG NE 1 1 19 4592 1 1 3 ARG NH1 N 3.295 -0.072 -7.708 1.00 . A A . 25 ARG NH1 1 1 19 4593 1 1 3 ARG NH2 N 4.993 -0.667 -9.089 1.00 . A A . 25 ARG NH2 1 1 19 4594 1 1 3 ARG O O 8.063 2.671 -2.797 1.00 . A A . 25 ARG O 1 1 19 4595 1 1 4 HIS C C 8.731 4.977 -0.985 1.00 . A A . 26 HIS C 1 1 19 4596 1 1 4 HIS CA C 8.193 5.359 -2.374 1.00 . A A . 26 HIS CA 1 1 19 4597 1 1 4 HIS CB C 7.851 6.856 -2.437 1.00 . A A . 26 HIS CB 1 1 19 4598 1 1 4 HIS CD2 C 7.322 6.487 -4.999 1.00 . A A . 26 HIS CD2 1 1 19 4599 1 1 4 HIS CE1 C 6.919 8.434 -5.431 1.00 . A A . 26 HIS CE1 1 1 19 4600 1 1 4 HIS CG C 7.460 7.263 -3.870 1.00 . A A . 26 HIS CG 1 1 19 4601 1 1 4 HIS H H 6.095 5.047 -2.795 1.00 . A A . 26 HIS H 1 1 19 4602 1 1 4 HIS HA H 8.958 5.123 -3.099 1.00 . A A . 26 HIS HA 1 1 19 4603 1 1 4 HIS HB2 H 7.033 7.090 -1.770 1.00 . A A . 26 HIS HB2 1 1 19 4604 1 1 4 HIS HB3 H 8.716 7.431 -2.136 1.00 . A A . 26 HIS HB3 1 1 19 4605 1 1 4 HIS HD1 H 7.218 9.277 -3.557 1.00 . A A . 26 HIS HD1 1 1 19 4606 1 1 4 HIS HD2 H 7.475 5.420 -5.063 1.00 . A A . 26 HIS HD2 1 1 19 4607 1 1 4 HIS HE1 H 6.654 9.316 -6.000 1.00 . A A . 26 HIS HE1 1 1 19 4608 1 1 4 HIS N N 6.956 4.584 -2.714 1.00 . A A . 26 HIS N 1 1 19 4609 1 1 4 HIS ND1 N 7.202 8.501 -4.158 1.00 . A A . 26 HIS ND1 1 1 19 4610 1 1 4 HIS NE2 N 6.973 7.255 -5.997 1.00 . A A . 26 HIS NE2 1 1 19 4611 1 1 4 HIS O O 9.727 5.495 -0.523 1.00 . A A . 26 HIS O 1 1 19 4612 1 1 5 TYR C C 9.116 2.210 0.856 1.00 . A A . 27 TYR C 1 1 19 4613 1 1 5 TYR CA C 8.451 3.577 0.993 1.00 . A A . 27 TYR CA 1 1 19 4614 1 1 5 TYR CB C 7.185 3.492 1.902 1.00 . A A . 27 TYR CB 1 1 19 4615 1 1 5 TYR CD1 C 7.119 5.995 2.367 1.00 . A A . 27 TYR CD1 1 1 19 4616 1 1 5 TYR CD2 C 7.187 4.502 4.217 1.00 . A A . 27 TYR CD2 1 1 19 4617 1 1 5 TYR CE1 C 7.115 7.067 3.239 1.00 . A A . 27 TYR CE1 1 1 19 4618 1 1 5 TYR CE2 C 7.184 5.572 5.086 1.00 . A A . 27 TYR CE2 1 1 19 4619 1 1 5 TYR CG C 7.157 4.701 2.850 1.00 . A A . 27 TYR CG 1 1 19 4620 1 1 5 TYR CZ C 7.148 6.863 4.601 1.00 . A A . 27 TYR CZ 1 1 19 4621 1 1 5 TYR H H 7.257 3.680 -0.789 1.00 . A A . 27 TYR H 1 1 19 4622 1 1 5 TYR HA H 9.203 4.242 1.374 1.00 . A A . 27 TYR HA 1 1 19 4623 1 1 5 TYR HB2 H 6.279 3.492 1.317 1.00 . A A . 27 TYR HB2 1 1 19 4624 1 1 5 TYR HB3 H 7.210 2.585 2.490 1.00 . A A . 27 TYR HB3 1 1 19 4625 1 1 5 TYR HD1 H 7.090 6.176 1.303 1.00 . A A . 27 TYR HD1 1 1 19 4626 1 1 5 TYR HD2 H 7.214 3.495 4.613 1.00 . A A . 27 TYR HD2 1 1 19 4627 1 1 5 TYR HE1 H 7.084 8.077 2.857 1.00 . A A . 27 TYR HE1 1 1 19 4628 1 1 5 TYR HE2 H 7.211 5.390 6.150 1.00 . A A . 27 TYR HE2 1 1 19 4629 1 1 5 TYR HH H 6.985 7.660 6.350 1.00 . A A . 27 TYR HH 1 1 19 4630 1 1 5 TYR N N 8.047 4.057 -0.360 1.00 . A A . 27 TYR N 1 1 19 4631 1 1 5 TYR O O 9.418 1.543 1.826 1.00 . A A . 27 TYR O 1 1 19 4632 1 1 5 TYR OH O 7.153 7.949 5.450 1.00 . A A . 27 TYR OH 1 1 19 4633 1 1 6 LYS C C 11.460 0.619 -0.286 1.00 . A A . 28 LYS C 1 1 19 4634 1 1 6 LYS CA C 9.984 0.535 -0.671 1.00 . A A . 28 LYS CA 1 1 19 4635 1 1 6 LYS CB C 9.823 0.249 -2.172 1.00 . A A . 28 LYS CB 1 1 19 4636 1 1 6 LYS CD C 8.238 -1.758 -1.927 1.00 . A A . 28 LYS CD 1 1 19 4637 1 1 6 LYS CE C 9.324 -2.716 -2.470 1.00 . A A . 28 LYS CE 1 1 19 4638 1 1 6 LYS CG C 8.427 -0.327 -2.490 1.00 . A A . 28 LYS CG 1 1 19 4639 1 1 6 LYS H H 9.068 2.435 -1.103 1.00 . A A . 28 LYS H 1 1 19 4640 1 1 6 LYS HA H 9.522 -0.232 -0.069 1.00 . A A . 28 LYS HA 1 1 19 4641 1 1 6 LYS HB2 H 9.952 1.162 -2.733 1.00 . A A . 28 LYS HB2 1 1 19 4642 1 1 6 LYS HB3 H 10.574 -0.440 -2.504 1.00 . A A . 28 LYS HB3 1 1 19 4643 1 1 6 LYS HD2 H 8.255 -1.744 -0.847 1.00 . A A . 28 LYS HD2 1 1 19 4644 1 1 6 LYS HD3 H 7.265 -2.122 -2.230 1.00 . A A . 28 LYS HD3 1 1 19 4645 1 1 6 LYS HE2 H 8.883 -3.683 -2.657 1.00 . A A . 28 LYS HE2 1 1 19 4646 1 1 6 LYS HE3 H 9.745 -2.347 -3.397 1.00 . A A . 28 LYS HE3 1 1 19 4647 1 1 6 LYS HG2 H 7.664 0.306 -2.062 1.00 . A A . 28 LYS HG2 1 1 19 4648 1 1 6 LYS HG3 H 8.290 -0.347 -3.561 1.00 . A A . 28 LYS HG3 1 1 19 4649 1 1 6 LYS HZ1 H 10.158 -3.160 -0.540 1.00 . A A . 28 LYS HZ1 1 1 19 4650 1 1 6 LYS N N 9.338 1.841 -0.372 1.00 . A A . 28 LYS N 1 1 19 4651 1 1 6 LYS NZ N 10.416 -2.870 -1.440 1.00 . A A . 28 LYS NZ 1 1 19 4652 1 1 6 LYS O O 11.936 -0.180 0.499 1.00 . A A . 28 LYS O 1 1 19 4653 1 1 7 ASN C C 13.807 1.635 0.940 1.00 . A A . 29 ASN C 1 1 19 4654 1 1 7 ASN CA C 13.607 1.785 -0.566 1.00 . A A . 29 ASN CA 1 1 19 4655 1 1 7 ASN CB C 14.083 3.204 -0.998 1.00 . A A . 29 ASN CB 1 1 19 4656 1 1 7 ASN CG C 15.610 3.178 -1.250 1.00 . A A . 29 ASN CG 1 1 19 4657 1 1 7 ASN H H 11.670 2.169 -1.478 1.00 . A A . 29 ASN H 1 1 19 4658 1 1 7 ASN HA H 14.178 1.020 -1.070 1.00 . A A . 29 ASN HA 1 1 19 4659 1 1 7 ASN HB2 H 13.585 3.518 -1.903 1.00 . A A . 29 ASN HB2 1 1 19 4660 1 1 7 ASN HB3 H 13.885 3.933 -0.227 1.00 . A A . 29 ASN HB3 1 1 19 4661 1 1 7 ASN HD21 H 15.431 3.811 -3.123 1.00 . A A . 29 ASN HD21 1 1 19 4662 1 1 7 ASN HD22 H 17.011 3.514 -2.600 1.00 . A A . 29 ASN HD22 1 1 19 4663 1 1 7 ASN N N 12.145 1.584 -0.856 1.00 . A A . 29 ASN N 1 1 19 4664 1 1 7 ASN ND2 N 16.053 3.530 -2.421 1.00 . A A . 29 ASN ND2 1 1 19 4665 1 1 7 ASN O O 14.620 0.859 1.372 1.00 . A A . 29 ASN O 1 1 19 4666 1 1 7 ASN OD1 O 16.431 2.846 -0.416 1.00 . A A . 29 ASN OD1 1 1 19 4667 1 1 8 LEU C C 13.388 0.898 3.761 1.00 . A A . 30 LEU C 1 1 19 4668 1 1 8 LEU CA C 13.157 2.314 3.196 1.00 . A A . 30 LEU CA 1 1 19 4669 1 1 8 LEU CB C 11.870 2.914 3.791 1.00 . A A . 30 LEU CB 1 1 19 4670 1 1 8 LEU CD1 C 10.402 4.931 3.936 1.00 . A A . 30 LEU CD1 1 1 19 4671 1 1 8 LEU CD2 C 12.866 5.227 4.128 1.00 . A A . 30 LEU CD2 1 1 19 4672 1 1 8 LEU CG C 11.753 4.419 3.431 1.00 . A A . 30 LEU CG 1 1 19 4673 1 1 8 LEU H H 12.397 2.980 1.281 1.00 . A A . 30 LEU H 1 1 19 4674 1 1 8 LEU HA H 14.015 2.898 3.489 1.00 . A A . 30 LEU HA 1 1 19 4675 1 1 8 LEU HB2 H 11.011 2.392 3.395 1.00 . A A . 30 LEU HB2 1 1 19 4676 1 1 8 LEU HB3 H 11.872 2.782 4.866 1.00 . A A . 30 LEU HB3 1 1 19 4677 1 1 8 LEU HD11 H 10.311 4.812 5.007 1.00 . A A . 30 LEU HD11 1 1 19 4678 1 1 8 LEU HD12 H 9.614 4.366 3.467 1.00 . A A . 30 LEU HD12 1 1 19 4679 1 1 8 LEU HD13 H 10.267 5.976 3.695 1.00 . A A . 30 LEU HD13 1 1 19 4680 1 1 8 LEU HD21 H 13.847 4.930 3.797 1.00 . A A . 30 LEU HD21 1 1 19 4681 1 1 8 LEU HD22 H 12.808 5.097 5.201 1.00 . A A . 30 LEU HD22 1 1 19 4682 1 1 8 LEU HD23 H 12.749 6.280 3.912 1.00 . A A . 30 LEU HD23 1 1 19 4683 1 1 8 LEU HG H 11.807 4.564 2.361 1.00 . A A . 30 LEU HG 1 1 19 4684 1 1 8 LEU N N 13.049 2.379 1.699 1.00 . A A . 30 LEU N 1 1 19 4685 1 1 8 LEU O O 14.291 0.669 4.545 1.00 . A A . 30 LEU O 1 1 19 4686 1 1 9 ILE C C 13.623 -2.185 2.860 1.00 . A A . 31 ILE C 1 1 19 4687 1 1 9 ILE CA C 12.688 -1.436 3.816 1.00 . A A . 31 ILE CA 1 1 19 4688 1 1 9 ILE CB C 11.248 -2.102 3.841 1.00 . A A . 31 ILE CB 1 1 19 4689 1 1 9 ILE CD1 C 9.894 -0.013 4.552 1.00 . A A . 31 ILE CD1 1 1 19 4690 1 1 9 ILE CG1 C 10.278 -1.458 4.889 1.00 . A A . 31 ILE CG1 1 1 19 4691 1 1 9 ILE CG2 C 11.338 -3.610 4.198 1.00 . A A . 31 ILE CG2 1 1 19 4692 1 1 9 ILE H H 11.868 0.222 2.687 1.00 . A A . 31 ILE H 1 1 19 4693 1 1 9 ILE HA H 13.164 -1.434 4.787 1.00 . A A . 31 ILE HA 1 1 19 4694 1 1 9 ILE HB H 10.807 -2.011 2.857 1.00 . A A . 31 ILE HB 1 1 19 4695 1 1 9 ILE HD11 H 9.414 0.035 3.586 1.00 . A A . 31 ILE HD11 1 1 19 4696 1 1 9 ILE HD12 H 10.758 0.626 4.559 1.00 . A A . 31 ILE HD12 1 1 19 4697 1 1 9 ILE HD13 H 9.202 0.361 5.293 1.00 . A A . 31 ILE HD13 1 1 19 4698 1 1 9 ILE HG12 H 9.363 -2.035 4.932 1.00 . A A . 31 ILE HG12 1 1 19 4699 1 1 9 ILE HG13 H 10.730 -1.482 5.871 1.00 . A A . 31 ILE HG13 1 1 19 4700 1 1 9 ILE HG21 H 10.346 -4.039 4.224 1.00 . A A . 31 ILE HG21 1 1 19 4701 1 1 9 ILE HG22 H 11.800 -3.743 5.167 1.00 . A A . 31 ILE HG22 1 1 19 4702 1 1 9 ILE HG23 H 11.917 -4.152 3.465 1.00 . A A . 31 ILE HG23 1 1 19 4703 1 1 9 ILE N N 12.566 -0.023 3.333 1.00 . A A . 31 ILE N 1 1 19 4704 1 1 9 ILE O O 14.125 -3.252 3.146 1.00 . A A . 31 ILE O 1 1 19 4705 1 1 10 GLU C C 16.052 -1.405 0.688 1.00 . A A . 32 GLU C 1 1 19 4706 1 1 10 GLU CA C 14.742 -2.206 0.700 1.00 . A A . 32 GLU CA 1 1 19 4707 1 1 10 GLU CB C 13.986 -2.131 -0.640 1.00 . A A . 32 GLU CB 1 1 19 4708 1 1 10 GLU CD C 11.688 -2.640 -1.676 1.00 . A A . 32 GLU CD 1 1 19 4709 1 1 10 GLU CG C 12.617 -2.867 -0.475 1.00 . A A . 32 GLU CG 1 1 19 4710 1 1 10 GLU H H 13.436 -0.717 1.562 1.00 . A A . 32 GLU H 1 1 19 4711 1 1 10 GLU HA H 14.969 -3.231 0.965 1.00 . A A . 32 GLU HA 1 1 19 4712 1 1 10 GLU HB2 H 13.820 -1.103 -0.919 1.00 . A A . 32 GLU HB2 1 1 19 4713 1 1 10 GLU HB3 H 14.573 -2.606 -1.413 1.00 . A A . 32 GLU HB3 1 1 19 4714 1 1 10 GLU HG2 H 12.781 -3.929 -0.380 1.00 . A A . 32 GLU HG2 1 1 19 4715 1 1 10 GLU HG3 H 12.092 -2.524 0.404 1.00 . A A . 32 GLU HG3 1 1 19 4716 1 1 10 GLU N N 13.854 -1.592 1.729 1.00 . A A . 32 GLU N 1 1 19 4717 1 1 10 GLU O O 16.746 -1.320 -0.304 1.00 . A A . 32 GLU O 1 1 19 4718 1 1 10 GLU OE1 O 12.128 -2.280 -2.752 1.00 . A A . 32 GLU OE1 1 1 19 4719 1 1 11 ARG C C 18.496 -0.955 2.778 1.00 . A A . 33 ARG C 1 1 19 4720 1 1 11 ARG CA C 17.545 -0.023 2.061 1.00 . A A . 33 ARG CA 1 1 19 4721 1 1 11 ARG CB C 17.165 1.206 2.933 1.00 . A A . 33 ARG CB 1 1 19 4722 1 1 11 ARG CD C 18.855 2.849 1.924 1.00 . A A . 33 ARG CD 1 1 19 4723 1 1 11 ARG CG C 18.364 2.148 3.218 1.00 . A A . 33 ARG CG 1 1 19 4724 1 1 11 ARG CZ C 20.017 1.660 0.067 1.00 . A A . 33 ARG CZ 1 1 19 4725 1 1 11 ARG H H 15.687 -0.972 2.567 1.00 . A A . 33 ARG H 1 1 19 4726 1 1 11 ARG HA H 17.969 0.261 1.117 1.00 . A A . 33 ARG HA 1 1 19 4727 1 1 11 ARG HB2 H 16.412 1.774 2.406 1.00 . A A . 33 ARG HB2 1 1 19 4728 1 1 11 ARG HB3 H 16.725 0.891 3.870 1.00 . A A . 33 ARG HB3 1 1 19 4729 1 1 11 ARG HD2 H 18.022 2.932 1.247 1.00 . A A . 33 ARG HD2 1 1 19 4730 1 1 11 ARG HD3 H 19.195 3.852 2.152 1.00 . A A . 33 ARG HD3 1 1 19 4731 1 1 11 ARG HE H 20.776 1.892 1.883 1.00 . A A . 33 ARG HE 1 1 19 4732 1 1 11 ARG HG2 H 18.045 2.905 3.922 1.00 . A A . 33 ARG HG2 1 1 19 4733 1 1 11 ARG HG3 H 19.166 1.592 3.681 1.00 . A A . 33 ARG HG3 1 1 19 4734 1 1 11 ARG HH11 H 18.179 2.346 -0.426 1.00 . A A . 33 ARG HH11 1 1 19 4735 1 1 11 ARG HH12 H 19.018 1.541 -1.670 1.00 . A A . 33 ARG HH12 1 1 19 4736 1 1 11 ARG HH21 H 21.840 0.869 0.309 1.00 . A A . 33 ARG HH21 1 1 19 4737 1 1 11 ARG HH22 H 21.188 0.684 -1.259 1.00 . A A . 33 ARG HH22 1 1 19 4738 1 1 11 ARG N N 16.326 -0.845 1.838 1.00 . A A . 33 ARG N 1 1 19 4739 1 1 11 ARG NE N 19.997 2.077 1.309 1.00 . A A . 33 ARG NE 1 1 19 4740 1 1 11 ARG NH1 N 19.005 1.864 -0.728 1.00 . A A . 33 ARG NH1 1 1 19 4741 1 1 11 ARG NH2 N 21.081 1.028 -0.330 1.00 . A A . 33 ARG NH2 1 1 19 4742 1 1 11 ARG O O 19.573 -1.229 2.292 1.00 . A A . 33 ARG O 1 1 19 4743 1 1 12 GLN C C 19.731 -3.256 3.994 1.00 . A A . 34 GLN C 1 1 19 4744 1 1 12 GLN CA C 18.793 -2.343 4.806 1.00 . A A . 34 GLN CA 1 1 19 4745 1 1 12 GLN CB C 17.744 -3.154 5.605 1.00 . A A . 34 GLN CB 1 1 19 4746 1 1 12 GLN CD C 16.067 -3.039 7.486 1.00 . A A . 34 GLN CD 1 1 19 4747 1 1 12 GLN CG C 17.094 -2.234 6.676 1.00 . A A . 34 GLN CG 1 1 19 4748 1 1 12 GLN H H 17.141 -1.087 4.177 1.00 . A A . 34 GLN H 1 1 19 4749 1 1 12 GLN HA H 19.408 -1.758 5.476 1.00 . A A . 34 GLN HA 1 1 19 4750 1 1 12 GLN HB2 H 16.978 -3.543 4.950 1.00 . A A . 34 GLN HB2 1 1 19 4751 1 1 12 GLN HB3 H 18.218 -3.988 6.105 1.00 . A A . 34 GLN HB3 1 1 19 4752 1 1 12 GLN HE21 H 14.704 -1.590 7.538 1.00 . A A . 34 GLN HE21 1 1 19 4753 1 1 12 GLN HE22 H 14.279 -3.040 8.308 1.00 . A A . 34 GLN HE22 1 1 19 4754 1 1 12 GLN HG2 H 17.842 -1.863 7.365 1.00 . A A . 34 GLN HG2 1 1 19 4755 1 1 12 GLN HG3 H 16.594 -1.393 6.221 1.00 . A A . 34 GLN HG3 1 1 19 4756 1 1 12 GLN N N 18.032 -1.401 3.918 1.00 . A A . 34 GLN N 1 1 19 4757 1 1 12 GLN NE2 N 14.924 -2.506 7.799 1.00 . A A . 34 GLN NE2 1 1 19 4758 1 1 12 GLN O O 20.924 -3.289 4.212 1.00 . A A . 34 GLN O 1 1 19 4759 1 1 12 GLN OE1 O 16.296 -4.173 7.848 1.00 . A A . 34 GLN OE1 1 1 19 4760 1 1 13 ARG C C 21.242 -4.461 1.751 1.00 . A A . 35 ARG C 1 1 19 4761 1 1 13 ARG CA C 19.844 -4.924 2.169 1.00 . A A . 35 ARG CA 1 1 19 4762 1 1 13 ARG CB C 18.953 -5.131 0.918 1.00 . A A . 35 ARG CB 1 1 19 4763 1 1 13 ARG CD C 18.460 -7.583 1.193 1.00 . A A . 35 ARG CD 1 1 19 4764 1 1 13 ARG CG C 17.840 -6.163 1.214 1.00 . A A . 35 ARG CG 1 1 19 4765 1 1 13 ARG CZ C 17.403 -9.356 2.579 1.00 . A A . 35 ARG CZ 1 1 19 4766 1 1 13 ARG H H 18.157 -3.868 3.003 1.00 . A A . 35 ARG H 1 1 19 4767 1 1 13 ARG HA H 19.985 -5.839 2.704 1.00 . A A . 35 ARG HA 1 1 19 4768 1 1 13 ARG HB2 H 18.505 -4.190 0.633 1.00 . A A . 35 ARG HB2 1 1 19 4769 1 1 13 ARG HB3 H 19.557 -5.469 0.086 1.00 . A A . 35 ARG HB3 1 1 19 4770 1 1 13 ARG HD2 H 18.099 -8.124 0.334 1.00 . A A . 35 ARG HD2 1 1 19 4771 1 1 13 ARG HD3 H 19.539 -7.534 1.104 1.00 . A A . 35 ARG HD3 1 1 19 4772 1 1 13 ARG HE H 18.544 -7.893 3.294 1.00 . A A . 35 ARG HE 1 1 19 4773 1 1 13 ARG HG2 H 17.370 -5.953 2.165 1.00 . A A . 35 ARG HG2 1 1 19 4774 1 1 13 ARG HG3 H 17.081 -6.086 0.447 1.00 . A A . 35 ARG HG3 1 1 19 4775 1 1 13 ARG HH11 H 16.968 -9.457 0.615 1.00 . A A . 35 ARG HH11 1 1 19 4776 1 1 13 ARG HH12 H 16.292 -10.694 1.573 1.00 . A A . 35 ARG HH12 1 1 19 4777 1 1 13 ARG HH21 H 17.662 -9.453 4.566 1.00 . A A . 35 ARG HH21 1 1 19 4778 1 1 13 ARG HH22 H 16.689 -10.696 3.908 1.00 . A A . 35 ARG HH22 1 1 19 4779 1 1 13 ARG N N 19.126 -3.971 3.083 1.00 . A A . 35 ARG N 1 1 19 4780 1 1 13 ARG NE N 18.142 -8.281 2.485 1.00 . A A . 35 ARG NE 1 1 19 4781 1 1 13 ARG NH1 N 16.850 -9.869 1.516 1.00 . A A . 35 ARG NH1 1 1 19 4782 1 1 13 ARG NH2 N 17.237 -9.873 3.764 1.00 . A A . 35 ARG NH2 1 1 19 4783 1 1 13 ARG O O 22.197 -5.209 1.726 1.00 . A A . 35 ARG O 1 1 19 4784 1 1 14 TYR C C 22.577 -1.269 1.898 1.00 . A A . 36 TYR C 1 1 19 4785 1 1 14 TYR CA C 22.484 -2.506 0.987 1.00 . A A . 36 TYR CA 1 1 19 4786 1 1 14 TYR CB C 22.302 -2.149 -0.516 1.00 . A A . 36 TYR CB 1 1 19 4787 1 1 14 TYR CD1 C 24.785 -1.662 -0.974 1.00 . A A . 36 TYR CD1 1 1 19 4788 1 1 14 TYR CD2 C 23.625 -3.151 -2.421 1.00 . A A . 36 TYR CD2 1 1 19 4789 1 1 14 TYR CE1 C 25.936 -1.841 -1.727 1.00 . A A . 36 TYR CE1 1 1 19 4790 1 1 14 TYR CE2 C 24.773 -3.326 -3.169 1.00 . A A . 36 TYR CE2 1 1 19 4791 1 1 14 TYR CG C 23.614 -2.318 -1.316 1.00 . A A . 36 TYR CG 1 1 19 4792 1 1 14 TYR CZ C 25.938 -2.672 -2.828 1.00 . A A . 36 TYR CZ 1 1 19 4793 1 1 14 TYR H H 20.423 -2.719 1.510 1.00 . A A . 36 TYR H 1 1 19 4794 1 1 14 TYR HA H 23.324 -3.150 1.166 1.00 . A A . 36 TYR HA 1 1 19 4795 1 1 14 TYR HB2 H 21.547 -2.787 -0.951 1.00 . A A . 36 TYR HB2 1 1 19 4796 1 1 14 TYR HB3 H 21.980 -1.132 -0.619 1.00 . A A . 36 TYR HB3 1 1 19 4797 1 1 14 TYR HD1 H 24.809 -1.004 -0.116 1.00 . A A . 36 TYR HD1 1 1 19 4798 1 1 14 TYR HD2 H 22.724 -3.673 -2.709 1.00 . A A . 36 TYR HD2 1 1 19 4799 1 1 14 TYR HE1 H 26.847 -1.329 -1.456 1.00 . A A . 36 TYR HE1 1 1 19 4800 1 1 14 TYR HE2 H 24.752 -3.980 -4.029 1.00 . A A . 36 TYR HE2 1 1 19 4801 1 1 14 TYR HH H 27.161 -3.748 -3.856 1.00 . A A . 36 TYR HH 1 1 19 4802 1 1 14 TYR N N 21.260 -3.206 1.432 1.00 . A A . 36 TYR N 1 1 19 4803 1 1 14 TYR O O 22.656 -0.133 1.464 1.00 . A A . 36 TYR O 1 1 19 4804 1 1 14 TYR OH O 27.092 -2.833 -3.568 1.00 . A A . 36 TYR OH 1 1 19 4805 1 1 15 NH2 HN1 H 22.501 -2.376 3.530 1.00 . A A . 37 NH2 HN1 1 1 19 4806 1 1 15 NH2 HN2 H 22.625 -0.702 3.794 1.00 . A A . 37 NH2 HN2 1 1 19 4807 1 1 15 NH2 N N 22.566 -1.457 3.179 1.00 . A A . 37 NH2 N 1 1 20 4808 1 1 1 ACE C C 2.685 -0.119 -1.316 1.00 . A A . 23 ACE C 1 1 20 4809 1 1 1 ACE CH3 C 2.662 -1.643 -1.325 1.00 . A A . 23 ACE CH3 1 1 20 4810 1 1 1 ACE H1 H 3.087 -1.999 -2.251 1.00 . A A . 23 ACE H1 1 1 20 4811 1 1 1 ACE H2 H 1.638 -1.983 -1.249 1.00 . A A . 23 ACE H2 1 1 20 4812 1 1 1 ACE H3 H 3.235 -2.029 -0.496 1.00 . A A . 23 ACE H3 1 1 20 4813 1 1 1 ACE O O 2.146 0.513 -2.203 1.00 . A A . 23 ACE O 1 1 20 4814 1 1 2 ALA C C 4.630 2.439 -0.973 1.00 . A A . 24 ALA C 1 1 20 4815 1 1 2 ALA CA C 3.382 1.947 -0.241 1.00 . A A . 24 ALA CA 1 1 20 4816 1 1 2 ALA CB C 3.421 2.354 1.251 1.00 . A A . 24 ALA CB 1 1 20 4817 1 1 2 ALA H H 3.749 -0.088 0.362 1.00 . A A . 24 ALA H 1 1 20 4818 1 1 2 ALA HA H 2.513 2.376 -0.717 1.00 . A A . 24 ALA HA 1 1 20 4819 1 1 2 ALA HB1 H 2.537 2.009 1.762 1.00 . A A . 24 ALA HB1 1 1 20 4820 1 1 2 ALA HB2 H 3.466 3.430 1.343 1.00 . A A . 24 ALA HB2 1 1 20 4821 1 1 2 ALA HB3 H 4.293 1.931 1.728 1.00 . A A . 24 ALA HB3 1 1 20 4822 1 1 2 ALA N N 3.314 0.458 -0.326 1.00 . A A . 24 ALA N 1 1 20 4823 1 1 2 ALA O O 5.577 2.881 -0.361 1.00 . A A . 24 ALA O 1 1 20 4824 1 1 3 ARG C C 6.783 3.758 -2.633 1.00 . A A . 25 ARG C 1 1 20 4825 1 1 3 ARG CA C 5.723 2.755 -3.179 1.00 . A A . 25 ARG CA 1 1 20 4826 1 1 3 ARG CB C 5.092 3.330 -4.492 1.00 . A A . 25 ARG CB 1 1 20 4827 1 1 3 ARG CD C 3.383 4.856 -5.535 1.00 . A A . 25 ARG CD 1 1 20 4828 1 1 3 ARG CG C 3.941 4.323 -4.202 1.00 . A A . 25 ARG CG 1 1 20 4829 1 1 3 ARG CZ C 1.976 6.907 -5.342 1.00 . A A . 25 ARG CZ 1 1 20 4830 1 1 3 ARG H H 3.777 1.934 -2.665 1.00 . A A . 25 ARG H 1 1 20 4831 1 1 3 ARG HA H 6.263 1.859 -3.455 1.00 . A A . 25 ARG HA 1 1 20 4832 1 1 3 ARG HB2 H 5.864 3.825 -5.065 1.00 . A A . 25 ARG HB2 1 1 20 4833 1 1 3 ARG HB3 H 4.718 2.506 -5.086 1.00 . A A . 25 ARG HB3 1 1 20 4834 1 1 3 ARG HD2 H 4.104 5.469 -6.052 1.00 . A A . 25 ARG HD2 1 1 20 4835 1 1 3 ARG HD3 H 3.124 4.029 -6.186 1.00 . A A . 25 ARG HD3 1 1 20 4836 1 1 3 ARG HE H 1.365 5.062 -4.917 1.00 . A A . 25 ARG HE 1 1 20 4837 1 1 3 ARG HG2 H 3.159 3.828 -3.647 1.00 . A A . 25 ARG HG2 1 1 20 4838 1 1 3 ARG HG3 H 4.302 5.157 -3.622 1.00 . A A . 25 ARG HG3 1 1 20 4839 1 1 3 ARG HH11 H 3.860 7.257 -5.939 1.00 . A A . 25 ARG HH11 1 1 20 4840 1 1 3 ARG HH12 H 2.878 8.644 -5.835 1.00 . A A . 25 ARG HH12 1 1 20 4841 1 1 3 ARG HH21 H 0.051 6.840 -4.754 1.00 . A A . 25 ARG HH21 1 1 20 4842 1 1 3 ARG HH22 H 0.642 8.400 -5.119 1.00 . A A . 25 ARG HH22 1 1 20 4843 1 1 3 ARG N N 4.592 2.326 -2.275 1.00 . A A . 25 ARG N 1 1 20 4844 1 1 3 ARG NE N 2.122 5.609 -5.221 1.00 . A A . 25 ARG NE 1 1 20 4845 1 1 3 ARG NH1 N 2.970 7.654 -5.732 1.00 . A A . 25 ARG NH1 1 1 20 4846 1 1 3 ARG NH2 N 0.812 7.417 -5.051 1.00 . A A . 25 ARG NH2 1 1 20 4847 1 1 3 ARG O O 7.957 3.457 -2.672 1.00 . A A . 25 ARG O 1 1 20 4848 1 1 4 HIS C C 8.234 5.345 -0.384 1.00 . A A . 26 HIS C 1 1 20 4849 1 1 4 HIS CA C 7.461 5.860 -1.613 1.00 . A A . 26 HIS CA 1 1 20 4850 1 1 4 HIS CB C 6.783 7.202 -1.280 1.00 . A A . 26 HIS CB 1 1 20 4851 1 1 4 HIS CD2 C 5.293 8.124 -3.222 1.00 . A A . 26 HIS CD2 1 1 20 4852 1 1 4 HIS CE1 C 6.803 8.933 -4.324 1.00 . A A . 26 HIS CE1 1 1 20 4853 1 1 4 HIS CG C 6.501 7.923 -2.603 1.00 . A A . 26 HIS CG 1 1 20 4854 1 1 4 HIS H H 5.453 5.126 -2.091 1.00 . A A . 26 HIS H 1 1 20 4855 1 1 4 HIS HA H 8.185 6.002 -2.403 1.00 . A A . 26 HIS HA 1 1 20 4856 1 1 4 HIS HB2 H 5.856 7.057 -0.743 1.00 . A A . 26 HIS HB2 1 1 20 4857 1 1 4 HIS HB3 H 7.444 7.817 -0.681 1.00 . A A . 26 HIS HB3 1 1 20 4858 1 1 4 HIS HD1 H 8.425 8.457 -3.110 1.00 . A A . 26 HIS HD1 1 1 20 4859 1 1 4 HIS HD2 H 4.335 7.797 -2.847 1.00 . A A . 26 HIS HD2 1 1 20 4860 1 1 4 HIS HE1 H 7.313 9.450 -5.126 1.00 . A A . 26 HIS HE1 1 1 20 4861 1 1 4 HIS N N 6.405 4.906 -2.129 1.00 . A A . 26 HIS N 1 1 20 4862 1 1 4 HIS ND1 N 7.462 8.441 -3.308 1.00 . A A . 26 HIS ND1 1 1 20 4863 1 1 4 HIS NE2 N 5.501 8.778 -4.335 1.00 . A A . 26 HIS NE2 1 1 20 4864 1 1 4 HIS O O 9.193 5.937 0.061 1.00 . A A . 26 HIS O 1 1 20 4865 1 1 5 TYR C C 8.874 2.178 0.843 1.00 . A A . 27 TYR C 1 1 20 4866 1 1 5 TYR CA C 8.345 3.538 1.300 1.00 . A A . 27 TYR CA 1 1 20 4867 1 1 5 TYR CB C 7.242 3.340 2.355 1.00 . A A . 27 TYR CB 1 1 20 4868 1 1 5 TYR CD1 C 7.189 5.752 3.120 1.00 . A A . 27 TYR CD1 1 1 20 4869 1 1 5 TYR CD2 C 7.546 4.062 4.757 1.00 . A A . 27 TYR CD2 1 1 20 4870 1 1 5 TYR CE1 C 7.265 6.716 4.102 1.00 . A A . 27 TYR CE1 1 1 20 4871 1 1 5 TYR CE2 C 7.622 5.027 5.739 1.00 . A A . 27 TYR CE2 1 1 20 4872 1 1 5 TYR CG C 7.328 4.418 3.440 1.00 . A A . 27 TYR CG 1 1 20 4873 1 1 5 TYR CZ C 7.482 6.362 5.414 1.00 . A A . 27 TYR CZ 1 1 20 4874 1 1 5 TYR H H 7.001 3.856 -0.333 1.00 . A A . 27 TYR H 1 1 20 4875 1 1 5 TYR HA H 9.174 4.112 1.687 1.00 . A A . 27 TYR HA 1 1 20 4876 1 1 5 TYR HB2 H 6.269 3.406 1.887 1.00 . A A . 27 TYR HB2 1 1 20 4877 1 1 5 TYR HB3 H 7.327 2.361 2.803 1.00 . A A . 27 TYR HB3 1 1 20 4878 1 1 5 TYR HD1 H 7.022 6.044 2.096 1.00 . A A . 27 TYR HD1 1 1 20 4879 1 1 5 TYR HD2 H 7.656 3.020 5.021 1.00 . A A . 27 TYR HD2 1 1 20 4880 1 1 5 TYR HE1 H 7.155 7.760 3.847 1.00 . A A . 27 TYR HE1 1 1 20 4881 1 1 5 TYR HE2 H 7.794 4.736 6.765 1.00 . A A . 27 TYR HE2 1 1 20 4882 1 1 5 TYR HH H 7.126 7.045 7.177 1.00 . A A . 27 TYR HH 1 1 20 4883 1 1 5 TYR N N 7.772 4.241 0.112 1.00 . A A . 27 TYR N 1 1 20 4884 1 1 5 TYR O O 9.141 1.299 1.641 1.00 . A A . 27 TYR O 1 1 20 4885 1 1 5 TYR OH O 7.557 7.348 6.374 1.00 . A A . 27 TYR OH 1 1 20 4886 1 1 6 LYS C C 11.050 0.790 -0.945 1.00 . A A . 28 LYS C 1 1 20 4887 1 1 6 LYS CA C 9.521 0.783 -1.032 1.00 . A A . 28 LYS CA 1 1 20 4888 1 1 6 LYS CB C 8.976 0.711 -2.488 1.00 . A A . 28 LYS CB 1 1 20 4889 1 1 6 LYS CD C 10.759 -0.047 -4.025 1.00 . A A . 28 LYS CD 1 1 20 4890 1 1 6 LYS CE C 11.630 -1.229 -4.371 1.00 . A A . 28 LYS CE 1 1 20 4891 1 1 6 LYS CG C 9.552 -0.519 -3.209 1.00 . A A . 28 LYS CG 1 1 20 4892 1 1 6 LYS H H 8.782 2.818 -1.019 1.00 . A A . 28 LYS H 1 1 20 4893 1 1 6 LYS HA H 9.149 -0.055 -0.474 1.00 . A A . 28 LYS HA 1 1 20 4894 1 1 6 LYS HB2 H 7.900 0.639 -2.461 1.00 . A A . 28 LYS HB2 1 1 20 4895 1 1 6 LYS HB3 H 9.241 1.606 -3.033 1.00 . A A . 28 LYS HB3 1 1 20 4896 1 1 6 LYS HD2 H 10.379 0.404 -4.926 1.00 . A A . 28 LYS HD2 1 1 20 4897 1 1 6 LYS HD3 H 11.349 0.692 -3.512 1.00 . A A . 28 LYS HD3 1 1 20 4898 1 1 6 LYS HE2 H 11.056 -1.981 -4.897 1.00 . A A . 28 LYS HE2 1 1 20 4899 1 1 6 LYS HE3 H 12.466 -0.932 -4.992 1.00 . A A . 28 LYS HE3 1 1 20 4900 1 1 6 LYS HG2 H 9.847 -1.284 -2.504 1.00 . A A . 28 LYS HG2 1 1 20 4901 1 1 6 LYS HG3 H 8.812 -0.938 -3.877 1.00 . A A . 28 LYS HG3 1 1 20 4902 1 1 6 LYS HZ1 H 11.491 -2.316 -2.522 1.00 . A A . 28 LYS HZ1 1 1 20 4903 1 1 6 LYS N N 9.016 2.057 -0.446 1.00 . A A . 28 LYS N 1 1 20 4904 1 1 6 LYS NZ N 12.114 -1.803 -3.075 1.00 . A A . 28 LYS NZ 1 1 20 4905 1 1 6 LYS O O 11.641 -0.106 -0.375 1.00 . A A . 28 LYS O 1 1 20 4906 1 1 7 ASN C C 13.693 1.560 -0.053 1.00 . A A . 29 ASN C 1 1 20 4907 1 1 7 ASN CA C 13.167 1.898 -1.464 1.00 . A A . 29 ASN CA 1 1 20 4908 1 1 7 ASN CB C 13.603 3.335 -1.850 1.00 . A A . 29 ASN CB 1 1 20 4909 1 1 7 ASN CG C 15.136 3.424 -1.779 1.00 . A A . 29 ASN CG 1 1 20 4910 1 1 7 ASN H H 11.104 2.476 -1.941 1.00 . A A . 29 ASN H 1 1 20 4911 1 1 7 ASN HA H 13.576 1.181 -2.162 1.00 . A A . 29 ASN HA 1 1 20 4912 1 1 7 ASN HB2 H 13.276 3.577 -2.851 1.00 . A A . 29 ASN HB2 1 1 20 4913 1 1 7 ASN HB3 H 13.196 4.064 -1.167 1.00 . A A . 29 ASN HB3 1 1 20 4914 1 1 7 ASN HD21 H 15.380 3.017 -3.703 1.00 . A A . 29 ASN HD21 1 1 20 4915 1 1 7 ASN HD22 H 16.804 3.269 -2.815 1.00 . A A . 29 ASN HD22 1 1 20 4916 1 1 7 ASN N N 11.661 1.801 -1.502 1.00 . A A . 29 ASN N 1 1 20 4917 1 1 7 ASN ND2 N 15.828 3.221 -2.857 1.00 . A A . 29 ASN ND2 1 1 20 4918 1 1 7 ASN O O 14.525 0.697 0.140 1.00 . A A . 29 ASN O 1 1 20 4919 1 1 7 ASN OD1 O 15.736 3.669 -0.749 1.00 . A A . 29 ASN OD1 1 1 20 4920 1 1 8 LEU C C 13.771 0.789 2.869 1.00 . A A . 30 LEU C 1 1 20 4921 1 1 8 LEU CA C 13.452 2.199 2.344 1.00 . A A . 30 LEU CA 1 1 20 4922 1 1 8 LEU CB C 12.230 2.779 3.108 1.00 . A A . 30 LEU CB 1 1 20 4923 1 1 8 LEU CD1 C 13.272 5.004 3.764 1.00 . A A . 30 LEU CD1 1 1 20 4924 1 1 8 LEU CD2 C 12.090 4.866 1.553 1.00 . A A . 30 LEU CD2 1 1 20 4925 1 1 8 LEU CG C 12.105 4.334 3.012 1.00 . A A . 30 LEU CG 1 1 20 4926 1 1 8 LEU H H 12.492 2.946 0.582 1.00 . A A . 30 LEU H 1 1 20 4927 1 1 8 LEU HA H 14.306 2.827 2.546 1.00 . A A . 30 LEU HA 1 1 20 4928 1 1 8 LEU HB2 H 11.324 2.334 2.722 1.00 . A A . 30 LEU HB2 1 1 20 4929 1 1 8 LEU HB3 H 12.304 2.500 4.151 1.00 . A A . 30 LEU HB3 1 1 20 4930 1 1 8 LEU HD11 H 13.260 4.710 4.804 1.00 . A A . 30 LEU HD11 1 1 20 4931 1 1 8 LEU HD12 H 13.170 6.079 3.717 1.00 . A A . 30 LEU HD12 1 1 20 4932 1 1 8 LEU HD13 H 14.228 4.738 3.337 1.00 . A A . 30 LEU HD13 1 1 20 4933 1 1 8 LEU HD21 H 11.966 5.939 1.564 1.00 . A A . 30 LEU HD21 1 1 20 4934 1 1 8 LEU HD22 H 11.264 4.451 0.994 1.00 . A A . 30 LEU HD22 1 1 20 4935 1 1 8 LEU HD23 H 13.023 4.653 1.053 1.00 . A A . 30 LEU HD23 1 1 20 4936 1 1 8 LEU HG H 11.180 4.619 3.487 1.00 . A A . 30 LEU HG 1 1 20 4937 1 1 8 LEU N N 13.152 2.291 0.879 1.00 . A A . 30 LEU N 1 1 20 4938 1 1 8 LEU O O 14.868 0.482 3.303 1.00 . A A . 30 LEU O 1 1 20 4939 1 1 9 ILE C C 13.960 -2.209 2.483 1.00 . A A . 31 ILE C 1 1 20 4940 1 1 9 ILE CA C 12.875 -1.459 3.265 1.00 . A A . 31 ILE CA 1 1 20 4941 1 1 9 ILE CB C 11.453 -2.085 3.082 1.00 . A A . 31 ILE CB 1 1 20 4942 1 1 9 ILE CD1 C 10.600 -0.999 5.290 1.00 . A A . 31 ILE CD1 1 1 20 4943 1 1 9 ILE CG1 C 10.344 -1.199 3.773 1.00 . A A . 31 ILE CG1 1 1 20 4944 1 1 9 ILE CG2 C 11.393 -3.521 3.647 1.00 . A A . 31 ILE CG2 1 1 20 4945 1 1 9 ILE H H 11.925 0.281 2.420 1.00 . A A . 31 ILE H 1 1 20 4946 1 1 9 ILE HA H 13.213 -1.464 4.299 1.00 . A A . 31 ILE HA 1 1 20 4947 1 1 9 ILE HB H 11.249 -2.124 2.019 1.00 . A A . 31 ILE HB 1 1 20 4948 1 1 9 ILE HD11 H 11.545 -0.505 5.465 1.00 . A A . 31 ILE HD11 1 1 20 4949 1 1 9 ILE HD12 H 10.599 -1.947 5.809 1.00 . A A . 31 ILE HD12 1 1 20 4950 1 1 9 ILE HD13 H 9.813 -0.384 5.706 1.00 . A A . 31 ILE HD13 1 1 20 4951 1 1 9 ILE HG12 H 10.291 -0.227 3.303 1.00 . A A . 31 ILE HG12 1 1 20 4952 1 1 9 ILE HG13 H 9.378 -1.664 3.635 1.00 . A A . 31 ILE HG13 1 1 20 4953 1 1 9 ILE HG21 H 10.401 -3.930 3.509 1.00 . A A . 31 ILE HG21 1 1 20 4954 1 1 9 ILE HG22 H 11.634 -3.530 4.700 1.00 . A A . 31 ILE HG22 1 1 20 4955 1 1 9 ILE HG23 H 12.102 -4.160 3.137 1.00 . A A . 31 ILE HG23 1 1 20 4956 1 1 9 ILE N N 12.770 -0.041 2.798 1.00 . A A . 31 ILE N 1 1 20 4957 1 1 9 ILE O O 14.377 -3.287 2.849 1.00 . A A . 31 ILE O 1 1 20 4958 1 1 10 GLU C C 16.810 -1.543 0.908 1.00 . A A . 32 GLU C 1 1 20 4959 1 1 10 GLU CA C 15.465 -2.218 0.560 1.00 . A A . 32 GLU CA 1 1 20 4960 1 1 10 GLU CB C 15.159 -1.951 -0.930 1.00 . A A . 32 GLU CB 1 1 20 4961 1 1 10 GLU CD C 13.348 -1.634 -2.669 1.00 . A A . 32 GLU CD 1 1 20 4962 1 1 10 GLU CG C 13.689 -2.285 -1.321 1.00 . A A . 32 GLU CG 1 1 20 4963 1 1 10 GLU H H 14.025 -0.728 1.196 1.00 . A A . 32 GLU H 1 1 20 4964 1 1 10 GLU HA H 15.550 -3.274 0.768 1.00 . A A . 32 GLU HA 1 1 20 4965 1 1 10 GLU HB2 H 15.363 -0.917 -1.161 1.00 . A A . 32 GLU HB2 1 1 20 4966 1 1 10 GLU HB3 H 15.833 -2.544 -1.533 1.00 . A A . 32 GLU HB3 1 1 20 4967 1 1 10 GLU HG2 H 13.570 -3.352 -1.435 1.00 . A A . 32 GLU HG2 1 1 20 4968 1 1 10 GLU HG3 H 12.981 -1.936 -0.591 1.00 . A A . 32 GLU HG3 1 1 20 4969 1 1 10 GLU N N 14.404 -1.605 1.420 1.00 . A A . 32 GLU N 1 1 20 4970 1 1 10 GLU O O 17.752 -1.647 0.150 1.00 . A A . 32 GLU O 1 1 20 4971 1 1 10 GLU OE1 O 14.182 -1.006 -3.298 1.00 . A A . 32 GLU OE1 1 1 20 4972 1 1 11 ARG C C 18.936 -1.032 3.441 1.00 . A A . 33 ARG C 1 1 20 4973 1 1 11 ARG CA C 18.159 -0.199 2.426 1.00 . A A . 33 ARG CA 1 1 20 4974 1 1 11 ARG CB C 17.806 1.207 3.003 1.00 . A A . 33 ARG CB 1 1 20 4975 1 1 11 ARG CD C 18.618 3.572 3.446 1.00 . A A . 33 ARG CD 1 1 20 4976 1 1 11 ARG CG C 19.040 2.162 2.945 1.00 . A A . 33 ARG CG 1 1 20 4977 1 1 11 ARG CZ C 19.320 5.079 1.643 1.00 . A A . 33 ARG CZ 1 1 20 4978 1 1 11 ARG H H 16.079 -0.823 2.604 1.00 . A A . 33 ARG H 1 1 20 4979 1 1 11 ARG HA H 18.777 -0.108 1.554 1.00 . A A . 33 ARG HA 1 1 20 4980 1 1 11 ARG HB2 H 16.986 1.613 2.425 1.00 . A A . 33 ARG HB2 1 1 20 4981 1 1 11 ARG HB3 H 17.474 1.093 4.026 1.00 . A A . 33 ARG HB3 1 1 20 4982 1 1 11 ARG HD2 H 17.584 3.814 3.238 1.00 . A A . 33 ARG HD2 1 1 20 4983 1 1 11 ARG HD3 H 18.731 3.602 4.523 1.00 . A A . 33 ARG HD3 1 1 20 4984 1 1 11 ARG HE H 20.274 4.973 3.402 1.00 . A A . 33 ARG HE 1 1 20 4985 1 1 11 ARG HG2 H 19.821 1.773 3.586 1.00 . A A . 33 ARG HG2 1 1 20 4986 1 1 11 ARG HG3 H 19.429 2.207 1.937 1.00 . A A . 33 ARG HG3 1 1 20 4987 1 1 11 ARG HH11 H 17.801 3.811 1.346 1.00 . A A . 33 ARG HH11 1 1 20 4988 1 1 11 ARG HH12 H 18.085 4.846 0.026 1.00 . A A . 33 ARG HH12 1 1 20 4989 1 1 11 ARG HH21 H 20.837 6.415 1.717 1.00 . A A . 33 ARG HH21 1 1 20 4990 1 1 11 ARG HH22 H 19.959 6.375 0.248 1.00 . A A . 33 ARG HH22 1 1 20 4991 1 1 11 ARG N N 16.877 -0.879 2.034 1.00 . A A . 33 ARG N 1 1 20 4992 1 1 11 ARG NE N 19.535 4.619 2.854 1.00 . A A . 33 ARG NE 1 1 20 4993 1 1 11 ARG NH1 N 18.341 4.555 0.949 1.00 . A A . 33 ARG NH1 1 1 20 4994 1 1 11 ARG NH2 N 20.094 6.021 1.173 1.00 . A A . 33 ARG NH2 1 1 20 4995 1 1 11 ARG O O 20.140 -1.161 3.349 1.00 . A A . 33 ARG O 1 1 20 4996 1 1 12 GLN C C 19.789 -3.506 4.788 1.00 . A A . 34 GLN C 1 1 20 4997 1 1 12 GLN CA C 18.900 -2.417 5.438 1.00 . A A . 34 GLN CA 1 1 20 4998 1 1 12 GLN CB C 17.794 -3.045 6.325 1.00 . A A . 34 GLN CB 1 1 20 4999 1 1 12 GLN CD C 16.074 -2.543 8.107 1.00 . A A . 34 GLN CD 1 1 20 5000 1 1 12 GLN CG C 17.185 -1.941 7.240 1.00 . A A . 34 GLN CG 1 1 20 5001 1 1 12 GLN H H 17.261 -1.415 4.376 1.00 . A A . 34 GLN H 1 1 20 5002 1 1 12 GLN HA H 19.546 -1.776 6.026 1.00 . A A . 34 GLN HA 1 1 20 5003 1 1 12 GLN HB2 H 17.015 -3.477 5.714 1.00 . A A . 34 GLN HB2 1 1 20 5004 1 1 12 GLN HB3 H 18.212 -3.819 6.950 1.00 . A A . 34 GLN HB3 1 1 20 5005 1 1 12 GLN HE21 H 14.779 -1.069 7.792 1.00 . A A . 34 GLN HE21 1 1 20 5006 1 1 12 GLN HE22 H 14.234 -2.337 8.773 1.00 . A A . 34 GLN HE22 1 1 20 5007 1 1 12 GLN HG2 H 17.941 -1.545 7.902 1.00 . A A . 34 GLN HG2 1 1 20 5008 1 1 12 GLN HG3 H 16.777 -1.132 6.654 1.00 . A A . 34 GLN HG3 1 1 20 5009 1 1 12 GLN N N 18.227 -1.575 4.389 1.00 . A A . 34 GLN N 1 1 20 5010 1 1 12 GLN NE2 N 14.937 -1.928 8.230 1.00 . A A . 34 GLN NE2 1 1 20 5011 1 1 12 GLN O O 20.942 -3.680 5.127 1.00 . A A . 34 GLN O 1 1 20 5012 1 1 12 GLN OE1 O 16.230 -3.595 8.693 1.00 . A A . 34 GLN OE1 1 1 20 5013 1 1 13 ARG C C 20.583 -4.684 1.874 1.00 . A A . 35 ARG C 1 1 20 5014 1 1 13 ARG CA C 19.934 -5.298 3.132 1.00 . A A . 35 ARG CA 1 1 20 5015 1 1 13 ARG CB C 18.915 -6.417 2.745 1.00 . A A . 35 ARG CB 1 1 20 5016 1 1 13 ARG CD C 18.051 -6.869 5.162 1.00 . A A . 35 ARG CD 1 1 20 5017 1 1 13 ARG CG C 18.683 -7.457 3.882 1.00 . A A . 35 ARG CG 1 1 20 5018 1 1 13 ARG CZ C 18.345 -8.204 7.256 1.00 . A A . 35 ARG CZ 1 1 20 5019 1 1 13 ARG H H 18.294 -4.030 3.620 1.00 . A A . 35 ARG H 1 1 20 5020 1 1 13 ARG HA H 20.712 -5.686 3.769 1.00 . A A . 35 ARG HA 1 1 20 5021 1 1 13 ARG HB2 H 17.974 -5.977 2.443 1.00 . A A . 35 ARG HB2 1 1 20 5022 1 1 13 ARG HB3 H 19.308 -6.947 1.887 1.00 . A A . 35 ARG HB3 1 1 20 5023 1 1 13 ARG HD2 H 18.702 -6.135 5.607 1.00 . A A . 35 ARG HD2 1 1 20 5024 1 1 13 ARG HD3 H 17.101 -6.402 4.935 1.00 . A A . 35 ARG HD3 1 1 20 5025 1 1 13 ARG HE H 17.179 -8.727 5.741 1.00 . A A . 35 ARG HE 1 1 20 5026 1 1 13 ARG HG2 H 18.040 -8.233 3.489 1.00 . A A . 35 ARG HG2 1 1 20 5027 1 1 13 ARG HG3 H 19.632 -7.913 4.131 1.00 . A A . 35 ARG HG3 1 1 20 5028 1 1 13 ARG HH11 H 19.402 -6.508 7.216 1.00 . A A . 35 ARG HH11 1 1 20 5029 1 1 13 ARG HH12 H 19.595 -7.436 8.643 1.00 . A A . 35 ARG HH12 1 1 20 5030 1 1 13 ARG HH21 H 17.398 -9.958 7.550 1.00 . A A . 35 ARG HH21 1 1 20 5031 1 1 13 ARG HH22 H 18.415 -9.453 8.824 1.00 . A A . 35 ARG HH22 1 1 20 5032 1 1 13 ARG N N 19.215 -4.216 3.857 1.00 . A A . 35 ARG N 1 1 20 5033 1 1 13 ARG NE N 17.799 -8.042 6.077 1.00 . A A . 35 ARG NE 1 1 20 5034 1 1 13 ARG NH1 N 19.172 -7.323 7.742 1.00 . A A . 35 ARG NH1 1 1 20 5035 1 1 13 ARG NH2 N 18.031 -9.277 7.920 1.00 . A A . 35 ARG NH2 1 1 20 5036 1 1 13 ARG O O 20.402 -5.156 0.772 1.00 . A A . 35 ARG O 1 1 20 5037 1 1 14 TYR C C 23.287 -3.717 0.544 1.00 . A A . 36 TYR C 1 1 20 5038 1 1 14 TYR CA C 22.013 -2.954 0.937 1.00 . A A . 36 TYR CA 1 1 20 5039 1 1 14 TYR CB C 22.429 -1.501 1.312 1.00 . A A . 36 TYR CB 1 1 20 5040 1 1 14 TYR CD1 C 23.257 -1.781 3.727 1.00 . A A . 36 TYR CD1 1 1 20 5041 1 1 14 TYR CD2 C 24.831 -1.231 2.033 1.00 . A A . 36 TYR CD2 1 1 20 5042 1 1 14 TYR CE1 C 24.274 -1.787 4.663 1.00 . A A . 36 TYR CE1 1 1 20 5043 1 1 14 TYR CE2 C 25.841 -1.238 2.969 1.00 . A A . 36 TYR CE2 1 1 20 5044 1 1 14 TYR CG C 23.528 -1.502 2.399 1.00 . A A . 36 TYR CG 1 1 20 5045 1 1 14 TYR CZ C 25.571 -1.516 4.289 1.00 . A A . 36 TYR CZ 1 1 20 5046 1 1 14 TYR H H 21.406 -3.308 3.002 1.00 . A A . 36 TYR H 1 1 20 5047 1 1 14 TYR HA H 21.341 -2.953 0.093 1.00 . A A . 36 TYR HA 1 1 20 5048 1 1 14 TYR HB2 H 22.825 -1.017 0.428 1.00 . A A . 36 TYR HB2 1 1 20 5049 1 1 14 TYR HB3 H 21.587 -0.925 1.659 1.00 . A A . 36 TYR HB3 1 1 20 5050 1 1 14 TYR HD1 H 22.248 -1.990 4.048 1.00 . A A . 36 TYR HD1 1 1 20 5051 1 1 14 TYR HD2 H 25.070 -1.012 1.002 1.00 . A A . 36 TYR HD2 1 1 20 5052 1 1 14 TYR HE1 H 24.053 -2.011 5.696 1.00 . A A . 36 TYR HE1 1 1 20 5053 1 1 14 TYR HE2 H 26.853 -1.025 2.657 1.00 . A A . 36 TYR HE2 1 1 20 5054 1 1 14 TYR HH H 27.023 -0.663 5.171 1.00 . A A . 36 TYR HH 1 1 20 5055 1 1 14 TYR N N 21.325 -3.637 2.086 1.00 . A A . 36 TYR N 1 1 20 5056 1 1 14 TYR O O 23.620 -3.876 -0.611 1.00 . A A . 36 TYR O 1 1 20 5057 1 1 14 TYR OH O 26.585 -1.517 5.223 1.00 . A A . 36 TYR OH 1 1 20 5058 1 1 15 NH2 HN1 H 23.771 -4.072 2.420 1.00 . A A . 37 NH2 HN1 1 1 20 5059 1 1 15 NH2 HN2 H 24.856 -4.683 1.247 1.00 . A A . 37 NH2 HN2 1 1 20 5060 1 1 15 NH2 N N 24.039 -4.201 1.486 1.00 . A A . 37 NH2 N 1 1 stop_ save_
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